data_25485 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25485 _Entry.PDB_ID 2MZE save_ save_delta_chem_shifts _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts _Entity_delta_chem_shifts.Model_type single _Entity_delta_chem_shifts.Entry_ID 25485 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.448 -0.141 25485 2 1 1 . 1 1 2 2 GLN C C 2 176.492 176.492 175.077 1.415 25485 3 1 1 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.152 0.597 25485 4 1 1 . 1 1 2 2 GLN CB C 2 28.654 28.654 29.276 -0.622 25485 5 1 1 . 1 1 3 3 GLU N N 3 121.668 121.668 120.781 0.887 25485 6 1 1 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.455 -0.666 25485 7 1 1 . 1 1 3 3 GLU C C 3 176.278 176.278 177.808 -1.530 25485 8 1 1 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.444 -0.385 25485 9 1 1 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.811 -0.120 25485 10 1 1 . 1 1 3 3 GLU H H 3 8.331 8.331 8.576 -0.245 25485 11 1 1 . 1 1 4 4 ALA N N 4 124.493 124.493 124.368 0.125 25485 12 1 1 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.207 0.303 25485 13 1 1 . 1 1 4 4 ALA C C 4 178.428 178.428 179.881 -1.453 25485 14 1 1 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.596 0.081 25485 15 1 1 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.095 0.614 25485 16 1 1 . 1 1 4 4 ALA H H 4 8.131 8.131 8.688 -0.557 25485 17 1 1 . 1 1 5 5 GLY N N 5 108.204 108.204 105.674 2.530 25485 18 1 1 . 1 1 5 5 GLY C C 5 174.858 174.858 175.891 -1.033 25485 19 1 1 . 1 1 5 5 GLY CA C 5 47.661 47.661 45.935 1.726 25485 20 1 1 . 1 1 5 5 GLY H H 5 8.279 8.279 8.426 -0.147 25485 21 1 1 . 1 1 6 6 GLY N N 6 108.820 108.820 108.542 0.278 25485 22 1 1 . 1 1 6 6 GLY C C 6 174.189 174.189 174.691 -0.502 25485 23 1 1 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.235 0.178 25485 24 1 1 . 1 1 6 6 GLY H H 6 8.246 8.246 7.777 0.469 25485 25 1 1 . 1 1 7 7 MET N N 7 119.938 119.938 119.086 0.852 25485 26 1 1 . 1 1 7 7 MET HA H 7 4.659 4.659 4.748 -0.089 25485 27 1 1 . 1 1 7 7 MET C C 7 176.191 176.191 175.623 0.568 25485 28 1 1 . 1 1 7 7 MET CA C 7 54.799 54.799 54.138 0.661 25485 29 1 1 . 1 1 7 7 MET CB C 7 33.046 33.046 33.613 -0.567 25485 30 1 1 . 1 1 7 7 MET H H 7 8.005 8.005 7.824 0.181 25485 31 1 1 . 1 1 8 8 SER N N 8 118.919 118.919 116.024 2.895 25485 32 1 1 . 1 1 8 8 SER HA H 8 4.239 4.239 4.614 -0.375 25485 33 1 1 . 1 1 8 8 SER C C 8 174.949 174.949 175.479 -0.530 25485 34 1 1 . 1 1 8 8 SER CA C 8 58.160 58.160 57.787 0.373 25485 35 1 1 . 1 1 8 8 SER CB C 8 65.440 65.440 64.377 1.063 25485 36 1 1 . 1 1 8 8 SER H H 8 8.731 8.731 8.324 0.407 25485 37 1 1 . 1 1 9 9 GLU N N 9 122.442 122.442 122.412 0.030 25485 38 1 1 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.065 0.256 25485 39 1 1 . 1 1 9 9 GLU C C 9 178.604 178.604 178.262 0.342 25485 40 1 1 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.502 -0.035 25485 41 1 1 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.126 0.050 25485 42 1 1 . 1 1 9 9 GLU H H 9 8.901 8.901 8.915 -0.014 25485 43 1 1 . 1 1 10 10 LEU N N 10 120.568 120.568 115.437 5.131 25485 44 1 1 . 1 1 10 10 LEU C C 10 179.307 179.307 179.011 0.296 25485 45 1 1 . 1 1 10 10 LEU CA C 10 57.480 57.480 57.462 0.019 25485 46 1 1 . 1 1 10 10 LEU CB C 10 41.575 41.575 40.982 0.593 25485 47 1 1 . 1 1 10 10 LEU H H 10 8.020 8.020 7.957 0.063 25485 48 1 1 . 1 1 11 11 GLN N N 11 119.930 119.930 119.408 0.522 25485 49 1 1 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.064 0.070 25485 50 1 1 . 1 1 11 11 GLN C C 11 178.330 178.330 178.413 -0.083 25485 51 1 1 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.531 -0.713 25485 52 1 1 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.523 -0.659 25485 53 1 1 . 1 1 11 11 GLN H H 11 7.811 7.811 7.826 -0.015 25485 54 1 1 . 1 1 12 12 TRP N N 12 121.031 121.031 120.183 0.848 25485 55 1 1 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.430 -0.016 25485 56 1 1 . 1 1 12 12 TRP C C 12 178.874 178.874 178.409 0.465 25485 57 1 1 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.497 0.010 25485 58 1 1 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.586 -0.199 25485 59 1 1 . 1 1 12 12 TRP H H 12 8.205 8.205 7.742 0.463 25485 60 1 1 . 1 1 13 13 GLU N N 13 121.877 121.877 119.234 2.643 25485 61 1 1 . 1 1 13 13 GLU C C 13 179.425 179.425 178.835 0.590 25485 62 1 1 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.590 0.447 25485 63 1 1 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.611 -0.689 25485 64 1 1 . 1 1 13 13 GLU H H 13 8.434 8.434 8.309 0.125 25485 65 1 1 . 1 1 14 14 GLN N N 14 120.449 120.449 119.253 1.196 25485 66 1 1 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.791 0.447 25485 67 1 1 . 1 1 14 14 GLN C C 14 179.210 179.210 177.997 1.213 25485 68 1 1 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.782 0.100 25485 69 1 1 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.418 -0.668 25485 70 1 1 . 1 1 14 14 GLN H H 14 8.124 8.124 8.396 -0.272 25485 71 1 1 . 1 1 15 15 ALA N N 15 123.114 123.114 120.435 2.679 25485 72 1 1 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.166 0.224 25485 73 1 1 . 1 1 15 15 ALA C C 15 179.352 179.352 179.358 -0.006 25485 74 1 1 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.088 -0.123 25485 75 1 1 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.066 0.597 25485 76 1 1 . 1 1 15 15 ALA H H 15 8.344 8.344 7.682 0.662 25485 77 1 1 . 1 1 16 16 GLN N N 16 117.718 117.718 117.741 -0.023 25485 78 1 1 . 1 1 16 16 GLN HA H 16 3.782 3.782 4.058 -0.276 25485 79 1 1 . 1 1 16 16 GLN C C 16 177.719 177.719 178.223 -0.504 25485 80 1 1 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.690 1.591 25485 81 1 1 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.627 -0.091 25485 82 1 1 . 1 1 16 16 GLN H H 16 8.500 8.500 7.634 0.866 25485 83 1 1 . 1 1 17 17 ASP N N 17 120.040 120.040 120.449 -0.409 25485 84 1 1 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.345 0.191 25485 85 1 1 . 1 1 17 17 ASP C C 17 177.630 177.630 178.731 -1.101 25485 86 1 1 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.413 0.392 25485 87 1 1 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.601 1.263 25485 88 1 1 . 1 1 17 17 ASP H H 17 7.871 7.871 7.506 0.365 25485 89 1 1 . 1 1 18 18 TYR N N 18 122.465 122.465 119.171 3.294 25485 90 1 1 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.197 -0.007 25485 91 1 1 . 1 1 18 18 TYR C C 18 178.439 178.439 177.846 0.593 25485 92 1 1 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.411 1.435 25485 93 1 1 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.345 1.595 25485 94 1 1 . 1 1 18 18 TYR H H 18 8.244 8.244 8.277 -0.033 25485 95 1 1 . 1 1 19 19 LEU N N 19 117.635 117.635 119.040 -1.405 25485 96 1 1 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.965 0.167 25485 97 1 1 . 1 1 19 19 LEU C C 19 180.940 180.940 178.395 2.545 25485 98 1 1 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.638 0.867 25485 99 1 1 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.358 -0.760 25485 100 1 1 . 1 1 19 19 LEU H H 19 8.713 8.713 7.628 1.085 25485 101 1 1 . 1 1 20 20 LYS N N 20 124.594 124.594 120.013 4.581 25485 102 1 1 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.354 -0.270 25485 103 1 1 . 1 1 20 20 LYS C C 20 178.387 178.387 179.044 -0.657 25485 104 1 1 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.902 0.903 25485 105 1 1 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.255 0.201 25485 106 1 1 . 1 1 20 20 LYS H H 20 8.815 8.815 7.575 1.240 25485 107 1 1 . 1 1 21 21 ARG N N 21 117.535 117.535 116.844 0.691 25485 108 1 1 . 1 1 21 21 ARG HA H 21 3.719 3.719 3.964 -0.245 25485 109 1 1 . 1 1 21 21 ARG C C 21 178.498 178.498 178.820 -0.322 25485 110 1 1 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.326 0.918 25485 111 1 1 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.067 0.374 25485 112 1 1 . 1 1 21 21 ARG H H 21 7.810 7.810 7.492 0.318 25485 113 1 1 . 1 1 22 22 PHE N N 22 112.113 112.113 121.121 -9.008 25485 114 1 1 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.040 0.871 25485 115 1 1 . 1 1 22 22 PHE C C 22 174.875 174.875 175.196 -0.321 25485 116 1 1 . 1 1 22 22 PHE CA C 22 57.475 57.475 61.721 -4.246 25485 117 1 1 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.316 -0.147 25485 118 1 1 . 1 1 22 22 PHE H H 22 8.010 8.010 7.390 0.620 25485 119 1 1 . 1 1 23 23 TYR N N 23 116.187 116.187 115.554 0.633 25485 120 1 1 . 1 1 23 23 TYR C C 23 173.455 173.455 175.468 -2.013 25485 121 1 1 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.076 3.351 25485 122 1 1 . 1 1 23 23 TYR CB C 23 39.529 39.529 36.538 2.991 25485 123 1 1 . 1 1 23 23 TYR H H 23 7.680 7.680 7.739 -0.059 25485 124 1 1 . 1 1 24 24 LEU N N 24 115.570 115.570 118.206 -2.636 25485 125 1 1 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.565 0.585 25485 126 1 1 . 1 1 24 24 LEU C C 24 176.661 176.661 175.642 1.019 25485 127 1 1 . 1 1 24 24 LEU CA C 24 56.152 56.152 57.488 -1.336 25485 128 1 1 . 1 1 24 24 LEU CB C 24 36.863 36.863 40.733 -3.870 25485 129 1 1 . 1 1 24 24 LEU H H 24 7.238 7.238 7.827 -0.589 25485 130 1 1 . 1 1 25 25 TYR N N 25 119.901 119.901 119.402 0.499 25485 131 1 1 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.749 -0.390 25485 132 1 1 . 1 1 25 25 TYR C C 25 173.784 173.784 173.675 0.109 25485 133 1 1 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.051 1.196 25485 134 1 1 . 1 1 25 25 TYR CB C 25 39.079 39.079 40.265 -1.186 25485 135 1 1 . 1 1 25 25 TYR H H 25 7.845 7.845 8.242 -0.397 25485 136 1 1 . 1 1 26 26 ASP N N 26 129.338 129.338 127.899 1.439 25485 137 1 1 . 1 1 26 26 ASP HA H 26 4.451 4.451 4.995 -0.544 25485 138 1 1 . 1 1 26 26 ASP C C 26 175.282 175.282 175.813 -0.531 25485 139 1 1 . 1 1 26 26 ASP CA C 26 52.433 52.433 54.338 -1.905 25485 140 1 1 . 1 1 26 26 ASP CB C 26 41.249 41.249 40.766 0.483 25485 141 1 1 . 1 1 26 26 ASP H H 26 8.108 8.108 8.676 -0.568 25485 142 1 1 . 1 1 27 27 SER C C 27 175.204 175.204 176.133 -0.929 25485 143 1 1 . 1 1 27 27 SER CA C 27 59.424 59.424 60.530 -1.106 25485 144 1 1 . 1 1 27 27 SER CB C 27 63.535 63.535 63.851 -0.316 25485 145 1 1 . 1 1 28 28 GLU N N 28 122.058 122.058 122.417 -0.359 25485 146 1 1 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.186 0.139 25485 147 1 1 . 1 1 28 28 GLU C C 28 177.073 177.073 177.148 -0.075 25485 148 1 1 . 1 1 28 28 GLU CA C 28 57.212 57.212 59.013 -1.801 25485 149 1 1 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.148 0.422 25485 150 1 1 . 1 1 28 28 GLU H H 28 8.255 8.255 8.798 -0.543 25485 151 1 1 . 1 1 29 29 THR N N 29 114.161 114.161 107.566 6.595 25485 152 1 1 . 1 1 29 29 THR HA H 29 4.260 4.260 4.370 -0.110 25485 153 1 1 . 1 1 29 29 THR C C 29 174.591 174.591 173.794 0.797 25485 154 1 1 . 1 1 29 29 THR CA C 29 61.976 61.976 61.354 0.622 25485 155 1 1 . 1 1 29 29 THR CB C 29 69.385 69.385 68.387 0.998 25485 156 1 1 . 1 1 29 29 THR H H 29 7.498 7.498 7.880 -0.382 25485 157 1 1 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.269 -0.051 25485 158 1 1 . 1 1 30 30 LYS H H 30 8.218 8.218 7.578 0.640 25485 159 1 1 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.696 -0.272 25485 160 1 1 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.527 -1.394 25485 161 1 1 . 1 1 32 32 ALA N N 32 126.484 126.484 122.873 3.611 25485 162 1 1 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.181 0.115 25485 163 1 1 . 1 1 32 32 ALA C C 32 178.012 178.012 178.502 -0.490 25485 164 1 1 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.956 -1.196 25485 165 1 1 . 1 1 32 32 ALA CB C 32 18.770 18.770 18.844 -0.074 25485 166 1 1 . 1 1 32 32 ALA H H 32 8.411 8.411 8.663 -0.252 25485 167 1 1 . 1 1 33 33 ASN N N 33 116.885 116.885 115.589 1.296 25485 168 1 1 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.629 0.069 25485 169 1 1 . 1 1 33 33 ASN C C 33 176.240 176.240 177.024 -0.784 25485 170 1 1 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.443 -1.256 25485 171 1 1 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.195 0.390 25485 172 1 1 . 1 1 33 33 ASN H H 33 8.309 8.309 8.621 -0.312 25485 173 1 1 . 1 1 34 34 SER N N 34 116.836 116.836 116.506 0.330 25485 174 1 1 . 1 1 34 34 SER HA H 34 4.544 4.544 4.252 0.292 25485 175 1 1 . 1 1 34 34 SER C C 34 175.253 175.253 175.863 -0.610 25485 176 1 1 . 1 1 34 34 SER CA C 34 59.583 59.583 61.123 -1.540 25485 177 1 1 . 1 1 34 34 SER CB C 34 63.919 63.919 62.740 1.179 25485 178 1 1 . 1 1 34 34 SER H H 34 8.115 8.115 8.364 -0.249 25485 179 1 1 . 1 1 35 35 LEU N N 35 125.355 125.355 123.568 1.787 25485 180 1 1 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.060 -0.484 25485 181 1 1 . 1 1 35 35 LEU C C 35 177.973 177.973 177.748 0.225 25485 182 1 1 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.177 0.320 25485 183 1 1 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.793 -1.101 25485 184 1 1 . 1 1 35 35 LEU H H 35 8.312 8.312 7.796 0.516 25485 185 1 1 . 1 1 36 36 GLU N N 36 119.201 119.201 118.705 0.496 25485 186 1 1 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.911 0.003 25485 187 1 1 . 1 1 36 36 GLU C C 36 178.141 178.141 178.874 -0.733 25485 188 1 1 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.580 0.079 25485 189 1 1 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.035 0.278 25485 190 1 1 . 1 1 36 36 GLU H H 36 8.225 8.225 7.957 0.268 25485 191 1 1 . 1 1 37 37 ALA N N 37 120.746 120.746 121.807 -1.061 25485 192 1 1 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.128 -0.049 25485 193 1 1 . 1 1 37 37 ALA C C 37 181.485 181.485 179.728 1.757 25485 194 1 1 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.819 0.640 25485 195 1 1 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.373 -0.206 25485 196 1 1 . 1 1 37 37 ALA H H 37 7.917 7.917 7.740 0.177 25485 197 1 1 . 1 1 38 38 LYS N N 38 119.326 119.326 120.388 -1.062 25485 198 1 1 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.503 -0.172 25485 199 1 1 . 1 1 38 38 LYS C C 38 177.946 177.946 178.987 -1.041 25485 200 1 1 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.495 -0.791 25485 201 1 1 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.395 -0.595 25485 202 1 1 . 1 1 38 38 LYS H H 38 8.216 8.216 8.044 0.172 25485 203 1 1 . 1 1 39 39 LEU N N 39 122.736 122.736 119.458 3.278 25485 204 1 1 . 1 1 39 39 LEU HA H 39 3.941 3.941 4.053 -0.112 25485 205 1 1 . 1 1 39 39 LEU C C 39 178.819 178.819 178.897 -0.078 25485 206 1 1 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.120 -0.039 25485 207 1 1 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.400 -0.772 25485 208 1 1 . 1 1 39 39 LEU H H 39 8.666 8.666 8.655 0.011 25485 209 1 1 . 1 1 40 40 LYS N N 40 118.411 118.411 120.706 -2.295 25485 210 1 1 . 1 1 40 40 LYS HA H 40 4.638 4.638 4.311 0.327 25485 211 1 1 . 1 1 40 40 LYS C C 40 179.329 179.329 179.257 0.072 25485 212 1 1 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.934 0.199 25485 213 1 1 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.547 -0.762 25485 214 1 1 . 1 1 40 40 LYS H H 40 8.227 8.227 8.197 0.030 25485 215 1 1 . 1 1 41 41 GLU N N 41 121.329 121.329 118.168 3.161 25485 216 1 1 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.118 -0.025 25485 217 1 1 . 1 1 41 41 GLU C C 41 178.989 178.989 179.174 -0.185 25485 218 1 1 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.892 0.867 25485 219 1 1 . 1 1 41 41 GLU CB C 41 29.836 29.836 29.293 0.543 25485 220 1 1 . 1 1 41 41 GLU H H 41 7.718 7.718 7.846 -0.128 25485 221 1 1 . 1 1 42 42 MET N N 42 123.817 123.817 121.419 2.398 25485 222 1 1 . 1 1 42 42 MET HA H 42 4.107 4.107 4.406 -0.299 25485 223 1 1 . 1 1 42 42 MET C C 42 177.719 177.719 178.212 -0.493 25485 224 1 1 . 1 1 42 42 MET CA C 42 59.912 59.912 58.378 1.534 25485 225 1 1 . 1 1 42 42 MET CB C 42 30.506 30.506 32.768 -2.262 25485 226 1 1 . 1 1 42 42 MET H H 42 7.657 7.657 8.095 -0.438 25485 227 1 1 . 1 1 43 43 GLN N N 43 119.998 119.998 118.754 1.244 25485 228 1 1 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.976 -0.171 25485 229 1 1 . 1 1 43 43 GLN C C 43 177.604 177.604 178.729 -1.125 25485 230 1 1 . 1 1 43 43 GLN CA C 43 59.965 59.965 59.332 0.633 25485 231 1 1 . 1 1 43 43 GLN CB C 43 26.555 26.555 28.459 -1.904 25485 232 1 1 . 1 1 43 43 GLN H H 43 8.910 8.910 8.640 0.270 25485 233 1 1 . 1 1 44 44 LYS N N 44 119.165 119.165 118.317 0.848 25485 234 1 1 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.209 -0.154 25485 235 1 1 . 1 1 44 44 LYS C C 44 179.991 179.991 178.753 1.238 25485 236 1 1 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.209 1.352 25485 237 1 1 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.229 0.069 25485 238 1 1 . 1 1 44 44 LYS H H 44 8.507 8.507 7.735 0.772 25485 239 1 1 . 1 1 45 45 PHE N N 45 123.602 123.602 120.178 3.424 25485 240 1 1 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.316 -0.415 25485 241 1 1 . 1 1 45 45 PHE C C 45 177.606 177.606 176.515 1.091 25485 242 1 1 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.565 2.469 25485 243 1 1 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.182 0.684 25485 244 1 1 . 1 1 45 45 PHE H H 45 8.445 8.445 7.571 0.874 25485 245 1 1 . 1 1 46 46 PHE N N 46 112.715 112.715 115.796 -3.081 25485 246 1 1 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.435 0.162 25485 247 1 1 . 1 1 46 46 PHE C C 46 175.285 175.285 176.711 -1.426 25485 248 1 1 . 1 1 46 46 PHE CA C 46 60.675 60.675 60.220 0.455 25485 249 1 1 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.268 -0.809 25485 250 1 1 . 1 1 46 46 PHE H H 46 8.272 8.272 8.010 0.262 25485 251 1 1 . 1 1 47 47 GLY N N 47 110.438 110.438 106.494 3.944 25485 252 1 1 . 1 1 47 47 GLY C C 47 174.935 174.935 174.435 0.500 25485 253 1 1 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.233 1.778 25485 254 1 1 . 1 1 47 47 GLY H H 47 7.926 7.926 8.018 -0.092 25485 255 1 1 . 1 1 48 48 LEU N N 48 121.830 121.830 119.452 2.378 25485 256 1 1 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.655 0.269 25485 257 1 1 . 1 1 48 48 LEU C C 48 174.009 174.009 176.024 -2.015 25485 258 1 1 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.620 -1.785 25485 259 1 1 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.822 0.641 25485 260 1 1 . 1 1 48 48 LEU H H 48 8.762 8.762 7.599 1.163 25485 261 1 1 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.372 -0.134 25485 262 1 1 . 1 1 49 49 PRO C C 49 176.874 176.874 176.874 0.000 25485 263 1 1 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.917 -0.399 25485 264 1 1 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.872 -0.793 25485 265 1 1 . 1 1 50 50 ILE N N 50 126.859 126.859 118.352 8.507 25485 266 1 1 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.018 0.083 25485 267 1 1 . 1 1 50 50 ILE C C 50 176.540 176.540 175.395 1.145 25485 268 1 1 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.077 -1.121 25485 269 1 1 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.333 -0.940 25485 270 1 1 . 1 1 50 50 ILE H H 50 8.548 8.548 7.831 0.717 25485 271 1 1 . 1 1 51 51 THR N N 51 116.443 116.443 119.001 -2.558 25485 272 1 1 . 1 1 51 51 THR HA H 51 4.584 4.584 4.583 0.001 25485 273 1 1 . 1 1 51 51 THR C C 51 176.672 176.672 175.250 1.422 25485 274 1 1 . 1 1 51 51 THR CA C 51 60.979 60.979 60.050 0.929 25485 275 1 1 . 1 1 51 51 THR CB C 51 71.505 71.505 70.398 1.107 25485 276 1 1 . 1 1 51 51 THR H H 51 8.001 8.001 7.629 0.372 25485 277 1 1 . 1 1 52 52 GLY N N 52 112.719 112.719 110.390 2.329 25485 278 1 1 . 1 1 52 52 GLY C C 52 170.609 170.609 173.900 -3.291 25485 279 1 1 . 1 1 52 52 GLY CA C 52 46.746 46.746 46.255 0.491 25485 280 1 1 . 1 1 52 52 GLY H H 52 9.499 9.499 9.131 0.368 25485 281 1 1 . 1 1 53 53 MET N N 53 116.621 116.621 117.411 -0.790 25485 282 1 1 . 1 1 53 53 MET HA H 53 4.023 4.023 4.670 -0.647 25485 283 1 1 . 1 1 53 53 MET C C 53 174.695 174.695 174.304 0.391 25485 284 1 1 . 1 1 53 53 MET CA C 53 53.460 53.460 53.555 -0.095 25485 285 1 1 . 1 1 53 53 MET CB C 53 35.408 35.408 36.289 -0.881 25485 286 1 1 . 1 1 53 53 MET H H 53 7.993 7.993 7.366 0.627 25485 287 1 1 . 1 1 54 54 LEU N N 54 122.679 122.679 121.694 0.985 25485 288 1 1 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.272 -0.521 25485 289 1 1 . 1 1 54 54 LEU C C 54 174.784 174.784 173.941 0.843 25485 290 1 1 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.234 0.067 25485 291 1 1 . 1 1 54 54 LEU CB C 54 42.010 42.010 43.131 -1.121 25485 292 1 1 . 1 1 54 54 LEU H H 54 7.940 7.940 8.406 -0.466 25485 293 1 1 . 1 1 55 55 ASN N N 55 115.797 115.797 120.762 -4.965 25485 294 1 1 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.549 0.200 25485 295 1 1 . 1 1 55 55 ASN C C 55 175.459 175.459 174.853 0.606 25485 296 1 1 . 1 1 55 55 ASN CA C 55 51.843 51.843 54.053 -2.210 25485 297 1 1 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.799 1.558 25485 298 1 1 . 1 1 55 55 ASN H H 55 6.543 6.543 8.473 -1.930 25485 299 1 1 . 1 1 56 56 SER N N 56 121.507 121.507 115.783 5.724 25485 300 1 1 . 1 1 56 56 SER HA H 56 4.638 4.638 4.398 0.240 25485 301 1 1 . 1 1 56 56 SER C C 56 175.727 175.727 175.623 0.104 25485 302 1 1 . 1 1 56 56 SER CA C 56 57.932 57.932 60.303 -2.371 25485 303 1 1 . 1 1 56 56 SER CB C 56 63.786 63.786 63.571 0.215 25485 304 1 1 . 1 1 56 56 SER H H 56 8.213 8.213 8.018 0.195 25485 305 1 1 . 1 1 57 57 ARG N N 57 122.951 122.951 120.344 2.607 25485 306 1 1 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.563 -0.362 25485 307 1 1 . 1 1 57 57 ARG C C 57 178.560 178.560 178.055 0.505 25485 308 1 1 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.466 -0.034 25485 309 1 1 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.672 -0.567 25485 310 1 1 . 1 1 57 57 ARG H H 57 7.895 7.895 8.347 -0.452 25485 311 1 1 . 1 1 58 58 VAL N N 58 118.778 118.778 120.032 -1.254 25485 312 1 1 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.502 -0.171 25485 313 1 1 . 1 1 58 58 VAL C C 58 177.370 177.370 177.458 -0.088 25485 314 1 1 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.543 -0.161 25485 315 1 1 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.457 0.751 25485 316 1 1 . 1 1 58 58 VAL H H 58 7.583 7.583 7.860 -0.277 25485 317 1 1 . 1 1 59 59 ILE N N 59 119.159 119.159 117.227 1.932 25485 318 1 1 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.610 -0.197 25485 319 1 1 . 1 1 59 59 ILE C C 59 177.067 177.067 177.737 -0.670 25485 320 1 1 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.087 0.546 25485 321 1 1 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.822 -0.126 25485 322 1 1 . 1 1 59 59 ILE H H 59 7.323 7.323 7.871 -0.548 25485 323 1 1 . 1 1 60 60 GLU N N 60 119.367 119.367 120.002 -0.635 25485 324 1 1 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.886 -0.148 25485 325 1 1 . 1 1 60 60 GLU C C 60 179.978 179.978 179.127 0.851 25485 326 1 1 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.956 -0.698 25485 327 1 1 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.550 -0.162 25485 328 1 1 . 1 1 60 60 GLU H H 60 7.879 7.879 7.375 0.504 25485 329 1 1 . 1 1 61 61 ILE N N 61 118.816 118.816 115.760 3.056 25485 330 1 1 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.816 -0.377 25485 331 1 1 . 1 1 61 61 ILE C C 61 179.033 179.033 176.594 2.439 25485 332 1 1 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.351 0.487 25485 333 1 1 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.862 -0.964 25485 334 1 1 . 1 1 61 61 ILE H H 61 7.246 7.246 7.493 -0.247 25485 335 1 1 . 1 1 62 62 MET N N 62 119.986 119.986 115.613 4.373 25485 336 1 1 . 1 1 62 62 MET HA H 62 3.444 3.444 4.011 -0.567 25485 337 1 1 . 1 1 62 62 MET C C 62 176.185 176.185 177.427 -1.242 25485 338 1 1 . 1 1 62 62 MET CA C 62 59.014 59.014 57.192 1.822 25485 339 1 1 . 1 1 62 62 MET CB C 62 31.250 31.250 32.047 -0.797 25485 340 1 1 . 1 1 62 62 MET H H 62 7.835 7.835 7.301 0.534 25485 341 1 1 . 1 1 63 63 GLN N N 63 116.163 116.163 114.971 1.192 25485 342 1 1 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.152 0.126 25485 343 1 1 . 1 1 63 63 GLN C C 63 176.727 176.727 176.661 0.066 25485 344 1 1 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.246 -0.108 25485 345 1 1 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.416 -0.350 25485 346 1 1 . 1 1 63 63 GLN H H 63 7.454 7.454 7.368 0.086 25485 347 1 1 . 1 1 64 64 LYS N N 64 121.430 121.430 121.914 -0.484 25485 348 1 1 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.509 0.034 25485 349 1 1 . 1 1 64 64 LYS C C 64 174.724 174.724 175.011 -0.287 25485 350 1 1 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.437 1.080 25485 351 1 1 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.358 -0.760 25485 352 1 1 . 1 1 64 64 LYS H H 64 7.483 7.483 7.601 -0.118 25485 353 1 1 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.516 -2.080 25485 354 1 1 . 1 1 65 65 PRO C C 65 176.158 176.158 176.172 -0.014 25485 355 1 1 . 1 1 65 65 PRO CA C 65 62.888 62.888 62.813 0.075 25485 356 1 1 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.608 -0.775 25485 357 1 1 . 1 1 66 66 ARG N N 66 112.697 112.697 119.386 -6.689 25485 358 1 1 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.650 -0.242 25485 359 1 1 . 1 1 66 66 ARG C C 66 174.478 174.478 174.497 -0.019 25485 360 1 1 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.677 -2.041 25485 361 1 1 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.395 3.278 25485 362 1 1 . 1 1 66 66 ARG H H 66 8.146 8.146 8.653 -0.507 25485 363 1 1 . 1 1 67 67 CYS N N 67 121.740 121.740 117.192 4.548 25485 364 1 1 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.650 -0.210 25485 365 1 1 . 1 1 67 67 CYS C C 67 175.659 175.659 175.308 0.351 25485 366 1 1 . 1 1 67 67 CYS CA C 67 59.195 59.195 57.630 1.565 25485 367 1 1 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.196 -0.990 25485 368 1 1 . 1 1 67 67 CYS H H 67 7.757 7.757 8.228 -0.471 25485 369 1 1 . 1 1 68 68 GLY N N 68 116.217 116.217 112.221 3.996 25485 370 1 1 . 1 1 68 68 GLY C C 68 172.210 172.210 172.928 -0.718 25485 371 1 1 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.728 1.831 25485 372 1 1 . 1 1 68 68 GLY H H 68 9.704 9.704 9.208 0.496 25485 373 1 1 . 1 1 69 69 VAL N N 69 126.372 126.372 119.711 6.661 25485 374 1 1 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.337 -0.506 25485 375 1 1 . 1 1 69 69 VAL C C 69 173.538 173.538 173.983 -0.445 25485 376 1 1 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.094 3.274 25485 377 1 1 . 1 1 69 69 VAL CB C 69 32.523 32.523 31.722 0.801 25485 378 1 1 . 1 1 69 69 VAL H H 69 9.113 9.113 7.454 1.659 25485 379 1 1 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.662 0.288 25485 380 1 1 . 1 1 70 70 PRO C C 70 175.019 175.019 176.430 -1.411 25485 381 1 1 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.578 0.770 25485 382 1 1 . 1 1 70 70 PRO CB C 70 32.358 32.358 33.128 -0.770 25485 383 1 1 . 1 1 71 71 ASP N N 71 118.986 118.986 118.727 0.259 25485 384 1 1 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.894 -0.461 25485 385 1 1 . 1 1 71 71 ASP C C 71 175.166 175.166 175.764 -0.598 25485 386 1 1 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.644 1.724 25485 387 1 1 . 1 1 71 71 ASP CB C 71 39.864 39.864 42.620 -2.756 25485 388 1 1 . 1 1 71 71 ASP H H 71 8.054 8.054 8.287 -0.233 25485 389 1 1 . 1 1 72 72 VAL N N 72 112.953 112.953 116.561 -3.608 25485 390 1 1 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.456 -0.160 25485 391 1 1 . 1 1 72 72 VAL C C 72 174.330 174.330 174.487 -0.157 25485 392 1 1 . 1 1 72 72 VAL CA C 72 59.645 59.645 61.048 -1.403 25485 393 1 1 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.817 0.055 25485 394 1 1 . 1 1 72 72 VAL H H 72 6.430 6.430 7.764 -1.334 25485 395 1 1 . 1 1 73 73 ALA N N 73 125.869 125.869 130.108 -4.239 25485 396 1 1 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.751 -0.446 25485 397 1 1 . 1 1 73 73 ALA C C 73 177.382 177.382 176.472 0.910 25485 398 1 1 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.671 0.378 25485 399 1 1 . 1 1 73 73 ALA CB C 73 19.951 19.951 21.231 -1.280 25485 400 1 1 . 1 1 73 73 ALA H H 73 8.177 8.177 8.123 0.054 25485 401 1 1 . 1 1 74 74 GLU N N 74 120.724 120.724 119.673 1.051 25485 402 1 1 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.465 -0.362 25485 403 1 1 . 1 1 74 74 GLU C C 74 176.246 176.246 174.964 1.282 25485 404 1 1 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.504 0.288 25485 405 1 1 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.380 -1.595 25485 406 1 1 . 1 1 74 74 GLU H H 74 8.381 8.381 8.540 -0.159 25485 407 1 1 . 1 1 75 75 TYR N N 75 121.473 121.473 122.698 -1.225 25485 408 1 1 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.146 0.299 25485 409 1 1 . 1 1 75 75 TYR C C 75 175.633 175.633 174.605 1.028 25485 410 1 1 . 1 1 75 75 TYR CA C 75 58.327 58.327 59.454 -1.127 25485 411 1 1 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.528 -0.115 25485 412 1 1 . 1 1 75 75 TYR H H 75 8.065 8.065 8.802 -0.737 25485 413 1 1 . 1 1 76 76 SER N N 76 117.860 117.860 116.289 1.571 25485 414 1 1 . 1 1 76 76 SER HA H 76 3.886 3.886 4.174 -0.288 25485 415 1 1 . 1 1 76 76 SER C C 76 173.859 173.859 174.646 -0.787 25485 416 1 1 . 1 1 76 76 SER CA C 76 58.250 58.250 58.695 -0.445 25485 417 1 1 . 1 1 76 76 SER CB C 76 64.117 64.117 63.201 0.916 25485 418 1 1 . 1 1 76 76 SER H H 76 7.748 7.748 8.112 -0.364 25485 419 1 1 . 1 1 77 77 LEU N N 77 123.789 123.789 118.776 5.013 25485 420 1 1 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.334 0.812 25485 421 1 1 . 1 1 77 77 LEU C C 77 176.451 176.451 175.887 0.564 25485 422 1 1 . 1 1 77 77 LEU CA C 77 55.464 55.464 56.636 -1.172 25485 423 1 1 . 1 1 77 77 LEU CB C 77 41.957 41.957 40.485 1.472 25485 424 1 1 . 1 1 77 77 LEU H H 77 7.979 7.979 8.180 -0.201 25485 425 1 1 . 1 1 78 78 PHE N N 78 119.275 119.275 113.771 5.504 25485 426 1 1 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.193 0.683 25485 427 1 1 . 1 1 78 78 PHE C C 78 173.844 173.844 173.688 0.156 25485 428 1 1 . 1 1 78 78 PHE CA C 78 55.372 55.372 56.891 -1.519 25485 429 1 1 . 1 1 78 78 PHE CB C 78 39.164 39.164 36.334 2.830 25485 430 1 1 . 1 1 78 78 PHE H H 78 7.827 7.827 7.960 -0.133 25485 431 1 1 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.227 0.129 25485 432 1 1 . 1 1 79 79 PRO C C 79 176.433 176.433 176.333 0.100 25485 433 1 1 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.275 1.575 25485 434 1 1 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.427 -0.735 25485 435 1 1 . 1 1 80 80 ASN N N 80 118.057 118.057 119.026 -0.969 25485 436 1 1 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.688 -0.041 25485 437 1 1 . 1 1 80 80 ASN C C 80 174.305 174.305 174.823 -0.518 25485 438 1 1 . 1 1 80 80 ASN CA C 80 52.860 52.860 53.443 -0.583 25485 439 1 1 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.768 0.815 25485 440 1 1 . 1 1 80 80 ASN H H 80 8.068 8.068 8.439 -0.371 25485 441 1 1 . 1 1 81 81 SER HA H 81 4.565 4.565 4.273 0.292 25485 442 1 1 . 1 1 81 81 SER CA C 81 56.800 56.800 58.617 -1.817 25485 443 1 1 . 1 1 81 81 SER CB C 81 63.128 63.128 63.886 -0.758 25485 444 1 1 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.272 0.189 25485 445 1 1 . 1 1 82 82 PRO C C 82 174.589 174.589 176.297 -1.708 25485 446 1 1 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.513 -0.867 25485 447 1 1 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.408 -1.154 25485 448 1 1 . 1 1 83 83 LYS N N 83 114.578 114.578 119.297 -4.719 25485 449 1 1 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.215 -0.062 25485 450 1 1 . 1 1 83 83 LYS C C 83 175.308 175.308 176.737 -1.429 25485 451 1 1 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.870 -1.463 25485 452 1 1 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.485 0.933 25485 453 1 1 . 1 1 83 83 LYS H H 83 7.356 7.356 7.618 -0.262 25485 454 1 1 . 1 1 84 84 TRP N N 84 122.455 122.455 120.240 2.215 25485 455 1 1 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.586 -0.566 25485 456 1 1 . 1 1 84 84 TRP C C 84 177.636 177.636 177.407 0.229 25485 457 1 1 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.334 -0.863 25485 458 1 1 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.428 0.890 25485 459 1 1 . 1 1 84 84 TRP H H 84 8.050 8.050 8.165 -0.115 25485 460 1 1 . 1 1 85 85 THR N N 85 113.501 113.501 116.949 -3.448 25485 461 1 1 . 1 1 85 85 THR HA H 85 4.573 4.573 4.439 0.134 25485 462 1 1 . 1 1 85 85 THR C C 85 174.757 174.757 174.403 0.354 25485 463 1 1 . 1 1 85 85 THR CA C 85 62.130 62.130 61.788 0.342 25485 464 1 1 . 1 1 85 85 THR CB C 85 69.107 69.107 69.896 -0.789 25485 465 1 1 . 1 1 85 85 THR H H 85 8.861 8.861 8.733 0.128 25485 466 1 1 . 1 1 86 86 SER N N 86 117.270 117.270 117.260 0.010 25485 467 1 1 . 1 1 86 86 SER HA H 86 4.741 4.741 4.627 0.114 25485 468 1 1 . 1 1 86 86 SER C C 86 173.457 173.457 174.741 -1.284 25485 469 1 1 . 1 1 86 86 SER CA C 86 56.739 56.739 58.995 -2.256 25485 470 1 1 . 1 1 86 86 SER CB C 86 64.717 64.717 64.204 0.513 25485 471 1 1 . 1 1 86 86 SER H H 86 7.743 7.743 8.376 -0.633 25485 472 1 1 . 1 1 87 87 LYS N N 87 120.329 120.329 119.540 0.789 25485 473 1 1 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.466 -0.237 25485 474 1 1 . 1 1 87 87 LYS CA C 87 57.592 57.592 56.119 1.473 25485 475 1 1 . 1 1 87 87 LYS CB C 87 32.123 32.123 33.085 -0.962 25485 476 1 1 . 1 1 87 87 LYS H H 87 8.285 8.285 8.455 -0.170 25485 477 1 1 . 1 1 88 88 VAL N N 88 117.531 117.531 117.224 0.307 25485 478 1 1 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.590 0.065 25485 479 1 1 . 1 1 88 88 VAL C C 88 174.868 174.868 174.094 0.774 25485 480 1 1 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.715 -0.620 25485 481 1 1 . 1 1 88 88 VAL CB C 88 33.695 33.695 34.900 -1.204 25485 482 1 1 . 1 1 88 88 VAL H H 88 7.428 7.428 7.220 0.208 25485 483 1 1 . 1 1 89 89 VAL N N 89 131.452 131.452 125.559 5.893 25485 484 1 1 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.040 0.119 25485 485 1 1 . 1 1 89 89 VAL C C 89 175.758 175.758 174.635 1.123 25485 486 1 1 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.402 0.319 25485 487 1 1 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.042 0.131 25485 488 1 1 . 1 1 89 89 VAL H H 89 8.603 8.603 8.234 0.369 25485 489 1 1 . 1 1 90 90 THR N N 90 118.206 118.206 115.346 2.860 25485 490 1 1 . 1 1 90 90 THR HA H 90 5.649 5.649 5.308 0.341 25485 491 1 1 . 1 1 90 90 THR C C 90 174.579 174.579 173.843 0.736 25485 492 1 1 . 1 1 90 90 THR CA C 90 58.959 58.959 59.493 -0.534 25485 493 1 1 . 1 1 90 90 THR CB C 90 72.288 72.288 72.562 -0.274 25485 494 1 1 . 1 1 90 90 THR H H 90 9.021 9.021 7.945 1.076 25485 495 1 1 . 1 1 91 91 TYR N N 91 118.117 118.117 116.136 1.981 25485 496 1 1 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.692 0.006 25485 497 1 1 . 1 1 91 91 TYR C C 91 171.233 171.233 172.817 -1.584 25485 498 1 1 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.869 -0.437 25485 499 1 1 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.311 0.949 25485 500 1 1 . 1 1 91 91 TYR H H 91 8.555 8.555 8.256 0.299 25485 501 1 1 . 1 1 92 92 ARG N N 92 120.252 120.252 120.013 0.239 25485 502 1 1 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.610 0.087 25485 503 1 1 . 1 1 92 92 ARG C C 92 173.932 173.932 174.398 -0.466 25485 504 1 1 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.572 0.269 25485 505 1 1 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.556 0.130 25485 506 1 1 . 1 1 92 92 ARG H H 92 8.520 8.520 9.074 -0.554 25485 507 1 1 . 1 1 93 93 ILE N N 93 128.305 128.305 127.038 1.267 25485 508 1 1 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.432 0.200 25485 509 1 1 . 1 1 93 93 ILE C C 93 175.468 175.468 176.501 -1.033 25485 510 1 1 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.369 0.859 25485 511 1 1 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.727 0.498 25485 512 1 1 . 1 1 93 93 ILE H H 93 8.886 8.886 8.745 0.141 25485 513 1 1 . 1 1 94 94 VAL N N 94 126.647 126.647 128.418 -1.771 25485 514 1 1 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.092 -0.096 25485 515 1 1 . 1 1 94 94 VAL C C 94 175.670 175.670 176.314 -0.644 25485 516 1 1 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.718 -1.304 25485 517 1 1 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.536 0.483 25485 518 1 1 . 1 1 94 94 VAL H H 94 9.517 9.517 8.871 0.646 25485 519 1 1 . 1 1 95 95 SER N N 95 113.398 113.398 112.716 0.682 25485 520 1 1 . 1 1 95 95 SER HA H 95 4.701 4.701 4.758 -0.057 25485 521 1 1 . 1 1 95 95 SER C C 95 170.684 170.684 172.752 -2.068 25485 522 1 1 . 1 1 95 95 SER CA C 95 56.945 56.945 57.625 -0.680 25485 523 1 1 . 1 1 95 95 SER CB C 95 65.276 65.276 65.002 0.274 25485 524 1 1 . 1 1 95 95 SER H H 95 7.463 7.463 7.639 -0.176 25485 525 1 1 . 1 1 96 96 TYR N N 96 116.512 116.512 119.115 -2.603 25485 526 1 1 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.678 -0.413 25485 527 1 1 . 1 1 96 96 TYR C C 96 174.856 174.856 174.506 0.350 25485 528 1 1 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.407 2.230 25485 529 1 1 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.660 1.502 25485 530 1 1 . 1 1 96 96 TYR H H 96 8.240 8.240 8.277 -0.037 25485 531 1 1 . 1 1 97 97 THR CA C 97 57.798 57.798 60.891 -3.093 25485 532 1 1 . 1 1 97 97 THR CB C 97 67.420 67.420 69.663 -2.243 25485 533 1 1 . 1 1 98 98 ARG N N 98 128.156 128.156 123.502 4.654 25485 534 1 1 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.168 0.157 25485 535 1 1 . 1 1 98 98 ARG C C 98 177.625 177.625 176.449 1.176 25485 536 1 1 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.572 -1.358 25485 537 1 1 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.940 -0.460 25485 538 1 1 . 1 1 98 98 ARG H H 98 8.914 8.914 8.511 0.403 25485 539 1 1 . 1 1 99 99 ASP N N 99 120.592 120.592 117.581 3.011 25485 540 1 1 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.672 -0.291 25485 541 1 1 . 1 1 99 99 ASP C C 99 175.679 175.679 175.534 0.145 25485 542 1 1 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.273 2.163 25485 543 1 1 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.496 0.874 25485 544 1 1 . 1 1 99 99 ASP H H 99 8.708 8.708 8.261 0.447 25485 545 1 1 . 1 1 100 100 LEU N N 100 116.829 116.829 118.637 -1.808 25485 546 1 1 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.731 0.225 25485 547 1 1 . 1 1 100 100 LEU C C 100 173.335 173.335 174.042 -0.707 25485 548 1 1 . 1 1 100 100 LEU CA C 100 51.037 51.037 52.089 -1.052 25485 549 1 1 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.495 1.772 25485 550 1 1 . 1 1 100 100 LEU H H 100 6.916 6.916 7.191 -0.275 25485 551 1 1 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.183 -0.008 25485 552 1 1 . 1 1 102 102 HIS C C 102 177.649 177.649 177.564 0.085 25485 553 1 1 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.229 -0.556 25485 554 1 1 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.162 -1.728 25485 555 1 1 . 1 1 103 103 ILE N N 103 115.170 115.170 118.375 -3.205 25485 556 1 1 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.853 0.320 25485 557 1 1 . 1 1 103 103 ILE C C 103 177.214 177.214 177.216 -0.002 25485 558 1 1 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.184 -1.019 25485 559 1 1 . 1 1 103 103 ILE CB C 103 37.765 37.765 38.011 -0.246 25485 560 1 1 . 1 1 103 103 ILE H H 103 8.234 8.234 8.197 0.037 25485 561 1 1 . 1 1 104 104 THR N N 104 119.374 119.374 117.459 1.915 25485 562 1 1 . 1 1 104 104 THR HA H 104 4.045 4.045 4.042 0.003 25485 563 1 1 . 1 1 104 104 THR C C 104 175.612 175.612 176.715 -1.103 25485 564 1 1 . 1 1 104 104 THR CA C 104 66.568 66.568 66.834 -0.266 25485 565 1 1 . 1 1 104 104 THR CB C 104 68.077 68.077 68.567 -0.490 25485 566 1 1 . 1 1 104 104 THR H H 104 6.947 6.947 7.698 -0.751 25485 567 1 1 . 1 1 105 105 VAL N N 105 123.263 123.263 120.729 2.534 25485 568 1 1 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.175 0.263 25485 569 1 1 . 1 1 105 105 VAL C C 105 177.322 177.322 177.460 -0.138 25485 570 1 1 . 1 1 105 105 VAL CA C 105 67.947 67.947 66.030 1.917 25485 571 1 1 . 1 1 105 105 VAL CB C 105 31.269 31.269 30.890 0.379 25485 572 1 1 . 1 1 105 105 VAL H H 105 7.407 7.407 8.148 -0.741 25485 573 1 1 . 1 1 106 106 ASP N N 106 119.972 119.972 119.447 0.525 25485 574 1 1 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.503 -0.181 25485 575 1 1 . 1 1 106 106 ASP C C 106 179.747 179.747 178.552 1.195 25485 576 1 1 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.349 0.886 25485 577 1 1 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.958 -0.596 25485 578 1 1 . 1 1 106 106 ASP H H 106 8.627 8.627 8.046 0.581 25485 579 1 1 . 1 1 107 107 ARG N N 107 121.033 121.033 118.658 2.375 25485 580 1 1 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.115 0.063 25485 581 1 1 . 1 1 107 107 ARG C C 107 179.485 179.485 178.526 0.959 25485 582 1 1 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.982 0.598 25485 583 1 1 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.736 0.472 25485 584 1 1 . 1 1 107 107 ARG H H 107 8.356 8.356 7.925 0.431 25485 585 1 1 . 1 1 108 108 LEU N N 108 121.463 121.463 120.991 0.472 25485 586 1 1 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.182 0.123 25485 587 1 1 . 1 1 108 108 LEU C C 108 178.852 178.852 178.959 -0.107 25485 588 1 1 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.647 0.235 25485 589 1 1 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.284 0.031 25485 590 1 1 . 1 1 108 108 LEU H H 108 8.790 8.790 7.911 0.879 25485 591 1 1 . 1 1 109 109 VAL N N 109 120.233 120.233 117.143 3.090 25485 592 1 1 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.732 -0.332 25485 593 1 1 . 1 1 109 109 VAL C C 109 177.019 177.019 177.701 -0.682 25485 594 1 1 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.284 1.762 25485 595 1 1 . 1 1 109 109 VAL CB C 109 31.189 31.189 30.543 0.646 25485 596 1 1 . 1 1 109 109 VAL H H 109 8.787 8.787 7.871 0.916 25485 597 1 1 . 1 1 110 110 SER N N 110 112.862 112.862 115.946 -3.084 25485 598 1 1 . 1 1 110 110 SER HA H 110 4.300 4.300 3.874 0.426 25485 599 1 1 . 1 1 110 110 SER C C 110 176.770 176.770 176.692 0.078 25485 600 1 1 . 1 1 110 110 SER CA C 110 61.744 61.744 61.570 0.174 25485 601 1 1 . 1 1 110 110 SER CB C 110 62.742 62.742 62.667 0.075 25485 602 1 1 . 1 1 110 110 SER H H 110 7.605 7.605 7.798 -0.193 25485 603 1 1 . 1 1 111 111 LYS N N 111 122.319 122.319 122.006 0.313 25485 604 1 1 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.004 0.057 25485 605 1 1 . 1 1 111 111 LYS C C 111 178.309 178.309 178.271 0.038 25485 606 1 1 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.173 0.641 25485 607 1 1 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.504 0.005 25485 608 1 1 . 1 1 111 111 LYS H H 111 8.156 8.156 7.870 0.286 25485 609 1 1 . 1 1 112 112 ALA N N 112 124.147 124.147 120.489 3.658 25485 610 1 1 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.271 -0.172 25485 611 1 1 . 1 1 112 112 ALA C C 112 179.445 179.445 178.748 0.697 25485 612 1 1 . 1 1 112 112 ALA CA C 112 55.226 55.226 53.919 1.307 25485 613 1 1 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.306 0.668 25485 614 1 1 . 1 1 112 112 ALA H H 112 8.278 8.278 7.362 0.916 25485 615 1 1 . 1 1 113 113 LEU N N 113 116.195 116.195 120.223 -4.028 25485 616 1 1 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.037 -0.286 25485 617 1 1 . 1 1 113 113 LEU C C 113 179.537 179.537 177.860 1.677 25485 618 1 1 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.989 -0.245 25485 619 1 1 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.925 -1.370 25485 620 1 1 . 1 1 113 113 LEU H H 113 8.021 8.021 8.528 -0.507 25485 621 1 1 . 1 1 114 114 ASN N N 114 116.570 116.570 117.352 -0.782 25485 622 1 1 . 1 1 114 114 ASN HA H 114 4.546 4.546 3.971 0.575 25485 623 1 1 . 1 1 114 114 ASN C C 114 177.136 177.136 176.987 0.149 25485 624 1 1 . 1 1 114 114 ASN CA C 114 55.764 55.764 55.776 -0.012 25485 625 1 1 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.091 0.532 25485 626 1 1 . 1 1 114 114 ASN H H 114 8.212 8.212 8.038 0.174 25485 627 1 1 . 1 1 115 115 MET N N 115 122.055 122.055 119.348 2.707 25485 628 1 1 . 1 1 115 115 MET HA H 115 4.010 4.010 3.932 0.078 25485 629 1 1 . 1 1 115 115 MET C C 115 177.681 177.681 177.786 -0.105 25485 630 1 1 . 1 1 115 115 MET CA C 115 59.445 59.445 59.399 0.046 25485 631 1 1 . 1 1 115 115 MET CB C 115 31.616 31.616 32.200 -0.584 25485 632 1 1 . 1 1 115 115 MET H H 115 7.937 7.937 7.619 0.318 25485 633 1 1 . 1 1 116 116 TRP N N 116 117.115 117.115 117.964 -0.849 25485 634 1 1 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.292 0.226 25485 635 1 1 . 1 1 116 116 TRP C C 116 179.054 179.054 179.254 -0.200 25485 636 1 1 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.182 0.329 25485 637 1 1 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.495 1.378 25485 638 1 1 . 1 1 116 116 TRP H H 116 6.783 6.783 7.278 -0.495 25485 639 1 1 . 1 1 117 117 GLY N N 117 104.511 104.511 107.118 -2.607 25485 640 1 1 . 1 1 117 117 GLY C C 117 175.035 175.035 176.219 -1.184 25485 641 1 1 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.949 0.048 25485 642 1 1 . 1 1 117 117 GLY H H 117 9.302 9.302 7.571 1.731 25485 643 1 1 . 1 1 118 118 LYS N N 118 118.580 118.580 119.672 -1.092 25485 644 1 1 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.124 0.083 25485 645 1 1 . 1 1 118 118 LYS C C 118 177.235 177.235 177.579 -0.344 25485 646 1 1 . 1 1 118 118 LYS CA C 118 57.891 57.891 56.918 0.973 25485 647 1 1 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.559 0.346 25485 648 1 1 . 1 1 118 118 LYS H H 118 7.940 7.940 7.838 0.102 25485 649 1 1 . 1 1 119 119 GLU N N 119 113.749 113.749 116.998 -3.249 25485 650 1 1 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.428 0.410 25485 651 1 1 . 1 1 119 119 GLU C C 119 178.024 178.024 175.811 2.213 25485 652 1 1 . 1 1 119 119 GLU CA C 119 55.275 55.275 56.003 -0.728 25485 653 1 1 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.839 0.847 25485 654 1 1 . 1 1 119 119 GLU H H 119 7.763 7.763 7.583 0.180 25485 655 1 1 . 1 1 120 120 ILE N N 120 111.144 111.144 113.019 -1.875 25485 656 1 1 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.746 0.625 25485 657 1 1 . 1 1 120 120 ILE C C 120 174.033 174.033 173.509 0.524 25485 658 1 1 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.585 0.869 25485 659 1 1 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.634 2.295 25485 660 1 1 . 1 1 120 120 ILE H H 120 7.518 7.518 7.617 -0.099 25485 661 1 1 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.398 0.264 25485 662 1 1 . 1 1 121 121 PRO C C 121 174.784 174.784 176.984 -2.200 25485 663 1 1 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.669 -1.654 25485 664 1 1 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.787 -2.402 25485 665 1 1 . 1 1 122 122 LEU N N 122 121.531 121.531 119.747 1.784 25485 666 1 1 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.168 0.171 25485 667 1 1 . 1 1 122 122 LEU C C 122 173.977 173.977 176.413 -2.436 25485 668 1 1 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.539 -0.981 25485 669 1 1 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.783 2.616 25485 670 1 1 . 1 1 122 122 LEU H H 122 6.847 6.847 7.667 -0.820 25485 671 1 1 . 1 1 123 123 HIS N N 123 121.054 121.054 115.334 5.720 25485 672 1 1 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.802 -0.195 25485 673 1 1 . 1 1 123 123 HIS C C 123 172.820 172.820 173.362 -0.542 25485 674 1 1 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.552 -1.043 25485 675 1 1 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.859 0.251 25485 676 1 1 . 1 1 123 123 HIS H H 123 7.760 7.760 8.206 -0.446 25485 677 1 1 . 1 1 124 124 PHE N N 124 120.465 120.465 121.173 -0.708 25485 678 1 1 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.330 0.504 25485 679 1 1 . 1 1 124 124 PHE C C 124 175.677 175.677 175.054 0.623 25485 680 1 1 . 1 1 124 124 PHE CA C 124 56.292 56.292 56.900 -0.608 25485 681 1 1 . 1 1 124 124 PHE CB C 124 41.822 41.822 42.820 -0.998 25485 682 1 1 . 1 1 124 124 PHE H H 124 8.306 8.306 8.463 -0.157 25485 683 1 1 . 1 1 125 125 ARG N N 125 124.008 124.008 122.897 1.111 25485 684 1 1 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.865 -0.154 25485 685 1 1 . 1 1 125 125 ARG C C 125 172.901 172.901 175.158 -2.257 25485 686 1 1 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.814 -0.540 25485 687 1 1 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.549 -0.727 25485 688 1 1 . 1 1 125 125 ARG H H 125 8.426 8.426 8.518 -0.092 25485 689 1 1 . 1 1 126 126 LYS N N 126 130.004 130.004 124.841 5.163 25485 690 1 1 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.249 -0.866 25485 691 1 1 . 1 1 126 126 LYS C C 126 176.126 176.126 175.671 0.455 25485 692 1 1 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.804 0.377 25485 693 1 1 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.079 -0.052 25485 694 1 1 . 1 1 126 126 LYS H H 126 8.481 8.481 8.509 -0.028 25485 695 1 1 . 1 1 127 127 VAL N N 127 125.288 125.288 120.637 4.651 25485 696 1 1 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.250 0.255 25485 697 1 1 . 1 1 127 127 VAL C C 127 175.565 175.565 174.997 0.568 25485 698 1 1 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.664 -1.716 25485 699 1 1 . 1 1 127 127 VAL CB C 127 34.362 34.362 33.225 1.137 25485 700 1 1 . 1 1 127 127 VAL H H 127 8.721 8.721 7.931 0.790 25485 701 1 1 . 1 1 128 128 VAL N N 128 117.467 117.467 116.932 0.535 25485 702 1 1 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.067 0.262 25485 703 1 1 . 1 1 128 128 VAL C C 128 174.622 174.622 174.961 -0.339 25485 704 1 1 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.537 0.581 25485 705 1 1 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.945 0.565 25485 706 1 1 . 1 1 128 128 VAL H H 128 8.406 8.406 7.841 0.565 25485 707 1 1 . 1 1 129 129 TRP N N 129 119.986 119.986 122.240 -2.254 25485 708 1 1 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.959 -0.243 25485 709 1 1 . 1 1 129 129 TRP C C 129 174.536 174.536 176.592 -2.056 25485 710 1 1 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.780 -0.863 25485 711 1 1 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.350 2.664 25485 712 1 1 . 1 1 129 129 TRP H H 129 7.435 7.435 7.411 0.024 25485 713 1 1 . 1 1 130 130 GLY N N 130 109.900 109.900 113.334 -3.434 25485 714 1 1 . 1 1 130 130 GLY C C 130 173.187 173.187 173.988 -0.801 25485 715 1 1 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.469 0.011 25485 716 1 1 . 1 1 130 130 GLY H H 130 8.006 8.006 8.484 -0.478 25485 717 1 1 . 1 1 131 131 THR N N 131 116.142 116.142 115.675 0.467 25485 718 1 1 . 1 1 131 131 THR HA H 131 4.162 4.162 4.462 -0.300 25485 719 1 1 . 1 1 131 131 THR C C 131 172.766 172.766 173.307 -0.541 25485 720 1 1 . 1 1 131 131 THR CA C 131 63.212 63.212 61.558 1.654 25485 721 1 1 . 1 1 131 131 THR CB C 131 69.308 69.308 70.164 -0.856 25485 722 1 1 . 1 1 131 131 THR H H 131 8.233 8.233 8.146 0.087 25485 723 1 1 . 1 1 132 132 ALA N N 132 129.807 129.807 124.472 5.335 25485 724 1 1 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.486 0.030 25485 725 1 1 . 1 1 132 132 ALA C C 132 175.358 175.358 176.159 -0.801 25485 726 1 1 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.789 -1.423 25485 727 1 1 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.362 1.436 25485 728 1 1 . 1 1 132 132 ALA H H 132 7.962 7.962 8.489 -0.527 25485 729 1 1 . 1 1 133 133 ASP N N 133 122.896 122.896 120.034 2.862 25485 730 1 1 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.586 -0.165 25485 731 1 1 . 1 1 133 133 ASP C C 133 177.314 177.314 176.933 0.381 25485 732 1 1 . 1 1 133 133 ASP CA C 133 57.919 57.919 57.001 0.918 25485 733 1 1 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.781 -1.310 25485 734 1 1 . 1 1 133 133 ASP H H 133 8.251 8.251 8.568 -0.317 25485 735 1 1 . 1 1 134 134 ILE N N 134 125.472 125.472 120.947 4.525 25485 736 1 1 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.502 -0.359 25485 737 1 1 . 1 1 134 134 ILE C C 134 174.201 174.201 175.110 -0.909 25485 738 1 1 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.240 0.031 25485 739 1 1 . 1 1 134 134 ILE CB C 134 38.710 38.710 38.810 -0.100 25485 740 1 1 . 1 1 134 134 ILE H H 134 8.802 8.802 8.073 0.729 25485 741 1 1 . 1 1 135 135 MET N N 135 127.265 127.265 126.784 0.481 25485 742 1 1 . 1 1 135 135 MET HA H 135 5.192 5.192 5.420 -0.228 25485 743 1 1 . 1 1 135 135 MET C C 135 176.206 176.206 175.770 0.436 25485 744 1 1 . 1 1 135 135 MET CA C 135 53.626 53.626 52.314 1.312 25485 745 1 1 . 1 1 135 135 MET CB C 135 32.639 32.639 33.803 -1.164 25485 746 1 1 . 1 1 135 135 MET H H 135 7.418 7.418 8.580 -1.162 25485 747 1 1 . 1 1 136 136 ILE N N 136 125.440 125.440 124.486 0.954 25485 748 1 1 . 1 1 136 136 ILE HA H 136 5.589 5.589 5.057 0.532 25485 749 1 1 . 1 1 136 136 ILE C C 136 175.190 175.190 175.883 -0.693 25485 750 1 1 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.818 1.290 25485 751 1 1 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.794 4.146 25485 752 1 1 . 1 1 136 136 ILE H H 136 9.124 9.124 9.188 -0.064 25485 753 1 1 . 1 1 137 137 GLY N N 137 112.211 112.211 114.574 -2.363 25485 754 1 1 . 1 1 137 137 GLY C C 137 170.855 170.855 171.644 -0.789 25485 755 1 1 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.045 1.360 25485 756 1 1 . 1 1 137 137 GLY H H 137 8.594 8.594 8.139 0.455 25485 757 1 1 . 1 1 138 138 PHE N N 138 119.463 119.463 119.158 0.305 25485 758 1 1 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.322 0.174 25485 759 1 1 . 1 1 138 138 PHE C C 138 175.186 175.186 175.872 -0.686 25485 760 1 1 . 1 1 138 138 PHE CA C 138 55.995 55.995 56.714 -0.719 25485 761 1 1 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.801 -0.359 25485 762 1 1 . 1 1 138 138 PHE H H 138 7.857 7.857 8.506 -0.649 25485 763 1 1 . 1 1 139 139 ALA N N 139 123.914 123.914 122.993 0.921 25485 764 1 1 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.596 0.135 25485 765 1 1 . 1 1 139 139 ALA C C 139 174.613 174.613 175.293 -0.680 25485 766 1 1 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.456 -1.421 25485 767 1 1 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.545 1.927 25485 768 1 1 . 1 1 139 139 ALA H H 139 8.955 8.955 8.291 0.664 25485 769 1 1 . 1 1 140 140 ARG N N 140 118.339 118.339 120.547 -2.208 25485 770 1 1 . 1 1 140 140 ARG HA H 140 5.106 5.106 5.017 0.089 25485 771 1 1 . 1 1 140 140 ARG C C 140 176.201 176.201 178.430 -2.229 25485 772 1 1 . 1 1 140 140 ARG CA C 140 54.166 54.166 55.075 -0.909 25485 773 1 1 . 1 1 140 140 ARG CB C 140 33.469 33.469 33.040 0.429 25485 774 1 1 . 1 1 140 140 ARG H H 140 8.546 8.546 8.489 0.057 25485 775 1 1 . 1 1 141 141 GLY N N 141 108.916 108.916 109.507 -0.591 25485 776 1 1 . 1 1 141 141 GLY C C 141 175.595 175.595 175.855 -0.260 25485 777 1 1 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.441 -1.151 25485 778 1 1 . 1 1 141 141 GLY H H 141 8.989 8.989 9.168 -0.179 25485 779 1 1 . 1 1 142 142 ALA N N 142 121.448 121.448 123.332 -1.884 25485 780 1 1 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.211 0.197 25485 781 1 1 . 1 1 142 142 ALA C C 142 177.027 177.027 178.190 -1.163 25485 782 1 1 . 1 1 142 142 ALA CA C 142 53.277 53.277 53.623 -0.346 25485 783 1 1 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.208 -0.244 25485 784 1 1 . 1 1 142 142 ALA H H 142 8.642 8.642 8.389 0.253 25485 785 1 1 . 1 1 143 143 HIS N N 143 120.356 120.356 114.966 5.390 25485 786 1 1 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.455 0.702 25485 787 1 1 . 1 1 143 143 HIS C C 143 174.303 174.303 176.331 -2.028 25485 788 1 1 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.273 -0.820 25485 789 1 1 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.807 -2.016 25485 790 1 1 . 1 1 143 143 HIS H H 143 8.990 8.990 8.184 0.806 25485 791 1 1 . 1 1 144 144 GLY N N 144 112.517 112.517 107.954 4.563 25485 792 1 1 . 1 1 144 144 GLY C C 144 173.758 173.758 173.037 0.721 25485 793 1 1 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.347 1.748 25485 794 1 1 . 1 1 144 144 GLY H H 144 5.175 5.175 7.449 -2.274 25485 795 1 1 . 1 1 145 145 ASP N N 145 117.762 117.762 120.653 -2.891 25485 796 1 1 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.841 -0.143 25485 797 1 1 . 1 1 145 145 ASP C C 145 175.851 175.851 175.655 0.196 25485 798 1 1 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.499 -0.540 25485 799 1 1 . 1 1 145 145 ASP CB C 145 41.799 41.799 43.715 -1.916 25485 800 1 1 . 1 1 145 145 ASP H H 145 7.096 7.096 7.714 -0.618 25485 801 1 1 . 1 1 146 146 SER N N 146 125.540 125.540 117.501 8.039 25485 802 1 1 . 1 1 146 146 SER HA H 146 4.204 4.204 4.091 0.113 25485 803 1 1 . 1 1 146 146 SER C C 146 172.319 172.319 173.897 -1.578 25485 804 1 1 . 1 1 146 146 SER CA C 146 58.862 58.862 58.234 0.628 25485 805 1 1 . 1 1 146 146 SER CB C 146 62.933 62.933 63.138 -0.205 25485 806 1 1 . 1 1 146 146 SER H H 146 8.261 8.261 8.146 0.115 25485 807 1 1 . 1 1 147 147 TYR N N 147 120.757 120.757 117.272 3.485 25485 808 1 1 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.313 0.509 25485 809 1 1 . 1 1 147 147 TYR C C 147 170.372 170.372 173.614 -3.242 25485 810 1 1 . 1 1 147 147 TYR CA C 147 53.268 53.268 56.898 -3.630 25485 811 1 1 . 1 1 147 147 TYR CB C 147 38.296 38.296 37.042 1.254 25485 812 1 1 . 1 1 147 147 TYR H H 147 7.450 7.450 8.176 -0.726 25485 813 1 1 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.556 0.316 25485 814 1 1 . 1 1 148 148 PRO C C 148 179.009 179.009 176.931 2.078 25485 815 1 1 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.586 0.789 25485 816 1 1 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.564 -1.655 25485 817 1 1 . 1 1 149 149 PHE N N 149 120.514 120.514 123.205 -2.691 25485 818 1 1 . 1 1 149 149 PHE C C 149 176.813 176.813 176.108 0.705 25485 819 1 1 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.482 -1.029 25485 820 1 1 . 1 1 149 149 PHE CB C 149 38.573 38.573 39.489 -0.916 25485 821 1 1 . 1 1 149 149 PHE H H 149 8.024 8.024 8.636 -0.612 25485 822 1 1 . 1 1 150 150 ASP N N 150 115.555 115.555 116.434 -0.879 25485 823 1 1 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.442 0.397 25485 824 1 1 . 1 1 150 150 ASP C C 150 177.007 177.007 176.520 0.487 25485 825 1 1 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.486 -0.615 25485 826 1 1 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.642 2.294 25485 827 1 1 . 1 1 150 150 ASP H H 150 7.511 7.511 8.544 -1.033 25485 828 1 1 . 1 1 151 151 GLY N N 151 110.650 110.650 109.627 1.023 25485 829 1 1 . 1 1 151 151 GLY C C 151 170.281 170.281 172.102 -1.821 25485 830 1 1 . 1 1 151 151 GLY CA C 151 44.398 44.398 45.337 -0.939 25485 831 1 1 . 1 1 151 151 GLY H H 151 9.080 9.080 8.199 0.881 25485 832 1 1 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.194 -0.138 25485 833 1 1 . 1 1 152 152 PRO C C 152 178.300 178.300 176.680 1.620 25485 834 1 1 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.249 0.601 25485 835 1 1 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.872 -0.612 25485 836 1 1 . 1 1 153 153 GLY N N 153 118.783 118.783 113.166 5.617 25485 837 1 1 . 1 1 153 153 GLY C C 153 174.098 174.098 173.295 0.803 25485 838 1 1 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.432 -0.826 25485 839 1 1 . 1 1 153 153 GLY H H 153 11.431 11.431 8.105 3.326 25485 840 1 1 . 1 1 154 154 ASN N N 154 120.679 120.679 121.104 -0.425 25485 841 1 1 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.365 -0.121 25485 842 1 1 . 1 1 154 154 ASN C C 154 174.636 174.636 174.975 -0.339 25485 843 1 1 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.513 2.155 25485 844 1 1 . 1 1 154 154 ASN CB C 154 36.971 36.971 37.877 -0.906 25485 845 1 1 . 1 1 154 154 ASN H H 154 9.247 9.247 8.436 0.811 25485 846 1 1 . 1 1 155 155 THR N N 155 118.252 118.252 110.851 7.401 25485 847 1 1 . 1 1 155 155 THR HA H 155 5.577 5.577 4.175 1.402 25485 848 1 1 . 1 1 155 155 THR C C 155 176.596 176.596 173.762 2.834 25485 849 1 1 . 1 1 155 155 THR CA C 155 61.731 61.731 62.796 -1.065 25485 850 1 1 . 1 1 155 155 THR CB C 155 71.325 71.325 69.007 2.317 25485 851 1 1 . 1 1 155 155 THR H H 155 9.501 9.501 8.453 1.048 25485 852 1 1 . 1 1 156 156 LEU N N 156 122.598 122.598 123.725 -1.127 25485 853 1 1 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.518 0.353 25485 854 1 1 . 1 1 156 156 LEU C C 156 175.655 175.655 175.430 0.225 25485 855 1 1 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.518 -0.980 25485 856 1 1 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.910 1.601 25485 857 1 1 . 1 1 156 156 LEU H H 156 8.492 8.492 8.356 0.136 25485 858 1 1 . 1 1 157 157 ALA N N 157 115.389 115.389 116.359 -0.970 25485 859 1 1 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.860 0.175 25485 860 1 1 . 1 1 157 157 ALA C C 157 175.739 175.739 175.080 0.659 25485 861 1 1 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.522 -0.583 25485 862 1 1 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.576 1.878 25485 863 1 1 . 1 1 157 157 ALA H H 157 7.567 7.567 7.703 -0.136 25485 864 1 1 . 1 1 158 158 HIS N N 158 111.900 111.900 118.359 -6.459 25485 865 1 1 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.774 -0.169 25485 866 1 1 . 1 1 158 158 HIS C C 158 170.186 170.186 172.254 -2.068 25485 867 1 1 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.213 1.862 25485 868 1 1 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.420 -1.234 25485 869 1 1 . 1 1 158 158 HIS H H 158 8.757 8.757 8.174 0.583 25485 870 1 1 . 1 1 159 159 ALA N N 159 118.286 118.286 125.654 -7.368 25485 871 1 1 . 1 1 159 159 ALA HA H 159 4.654 4.654 3.994 0.660 25485 872 1 1 . 1 1 159 159 ALA C C 159 174.036 174.036 175.584 -1.548 25485 873 1 1 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.506 0.627 25485 874 1 1 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.487 2.550 25485 875 1 1 . 1 1 159 159 ALA H H 159 6.110 6.110 8.246 -2.136 25485 876 1 1 . 1 1 160 160 PHE N N 160 117.937 117.937 119.056 -1.119 25485 877 1 1 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.710 -0.207 25485 878 1 1 . 1 1 160 160 PHE C C 160 174.455 174.455 175.038 -0.583 25485 879 1 1 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.282 1.530 25485 880 1 1 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.635 0.560 25485 881 1 1 . 1 1 160 160 PHE H H 160 7.912 7.912 7.953 -0.041 25485 882 1 1 . 1 1 161 161 ALA N N 161 123.531 123.531 123.645 -0.114 25485 883 1 1 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.530 -0.039 25485 884 1 1 . 1 1 161 161 ALA C C 161 175.503 175.503 175.960 -0.457 25485 885 1 1 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.185 1.448 25485 886 1 1 . 1 1 161 161 ALA CB C 161 16.556 16.556 18.835 -2.279 25485 887 1 1 . 1 1 161 161 ALA H H 161 8.107 8.107 8.444 -0.337 25485 888 1 1 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.318 -0.408 25485 889 1 1 . 1 1 162 162 PRO C C 162 173.465 173.465 175.376 -1.911 25485 890 1 1 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.302 1.955 25485 891 1 1 . 1 1 162 162 PRO CB C 162 31.242 31.242 28.961 2.281 25485 892 1 1 . 1 1 163 163 GLY N N 163 107.206 107.206 110.392 -3.186 25485 893 1 1 . 1 1 163 163 GLY C C 163 172.092 172.092 172.640 -0.548 25485 894 1 1 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.225 -0.232 25485 895 1 1 . 1 1 163 163 GLY H H 163 5.997 5.997 7.911 -1.914 25485 896 1 1 . 1 1 165 165 GLY N N 165 103.110 103.110 108.025 -4.915 25485 897 1 1 . 1 1 165 165 GLY C C 165 177.158 177.158 175.171 1.987 25485 898 1 1 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.792 -1.549 25485 899 1 1 . 1 1 165 165 GLY H H 165 9.145 9.145 8.371 0.774 25485 900 1 1 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.249 -0.070 25485 901 1 1 . 1 1 166 166 LEU C C 166 176.437 176.437 177.477 -1.040 25485 902 1 1 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.407 -0.207 25485 903 1 1 . 1 1 166 166 LEU CB C 166 41.834 41.834 41.877 -0.043 25485 904 1 1 . 1 1 167 167 GLY N N 167 103.318 103.318 103.534 -0.216 25485 905 1 1 . 1 1 167 167 GLY C C 167 174.803 174.803 174.294 0.509 25485 906 1 1 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.953 2.280 25485 907 1 1 . 1 1 167 167 GLY H H 167 7.768 7.768 7.512 0.256 25485 908 1 1 . 1 1 168 168 GLY N N 168 121.051 121.051 110.435 10.616 25485 909 1 1 . 1 1 168 168 GLY C C 168 172.122 172.122 173.982 -1.860 25485 910 1 1 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.045 1.557 25485 911 1 1 . 1 1 168 168 GLY H H 168 7.698 7.698 8.578 -0.880 25485 912 1 1 . 1 1 169 169 ASP N N 169 123.641 123.641 121.090 2.551 25485 913 1 1 . 1 1 169 169 ASP C C 169 173.942 173.942 173.689 0.253 25485 914 1 1 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.815 2.027 25485 915 1 1 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.723 -2.853 25485 916 1 1 . 1 1 169 169 ASP H H 169 8.595 8.595 8.050 0.545 25485 917 1 1 . 1 1 170 170 ALA N N 170 119.366 119.366 119.755 -0.389 25485 918 1 1 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.419 0.311 25485 919 1 1 . 1 1 170 170 ALA C C 170 174.593 174.593 175.012 -0.419 25485 920 1 1 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.803 0.321 25485 921 1 1 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.605 0.730 25485 922 1 1 . 1 1 170 170 ALA H H 170 8.324 8.324 8.408 -0.084 25485 923 1 1 . 1 1 171 171 HIS N N 171 120.239 120.239 120.493 -0.254 25485 924 1 1 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.497 0.251 25485 925 1 1 . 1 1 171 171 HIS C C 171 172.949 172.949 174.027 -1.078 25485 926 1 1 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.312 -2.588 25485 927 1 1 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.866 0.675 25485 928 1 1 . 1 1 171 171 HIS H H 171 8.499 8.499 7.774 0.725 25485 929 1 1 . 1 1 172 172 PHE N N 172 121.125 121.125 118.499 2.626 25485 930 1 1 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.586 -0.058 25485 931 1 1 . 1 1 172 172 PHE C C 172 173.875 173.875 173.702 0.173 25485 932 1 1 . 1 1 172 172 PHE CA C 172 56.920 56.920 57.059 -0.139 25485 933 1 1 . 1 1 172 172 PHE CB C 172 41.903 41.903 42.787 -0.884 25485 934 1 1 . 1 1 172 172 PHE H H 172 8.445 8.445 8.045 0.400 25485 935 1 1 . 1 1 173 173 ASP N N 173 124.014 124.014 123.171 0.843 25485 936 1 1 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.289 -0.375 25485 937 1 1 . 1 1 173 173 ASP C C 173 178.613 178.613 177.540 1.073 25485 938 1 1 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.320 1.478 25485 939 1 1 . 1 1 173 173 ASP CB C 173 40.743 40.743 40.823 -0.080 25485 940 1 1 . 1 1 173 173 ASP H H 173 7.927 7.927 8.750 -0.823 25485 941 1 1 . 1 1 174 174 GLU N N 174 132.469 132.469 126.217 6.252 25485 942 1 1 . 1 1 174 174 GLU C C 174 176.442 176.442 177.198 -0.756 25485 943 1 1 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.890 -1.706 25485 944 1 1 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.673 0.612 25485 945 1 1 . 1 1 174 174 GLU H H 174 9.528 9.528 8.558 0.970 25485 946 1 1 . 1 1 175 175 ASP N N 175 117.394 117.394 117.678 -0.284 25485 947 1 1 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.638 0.155 25485 948 1 1 . 1 1 175 175 ASP C C 175 176.645 176.645 176.641 0.004 25485 949 1 1 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.282 0.649 25485 950 1 1 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.687 -1.546 25485 951 1 1 . 1 1 175 175 ASP H H 175 8.768 8.768 8.395 0.373 25485 952 1 1 . 1 1 176 176 GLU N N 176 116.493 116.493 118.810 -2.317 25485 953 1 1 . 1 1 176 176 GLU C C 176 175.038 175.038 176.028 -0.990 25485 954 1 1 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.415 -1.750 25485 955 1 1 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.391 -4.168 25485 956 1 1 . 1 1 176 176 GLU H H 176 7.159 7.159 8.014 -0.855 25485 957 1 1 . 1 1 177 177 ARG N N 177 122.186 122.186 119.343 2.843 25485 958 1 1 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.352 0.337 25485 959 1 1 . 1 1 177 177 ARG C C 177 174.482 174.482 174.675 -0.193 25485 960 1 1 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.225 -1.538 25485 961 1 1 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.936 -1.852 25485 962 1 1 . 1 1 177 177 ARG H H 177 7.560 7.560 8.255 -0.695 25485 963 1 1 . 1 1 178 178 TRP N N 178 129.179 129.179 124.339 4.840 25485 964 1 1 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.385 -0.285 25485 965 1 1 . 1 1 178 178 TRP C C 178 176.298 176.298 176.593 -0.295 25485 966 1 1 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.249 0.564 25485 967 1 1 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.163 -0.966 25485 968 1 1 . 1 1 178 178 TRP H H 178 8.807 8.807 8.502 0.305 25485 969 1 1 . 1 1 179 179 THR N N 179 112.792 112.792 115.082 -2.290 25485 970 1 1 . 1 1 179 179 THR HA H 179 4.985 4.985 4.566 0.419 25485 971 1 1 . 1 1 179 179 THR C C 179 172.765 172.765 172.472 0.293 25485 972 1 1 . 1 1 179 179 THR CA C 179 59.106 59.106 61.529 -2.423 25485 973 1 1 . 1 1 179 179 THR CB C 179 71.786 71.786 70.956 0.830 25485 974 1 1 . 1 1 179 179 THR H H 179 8.974 8.974 8.492 0.482 25485 975 1 1 . 1 1 180 180 ASP N N 180 122.074 122.074 124.150 -2.076 25485 976 1 1 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.139 -0.676 25485 977 1 1 . 1 1 180 180 ASP C C 180 176.366 176.366 178.461 -2.095 25485 978 1 1 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.565 -2.522 25485 979 1 1 . 1 1 180 180 ASP CB C 180 41.728 41.728 41.722 0.006 25485 980 1 1 . 1 1 180 180 ASP H H 180 8.485 8.485 8.604 -0.119 25485 981 1 1 . 1 1 181 181 GLY N N 181 110.123 110.123 109.272 0.851 25485 982 1 1 . 1 1 181 181 GLY C C 181 174.325 174.325 175.132 -0.807 25485 983 1 1 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.284 1.377 25485 984 1 1 . 1 1 181 181 GLY H H 181 8.569 8.569 8.487 0.082 25485 985 1 1 . 1 1 182 182 SER N N 182 115.562 115.562 114.588 0.974 25485 986 1 1 . 1 1 182 182 SER HA H 182 4.519 4.519 4.514 0.005 25485 987 1 1 . 1 1 182 182 SER C C 182 173.783 173.783 174.957 -1.174 25485 988 1 1 . 1 1 182 182 SER CA C 182 57.965 57.965 57.848 0.117 25485 989 1 1 . 1 1 182 182 SER CB C 182 64.166 64.166 64.212 -0.046 25485 990 1 1 . 1 1 182 182 SER H H 182 8.160 8.160 7.587 0.573 25485 991 1 1 . 1 1 183 183 SER N N 183 117.153 117.153 116.381 0.772 25485 992 1 1 . 1 1 183 183 SER HA H 183 4.275 4.275 4.393 -0.118 25485 993 1 1 . 1 1 183 183 SER C C 183 173.333 173.333 174.560 -1.227 25485 994 1 1 . 1 1 183 183 SER CA C 183 59.902 59.902 59.672 0.230 25485 995 1 1 . 1 1 183 183 SER CB C 183 64.941 64.941 61.800 3.141 25485 996 1 1 . 1 1 183 183 SER H H 183 7.796 7.796 7.772 0.024 25485 997 1 1 . 1 1 184 184 LEU N N 184 122.351 122.351 120.520 1.831 25485 998 1 1 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.495 -0.103 25485 999 1 1 . 1 1 184 184 LEU C C 184 176.250 176.250 176.680 -0.430 25485 1000 1 1 . 1 1 184 184 LEU CA C 184 55.575 55.575 56.448 -0.873 25485 1001 1 1 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.132 -1.050 25485 1002 1 1 . 1 1 184 184 LEU H H 184 8.092 8.092 7.700 0.392 25485 1003 1 1 . 1 1 185 185 GLY N N 185 108.871 108.871 106.691 2.180 25485 1004 1 1 . 1 1 185 185 GLY C C 185 172.375 172.375 173.604 -1.229 25485 1005 1 1 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.287 0.093 25485 1006 1 1 . 1 1 185 185 GLY H H 185 7.960 7.960 7.875 0.085 25485 1007 1 1 . 1 1 186 186 ILE N N 186 123.096 123.096 122.445 0.651 25485 1008 1 1 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.169 -0.328 25485 1009 1 1 . 1 1 186 186 ILE C C 186 175.350 175.350 175.874 -0.524 25485 1010 1 1 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.403 -1.002 25485 1011 1 1 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.391 0.065 25485 1012 1 1 . 1 1 186 186 ILE H H 186 8.893 8.893 8.223 0.670 25485 1013 1 1 . 1 1 187 187 ASN N N 187 127.167 127.167 127.004 0.163 25485 1014 1 1 . 1 1 187 187 ASN HA H 187 4.353 4.353 5.014 -0.661 25485 1015 1 1 . 1 1 187 187 ASN C C 187 175.849 175.849 177.043 -1.194 25485 1016 1 1 . 1 1 187 187 ASN CA C 187 55.714 55.714 53.674 2.040 25485 1017 1 1 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.477 0.653 25485 1018 1 1 . 1 1 187 187 ASN H H 187 8.580 8.580 8.526 0.054 25485 1019 1 1 . 1 1 188 188 PHE N N 188 129.985 129.985 127.251 2.734 25485 1020 1 1 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.346 0.227 25485 1021 1 1 . 1 1 188 188 PHE C C 188 175.578 175.578 177.713 -2.135 25485 1022 1 1 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.361 -0.633 25485 1023 1 1 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.600 -0.168 25485 1024 1 1 . 1 1 188 188 PHE H H 188 9.361 9.361 8.442 0.919 25485 1025 1 1 . 1 1 189 189 LEU N N 189 119.113 119.113 118.335 0.778 25485 1026 1 1 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.160 -0.359 25485 1027 1 1 . 1 1 189 189 LEU C C 189 179.601 179.601 178.617 0.984 25485 1028 1 1 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.690 -0.181 25485 1029 1 1 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.202 -1.325 25485 1030 1 1 . 1 1 189 189 LEU H H 189 8.562 8.562 8.268 0.294 25485 1031 1 1 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.972 -0.055 25485 1032 1 1 . 1 1 190 190 TYR C C 190 177.621 177.621 177.719 -0.098 25485 1033 1 1 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.079 -0.271 25485 1034 1 1 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.676 2.093 25485 1035 1 1 . 1 1 191 191 ALA N N 191 120.352 120.352 121.158 -0.806 25485 1036 1 1 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.073 0.242 25485 1037 1 1 . 1 1 191 191 ALA C C 191 180.252 180.252 178.928 1.324 25485 1038 1 1 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.671 0.511 25485 1039 1 1 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.512 0.630 25485 1040 1 1 . 1 1 191 191 ALA H H 191 7.993 7.993 8.954 -0.961 25485 1041 1 1 . 1 1 192 192 ALA N N 192 121.409 121.409 121.363 0.046 25485 1042 1 1 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.056 0.001 25485 1043 1 1 . 1 1 192 192 ALA C C 192 178.575 178.575 179.716 -1.141 25485 1044 1 1 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.566 -0.381 25485 1045 1 1 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.155 -1.957 25485 1046 1 1 . 1 1 192 192 ALA H H 192 9.297 9.297 8.486 0.811 25485 1047 1 1 . 1 1 193 193 THR N N 193 116.996 116.996 114.017 2.979 25485 1048 1 1 . 1 1 193 193 THR HA H 193 3.833 3.833 4.120 -0.287 25485 1049 1 1 . 1 1 193 193 THR CA C 193 69.138 69.138 67.406 1.732 25485 1050 1 1 . 1 1 193 193 THR CB C 193 67.365 67.365 68.336 -0.971 25485 1051 1 1 . 1 1 193 193 THR H H 193 8.226 8.226 7.735 0.491 25485 1052 1 1 . 1 1 194 194 HIS N N 194 120.296 120.296 123.058 -2.762 25485 1053 1 1 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.358 -0.122 25485 1054 1 1 . 1 1 194 194 HIS C C 194 175.962 175.962 177.062 -1.100 25485 1055 1 1 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.197 1.550 25485 1056 1 1 . 1 1 194 194 HIS CB C 194 27.919 27.919 30.098 -2.179 25485 1057 1 1 . 1 1 194 194 HIS H H 194 7.782 7.782 7.679 0.103 25485 1058 1 1 . 1 1 195 195 ALA N N 195 121.290 121.290 122.539 -1.249 25485 1059 1 1 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.949 0.207 25485 1060 1 1 . 1 1 195 195 ALA CA C 195 55.964 55.964 55.037 0.927 25485 1061 1 1 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.503 0.207 25485 1062 1 1 . 1 1 195 195 ALA H H 195 8.690 8.690 8.498 0.192 25485 1063 1 1 . 1 1 196 196 LEU N N 196 114.899 114.899 117.653 -2.754 25485 1064 1 1 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.157 0.013 25485 1065 1 1 . 1 1 196 196 LEU C C 196 177.946 177.946 179.996 -2.050 25485 1066 1 1 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.364 -1.136 25485 1067 1 1 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.955 -1.179 25485 1068 1 1 . 1 1 196 196 LEU H H 196 8.715 8.715 8.918 -0.203 25485 1069 1 1 . 1 1 197 197 GLY N N 197 107.901 107.901 106.313 1.588 25485 1070 1 1 . 1 1 197 197 GLY C C 197 178.641 178.641 175.635 3.006 25485 1071 1 1 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.752 0.815 25485 1072 1 1 . 1 1 197 197 GLY H H 197 7.546 7.546 8.285 -0.739 25485 1073 1 1 . 1 1 198 198 HIS N N 198 122.017 122.017 119.809 2.208 25485 1074 1 1 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.518 0.339 25485 1075 1 1 . 1 1 198 198 HIS C C 198 179.874 179.874 178.410 1.464 25485 1076 1 1 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.498 1.024 25485 1077 1 1 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.405 -1.859 25485 1078 1 1 . 1 1 198 198 HIS H H 198 7.196 7.196 7.593 -0.397 25485 1079 1 1 . 1 1 199 199 SER N N 199 118.486 118.486 114.336 4.150 25485 1080 1 1 . 1 1 199 199 SER HA H 199 4.490 4.490 4.483 0.007 25485 1081 1 1 . 1 1 199 199 SER C C 199 174.493 174.493 175.504 -1.011 25485 1082 1 1 . 1 1 199 199 SER CA C 199 58.173 58.173 60.261 -2.088 25485 1083 1 1 . 1 1 199 199 SER CB C 199 63.589 63.589 63.214 0.375 25485 1084 1 1 . 1 1 199 199 SER H H 199 7.884 7.884 7.758 0.127 25485 1085 1 1 . 1 1 200 200 LEU N N 200 114.686 114.686 117.130 -2.444 25485 1086 1 1 . 1 1 200 200 LEU C C 200 177.720 177.720 177.034 0.686 25485 1087 1 1 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.301 0.536 25485 1088 1 1 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.985 0.372 25485 1089 1 1 . 1 1 200 200 LEU H H 200 7.108 7.108 7.221 -0.113 25485 1090 1 1 . 1 1 201 201 GLY N N 201 108.363 108.363 106.292 2.071 25485 1091 1 1 . 1 1 201 201 GLY C C 201 174.008 174.008 174.890 -0.882 25485 1092 1 1 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.539 -1.125 25485 1093 1 1 . 1 1 201 201 GLY H H 201 8.195 8.195 7.882 0.313 25485 1094 1 1 . 1 1 202 202 MET N N 202 119.635 119.635 121.923 -2.288 25485 1095 1 1 . 1 1 202 202 MET HA H 202 4.473 4.473 4.382 0.091 25485 1096 1 1 . 1 1 202 202 MET C C 202 176.593 176.593 175.314 1.279 25485 1097 1 1 . 1 1 202 202 MET CA C 202 54.500 54.500 55.422 -0.922 25485 1098 1 1 . 1 1 202 202 MET CB C 202 32.161 32.161 33.374 -1.214 25485 1099 1 1 . 1 1 202 202 MET H H 202 8.182 8.182 7.210 0.972 25485 1100 1 1 . 1 1 203 203 GLY N N 203 109.749 109.749 113.335 -3.586 25485 1101 1 1 . 1 1 203 203 GLY C C 203 174.042 174.042 173.573 0.469 25485 1102 1 1 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.276 -0.272 25485 1103 1 1 . 1 1 203 203 GLY H H 203 8.405 8.405 8.460 -0.055 25485 1104 1 1 . 1 1 204 204 HIS N N 204 115.732 115.732 118.575 -2.843 25485 1105 1 1 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.390 1.010 25485 1106 1 1 . 1 1 204 204 HIS C C 204 174.430 174.430 174.474 -0.044 25485 1107 1 1 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.598 -1.784 25485 1108 1 1 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.382 -0.556 25485 1109 1 1 . 1 1 204 204 HIS H H 204 8.364 8.364 8.717 -0.353 25485 1110 1 1 . 1 1 205 205 SER N N 205 115.484 115.484 115.084 0.400 25485 1111 1 1 . 1 1 205 205 SER HA H 205 4.766 4.766 4.638 0.128 25485 1112 1 1 . 1 1 205 205 SER C C 205 173.611 173.611 174.715 -1.104 25485 1113 1 1 . 1 1 205 205 SER CA C 205 54.729 54.729 57.696 -2.967 25485 1114 1 1 . 1 1 205 205 SER CB C 205 65.855 65.855 65.587 0.268 25485 1115 1 1 . 1 1 205 205 SER H H 205 7.231 7.231 8.331 -1.100 25485 1116 1 1 . 1 1 206 206 SER N N 206 119.263 119.263 119.332 -0.069 25485 1117 1 1 . 1 1 206 206 SER HA H 206 3.701 3.701 4.815 -1.114 25485 1118 1 1 . 1 1 206 206 SER C C 206 173.635 173.635 174.147 -0.512 25485 1119 1 1 . 1 1 206 206 SER CA C 206 63.846 63.846 58.853 4.993 25485 1120 1 1 . 1 1 206 206 SER CB C 206 63.764 63.764 63.978 -0.214 25485 1121 1 1 . 1 1 206 206 SER H H 206 8.289 8.289 8.852 -0.563 25485 1122 1 1 . 1 1 207 207 ASP N N 207 126.646 126.646 122.677 3.969 25485 1123 1 1 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.643 0.286 25485 1124 1 1 . 1 1 207 207 ASP C C 207 174.614 174.614 175.597 -0.983 25485 1125 1 1 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.558 -1.286 25485 1126 1 1 . 1 1 207 207 ASP CB C 207 41.288 41.288 41.982 -0.694 25485 1127 1 1 . 1 1 207 207 ASP H H 207 8.541 8.541 7.988 0.553 25485 1128 1 1 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.758 0.029 25485 1129 1 1 . 1 1 208 208 PRO C C 208 177.467 177.467 175.706 1.761 25485 1130 1 1 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.918 -1.082 25485 1131 1 1 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.421 -0.824 25485 1132 1 1 . 1 1 209 209 ASN N N 209 116.020 116.020 113.595 2.425 25485 1133 1 1 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.637 0.004 25485 1134 1 1 . 1 1 209 209 ASN C C 209 174.695 174.695 173.833 0.862 25485 1135 1 1 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.268 1.952 25485 1136 1 1 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.378 0.732 25485 1137 1 1 . 1 1 209 209 ASN H H 209 8.350 8.350 7.896 0.454 25485 1138 1 1 . 1 1 210 210 ALA N N 210 124.892 124.892 121.857 3.035 25485 1139 1 1 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.497 -0.402 25485 1140 1 1 . 1 1 210 210 ALA C C 210 179.495 179.495 177.916 1.579 25485 1141 1 1 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.604 1.450 25485 1142 1 1 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.204 -1.005 25485 1143 1 1 . 1 1 210 210 ALA H H 210 8.193 8.193 7.165 1.028 25485 1144 1 1 . 1 1 211 211 VAL N N 211 130.402 130.402 123.712 6.690 25485 1145 1 1 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.939 0.324 25485 1146 1 1 . 1 1 211 211 VAL C C 211 179.408 179.408 175.823 3.585 25485 1147 1 1 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.436 -0.384 25485 1148 1 1 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.639 -1.656 25485 1149 1 1 . 1 1 211 211 VAL H H 211 11.592 11.592 8.992 2.600 25485 1150 1 1 . 1 1 212 212 MET N N 212 113.285 113.285 115.768 -2.483 25485 1151 1 1 . 1 1 212 212 MET C C 212 176.996 176.996 174.979 2.017 25485 1152 1 1 . 1 1 212 212 MET CA C 212 53.614 53.614 53.541 0.073 25485 1153 1 1 . 1 1 212 212 MET CB C 212 26.975 26.975 32.451 -5.476 25485 1154 1 1 . 1 1 212 212 MET H H 212 7.724 7.724 7.627 0.097 25485 1155 1 1 . 1 1 213 213 TYR N N 213 129.919 129.919 124.019 5.900 25485 1156 1 1 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.433 1.263 25485 1157 1 1 . 1 1 213 213 TYR C C 213 178.411 178.411 175.237 3.174 25485 1158 1 1 . 1 1 213 213 TYR CA C 213 57.131 57.131 56.669 0.462 25485 1159 1 1 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.260 0.907 25485 1160 1 1 . 1 1 213 213 TYR H H 213 7.902 7.902 7.293 0.609 25485 1161 1 1 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.560 -1.085 25485 1162 1 1 . 1 1 214 214 PRO C C 214 177.694 177.694 176.642 1.052 25485 1163 1 1 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.511 1.517 25485 1164 1 1 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.686 1.137 25485 1165 1 1 . 1 1 215 215 THR N N 215 104.450 104.450 109.626 -5.176 25485 1166 1 1 . 1 1 215 215 THR HA H 215 4.444 4.444 4.372 0.072 25485 1167 1 1 . 1 1 215 215 THR C C 215 173.429 173.429 173.773 -0.344 25485 1168 1 1 . 1 1 215 215 THR CA C 215 60.528 60.528 60.221 0.307 25485 1169 1 1 . 1 1 215 215 THR CB C 215 69.614 69.614 67.674 1.940 25485 1170 1 1 . 1 1 215 215 THR H H 215 6.407 6.407 7.370 -0.963 25485 1171 1 1 . 1 1 216 216 TYR N N 216 124.618 124.618 126.477 -1.859 25485 1172 1 1 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.257 -0.025 25485 1173 1 1 . 1 1 216 216 TYR C C 216 175.669 175.669 175.409 0.260 25485 1174 1 1 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.230 -0.643 25485 1175 1 1 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.370 2.521 25485 1176 1 1 . 1 1 216 216 TYR H H 216 8.331 8.331 7.650 0.681 25485 1177 1 1 . 1 1 217 217 GLY N N 217 116.089 116.089 116.554 -0.465 25485 1178 1 1 . 1 1 217 217 GLY C C 217 173.560 173.560 172.382 1.178 25485 1179 1 1 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.391 0.928 25485 1180 1 1 . 1 1 217 217 GLY H H 217 7.695 7.695 8.129 -0.434 25485 1181 1 1 . 1 1 218 218 ASN N N 218 120.167 120.167 120.534 -0.367 25485 1182 1 1 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.733 -0.067 25485 1183 1 1 . 1 1 218 218 ASN C C 218 175.343 175.343 174.176 1.167 25485 1184 1 1 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.610 0.005 25485 1185 1 1 . 1 1 218 218 ASN CB C 218 38.546 38.546 39.221 -0.675 25485 1186 1 1 . 1 1 218 218 ASN H H 218 8.237 8.237 8.268 -0.031 25485 1187 1 1 . 1 1 219 219 GLY N N 219 109.322 109.322 110.210 -0.888 25485 1188 1 1 . 1 1 219 219 GLY C C 219 172.842 172.842 173.472 -0.630 25485 1189 1 1 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.785 -0.067 25485 1190 1 1 . 1 1 219 219 GLY H H 219 8.027 8.027 8.160 -0.133 25485 1191 1 1 . 1 1 220 220 ASP N N 220 123.006 123.006 121.124 1.882 25485 1192 1 1 . 1 1 220 220 ASP H H 220 8.273 8.273 8.452 -0.179 25485 1193 1 1 . 1 1 221 221 PRO C C 221 177.138 177.138 176.982 0.156 25485 1194 1 1 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.555 -5.492 25485 1195 1 1 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.949 -1.253 25485 1196 1 1 . 1 1 222 222 GLN N N 222 116.718 116.718 118.888 -2.170 25485 1197 1 1 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.178 0.158 25485 1198 1 1 . 1 1 222 222 GLN C C 222 176.321 176.321 176.638 -0.317 25485 1199 1 1 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.896 -0.753 25485 1200 1 1 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.889 0.608 25485 1201 1 1 . 1 1 222 222 GLN H H 222 8.240 8.240 8.484 -0.244 25485 1202 1 1 . 1 1 223 223 ASN N N 223 118.368 118.368 115.185 3.183 25485 1203 1 1 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.773 0.143 25485 1204 1 1 . 1 1 223 223 ASN C C 223 173.271 173.271 174.041 -0.770 25485 1205 1 1 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.098 -0.502 25485 1206 1 1 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.667 -0.452 25485 1207 1 1 . 1 1 223 223 ASN H H 223 7.946 7.946 8.208 -0.262 25485 1208 1 1 . 1 1 224 224 PHE N N 224 118.429 118.429 118.117 0.312 25485 1209 1 1 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.227 0.224 25485 1210 1 1 . 1 1 224 224 PHE C C 224 172.897 172.897 173.707 -0.810 25485 1211 1 1 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.063 0.346 25485 1212 1 1 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.093 1.607 25485 1213 1 1 . 1 1 224 224 PHE H H 224 6.992 6.992 7.971 -0.979 25485 1214 1 1 . 1 1 225 225 LYS N N 225 121.714 121.714 125.997 -4.283 25485 1215 1 1 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.631 0.799 25485 1216 1 1 . 1 1 225 225 LYS C C 225 174.664 174.664 174.485 0.179 25485 1217 1 1 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.969 0.343 25485 1218 1 1 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.212 0.515 25485 1219 1 1 . 1 1 225 225 LYS H H 225 7.709 7.709 8.026 -0.317 25485 1220 1 1 . 1 1 226 226 LEU N N 226 119.026 119.026 122.090 -3.064 25485 1221 1 1 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.964 0.176 25485 1222 1 1 . 1 1 226 226 LEU C C 226 177.495 177.495 176.762 0.733 25485 1223 1 1 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.307 0.291 25485 1224 1 1 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.971 -0.690 25485 1225 1 1 . 1 1 226 226 LEU H H 226 8.015 8.015 8.043 -0.028 25485 1226 1 1 . 1 1 227 227 SER N N 227 120.320 120.320 116.211 4.109 25485 1227 1 1 . 1 1 227 227 SER HA H 227 4.600 4.600 4.449 0.151 25485 1228 1 1 . 1 1 227 227 SER C C 227 175.492 175.492 175.188 0.304 25485 1229 1 1 . 1 1 227 227 SER CA C 227 57.239 57.239 57.458 -0.219 25485 1230 1 1 . 1 1 227 227 SER CB C 227 66.278 66.278 65.096 1.182 25485 1231 1 1 . 1 1 227 227 SER H H 227 9.654 9.654 7.829 1.825 25485 1232 1 1 . 1 1 228 228 GLN N N 228 127.511 127.511 124.421 3.090 25485 1233 1 1 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.969 0.725 25485 1234 1 1 . 1 1 228 228 GLN H H 228 8.248 8.248 9.124 -0.876 25485 1235 1 1 . 1 1 229 229 ASP N N 229 124.358 124.358 119.035 5.323 25485 1236 1 1 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.389 -0.015 25485 1237 1 1 . 1 1 229 229 ASP C C 229 178.793 178.793 178.621 0.172 25485 1238 1 1 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.307 0.834 25485 1239 1 1 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.709 2.533 25485 1240 1 1 . 1 1 229 229 ASP H H 229 8.138 8.138 8.301 -0.163 25485 1241 1 1 . 1 1 230 230 ASP N N 230 119.694 119.694 119.591 0.103 25485 1242 1 1 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.525 -0.103 25485 1243 1 1 . 1 1 230 230 ASP C C 230 177.736 177.736 178.421 -0.685 25485 1244 1 1 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.770 0.152 25485 1245 1 1 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.420 1.816 25485 1246 1 1 . 1 1 230 230 ASP H H 230 7.393 7.393 7.425 -0.032 25485 1247 1 1 . 1 1 231 231 ILE N N 231 120.364 120.364 119.873 0.491 25485 1248 1 1 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.879 -0.214 25485 1249 1 1 . 1 1 231 231 ILE C C 231 177.631 177.631 177.706 -0.075 25485 1250 1 1 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.558 -0.059 25485 1251 1 1 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.044 0.469 25485 1252 1 1 . 1 1 231 231 ILE H H 231 8.115 8.115 8.015 0.100 25485 1253 1 1 . 1 1 232 232 LYS N N 232 119.156 119.156 120.678 -1.522 25485 1254 1 1 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.133 -0.019 25485 1255 1 1 . 1 1 232 232 LYS C C 232 180.574 180.574 179.124 1.450 25485 1256 1 1 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.148 0.412 25485 1257 1 1 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.308 0.489 25485 1258 1 1 . 1 1 232 232 LYS H H 232 8.607 8.607 8.506 0.101 25485 1259 1 1 . 1 1 233 233 GLY N N 233 106.425 106.425 107.782 -1.357 25485 1260 1 1 . 1 1 233 233 GLY C C 233 176.098 176.098 175.869 0.229 25485 1261 1 1 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.759 0.878 25485 1262 1 1 . 1 1 233 233 GLY H H 233 8.075 8.075 7.624 0.451 25485 1263 1 1 . 1 1 234 234 ILE N N 234 125.119 125.119 122.292 2.827 25485 1264 1 1 . 1 1 234 234 ILE C C 234 178.231 178.231 177.394 0.837 25485 1265 1 1 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.426 -1.833 25485 1266 1 1 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.407 -0.861 25485 1267 1 1 . 1 1 234 234 ILE H H 234 8.539 8.539 7.435 1.104 25485 1268 1 1 . 1 1 235 235 GLN N N 235 122.877 122.877 119.158 3.719 25485 1269 1 1 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.133 0.224 25485 1270 1 1 . 1 1 235 235 GLN C C 235 180.105 180.105 178.485 1.620 25485 1271 1 1 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.300 -1.413 25485 1272 1 1 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.661 -1.124 25485 1273 1 1 . 1 1 235 235 GLN H H 235 8.296 8.296 8.791 -0.495 25485 1274 1 1 . 1 1 236 236 LYS N N 236 123.678 123.678 118.050 5.628 25485 1275 1 1 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.327 -0.245 25485 1276 1 1 . 1 1 236 236 LYS C C 236 178.169 178.169 177.425 0.744 25485 1277 1 1 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.375 1.001 25485 1278 1 1 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.924 0.054 25485 1279 1 1 . 1 1 236 236 LYS H H 236 8.024 8.024 7.762 0.262 25485 1280 1 1 . 1 1 237 237 LEU N N 237 116.873 116.873 118.940 -2.067 25485 1281 1 1 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.299 -0.312 25485 1282 1 1 . 1 1 237 237 LEU C C 237 177.893 177.893 177.954 -0.061 25485 1283 1 1 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.775 0.664 25485 1284 1 1 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.951 0.662 25485 1285 1 1 . 1 1 237 237 LEU H H 237 6.888 6.888 7.466 -0.578 25485 1286 1 1 . 1 1 238 238 TYR N N 238 112.237 112.237 116.152 -3.915 25485 1287 1 1 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.481 0.170 25485 1288 1 1 . 1 1 238 238 TYR C C 238 176.082 176.082 177.187 -1.105 25485 1289 1 1 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.286 -0.650 25485 1290 1 1 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.764 1.633 25485 1291 1 1 . 1 1 238 238 TYR H H 238 7.445 7.445 8.613 -1.168 25485 1292 1 1 . 1 1 239 239 GLY N N 239 110.906 110.906 107.323 3.583 25485 1293 1 1 . 1 1 239 239 GLY C C 239 171.269 171.269 173.226 -1.957 25485 1294 1 1 . 1 1 239 239 GLY CA C 239 43.886 43.886 44.761 -0.875 25485 1295 1 1 . 1 1 239 239 GLY H H 239 8.443 8.443 7.961 0.482 25485 1296 1 1 . 1 1 240 240 LYS N N 240 114.281 114.281 121.931 -7.650 25485 1297 1 1 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.543 0.195 25485 1298 1 1 . 1 1 240 240 LYS C C 240 177.527 177.527 176.844 0.683 25485 1299 1 1 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.818 -0.860 25485 1300 1 1 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.798 0.477 25485 1301 1 1 . 1 1 240 240 LYS H H 240 7.873 7.873 8.292 -0.419 25485 1302 1 1 . 1 1 241 241 ARG N N 241 123.758 123.758 124.838 -1.080 25485 1303 1 1 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.498 -0.501 25485 1304 1 1 . 1 1 241 241 ARG C C 241 176.026 176.026 175.596 0.430 25485 1305 1 1 . 1 1 241 241 ARG CA C 241 57.492 57.492 56.179 1.313 25485 1306 1 1 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.651 -0.280 25485 1307 1 1 . 1 1 241 241 ARG H H 241 7.742 7.742 8.667 -0.925 25485 1308 1 1 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.655 -0.315 25485 1309 1 1 . 1 1 246 246 LYS C C 246 175.403 175.403 176.210 -0.807 25485 1310 1 1 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.683 0.826 25485 1311 1 1 . 1 1 246 246 LYS CB C 246 32.858 32.858 33.920 -1.062 25485 1312 1 2 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.492 -0.185 25485 1313 1 2 . 1 1 2 2 GLN C C 2 176.492 176.492 175.510 0.982 25485 1314 1 2 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.529 0.220 25485 1315 1 2 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.375 0.279 25485 1316 1 2 . 1 1 3 3 GLU N N 3 121.668 121.668 120.496 1.172 25485 1317 1 2 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.401 -0.612 25485 1318 1 2 . 1 1 3 3 GLU C C 3 176.278 176.278 177.711 -1.433 25485 1319 1 2 . 1 1 3 3 GLU CA C 3 57.059 57.059 56.661 0.398 25485 1320 1 2 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.737 -0.046 25485 1321 1 2 . 1 1 3 3 GLU H H 3 8.331 8.331 8.585 -0.254 25485 1322 1 2 . 1 1 4 4 ALA N N 4 124.493 124.493 123.361 1.132 25485 1323 1 2 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.215 0.295 25485 1324 1 2 . 1 1 4 4 ALA C C 4 178.428 178.428 179.657 -1.229 25485 1325 1 2 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.545 0.131 25485 1326 1 2 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.241 0.467 25485 1327 1 2 . 1 1 4 4 ALA H H 4 8.131 8.131 8.384 -0.253 25485 1328 1 2 . 1 1 5 5 GLY N N 5 108.204 108.204 107.261 0.943 25485 1329 1 2 . 1 1 5 5 GLY C C 5 174.858 174.858 175.360 -0.502 25485 1330 1 2 . 1 1 5 5 GLY CA C 5 47.661 47.661 45.723 1.938 25485 1331 1 2 . 1 1 5 5 GLY H H 5 8.279 8.279 8.561 -0.282 25485 1332 1 2 . 1 1 6 6 GLY N N 6 108.820 108.820 107.317 1.503 25485 1333 1 2 . 1 1 6 6 GLY C C 6 174.189 174.189 174.483 -0.294 25485 1334 1 2 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.473 -0.060 25485 1335 1 2 . 1 1 6 6 GLY H H 6 8.246 8.246 7.986 0.260 25485 1336 1 2 . 1 1 7 7 MET N N 7 119.938 119.938 118.797 1.141 25485 1337 1 2 . 1 1 7 7 MET HA H 7 4.659 4.659 4.681 -0.022 25485 1338 1 2 . 1 1 7 7 MET C C 7 176.191 176.191 176.617 -0.426 25485 1339 1 2 . 1 1 7 7 MET CA C 7 54.799 54.799 54.812 -0.013 25485 1340 1 2 . 1 1 7 7 MET CB C 7 33.046 33.046 32.454 0.592 25485 1341 1 2 . 1 1 7 7 MET H H 7 8.005 8.005 7.326 0.679 25485 1342 1 2 . 1 1 8 8 SER N N 8 118.919 118.919 114.641 4.278 25485 1343 1 2 . 1 1 8 8 SER HA H 8 4.239 4.239 4.833 -0.594 25485 1344 1 2 . 1 1 8 8 SER C C 8 174.949 174.949 174.956 -0.007 25485 1345 1 2 . 1 1 8 8 SER CA C 8 58.160 58.160 56.872 1.288 25485 1346 1 2 . 1 1 8 8 SER CB C 8 65.440 65.440 65.121 0.319 25485 1347 1 2 . 1 1 8 8 SER H H 8 8.731 8.731 8.408 0.323 25485 1348 1 2 . 1 1 9 9 GLU N N 9 122.442 122.442 123.082 -0.640 25485 1349 1 2 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.117 0.204 25485 1350 1 2 . 1 1 9 9 GLU C C 9 178.604 178.604 178.518 0.086 25485 1351 1 2 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.596 -0.130 25485 1352 1 2 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.336 -0.160 25485 1353 1 2 . 1 1 9 9 GLU H H 9 8.901 8.901 8.940 -0.039 25485 1354 1 2 . 1 1 10 10 LEU N N 10 120.568 120.568 119.627 0.941 25485 1355 1 2 . 1 1 10 10 LEU C C 10 179.307 179.307 178.869 0.438 25485 1356 1 2 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.128 -0.648 25485 1357 1 2 . 1 1 10 10 LEU CB C 10 41.575 41.575 40.947 0.628 25485 1358 1 2 . 1 1 10 10 LEU H H 10 8.020 8.020 8.309 -0.289 25485 1359 1 2 . 1 1 11 11 GLN N N 11 119.930 119.930 118.462 1.468 25485 1360 1 2 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.091 0.043 25485 1361 1 2 . 1 1 11 11 GLN C C 11 178.330 178.330 178.663 -0.333 25485 1362 1 2 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.523 -0.705 25485 1363 1 2 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.704 -0.840 25485 1364 1 2 . 1 1 11 11 GLN H H 11 7.811 7.811 7.808 0.003 25485 1365 1 2 . 1 1 12 12 TRP N N 12 121.031 121.031 120.814 0.217 25485 1366 1 2 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.391 0.023 25485 1367 1 2 . 1 1 12 12 TRP C C 12 178.874 178.874 178.109 0.765 25485 1368 1 2 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.099 0.408 25485 1369 1 2 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.865 -0.478 25485 1370 1 2 . 1 1 12 12 TRP H H 12 8.205 8.205 8.240 -0.035 25485 1371 1 2 . 1 1 13 13 GLU N N 13 121.877 121.877 120.045 1.832 25485 1372 1 2 . 1 1 13 13 GLU C C 13 179.425 179.425 178.889 0.536 25485 1373 1 2 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.501 0.536 25485 1374 1 2 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.777 -0.855 25485 1375 1 2 . 1 1 13 13 GLU H H 13 8.434 8.434 8.547 -0.113 25485 1376 1 2 . 1 1 14 14 GLN N N 14 120.449 120.449 118.275 2.174 25485 1377 1 2 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.920 0.318 25485 1378 1 2 . 1 1 14 14 GLN C C 14 179.210 179.210 178.464 0.746 25485 1379 1 2 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.419 0.464 25485 1380 1 2 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.262 -0.512 25485 1381 1 2 . 1 1 14 14 GLN H H 14 8.124 8.124 8.368 -0.244 25485 1382 1 2 . 1 1 15 15 ALA N N 15 123.114 123.114 121.874 1.240 25485 1383 1 2 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.027 0.363 25485 1384 1 2 . 1 1 15 15 ALA C C 15 179.352 179.352 179.218 0.134 25485 1385 1 2 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.461 -0.496 25485 1386 1 2 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.010 0.653 25485 1387 1 2 . 1 1 15 15 ALA H H 15 8.344 8.344 7.630 0.714 25485 1388 1 2 . 1 1 16 16 GLN N N 16 117.718 117.718 117.898 -0.180 25485 1389 1 2 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.931 -0.149 25485 1390 1 2 . 1 1 16 16 GLN C C 16 177.719 177.719 178.057 -0.338 25485 1391 1 2 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.750 1.531 25485 1392 1 2 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.669 -0.133 25485 1393 1 2 . 1 1 16 16 GLN H H 16 8.500 8.500 7.608 0.892 25485 1394 1 2 . 1 1 17 17 ASP N N 17 120.040 120.040 119.973 0.067 25485 1395 1 2 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.341 0.195 25485 1396 1 2 . 1 1 17 17 ASP C C 17 177.630 177.630 178.510 -0.880 25485 1397 1 2 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.270 0.535 25485 1398 1 2 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.466 1.398 25485 1399 1 2 . 1 1 17 17 ASP H H 17 7.871 7.871 8.090 -0.219 25485 1400 1 2 . 1 1 18 18 TYR N N 18 122.465 122.465 119.946 2.519 25485 1401 1 2 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.129 0.061 25485 1402 1 2 . 1 1 18 18 TYR C C 18 178.439 178.439 177.818 0.621 25485 1403 1 2 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.841 1.005 25485 1404 1 2 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.432 1.508 25485 1405 1 2 . 1 1 18 18 TYR H H 18 8.244 8.244 8.032 0.212 25485 1406 1 2 . 1 1 19 19 LEU N N 19 117.635 117.635 118.880 -1.245 25485 1407 1 2 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.152 -0.020 25485 1408 1 2 . 1 1 19 19 LEU C C 19 180.940 180.940 177.760 3.180 25485 1409 1 2 . 1 1 19 19 LEU CA C 19 57.505 57.505 57.191 0.314 25485 1410 1 2 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.453 -0.855 25485 1411 1 2 . 1 1 19 19 LEU H H 19 8.713 8.713 7.542 1.171 25485 1412 1 2 . 1 1 20 20 LYS N N 20 124.594 124.594 116.181 8.413 25485 1413 1 2 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.114 -0.030 25485 1414 1 2 . 1 1 20 20 LYS C C 20 178.387 178.387 178.346 0.041 25485 1415 1 2 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.887 0.918 25485 1416 1 2 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.144 0.312 25485 1417 1 2 . 1 1 20 20 LYS H H 20 8.815 8.815 7.445 1.370 25485 1418 1 2 . 1 1 21 21 ARG N N 21 117.535 117.535 117.540 -0.005 25485 1419 1 2 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.194 -0.475 25485 1420 1 2 . 1 1 21 21 ARG C C 21 178.498 178.498 177.710 0.788 25485 1421 1 2 . 1 1 21 21 ARG CA C 21 59.244 59.244 57.932 1.312 25485 1422 1 2 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.309 0.132 25485 1423 1 2 . 1 1 21 21 ARG H H 21 7.810 7.810 7.150 0.660 25485 1424 1 2 . 1 1 22 22 PHE N N 22 112.113 112.113 118.242 -6.129 25485 1425 1 2 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.282 0.629 25485 1426 1 2 . 1 1 22 22 PHE C C 22 174.875 174.875 175.557 -0.682 25485 1427 1 2 . 1 1 22 22 PHE CA C 22 57.475 57.475 61.099 -3.624 25485 1428 1 2 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.039 0.130 25485 1429 1 2 . 1 1 22 22 PHE H H 22 8.010 8.010 7.496 0.514 25485 1430 1 2 . 1 1 23 23 TYR N N 23 116.187 116.187 116.255 -0.068 25485 1431 1 2 . 1 1 23 23 TYR C C 23 173.455 173.455 175.834 -2.379 25485 1432 1 2 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.206 3.221 25485 1433 1 2 . 1 1 23 23 TYR CB C 23 39.529 39.529 36.522 3.007 25485 1434 1 2 . 1 1 23 23 TYR H H 23 7.680 7.680 7.580 0.100 25485 1435 1 2 . 1 1 24 24 LEU N N 24 115.570 115.570 119.007 -3.437 25485 1436 1 2 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.072 0.078 25485 1437 1 2 . 1 1 24 24 LEU C C 24 176.661 176.661 175.947 0.714 25485 1438 1 2 . 1 1 24 24 LEU CA C 24 56.152 56.152 57.682 -1.530 25485 1439 1 2 . 1 1 24 24 LEU CB C 24 36.863 36.863 40.820 -3.957 25485 1440 1 2 . 1 1 24 24 LEU H H 24 7.238 7.238 8.134 -0.896 25485 1441 1 2 . 1 1 25 25 TYR N N 25 119.901 119.901 119.205 0.696 25485 1442 1 2 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.847 -0.488 25485 1443 1 2 . 1 1 25 25 TYR C C 25 173.784 173.784 173.628 0.156 25485 1444 1 2 . 1 1 25 25 TYR CA C 25 58.247 58.247 56.832 1.415 25485 1445 1 2 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.455 -0.376 25485 1446 1 2 . 1 1 25 25 TYR H H 25 7.845 7.845 8.326 -0.481 25485 1447 1 2 . 1 1 26 26 ASP N N 26 129.338 129.338 127.269 2.069 25485 1448 1 2 . 1 1 26 26 ASP HA H 26 4.451 4.451 4.968 -0.517 25485 1449 1 2 . 1 1 26 26 ASP C C 26 175.282 175.282 175.393 -0.111 25485 1450 1 2 . 1 1 26 26 ASP CA C 26 52.433 52.433 54.148 -1.715 25485 1451 1 2 . 1 1 26 26 ASP CB C 26 41.249 41.249 40.518 0.731 25485 1452 1 2 . 1 1 26 26 ASP H H 26 8.108 8.108 8.366 -0.258 25485 1453 1 2 . 1 1 27 27 SER C C 27 175.204 175.204 176.337 -1.133 25485 1454 1 2 . 1 1 27 27 SER CA C 27 59.424 59.424 60.534 -1.110 25485 1455 1 2 . 1 1 27 27 SER CB C 27 63.535 63.535 63.625 -0.090 25485 1456 1 2 . 1 1 28 28 GLU N N 28 122.058 122.058 120.215 1.843 25485 1457 1 2 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.227 0.098 25485 1458 1 2 . 1 1 28 28 GLU C C 28 177.073 177.073 177.181 -0.108 25485 1459 1 2 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.592 -1.380 25485 1460 1 2 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.490 0.080 25485 1461 1 2 . 1 1 28 28 GLU H H 28 8.255 8.255 8.820 -0.565 25485 1462 1 2 . 1 1 29 29 THR N N 29 114.161 114.161 110.293 3.868 25485 1463 1 2 . 1 1 29 29 THR HA H 29 4.260 4.260 4.377 -0.117 25485 1464 1 2 . 1 1 29 29 THR C C 29 174.591 174.591 173.446 1.145 25485 1465 1 2 . 1 1 29 29 THR CA C 29 61.976 61.976 62.138 -0.162 25485 1466 1 2 . 1 1 29 29 THR CB C 29 69.385 69.385 68.912 0.473 25485 1467 1 2 . 1 1 29 29 THR H H 29 7.498 7.498 7.845 -0.347 25485 1468 1 2 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.583 -0.365 25485 1469 1 2 . 1 1 30 30 LYS H H 30 8.218 8.218 7.383 0.835 25485 1470 1 2 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.768 -0.344 25485 1471 1 2 . 1 1 31 31 ASN CB C 31 39.133 39.133 41.257 -2.124 25485 1472 1 2 . 1 1 32 32 ALA N N 32 126.484 126.484 123.027 3.457 25485 1473 1 2 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.180 0.116 25485 1474 1 2 . 1 1 32 32 ALA C C 32 178.012 178.012 178.793 -0.781 25485 1475 1 2 . 1 1 32 32 ALA CA C 32 53.760 53.760 55.158 -1.398 25485 1476 1 2 . 1 1 32 32 ALA CB C 32 18.770 18.770 18.864 -0.094 25485 1477 1 2 . 1 1 32 32 ALA H H 32 8.411 8.411 8.756 -0.345 25485 1478 1 2 . 1 1 33 33 ASN N N 33 116.885 116.885 116.317 0.568 25485 1479 1 2 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.771 -0.073 25485 1480 1 2 . 1 1 33 33 ASN C C 33 176.240 176.240 177.314 -1.074 25485 1481 1 2 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.397 -1.210 25485 1482 1 2 . 1 1 33 33 ASN CB C 33 38.585 38.585 37.758 0.827 25485 1483 1 2 . 1 1 33 33 ASN H H 33 8.309 8.309 8.511 -0.202 25485 1484 1 2 . 1 1 34 34 SER N N 34 116.836 116.836 116.278 0.558 25485 1485 1 2 . 1 1 34 34 SER HA H 34 4.544 4.544 4.280 0.264 25485 1486 1 2 . 1 1 34 34 SER C C 34 175.253 175.253 176.250 -0.997 25485 1487 1 2 . 1 1 34 34 SER CA C 34 59.583 59.583 60.876 -1.293 25485 1488 1 2 . 1 1 34 34 SER CB C 34 63.919 63.919 62.406 1.513 25485 1489 1 2 . 1 1 34 34 SER H H 34 8.115 8.115 8.447 -0.332 25485 1490 1 2 . 1 1 35 35 LEU N N 35 125.355 125.355 123.485 1.870 25485 1491 1 2 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.163 -0.587 25485 1492 1 2 . 1 1 35 35 LEU C C 35 177.973 177.973 178.425 -0.452 25485 1493 1 2 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.114 0.383 25485 1494 1 2 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.978 -1.286 25485 1495 1 2 . 1 1 35 35 LEU H H 35 8.312 8.312 8.049 0.263 25485 1496 1 2 . 1 1 36 36 GLU N N 36 119.201 119.201 119.620 -0.419 25485 1497 1 2 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.990 -0.076 25485 1498 1 2 . 1 1 36 36 GLU C C 36 178.141 178.141 178.537 -0.396 25485 1499 1 2 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.667 -0.008 25485 1500 1 2 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.476 -0.163 25485 1501 1 2 . 1 1 36 36 GLU H H 36 8.225 8.225 7.828 0.397 25485 1502 1 2 . 1 1 37 37 ALA N N 37 120.746 120.746 121.521 -0.775 25485 1503 1 2 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.043 0.036 25485 1504 1 2 . 1 1 37 37 ALA C C 37 181.485 181.485 179.816 1.669 25485 1505 1 2 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.191 0.268 25485 1506 1 2 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.505 -0.338 25485 1507 1 2 . 1 1 37 37 ALA H H 37 7.917 7.917 7.490 0.427 25485 1508 1 2 . 1 1 38 38 LYS N N 38 119.326 119.326 118.514 0.812 25485 1509 1 2 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.065 0.266 25485 1510 1 2 . 1 1 38 38 LYS C C 38 177.946 177.946 178.812 -0.866 25485 1511 1 2 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.719 -1.015 25485 1512 1 2 . 1 1 38 38 LYS CB C 38 31.800 31.800 31.863 -0.063 25485 1513 1 2 . 1 1 38 38 LYS H H 38 8.216 8.216 8.183 0.033 25485 1514 1 2 . 1 1 39 39 LEU N N 39 122.736 122.736 120.448 2.288 25485 1515 1 2 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.997 -0.056 25485 1516 1 2 . 1 1 39 39 LEU C C 39 178.819 178.819 178.747 0.072 25485 1517 1 2 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.196 -0.115 25485 1518 1 2 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.416 -0.788 25485 1519 1 2 . 1 1 39 39 LEU H H 39 8.666 8.666 8.093 0.573 25485 1520 1 2 . 1 1 40 40 LYS N N 40 118.411 118.411 118.574 -0.163 25485 1521 1 2 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.930 0.708 25485 1522 1 2 . 1 1 40 40 LYS C C 40 179.329 179.329 178.270 1.059 25485 1523 1 2 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.969 0.164 25485 1524 1 2 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.183 -0.398 25485 1525 1 2 . 1 1 40 40 LYS H H 40 8.227 8.227 7.658 0.569 25485 1526 1 2 . 1 1 41 41 GLU N N 41 121.329 121.329 117.765 3.564 25485 1527 1 2 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.127 -0.034 25485 1528 1 2 . 1 1 41 41 GLU C C 41 178.989 178.989 179.045 -0.056 25485 1529 1 2 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.200 0.560 25485 1530 1 2 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.861 0.975 25485 1531 1 2 . 1 1 41 41 GLU H H 41 7.718 7.718 7.772 -0.054 25485 1532 1 2 . 1 1 42 42 MET N N 42 123.817 123.817 119.393 4.424 25485 1533 1 2 . 1 1 42 42 MET HA H 42 4.107 4.107 4.400 -0.293 25485 1534 1 2 . 1 1 42 42 MET C C 42 177.719 177.719 178.346 -0.627 25485 1535 1 2 . 1 1 42 42 MET CA C 42 59.912 59.912 58.667 1.245 25485 1536 1 2 . 1 1 42 42 MET CB C 42 30.506 30.506 32.736 -2.230 25485 1537 1 2 . 1 1 42 42 MET H H 42 7.657 7.657 7.405 0.252 25485 1538 1 2 . 1 1 43 43 GLN N N 43 119.998 119.998 118.611 1.387 25485 1539 1 2 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.104 -0.299 25485 1540 1 2 . 1 1 43 43 GLN C C 43 177.604 177.604 178.787 -1.183 25485 1541 1 2 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.842 1.123 25485 1542 1 2 . 1 1 43 43 GLN CB C 43 26.555 26.555 28.018 -1.463 25485 1543 1 2 . 1 1 43 43 GLN H H 43 8.910 8.910 7.944 0.966 25485 1544 1 2 . 1 1 44 44 LYS N N 44 119.165 119.165 118.118 1.047 25485 1545 1 2 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.255 -0.200 25485 1546 1 2 . 1 1 44 44 LYS C C 44 179.991 179.991 178.665 1.326 25485 1547 1 2 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.274 1.287 25485 1548 1 2 . 1 1 44 44 LYS CB C 44 32.298 32.298 31.558 0.740 25485 1549 1 2 . 1 1 44 44 LYS H H 44 8.507 8.507 7.657 0.850 25485 1550 1 2 . 1 1 45 45 PHE N N 45 123.602 123.602 120.190 3.412 25485 1551 1 2 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.321 -0.420 25485 1552 1 2 . 1 1 45 45 PHE C C 45 177.606 177.606 176.339 1.267 25485 1553 1 2 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.870 2.164 25485 1554 1 2 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.664 0.202 25485 1555 1 2 . 1 1 45 45 PHE H H 45 8.445 8.445 7.696 0.749 25485 1556 1 2 . 1 1 46 46 PHE N N 46 112.715 112.715 115.131 -2.416 25485 1557 1 2 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.642 -0.045 25485 1558 1 2 . 1 1 46 46 PHE C C 46 175.285 175.285 177.121 -1.836 25485 1559 1 2 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.917 0.758 25485 1560 1 2 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.513 -1.054 25485 1561 1 2 . 1 1 46 46 PHE H H 46 8.272 8.272 8.236 0.036 25485 1562 1 2 . 1 1 47 47 GLY N N 47 110.438 110.438 107.343 3.095 25485 1563 1 2 . 1 1 47 47 GLY C C 47 174.935 174.935 174.469 0.466 25485 1564 1 2 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.322 1.689 25485 1565 1 2 . 1 1 47 47 GLY H H 47 7.926 7.926 8.405 -0.479 25485 1566 1 2 . 1 1 48 48 LEU N N 48 121.830 121.830 119.383 2.447 25485 1567 1 2 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.654 0.270 25485 1568 1 2 . 1 1 48 48 LEU C C 48 174.009 174.009 175.848 -1.839 25485 1569 1 2 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.609 -1.774 25485 1570 1 2 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.947 0.516 25485 1571 1 2 . 1 1 48 48 LEU H H 48 8.762 8.762 7.619 1.143 25485 1572 1 2 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.396 -0.158 25485 1573 1 2 . 1 1 49 49 PRO C C 49 176.874 176.874 176.788 0.086 25485 1574 1 2 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.741 -0.223 25485 1575 1 2 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.889 -0.810 25485 1576 1 2 . 1 1 50 50 ILE N N 50 126.859 126.859 118.179 8.680 25485 1577 1 2 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.049 0.052 25485 1578 1 2 . 1 1 50 50 ILE C C 50 176.540 176.540 175.781 0.759 25485 1579 1 2 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.032 -1.076 25485 1580 1 2 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.091 -0.698 25485 1581 1 2 . 1 1 50 50 ILE H H 50 8.548 8.548 7.866 0.682 25485 1582 1 2 . 1 1 51 51 THR N N 51 116.443 116.443 117.771 -1.328 25485 1583 1 2 . 1 1 51 51 THR HA H 51 4.584 4.584 4.506 0.078 25485 1584 1 2 . 1 1 51 51 THR C C 51 176.672 176.672 175.360 1.312 25485 1585 1 2 . 1 1 51 51 THR CA C 51 60.979 60.979 61.086 -0.107 25485 1586 1 2 . 1 1 51 51 THR CB C 51 71.505 71.505 70.377 1.128 25485 1587 1 2 . 1 1 51 51 THR H H 51 8.001 8.001 7.754 0.247 25485 1588 1 2 . 1 1 52 52 GLY N N 52 112.719 112.719 110.446 2.273 25485 1589 1 2 . 1 1 52 52 GLY C C 52 170.609 170.609 174.557 -3.948 25485 1590 1 2 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.796 0.950 25485 1591 1 2 . 1 1 52 52 GLY H H 52 9.499 9.499 8.552 0.947 25485 1592 1 2 . 1 1 53 53 MET N N 53 116.621 116.621 118.843 -2.222 25485 1593 1 2 . 1 1 53 53 MET HA H 53 4.023 4.023 4.669 -0.646 25485 1594 1 2 . 1 1 53 53 MET C C 53 174.695 174.695 174.881 -0.186 25485 1595 1 2 . 1 1 53 53 MET CA C 53 53.460 53.460 54.217 -0.757 25485 1596 1 2 . 1 1 53 53 MET CB C 53 35.408 35.408 34.245 1.163 25485 1597 1 2 . 1 1 53 53 MET H H 53 7.993 7.993 7.547 0.446 25485 1598 1 2 . 1 1 54 54 LEU N N 54 122.679 122.679 122.634 0.045 25485 1599 1 2 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.466 -0.715 25485 1600 1 2 . 1 1 54 54 LEU C C 54 174.784 174.784 174.723 0.061 25485 1601 1 2 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.943 -0.642 25485 1602 1 2 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.564 -0.554 25485 1603 1 2 . 1 1 54 54 LEU H H 54 7.940 7.940 8.284 -0.344 25485 1604 1 2 . 1 1 55 55 ASN N N 55 115.797 115.797 118.042 -2.245 25485 1605 1 2 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.665 0.084 25485 1606 1 2 . 1 1 55 55 ASN C C 55 175.459 175.459 174.975 0.484 25485 1607 1 2 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.385 -1.542 25485 1608 1 2 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.905 1.452 25485 1609 1 2 . 1 1 55 55 ASN H H 55 6.543 6.543 8.482 -1.939 25485 1610 1 2 . 1 1 56 56 SER N N 56 121.507 121.507 117.513 3.994 25485 1611 1 2 . 1 1 56 56 SER HA H 56 4.638 4.638 4.447 0.191 25485 1612 1 2 . 1 1 56 56 SER C C 56 175.727 175.727 175.513 0.214 25485 1613 1 2 . 1 1 56 56 SER CA C 56 57.932 57.932 58.983 -1.051 25485 1614 1 2 . 1 1 56 56 SER CB C 56 63.786 63.786 63.756 0.030 25485 1615 1 2 . 1 1 56 56 SER H H 56 8.213 8.213 8.053 0.160 25485 1616 1 2 . 1 1 57 57 ARG N N 57 122.951 122.951 120.829 2.122 25485 1617 1 2 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.314 -0.113 25485 1618 1 2 . 1 1 57 57 ARG C C 57 178.560 178.560 178.124 0.436 25485 1619 1 2 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.819 -0.388 25485 1620 1 2 . 1 1 57 57 ARG CB C 57 29.105 29.105 30.147 -1.042 25485 1621 1 2 . 1 1 57 57 ARG H H 57 7.895 7.895 8.512 -0.617 25485 1622 1 2 . 1 1 58 58 VAL N N 58 118.778 118.778 120.100 -1.322 25485 1623 1 2 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.570 -0.239 25485 1624 1 2 . 1 1 58 58 VAL C C 58 177.370 177.370 177.519 -0.149 25485 1625 1 2 . 1 1 58 58 VAL CA C 58 66.382 66.382 65.867 0.515 25485 1626 1 2 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.075 1.134 25485 1627 1 2 . 1 1 58 58 VAL H H 58 7.583 7.583 8.038 -0.455 25485 1628 1 2 . 1 1 59 59 ILE N N 59 119.159 119.159 117.656 1.503 25485 1629 1 2 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.702 -0.289 25485 1630 1 2 . 1 1 59 59 ILE C C 59 177.067 177.067 177.838 -0.771 25485 1631 1 2 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.025 0.608 25485 1632 1 2 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.858 -0.162 25485 1633 1 2 . 1 1 59 59 ILE H H 59 7.323 7.323 8.010 -0.687 25485 1634 1 2 . 1 1 60 60 GLU N N 60 119.367 119.367 119.177 0.190 25485 1635 1 2 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.964 -0.226 25485 1636 1 2 . 1 1 60 60 GLU C C 60 179.978 179.978 179.155 0.823 25485 1637 1 2 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.627 -0.369 25485 1638 1 2 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.352 0.036 25485 1639 1 2 . 1 1 60 60 GLU H H 60 7.879 7.879 7.503 0.376 25485 1640 1 2 . 1 1 61 61 ILE N N 61 118.816 118.816 114.964 3.852 25485 1641 1 2 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.917 -0.478 25485 1642 1 2 . 1 1 61 61 ILE C C 61 179.033 179.033 176.320 2.713 25485 1643 1 2 . 1 1 61 61 ILE CA C 61 64.838 64.838 63.874 0.964 25485 1644 1 2 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.807 -0.908 25485 1645 1 2 . 1 1 61 61 ILE H H 61 7.246 7.246 7.170 0.076 25485 1646 1 2 . 1 1 62 62 MET N N 62 119.986 119.986 116.798 3.188 25485 1647 1 2 . 1 1 62 62 MET HA H 62 3.444 3.444 4.281 -0.837 25485 1648 1 2 . 1 1 62 62 MET C C 62 176.185 176.185 177.699 -1.514 25485 1649 1 2 . 1 1 62 62 MET CA C 62 59.014 59.014 56.950 2.064 25485 1650 1 2 . 1 1 62 62 MET CB C 62 31.250 31.250 32.527 -1.277 25485 1651 1 2 . 1 1 62 62 MET H H 62 7.835 7.835 7.191 0.644 25485 1652 1 2 . 1 1 63 63 GLN N N 63 116.163 116.163 115.550 0.613 25485 1653 1 2 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.208 0.070 25485 1654 1 2 . 1 1 63 63 GLN C C 63 176.727 176.727 176.582 0.145 25485 1655 1 2 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.484 -0.346 25485 1656 1 2 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.583 -0.517 25485 1657 1 2 . 1 1 63 63 GLN H H 63 7.454 7.454 7.616 -0.162 25485 1658 1 2 . 1 1 64 64 LYS N N 64 121.430 121.430 121.048 0.382 25485 1659 1 2 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.483 0.060 25485 1660 1 2 . 1 1 64 64 LYS C C 64 174.724 174.724 174.879 -0.155 25485 1661 1 2 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.261 1.256 25485 1662 1 2 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.567 -0.970 25485 1663 1 2 . 1 1 64 64 LYS H H 64 7.483 7.483 7.557 -0.074 25485 1664 1 2 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.511 -2.075 25485 1665 1 2 . 1 1 65 65 PRO C C 65 176.158 176.158 175.935 0.223 25485 1666 1 2 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.098 -0.210 25485 1667 1 2 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.479 -0.646 25485 1668 1 2 . 1 1 66 66 ARG N N 66 112.697 112.697 120.658 -7.961 25485 1669 1 2 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.555 -0.147 25485 1670 1 2 . 1 1 66 66 ARG C C 66 174.478 174.478 174.137 0.341 25485 1671 1 2 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.734 -2.098 25485 1672 1 2 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.819 2.854 25485 1673 1 2 . 1 1 66 66 ARG H H 66 8.146 8.146 8.736 -0.590 25485 1674 1 2 . 1 1 67 67 CYS N N 67 121.740 121.740 115.787 5.953 25485 1675 1 2 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.817 -0.377 25485 1676 1 2 . 1 1 67 67 CYS C C 67 175.659 175.659 175.135 0.524 25485 1677 1 2 . 1 1 67 67 CYS CA C 67 59.195 59.195 56.488 2.707 25485 1678 1 2 . 1 1 67 67 CYS CB C 67 30.206 30.206 32.006 -1.800 25485 1679 1 2 . 1 1 67 67 CYS H H 67 7.757 7.757 7.875 -0.118 25485 1680 1 2 . 1 1 68 68 GLY N N 68 116.217 116.217 110.855 5.362 25485 1681 1 2 . 1 1 68 68 GLY C C 68 172.210 172.210 173.702 -1.492 25485 1682 1 2 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.161 1.398 25485 1683 1 2 . 1 1 68 68 GLY H H 68 9.704 9.704 9.320 0.384 25485 1684 1 2 . 1 1 69 69 VAL N N 69 126.372 126.372 121.287 5.085 25485 1685 1 2 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.475 -0.644 25485 1686 1 2 . 1 1 69 69 VAL C C 69 173.538 173.538 174.637 -1.099 25485 1687 1 2 . 1 1 69 69 VAL CA C 69 61.368 61.368 57.846 3.522 25485 1688 1 2 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.888 -0.365 25485 1689 1 2 . 1 1 69 69 VAL H H 69 9.113 9.113 7.446 1.667 25485 1690 1 2 . 1 1 70 70 PRO HA H 70 4.950 4.950 5.102 -0.152 25485 1691 1 2 . 1 1 70 70 PRO C C 70 175.019 175.019 176.736 -1.717 25485 1692 1 2 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.690 0.659 25485 1693 1 2 . 1 1 70 70 PRO CB C 70 32.358 32.358 33.199 -0.841 25485 1694 1 2 . 1 1 71 71 ASP N N 71 118.986 118.986 118.239 0.747 25485 1695 1 2 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.805 -0.372 25485 1696 1 2 . 1 1 71 71 ASP C C 71 175.166 175.166 174.585 0.581 25485 1697 1 2 . 1 1 71 71 ASP CA C 71 55.368 55.368 54.004 1.364 25485 1698 1 2 . 1 1 71 71 ASP CB C 71 39.864 39.864 42.145 -2.280 25485 1699 1 2 . 1 1 71 71 ASP H H 71 8.054 8.054 8.805 -0.751 25485 1700 1 2 . 1 1 72 72 VAL N N 72 112.953 112.953 114.442 -1.489 25485 1701 1 2 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.458 -0.162 25485 1702 1 2 . 1 1 72 72 VAL C C 72 174.330 174.330 174.223 0.107 25485 1703 1 2 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.151 -0.506 25485 1704 1 2 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.721 0.152 25485 1705 1 2 . 1 1 72 72 VAL H H 72 6.430 6.430 7.471 -1.041 25485 1706 1 2 . 1 1 73 73 ALA N N 73 125.869 125.869 129.759 -3.890 25485 1707 1 2 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.532 -0.227 25485 1708 1 2 . 1 1 73 73 ALA C C 73 177.382 177.382 176.178 1.204 25485 1709 1 2 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.430 0.619 25485 1710 1 2 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.362 -0.411 25485 1711 1 2 . 1 1 73 73 ALA H H 73 8.177 8.177 8.044 0.133 25485 1712 1 2 . 1 1 74 74 GLU N N 74 120.724 120.724 119.025 1.699 25485 1713 1 2 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.414 -0.311 25485 1714 1 2 . 1 1 74 74 GLU C C 74 176.246 176.246 175.245 1.001 25485 1715 1 2 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.392 0.400 25485 1716 1 2 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.510 -1.725 25485 1717 1 2 . 1 1 74 74 GLU H H 74 8.381 8.381 8.371 0.010 25485 1718 1 2 . 1 1 75 75 TYR N N 75 121.473 121.473 123.893 -2.420 25485 1719 1 2 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.189 0.256 25485 1720 1 2 . 1 1 75 75 TYR C C 75 175.633 175.633 173.655 1.978 25485 1721 1 2 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.948 -0.621 25485 1722 1 2 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.173 0.240 25485 1723 1 2 . 1 1 75 75 TYR H H 75 8.065 8.065 8.464 -0.399 25485 1724 1 2 . 1 1 76 76 SER N N 76 117.860 117.860 118.540 -0.680 25485 1725 1 2 . 1 1 76 76 SER HA H 76 3.886 3.886 4.550 -0.664 25485 1726 1 2 . 1 1 76 76 SER C C 76 173.859 173.859 173.947 -0.088 25485 1727 1 2 . 1 1 76 76 SER CA C 76 58.250 58.250 57.474 0.776 25485 1728 1 2 . 1 1 76 76 SER CB C 76 64.117 64.117 64.796 -0.679 25485 1729 1 2 . 1 1 76 76 SER H H 76 7.748 7.748 7.999 -0.251 25485 1730 1 2 . 1 1 77 77 LEU N N 77 123.789 123.789 126.742 -2.953 25485 1731 1 2 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.413 -0.267 25485 1732 1 2 . 1 1 77 77 LEU C C 77 176.451 176.451 175.835 0.616 25485 1733 1 2 . 1 1 77 77 LEU CA C 77 55.464 55.464 54.421 1.043 25485 1734 1 2 . 1 1 77 77 LEU CB C 77 41.957 41.957 39.188 2.768 25485 1735 1 2 . 1 1 77 77 LEU H H 77 7.979 7.979 8.741 -0.762 25485 1736 1 2 . 1 1 78 78 PHE N N 78 119.275 119.275 123.164 -3.889 25485 1737 1 2 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.275 0.601 25485 1738 1 2 . 1 1 78 78 PHE C C 78 173.844 173.844 175.193 -1.349 25485 1739 1 2 . 1 1 78 78 PHE CA C 78 55.372 55.372 56.879 -1.507 25485 1740 1 2 . 1 1 78 78 PHE CB C 78 39.164 39.164 38.417 0.747 25485 1741 1 2 . 1 1 78 78 PHE H H 78 7.827 7.827 8.085 -0.258 25485 1742 1 2 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.371 -0.015 25485 1743 1 2 . 1 1 79 79 PRO C C 79 176.433 176.433 175.657 0.776 25485 1744 1 2 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.288 1.562 25485 1745 1 2 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.459 -0.767 25485 1746 1 2 . 1 1 80 80 ASN N N 80 118.057 118.057 119.526 -1.469 25485 1747 1 2 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.365 0.282 25485 1748 1 2 . 1 1 80 80 ASN C C 80 174.305 174.305 174.673 -0.368 25485 1749 1 2 . 1 1 80 80 ASN CA C 80 52.860 52.860 54.380 -1.520 25485 1750 1 2 . 1 1 80 80 ASN CB C 80 39.583 39.583 37.873 1.710 25485 1751 1 2 . 1 1 80 80 ASN H H 80 8.068 8.068 8.535 -0.467 25485 1752 1 2 . 1 1 81 81 SER HA H 81 4.565 4.565 4.203 0.362 25485 1753 1 2 . 1 1 81 81 SER CA C 81 56.800 56.800 58.909 -2.109 25485 1754 1 2 . 1 1 81 81 SER CB C 81 63.128 63.128 63.526 -0.398 25485 1755 1 2 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.481 -0.020 25485 1756 1 2 . 1 1 82 82 PRO C C 82 174.589 174.589 176.499 -1.910 25485 1757 1 2 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.783 -1.137 25485 1758 1 2 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.186 -0.932 25485 1759 1 2 . 1 1 83 83 LYS N N 83 114.578 114.578 118.524 -3.946 25485 1760 1 2 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.472 -0.319 25485 1761 1 2 . 1 1 83 83 LYS C C 83 175.308 175.308 176.398 -1.090 25485 1762 1 2 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.138 -0.731 25485 1763 1 2 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.681 0.737 25485 1764 1 2 . 1 1 83 83 LYS H H 83 7.356 7.356 7.493 -0.137 25485 1765 1 2 . 1 1 84 84 TRP N N 84 122.455 122.455 121.699 0.756 25485 1766 1 2 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.448 -0.428 25485 1767 1 2 . 1 1 84 84 TRP C C 84 177.636 177.636 177.020 0.616 25485 1768 1 2 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.473 -1.002 25485 1769 1 2 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.924 0.394 25485 1770 1 2 . 1 1 84 84 TRP H H 84 8.050 8.050 8.159 -0.109 25485 1771 1 2 . 1 1 85 85 THR N N 85 113.501 113.501 115.241 -1.740 25485 1772 1 2 . 1 1 85 85 THR HA H 85 4.573 4.573 4.437 0.136 25485 1773 1 2 . 1 1 85 85 THR C C 85 174.757 174.757 174.797 -0.040 25485 1774 1 2 . 1 1 85 85 THR CA C 85 62.130 62.130 61.188 0.942 25485 1775 1 2 . 1 1 85 85 THR CB C 85 69.107 69.107 69.733 -0.626 25485 1776 1 2 . 1 1 85 85 THR H H 85 8.861 8.861 8.555 0.306 25485 1777 1 2 . 1 1 86 86 SER N N 86 117.270 117.270 118.178 -0.908 25485 1778 1 2 . 1 1 86 86 SER HA H 86 4.741 4.741 4.605 0.136 25485 1779 1 2 . 1 1 86 86 SER C C 86 173.457 173.457 174.359 -0.902 25485 1780 1 2 . 1 1 86 86 SER CA C 86 56.739 56.739 58.123 -1.384 25485 1781 1 2 . 1 1 86 86 SER CB C 86 64.717 64.717 64.471 0.247 25485 1782 1 2 . 1 1 86 86 SER H H 86 7.743 7.743 8.177 -0.434 25485 1783 1 2 . 1 1 87 87 LYS N N 87 120.329 120.329 119.666 0.663 25485 1784 1 2 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.389 -0.160 25485 1785 1 2 . 1 1 87 87 LYS CA C 87 57.592 57.592 56.620 0.972 25485 1786 1 2 . 1 1 87 87 LYS CB C 87 32.123 32.123 33.246 -1.123 25485 1787 1 2 . 1 1 87 87 LYS H H 87 8.285 8.285 8.173 0.112 25485 1788 1 2 . 1 1 88 88 VAL N N 88 117.531 117.531 118.214 -0.683 25485 1789 1 2 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.473 0.182 25485 1790 1 2 . 1 1 88 88 VAL C C 88 174.868 174.868 173.692 1.176 25485 1791 1 2 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.539 -0.444 25485 1792 1 2 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.434 -1.739 25485 1793 1 2 . 1 1 88 88 VAL H H 88 7.428 7.428 7.244 0.184 25485 1794 1 2 . 1 1 89 89 VAL N N 89 131.452 131.452 126.127 5.325 25485 1795 1 2 . 1 1 89 89 VAL HA H 89 4.159 4.159 3.912 0.247 25485 1796 1 2 . 1 1 89 89 VAL C C 89 175.758 175.758 174.595 1.163 25485 1797 1 2 . 1 1 89 89 VAL CA C 89 60.721 60.721 59.958 0.763 25485 1798 1 2 . 1 1 89 89 VAL CB C 89 34.173 34.173 32.965 1.208 25485 1799 1 2 . 1 1 89 89 VAL H H 89 8.603 8.603 8.640 -0.037 25485 1800 1 2 . 1 1 90 90 THR N N 90 118.206 118.206 117.293 0.913 25485 1801 1 2 . 1 1 90 90 THR HA H 90 5.649 5.649 5.510 0.139 25485 1802 1 2 . 1 1 90 90 THR C C 90 174.579 174.579 173.659 0.920 25485 1803 1 2 . 1 1 90 90 THR CA C 90 58.959 58.959 59.183 -0.224 25485 1804 1 2 . 1 1 90 90 THR CB C 90 72.288 72.288 72.285 0.003 25485 1805 1 2 . 1 1 90 90 THR H H 90 9.021 9.021 8.012 1.009 25485 1806 1 2 . 1 1 91 91 TYR N N 91 118.117 118.117 117.007 1.110 25485 1807 1 2 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.505 0.193 25485 1808 1 2 . 1 1 91 91 TYR C C 91 171.233 171.233 172.668 -1.435 25485 1809 1 2 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.886 -0.454 25485 1810 1 2 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.281 0.979 25485 1811 1 2 . 1 1 91 91 TYR H H 91 8.555 8.555 8.201 0.354 25485 1812 1 2 . 1 1 92 92 ARG N N 92 120.252 120.252 120.255 -0.003 25485 1813 1 2 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.668 0.029 25485 1814 1 2 . 1 1 92 92 ARG C C 92 173.932 173.932 174.814 -0.882 25485 1815 1 2 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.696 0.145 25485 1816 1 2 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.517 0.169 25485 1817 1 2 . 1 1 92 92 ARG H H 92 8.520 8.520 8.712 -0.192 25485 1818 1 2 . 1 1 93 93 ILE N N 93 128.305 128.305 127.035 1.270 25485 1819 1 2 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.237 0.395 25485 1820 1 2 . 1 1 93 93 ILE C C 93 175.468 175.468 176.318 -0.850 25485 1821 1 2 . 1 1 93 93 ILE CA C 93 61.228 61.228 62.557 -1.329 25485 1822 1 2 . 1 1 93 93 ILE CB C 93 37.225 37.225 38.235 -1.010 25485 1823 1 2 . 1 1 93 93 ILE H H 93 8.886 8.886 8.742 0.144 25485 1824 1 2 . 1 1 94 94 VAL N N 94 126.647 126.647 127.988 -1.341 25485 1825 1 2 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.136 -0.140 25485 1826 1 2 . 1 1 94 94 VAL C C 94 175.670 175.670 176.019 -0.349 25485 1827 1 2 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.968 -0.553 25485 1828 1 2 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.672 0.347 25485 1829 1 2 . 1 1 94 94 VAL H H 94 9.517 9.517 8.817 0.700 25485 1830 1 2 . 1 1 95 95 SER N N 95 113.398 113.398 112.906 0.492 25485 1831 1 2 . 1 1 95 95 SER HA H 95 4.701 4.701 4.791 -0.090 25485 1832 1 2 . 1 1 95 95 SER C C 95 170.684 170.684 172.845 -2.161 25485 1833 1 2 . 1 1 95 95 SER CA C 95 56.945 56.945 57.164 -0.219 25485 1834 1 2 . 1 1 95 95 SER CB C 95 65.276 65.276 64.683 0.593 25485 1835 1 2 . 1 1 95 95 SER H H 95 7.463 7.463 7.437 0.026 25485 1836 1 2 . 1 1 96 96 TYR N N 96 116.512 116.512 119.306 -2.794 25485 1837 1 2 . 1 1 96 96 TYR HA H 96 4.264 4.264 5.050 -0.786 25485 1838 1 2 . 1 1 96 96 TYR C C 96 174.856 174.856 174.657 0.199 25485 1839 1 2 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.210 2.427 25485 1840 1 2 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.201 0.962 25485 1841 1 2 . 1 1 96 96 TYR H H 96 8.240 8.240 8.196 0.044 25485 1842 1 2 . 1 1 97 97 THR CA C 97 57.798 57.798 62.157 -4.359 25485 1843 1 2 . 1 1 97 97 THR CB C 97 67.420 67.420 69.633 -2.213 25485 1844 1 2 . 1 1 98 98 ARG N N 98 128.156 128.156 124.044 4.112 25485 1845 1 2 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.287 0.038 25485 1846 1 2 . 1 1 98 98 ARG C C 98 177.625 177.625 176.203 1.422 25485 1847 1 2 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.105 -0.891 25485 1848 1 2 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.806 -0.327 25485 1849 1 2 . 1 1 98 98 ARG H H 98 8.914 8.914 8.842 0.072 25485 1850 1 2 . 1 1 99 99 ASP N N 99 120.592 120.592 118.114 2.478 25485 1851 1 2 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.622 -0.241 25485 1852 1 2 . 1 1 99 99 ASP C C 99 175.679 175.679 175.368 0.311 25485 1853 1 2 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.825 1.611 25485 1854 1 2 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.550 0.820 25485 1855 1 2 . 1 1 99 99 ASP H H 99 8.708 8.708 8.381 0.327 25485 1856 1 2 . 1 1 100 100 LEU N N 100 116.829 116.829 119.385 -2.556 25485 1857 1 2 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.706 0.250 25485 1858 1 2 . 1 1 100 100 LEU C C 100 173.335 173.335 174.191 -0.856 25485 1859 1 2 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.852 -0.815 25485 1860 1 2 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.011 2.256 25485 1861 1 2 . 1 1 100 100 LEU H H 100 6.916 6.916 7.098 -0.182 25485 1862 1 2 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.143 0.032 25485 1863 1 2 . 1 1 102 102 HIS C C 102 177.649 177.649 177.337 0.312 25485 1864 1 2 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.533 -0.860 25485 1865 1 2 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.196 -1.762 25485 1866 1 2 . 1 1 103 103 ILE N N 103 115.170 115.170 118.792 -3.622 25485 1867 1 2 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.865 0.308 25485 1868 1 2 . 1 1 103 103 ILE C C 103 177.214 177.214 177.150 0.064 25485 1869 1 2 . 1 1 103 103 ILE CA C 103 63.165 63.165 63.398 -0.233 25485 1870 1 2 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.656 0.109 25485 1871 1 2 . 1 1 103 103 ILE H H 103 8.234 8.234 8.193 0.041 25485 1872 1 2 . 1 1 104 104 THR N N 104 119.374 119.374 117.339 2.035 25485 1873 1 2 . 1 1 104 104 THR HA H 104 4.045 4.045 3.993 0.052 25485 1874 1 2 . 1 1 104 104 THR C C 104 175.612 175.612 176.708 -1.096 25485 1875 1 2 . 1 1 104 104 THR CA C 104 66.568 66.568 67.288 -0.720 25485 1876 1 2 . 1 1 104 104 THR CB C 104 68.077 68.077 68.665 -0.588 25485 1877 1 2 . 1 1 104 104 THR H H 104 6.947 6.947 7.598 -0.651 25485 1878 1 2 . 1 1 105 105 VAL N N 105 123.263 123.263 121.145 2.118 25485 1879 1 2 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.147 0.291 25485 1880 1 2 . 1 1 105 105 VAL C C 105 177.322 177.322 177.109 0.213 25485 1881 1 2 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.084 0.863 25485 1882 1 2 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.606 -0.337 25485 1883 1 2 . 1 1 105 105 VAL H H 105 7.407 7.407 8.128 -0.721 25485 1884 1 2 . 1 1 106 106 ASP N N 106 119.972 119.972 120.009 -0.037 25485 1885 1 2 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.418 -0.096 25485 1886 1 2 . 1 1 106 106 ASP C C 106 179.747 179.747 178.110 1.637 25485 1887 1 2 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.315 0.920 25485 1888 1 2 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.860 -0.498 25485 1889 1 2 . 1 1 106 106 ASP H H 106 8.627 8.627 8.167 0.460 25485 1890 1 2 . 1 1 107 107 ARG N N 107 121.033 121.033 118.591 2.442 25485 1891 1 2 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.108 0.070 25485 1892 1 2 . 1 1 107 107 ARG C C 107 179.485 179.485 178.496 0.989 25485 1893 1 2 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.953 0.627 25485 1894 1 2 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.777 0.431 25485 1895 1 2 . 1 1 107 107 ARG H H 107 8.356 8.356 7.890 0.466 25485 1896 1 2 . 1 1 108 108 LEU N N 108 121.463 121.463 121.084 0.379 25485 1897 1 2 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.213 0.092 25485 1898 1 2 . 1 1 108 108 LEU C C 108 178.852 178.852 178.807 0.045 25485 1899 1 2 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.623 0.259 25485 1900 1 2 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.372 -0.057 25485 1901 1 2 . 1 1 108 108 LEU H H 108 8.790 8.790 7.927 0.863 25485 1902 1 2 . 1 1 109 109 VAL N N 109 120.233 120.233 117.027 3.206 25485 1903 1 2 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.724 -0.324 25485 1904 1 2 . 1 1 109 109 VAL C C 109 177.019 177.019 177.766 -0.747 25485 1905 1 2 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.436 1.609 25485 1906 1 2 . 1 1 109 109 VAL CB C 109 31.189 31.189 30.592 0.597 25485 1907 1 2 . 1 1 109 109 VAL H H 109 8.787 8.787 7.865 0.922 25485 1908 1 2 . 1 1 110 110 SER N N 110 112.862 112.862 116.084 -3.222 25485 1909 1 2 . 1 1 110 110 SER HA H 110 4.300 4.300 3.963 0.337 25485 1910 1 2 . 1 1 110 110 SER C C 110 176.770 176.770 176.835 -0.065 25485 1911 1 2 . 1 1 110 110 SER CA C 110 61.744 61.744 62.014 -0.270 25485 1912 1 2 . 1 1 110 110 SER CB C 110 62.742 62.742 62.753 -0.011 25485 1913 1 2 . 1 1 110 110 SER H H 110 7.605 7.605 7.816 -0.211 25485 1914 1 2 . 1 1 111 111 LYS N N 111 122.319 122.319 122.009 0.310 25485 1915 1 2 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.020 0.041 25485 1916 1 2 . 1 1 111 111 LYS C C 111 178.309 178.309 178.352 -0.043 25485 1917 1 2 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.244 0.570 25485 1918 1 2 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.515 -0.006 25485 1919 1 2 . 1 1 111 111 LYS H H 111 8.156 8.156 7.967 0.189 25485 1920 1 2 . 1 1 112 112 ALA N N 112 124.147 124.147 120.508 3.639 25485 1921 1 2 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.322 -0.223 25485 1922 1 2 . 1 1 112 112 ALA C C 112 179.445 179.445 178.760 0.685 25485 1923 1 2 . 1 1 112 112 ALA CA C 112 55.226 55.226 53.986 1.240 25485 1924 1 2 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.325 0.650 25485 1925 1 2 . 1 1 112 112 ALA H H 112 8.278 8.278 7.382 0.896 25485 1926 1 2 . 1 1 113 113 LEU N N 113 116.195 116.195 120.239 -4.044 25485 1927 1 2 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.028 -0.277 25485 1928 1 2 . 1 1 113 113 LEU C C 113 179.537 179.537 177.822 1.715 25485 1929 1 2 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.016 -0.272 25485 1930 1 2 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.918 -1.363 25485 1931 1 2 . 1 1 113 113 LEU H H 113 8.021 8.021 8.520 -0.499 25485 1932 1 2 . 1 1 114 114 ASN N N 114 116.570 116.570 117.316 -0.746 25485 1933 1 2 . 1 1 114 114 ASN HA H 114 4.546 4.546 3.971 0.575 25485 1934 1 2 . 1 1 114 114 ASN C C 114 177.136 177.136 177.046 0.090 25485 1935 1 2 . 1 1 114 114 ASN CA C 114 55.764 55.764 55.907 -0.143 25485 1936 1 2 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.175 0.448 25485 1937 1 2 . 1 1 114 114 ASN H H 114 8.212 8.212 8.110 0.102 25485 1938 1 2 . 1 1 115 115 MET N N 115 122.055 122.055 119.867 2.188 25485 1939 1 2 . 1 1 115 115 MET HA H 115 4.010 4.010 3.951 0.059 25485 1940 1 2 . 1 1 115 115 MET C C 115 177.681 177.681 178.089 -0.408 25485 1941 1 2 . 1 1 115 115 MET CA C 115 59.445 59.445 59.257 0.188 25485 1942 1 2 . 1 1 115 115 MET CB C 115 31.616 31.616 32.351 -0.735 25485 1943 1 2 . 1 1 115 115 MET H H 115 7.937 7.937 7.527 0.410 25485 1944 1 2 . 1 1 116 116 TRP N N 116 117.115 117.115 119.042 -1.927 25485 1945 1 2 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.195 0.323 25485 1946 1 2 . 1 1 116 116 TRP C C 116 179.054 179.054 179.404 -0.350 25485 1947 1 2 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.502 0.009 25485 1948 1 2 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.165 1.708 25485 1949 1 2 . 1 1 116 116 TRP H H 116 6.783 6.783 7.531 -0.748 25485 1950 1 2 . 1 1 117 117 GLY N N 117 104.511 104.511 106.468 -1.957 25485 1951 1 2 . 1 1 117 117 GLY C C 117 175.035 175.035 176.118 -1.083 25485 1952 1 2 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.773 0.224 25485 1953 1 2 . 1 1 117 117 GLY H H 117 9.302 9.302 7.547 1.755 25485 1954 1 2 . 1 1 118 118 LYS N N 118 118.580 118.580 119.654 -1.074 25485 1955 1 2 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.093 0.114 25485 1956 1 2 . 1 1 118 118 LYS C C 118 177.235 177.235 177.489 -0.254 25485 1957 1 2 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.752 0.139 25485 1958 1 2 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.067 -0.162 25485 1959 1 2 . 1 1 118 118 LYS H H 118 7.940 7.940 7.951 -0.011 25485 1960 1 2 . 1 1 119 119 GLU N N 119 113.749 113.749 117.619 -3.870 25485 1961 1 2 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.357 0.481 25485 1962 1 2 . 1 1 119 119 GLU C C 119 178.024 178.024 175.591 2.433 25485 1963 1 2 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.924 -0.649 25485 1964 1 2 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.711 0.975 25485 1965 1 2 . 1 1 119 119 GLU H H 119 7.763 7.763 7.572 0.191 25485 1966 1 2 . 1 1 120 120 ILE N N 120 111.144 111.144 112.889 -1.745 25485 1967 1 2 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.743 0.628 25485 1968 1 2 . 1 1 120 120 ILE C C 120 174.033 174.033 173.754 0.279 25485 1969 1 2 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.573 0.881 25485 1970 1 2 . 1 1 120 120 ILE CB C 120 41.929 41.929 40.496 1.433 25485 1971 1 2 . 1 1 120 120 ILE H H 120 7.518 7.518 7.590 -0.072 25485 1972 1 2 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.399 0.263 25485 1973 1 2 . 1 1 121 121 PRO C C 121 174.784 174.784 177.052 -2.268 25485 1974 1 2 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.625 -1.610 25485 1975 1 2 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.747 -2.362 25485 1976 1 2 . 1 1 122 122 LEU N N 122 121.531 121.531 118.930 2.601 25485 1977 1 2 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.298 0.041 25485 1978 1 2 . 1 1 122 122 LEU C C 122 173.977 173.977 176.368 -2.391 25485 1979 1 2 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.701 -1.143 25485 1980 1 2 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.935 2.464 25485 1981 1 2 . 1 1 122 122 LEU H H 122 6.847 6.847 7.680 -0.833 25485 1982 1 2 . 1 1 123 123 HIS N N 123 121.054 121.054 115.564 5.490 25485 1983 1 2 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.827 -0.220 25485 1984 1 2 . 1 1 123 123 HIS C C 123 172.820 172.820 173.220 -0.400 25485 1985 1 2 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.391 -0.882 25485 1986 1 2 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.979 0.131 25485 1987 1 2 . 1 1 123 123 HIS H H 123 7.760 7.760 8.265 -0.505 25485 1988 1 2 . 1 1 124 124 PHE N N 124 120.465 120.465 122.354 -1.889 25485 1989 1 2 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.460 0.374 25485 1990 1 2 . 1 1 124 124 PHE C C 124 175.677 175.677 175.017 0.660 25485 1991 1 2 . 1 1 124 124 PHE CA C 124 56.292 56.292 56.949 -0.657 25485 1992 1 2 . 1 1 124 124 PHE CB C 124 41.822 41.822 42.664 -0.842 25485 1993 1 2 . 1 1 124 124 PHE H H 124 8.306 8.306 8.543 -0.237 25485 1994 1 2 . 1 1 125 125 ARG N N 125 124.008 124.008 122.810 1.198 25485 1995 1 2 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.812 -0.101 25485 1996 1 2 . 1 1 125 125 ARG C C 125 172.901 172.901 175.278 -2.377 25485 1997 1 2 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.723 -0.449 25485 1998 1 2 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.420 -0.598 25485 1999 1 2 . 1 1 125 125 ARG H H 125 8.426 8.426 9.170 -0.744 25485 2000 1 2 . 1 1 126 126 LYS N N 126 130.004 130.004 124.126 5.878 25485 2001 1 2 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.223 -0.840 25485 2002 1 2 . 1 1 126 126 LYS C C 126 176.126 176.126 175.918 0.208 25485 2003 1 2 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.764 0.417 25485 2004 1 2 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.596 -0.570 25485 2005 1 2 . 1 1 126 126 LYS H H 126 8.481 8.481 8.594 -0.113 25485 2006 1 2 . 1 1 127 127 VAL N N 127 125.288 125.288 120.586 4.702 25485 2007 1 2 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.169 0.336 25485 2008 1 2 . 1 1 127 127 VAL C C 127 175.565 175.565 174.988 0.577 25485 2009 1 2 . 1 1 127 127 VAL CA C 127 59.949 59.949 62.008 -2.059 25485 2010 1 2 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.102 2.260 25485 2011 1 2 . 1 1 127 127 VAL H H 127 8.721 8.721 8.262 0.459 25485 2012 1 2 . 1 1 128 128 VAL N N 128 117.467 117.467 120.669 -3.202 25485 2013 1 2 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.051 0.278 25485 2014 1 2 . 1 1 128 128 VAL C C 128 174.622 174.622 174.966 -0.344 25485 2015 1 2 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.081 1.036 25485 2016 1 2 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.141 0.369 25485 2017 1 2 . 1 1 128 128 VAL H H 128 8.406 8.406 8.116 0.290 25485 2018 1 2 . 1 1 129 129 TRP N N 129 119.986 119.986 120.792 -0.806 25485 2019 1 2 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.815 -0.099 25485 2020 1 2 . 1 1 129 129 TRP C C 129 174.536 174.536 176.094 -1.558 25485 2021 1 2 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.922 -1.005 25485 2022 1 2 . 1 1 129 129 TRP CB C 129 32.014 32.014 30.025 1.989 25485 2023 1 2 . 1 1 129 129 TRP H H 129 7.435 7.435 7.221 0.214 25485 2024 1 2 . 1 1 130 130 GLY N N 130 109.900 109.900 114.053 -4.153 25485 2025 1 2 . 1 1 130 130 GLY C C 130 173.187 173.187 173.690 -0.503 25485 2026 1 2 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.567 -0.087 25485 2027 1 2 . 1 1 130 130 GLY H H 130 8.006 8.006 8.309 -0.303 25485 2028 1 2 . 1 1 131 131 THR N N 131 116.142 116.142 116.152 -0.010 25485 2029 1 2 . 1 1 131 131 THR HA H 131 4.162 4.162 4.612 -0.450 25485 2030 1 2 . 1 1 131 131 THR C C 131 172.766 172.766 173.836 -1.070 25485 2031 1 2 . 1 1 131 131 THR CA C 131 63.212 63.212 61.440 1.772 25485 2032 1 2 . 1 1 131 131 THR CB C 131 69.308 69.308 70.101 -0.793 25485 2033 1 2 . 1 1 131 131 THR H H 131 8.233 8.233 8.237 -0.004 25485 2034 1 2 . 1 1 132 132 ALA N N 132 129.807 129.807 123.528 6.279 25485 2035 1 2 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.481 0.035 25485 2036 1 2 . 1 1 132 132 ALA C C 132 175.358 175.358 176.301 -0.943 25485 2037 1 2 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.473 -1.107 25485 2038 1 2 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.462 1.336 25485 2039 1 2 . 1 1 132 132 ALA H H 132 7.962 7.962 8.095 -0.133 25485 2040 1 2 . 1 1 133 133 ASP N N 133 122.896 122.896 119.768 3.128 25485 2041 1 2 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.546 -0.125 25485 2042 1 2 . 1 1 133 133 ASP C C 133 177.314 177.314 177.031 0.283 25485 2043 1 2 . 1 1 133 133 ASP CA C 133 57.919 57.919 57.362 0.557 25485 2044 1 2 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.736 -1.265 25485 2045 1 2 . 1 1 133 133 ASP H H 133 8.251 8.251 8.561 -0.310 25485 2046 1 2 . 1 1 134 134 ILE N N 134 125.472 125.472 121.248 4.224 25485 2047 1 2 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.492 -0.349 25485 2048 1 2 . 1 1 134 134 ILE C C 134 174.201 174.201 175.002 -0.801 25485 2049 1 2 . 1 1 134 134 ILE CA C 134 61.271 61.271 60.916 0.355 25485 2050 1 2 . 1 1 134 134 ILE CB C 134 38.710 38.710 37.861 0.849 25485 2051 1 2 . 1 1 134 134 ILE H H 134 8.802 8.802 8.313 0.489 25485 2052 1 2 . 1 1 135 135 MET N N 135 127.265 127.265 128.189 -0.924 25485 2053 1 2 . 1 1 135 135 MET HA H 135 5.192 5.192 5.267 -0.075 25485 2054 1 2 . 1 1 135 135 MET C C 135 176.206 176.206 175.778 0.428 25485 2055 1 2 . 1 1 135 135 MET CA C 135 53.626 53.626 55.021 -1.395 25485 2056 1 2 . 1 1 135 135 MET CB C 135 32.639 32.639 34.501 -1.862 25485 2057 1 2 . 1 1 135 135 MET H H 135 7.418 7.418 8.197 -0.779 25485 2058 1 2 . 1 1 136 136 ILE N N 136 125.440 125.440 123.945 1.495 25485 2059 1 2 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.943 0.646 25485 2060 1 2 . 1 1 136 136 ILE C C 136 175.190 175.190 175.766 -0.576 25485 2061 1 2 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.466 1.642 25485 2062 1 2 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.425 4.514 25485 2063 1 2 . 1 1 136 136 ILE H H 136 9.124 9.124 8.809 0.315 25485 2064 1 2 . 1 1 137 137 GLY N N 137 112.211 112.211 114.576 -2.365 25485 2065 1 2 . 1 1 137 137 GLY C C 137 170.855 170.855 171.650 -0.795 25485 2066 1 2 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.855 1.550 25485 2067 1 2 . 1 1 137 137 GLY H H 137 8.594 8.594 8.065 0.529 25485 2068 1 2 . 1 1 138 138 PHE N N 138 119.463 119.463 118.771 0.692 25485 2069 1 2 . 1 1 138 138 PHE HA H 138 5.496 5.496 4.944 0.552 25485 2070 1 2 . 1 1 138 138 PHE C C 138 175.186 175.186 175.700 -0.514 25485 2071 1 2 . 1 1 138 138 PHE CA C 138 55.995 55.995 56.704 -0.709 25485 2072 1 2 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.330 0.112 25485 2073 1 2 . 1 1 138 138 PHE H H 138 7.857 7.857 8.262 -0.405 25485 2074 1 2 . 1 1 139 139 ALA N N 139 123.914 123.914 124.774 -0.860 25485 2075 1 2 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.619 0.112 25485 2076 1 2 . 1 1 139 139 ALA C C 139 174.613 174.613 175.074 -0.461 25485 2077 1 2 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.217 -1.182 25485 2078 1 2 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.713 1.759 25485 2079 1 2 . 1 1 139 139 ALA H H 139 8.955 8.955 8.344 0.611 25485 2080 1 2 . 1 1 140 140 ARG N N 140 118.339 118.339 120.139 -1.800 25485 2081 1 2 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.841 0.265 25485 2082 1 2 . 1 1 140 140 ARG C C 140 176.201 176.201 178.381 -2.180 25485 2083 1 2 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.903 -0.737 25485 2084 1 2 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.606 0.863 25485 2085 1 2 . 1 1 140 140 ARG H H 140 8.546 8.546 8.538 0.008 25485 2086 1 2 . 1 1 141 141 GLY N N 141 108.916 108.916 108.914 0.002 25485 2087 1 2 . 1 1 141 141 GLY C C 141 175.595 175.595 175.000 0.595 25485 2088 1 2 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.311 -1.021 25485 2089 1 2 . 1 1 141 141 GLY H H 141 8.989 8.989 9.304 -0.315 25485 2090 1 2 . 1 1 142 142 ALA N N 142 121.448 121.448 121.434 0.014 25485 2091 1 2 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.478 -0.070 25485 2092 1 2 . 1 1 142 142 ALA C C 142 177.027 177.027 177.663 -0.636 25485 2093 1 2 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.096 1.181 25485 2094 1 2 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.148 -0.183 25485 2095 1 2 . 1 1 142 142 ALA H H 142 8.642 8.642 8.189 0.453 25485 2096 1 2 . 1 1 143 143 HIS N N 143 120.356 120.356 115.968 4.388 25485 2097 1 2 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.475 0.682 25485 2098 1 2 . 1 1 143 143 HIS C C 143 174.303 174.303 176.331 -2.028 25485 2099 1 2 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.429 -0.976 25485 2100 1 2 . 1 1 143 143 HIS CB C 143 27.791 27.791 30.088 -2.297 25485 2101 1 2 . 1 1 143 143 HIS H H 143 8.990 8.990 8.214 0.776 25485 2102 1 2 . 1 1 144 144 GLY N N 144 112.517 112.517 107.606 4.911 25485 2103 1 2 . 1 1 144 144 GLY C C 144 173.758 173.758 172.931 0.827 25485 2104 1 2 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.550 1.545 25485 2105 1 2 . 1 1 144 144 GLY H H 144 5.175 5.175 7.668 -2.493 25485 2106 1 2 . 1 1 145 145 ASP N N 145 117.762 117.762 118.090 -0.328 25485 2107 1 2 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.637 0.061 25485 2108 1 2 . 1 1 145 145 ASP C C 145 175.851 175.851 174.892 0.959 25485 2109 1 2 . 1 1 145 145 ASP CA C 145 51.959 51.959 53.129 -1.170 25485 2110 1 2 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.405 -0.606 25485 2111 1 2 . 1 1 145 145 ASP H H 145 7.096 7.096 7.526 -0.430 25485 2112 1 2 . 1 1 146 146 SER N N 146 125.540 125.540 115.028 10.512 25485 2113 1 2 . 1 1 146 146 SER HA H 146 4.204 4.204 4.394 -0.190 25485 2114 1 2 . 1 1 146 146 SER C C 146 172.319 172.319 173.491 -1.172 25485 2115 1 2 . 1 1 146 146 SER CA C 146 58.862 58.862 59.112 -0.250 25485 2116 1 2 . 1 1 146 146 SER CB C 146 62.933 62.933 63.710 -0.777 25485 2117 1 2 . 1 1 146 146 SER H H 146 8.261 8.261 8.288 -0.027 25485 2118 1 2 . 1 1 147 147 TYR N N 147 120.757 120.757 116.927 3.830 25485 2119 1 2 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.211 0.611 25485 2120 1 2 . 1 1 147 147 TYR C C 147 170.372 170.372 173.403 -3.031 25485 2121 1 2 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.904 -4.636 25485 2122 1 2 . 1 1 147 147 TYR CB C 147 38.296 38.296 38.264 0.032 25485 2123 1 2 . 1 1 147 147 TYR H H 147 7.450 7.450 8.434 -0.984 25485 2124 1 2 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.298 0.574 25485 2125 1 2 . 1 1 148 148 PRO C C 148 179.009 179.009 176.313 2.696 25485 2126 1 2 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.206 1.169 25485 2127 1 2 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.080 -1.171 25485 2128 1 2 . 1 1 149 149 PHE N N 149 120.514 120.514 118.422 2.092 25485 2129 1 2 . 1 1 149 149 PHE C C 149 176.813 176.813 175.954 0.859 25485 2130 1 2 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.597 -1.144 25485 2131 1 2 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.536 0.037 25485 2132 1 2 . 1 1 149 149 PHE H H 149 8.024 8.024 7.618 0.406 25485 2133 1 2 . 1 1 150 150 ASP N N 150 115.555 115.555 116.751 -1.196 25485 2134 1 2 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.309 0.530 25485 2135 1 2 . 1 1 150 150 ASP C C 150 177.007 177.007 175.982 1.025 25485 2136 1 2 . 1 1 150 150 ASP CA C 150 53.871 53.871 55.141 -1.270 25485 2137 1 2 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.296 2.640 25485 2138 1 2 . 1 1 150 150 ASP H H 150 7.511 7.511 7.797 -0.286 25485 2139 1 2 . 1 1 151 151 GLY N N 151 110.650 110.650 109.656 0.994 25485 2140 1 2 . 1 1 151 151 GLY C C 151 170.281 170.281 172.433 -2.152 25485 2141 1 2 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.669 -0.271 25485 2142 1 2 . 1 1 151 151 GLY H H 151 9.080 9.080 8.358 0.722 25485 2143 1 2 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.249 -0.193 25485 2144 1 2 . 1 1 152 152 PRO C C 152 178.300 178.300 176.528 1.772 25485 2145 1 2 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.234 0.616 25485 2146 1 2 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.959 -0.699 25485 2147 1 2 . 1 1 153 153 GLY N N 153 118.783 118.783 112.939 5.844 25485 2148 1 2 . 1 1 153 153 GLY C C 153 174.098 174.098 173.124 0.974 25485 2149 1 2 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.377 -0.771 25485 2150 1 2 . 1 1 153 153 GLY H H 153 11.431 11.431 8.065 3.366 25485 2151 1 2 . 1 1 154 154 ASN N N 154 120.679 120.679 121.936 -1.257 25485 2152 1 2 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.326 -0.082 25485 2153 1 2 . 1 1 154 154 ASN C C 154 174.636 174.636 175.103 -0.467 25485 2154 1 2 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.504 2.164 25485 2155 1 2 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.391 -1.420 25485 2156 1 2 . 1 1 154 154 ASN H H 154 9.247 9.247 8.330 0.917 25485 2157 1 2 . 1 1 155 155 THR N N 155 118.252 118.252 111.859 6.393 25485 2158 1 2 . 1 1 155 155 THR HA H 155 5.577 5.577 4.360 1.217 25485 2159 1 2 . 1 1 155 155 THR C C 155 176.596 176.596 173.145 3.451 25485 2160 1 2 . 1 1 155 155 THR CA C 155 61.731 61.731 63.134 -1.403 25485 2161 1 2 . 1 1 155 155 THR CB C 155 71.325 71.325 68.202 3.123 25485 2162 1 2 . 1 1 155 155 THR H H 155 9.501 9.501 8.520 0.981 25485 2163 1 2 . 1 1 156 156 LEU N N 156 122.598 122.598 125.142 -2.544 25485 2164 1 2 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.595 0.276 25485 2165 1 2 . 1 1 156 156 LEU C C 156 175.655 175.655 176.303 -0.648 25485 2166 1 2 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.344 -0.806 25485 2167 1 2 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.806 1.705 25485 2168 1 2 . 1 1 156 156 LEU H H 156 8.492 8.492 8.416 0.076 25485 2169 1 2 . 1 1 157 157 ALA N N 157 115.389 115.389 116.003 -0.614 25485 2170 1 2 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.512 0.523 25485 2171 1 2 . 1 1 157 157 ALA C C 157 175.739 175.739 175.030 0.709 25485 2172 1 2 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.507 -0.568 25485 2173 1 2 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.460 1.994 25485 2174 1 2 . 1 1 157 157 ALA H H 157 7.567 7.567 7.587 -0.020 25485 2175 1 2 . 1 1 158 158 HIS N N 158 111.900 111.900 118.210 -6.310 25485 2176 1 2 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.874 -0.269 25485 2177 1 2 . 1 1 158 158 HIS C C 158 170.186 170.186 172.327 -2.141 25485 2178 1 2 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.280 1.795 25485 2179 1 2 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.565 -1.379 25485 2180 1 2 . 1 1 158 158 HIS H H 158 8.757 8.757 8.092 0.665 25485 2181 1 2 . 1 1 159 159 ALA N N 159 118.286 118.286 125.689 -7.403 25485 2182 1 2 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.058 0.596 25485 2183 1 2 . 1 1 159 159 ALA C C 159 174.036 174.036 175.594 -1.558 25485 2184 1 2 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.507 0.626 25485 2185 1 2 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.618 2.419 25485 2186 1 2 . 1 1 159 159 ALA H H 159 6.110 6.110 8.285 -2.175 25485 2187 1 2 . 1 1 160 160 PHE N N 160 117.937 117.937 119.275 -1.338 25485 2188 1 2 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.718 -0.215 25485 2189 1 2 . 1 1 160 160 PHE C C 160 174.455 174.455 175.009 -0.554 25485 2190 1 2 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.361 1.452 25485 2191 1 2 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.615 0.579 25485 2192 1 2 . 1 1 160 160 PHE H H 160 7.912 7.912 7.983 -0.071 25485 2193 1 2 . 1 1 161 161 ALA N N 161 123.531 123.531 123.780 -0.249 25485 2194 1 2 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.545 -0.054 25485 2195 1 2 . 1 1 161 161 ALA C C 161 175.503 175.503 175.920 -0.417 25485 2196 1 2 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.191 1.442 25485 2197 1 2 . 1 1 161 161 ALA CB C 161 16.556 16.556 18.930 -2.374 25485 2198 1 2 . 1 1 161 161 ALA H H 161 8.107 8.107 8.470 -0.363 25485 2199 1 2 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.529 -0.619 25485 2200 1 2 . 1 1 162 162 PRO C C 162 173.465 173.465 175.380 -1.915 25485 2201 1 2 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.363 1.894 25485 2202 1 2 . 1 1 162 162 PRO CB C 162 31.242 31.242 28.996 2.246 25485 2203 1 2 . 1 1 163 163 GLY N N 163 107.206 107.206 109.639 -2.433 25485 2204 1 2 . 1 1 163 163 GLY C C 163 172.092 172.092 172.777 -0.685 25485 2205 1 2 . 1 1 163 163 GLY CA C 163 43.993 43.993 43.942 0.051 25485 2206 1 2 . 1 1 163 163 GLY H H 163 5.997 5.997 7.831 -1.834 25485 2207 1 2 . 1 1 165 165 GLY N N 165 103.110 103.110 106.989 -3.879 25485 2208 1 2 . 1 1 165 165 GLY C C 165 177.158 177.158 175.848 1.310 25485 2209 1 2 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.901 -1.658 25485 2210 1 2 . 1 1 165 165 GLY H H 165 9.145 9.145 8.420 0.725 25485 2211 1 2 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.336 -0.157 25485 2212 1 2 . 1 1 166 166 LEU C C 166 176.437 176.437 177.055 -0.618 25485 2213 1 2 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.210 0.990 25485 2214 1 2 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.546 -0.712 25485 2215 1 2 . 1 1 167 167 GLY N N 167 103.318 103.318 106.009 -2.691 25485 2216 1 2 . 1 1 167 167 GLY C C 167 174.803 174.803 173.827 0.976 25485 2217 1 2 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.838 2.395 25485 2218 1 2 . 1 1 167 167 GLY H H 167 7.768 7.768 7.552 0.216 25485 2219 1 2 . 1 1 168 168 GLY N N 168 121.051 121.051 107.984 13.067 25485 2220 1 2 . 1 1 168 168 GLY C C 168 172.122 172.122 174.081 -1.959 25485 2221 1 2 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.051 1.550 25485 2222 1 2 . 1 1 168 168 GLY H H 168 7.698 7.698 8.537 -0.839 25485 2223 1 2 . 1 1 169 169 ASP N N 169 123.641 123.641 120.774 2.867 25485 2224 1 2 . 1 1 169 169 ASP C C 169 173.942 173.942 173.978 -0.036 25485 2225 1 2 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.434 2.409 25485 2226 1 2 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.930 -3.060 25485 2227 1 2 . 1 1 169 169 ASP H H 169 8.595 8.595 7.988 0.607 25485 2228 1 2 . 1 1 170 170 ALA N N 170 119.366 119.366 120.694 -1.328 25485 2229 1 2 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.495 0.235 25485 2230 1 2 . 1 1 170 170 ALA C C 170 174.593 174.593 175.403 -0.810 25485 2231 1 2 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.692 0.432 25485 2232 1 2 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.394 0.941 25485 2233 1 2 . 1 1 170 170 ALA H H 170 8.324 8.324 8.304 0.020 25485 2234 1 2 . 1 1 171 171 HIS N N 171 120.239 120.239 120.412 -0.173 25485 2235 1 2 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.397 0.351 25485 2236 1 2 . 1 1 171 171 HIS C C 171 172.949 172.949 174.026 -1.077 25485 2237 1 2 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.607 -2.883 25485 2238 1 2 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.606 0.935 25485 2239 1 2 . 1 1 171 171 HIS H H 171 8.499 8.499 8.123 0.376 25485 2240 1 2 . 1 1 172 172 PHE N N 172 121.125 121.125 118.987 2.138 25485 2241 1 2 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.594 -0.066 25485 2242 1 2 . 1 1 172 172 PHE C C 172 173.875 173.875 173.884 -0.009 25485 2243 1 2 . 1 1 172 172 PHE CA C 172 56.920 56.920 57.338 -0.418 25485 2244 1 2 . 1 1 172 172 PHE CB C 172 41.903 41.903 42.903 -1.000 25485 2245 1 2 . 1 1 172 172 PHE H H 172 8.445 8.445 8.084 0.361 25485 2246 1 2 . 1 1 173 173 ASP N N 173 124.014 124.014 123.709 0.305 25485 2247 1 2 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.810 -0.896 25485 2248 1 2 . 1 1 173 173 ASP C C 173 178.613 178.613 177.896 0.717 25485 2249 1 2 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.853 0.945 25485 2250 1 2 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.169 -0.426 25485 2251 1 2 . 1 1 173 173 ASP H H 173 7.927 7.927 8.839 -0.912 25485 2252 1 2 . 1 1 174 174 GLU N N 174 132.469 132.469 126.863 5.606 25485 2253 1 2 . 1 1 174 174 GLU C C 174 176.442 176.442 177.589 -1.147 25485 2254 1 2 . 1 1 174 174 GLU CA C 174 57.184 57.184 59.115 -1.931 25485 2255 1 2 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.681 0.604 25485 2256 1 2 . 1 1 174 174 GLU H H 174 9.528 9.528 8.784 0.744 25485 2257 1 2 . 1 1 175 175 ASP N N 175 117.394 117.394 118.264 -0.870 25485 2258 1 2 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.703 0.090 25485 2259 1 2 . 1 1 175 175 ASP C C 175 176.645 176.645 176.684 -0.039 25485 2260 1 2 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.267 0.664 25485 2261 1 2 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.806 -1.665 25485 2262 1 2 . 1 1 175 175 ASP H H 175 8.768 8.768 8.596 0.172 25485 2263 1 2 . 1 1 176 176 GLU N N 176 116.493 116.493 119.019 -2.526 25485 2264 1 2 . 1 1 176 176 GLU C C 176 175.038 175.038 175.952 -0.914 25485 2265 1 2 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.810 -2.145 25485 2266 1 2 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.297 -4.074 25485 2267 1 2 . 1 1 176 176 GLU H H 176 7.159 7.159 8.272 -1.113 25485 2268 1 2 . 1 1 177 177 ARG N N 177 122.186 122.186 119.707 2.479 25485 2269 1 2 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.307 0.382 25485 2270 1 2 . 1 1 177 177 ARG C C 177 174.482 174.482 174.561 -0.079 25485 2271 1 2 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.210 -1.523 25485 2272 1 2 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.425 -1.341 25485 2273 1 2 . 1 1 177 177 ARG H H 177 7.560 7.560 8.302 -0.742 25485 2274 1 2 . 1 1 178 178 TRP N N 178 129.179 129.179 124.436 4.743 25485 2275 1 2 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.257 -0.157 25485 2276 1 2 . 1 1 178 178 TRP C C 178 176.298 176.298 176.506 -0.208 25485 2277 1 2 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.183 0.630 25485 2278 1 2 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.818 -0.621 25485 2279 1 2 . 1 1 178 178 TRP H H 178 8.807 8.807 8.341 0.466 25485 2280 1 2 . 1 1 179 179 THR N N 179 112.792 112.792 115.271 -2.479 25485 2281 1 2 . 1 1 179 179 THR HA H 179 4.985 4.985 4.619 0.366 25485 2282 1 2 . 1 1 179 179 THR C C 179 172.765 172.765 172.329 0.436 25485 2283 1 2 . 1 1 179 179 THR CA C 179 59.106 59.106 62.193 -3.087 25485 2284 1 2 . 1 1 179 179 THR CB C 179 71.786 71.786 71.847 -0.061 25485 2285 1 2 . 1 1 179 179 THR H H 179 8.974 8.974 8.434 0.540 25485 2286 1 2 . 1 1 180 180 ASP N N 180 122.074 122.074 124.325 -2.251 25485 2287 1 2 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.088 -0.625 25485 2288 1 2 . 1 1 180 180 ASP C C 180 176.366 176.366 178.511 -2.145 25485 2289 1 2 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.136 -2.093 25485 2290 1 2 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.298 -0.570 25485 2291 1 2 . 1 1 180 180 ASP H H 180 8.485 8.485 8.889 -0.404 25485 2292 1 2 . 1 1 181 181 GLY N N 181 110.123 110.123 108.042 2.081 25485 2293 1 2 . 1 1 181 181 GLY C C 181 174.325 174.325 175.345 -1.020 25485 2294 1 2 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.979 0.682 25485 2295 1 2 . 1 1 181 181 GLY H H 181 8.569 8.569 8.648 -0.079 25485 2296 1 2 . 1 1 182 182 SER N N 182 115.562 115.562 114.915 0.647 25485 2297 1 2 . 1 1 182 182 SER HA H 182 4.519 4.519 4.532 -0.013 25485 2298 1 2 . 1 1 182 182 SER C C 182 173.783 173.783 174.218 -0.435 25485 2299 1 2 . 1 1 182 182 SER CA C 182 57.965 57.965 57.963 0.002 25485 2300 1 2 . 1 1 182 182 SER CB C 182 64.166 64.166 64.134 0.032 25485 2301 1 2 . 1 1 182 182 SER H H 182 8.160 8.160 7.624 0.536 25485 2302 1 2 . 1 1 183 183 SER N N 183 117.153 117.153 115.491 1.662 25485 2303 1 2 . 1 1 183 183 SER HA H 183 4.275 4.275 4.355 -0.080 25485 2304 1 2 . 1 1 183 183 SER C C 183 173.333 173.333 174.238 -0.905 25485 2305 1 2 . 1 1 183 183 SER CA C 183 59.902 59.902 59.554 0.348 25485 2306 1 2 . 1 1 183 183 SER CB C 183 64.941 64.941 62.606 2.335 25485 2307 1 2 . 1 1 183 183 SER H H 183 7.796 7.796 7.854 -0.058 25485 2308 1 2 . 1 1 184 184 LEU N N 184 122.351 122.351 118.676 3.675 25485 2309 1 2 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.582 -0.190 25485 2310 1 2 . 1 1 184 184 LEU C C 184 176.250 176.250 176.333 -0.083 25485 2311 1 2 . 1 1 184 184 LEU CA C 184 55.575 55.575 56.264 -0.689 25485 2312 1 2 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.535 -1.454 25485 2313 1 2 . 1 1 184 184 LEU H H 184 8.092 8.092 7.915 0.177 25485 2314 1 2 . 1 1 185 185 GLY N N 185 108.871 108.871 106.973 1.898 25485 2315 1 2 . 1 1 185 185 GLY C C 185 172.375 172.375 173.720 -1.345 25485 2316 1 2 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.109 0.271 25485 2317 1 2 . 1 1 185 185 GLY H H 185 7.960 7.960 7.679 0.281 25485 2318 1 2 . 1 1 186 186 ILE N N 186 123.096 123.096 122.055 1.041 25485 2319 1 2 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.136 -0.295 25485 2320 1 2 . 1 1 186 186 ILE C C 186 175.350 175.350 176.009 -0.659 25485 2321 1 2 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.265 -0.864 25485 2322 1 2 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.393 0.063 25485 2323 1 2 . 1 1 186 186 ILE H H 186 8.893 8.893 8.126 0.767 25485 2324 1 2 . 1 1 187 187 ASN N N 187 127.167 127.167 126.592 0.575 25485 2325 1 2 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.918 -0.565 25485 2326 1 2 . 1 1 187 187 ASN C C 187 175.849 175.849 176.821 -0.972 25485 2327 1 2 . 1 1 187 187 ASN CA C 187 55.714 55.714 53.998 1.716 25485 2328 1 2 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.726 0.404 25485 2329 1 2 . 1 1 187 187 ASN H H 187 8.580 8.580 8.552 0.028 25485 2330 1 2 . 1 1 188 188 PHE N N 188 129.985 129.985 127.434 2.551 25485 2331 1 2 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.359 0.214 25485 2332 1 2 . 1 1 188 188 PHE C C 188 175.578 175.578 177.462 -1.884 25485 2333 1 2 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.184 -0.455 25485 2334 1 2 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.563 -0.131 25485 2335 1 2 . 1 1 188 188 PHE H H 188 9.361 9.361 8.490 0.871 25485 2336 1 2 . 1 1 189 189 LEU N N 189 119.113 119.113 119.814 -0.701 25485 2337 1 2 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.149 -0.348 25485 2338 1 2 . 1 1 189 189 LEU C C 189 179.601 179.601 178.481 1.120 25485 2339 1 2 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.407 0.102 25485 2340 1 2 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.233 -1.356 25485 2341 1 2 . 1 1 189 189 LEU H H 189 8.562 8.562 8.001 0.561 25485 2342 1 2 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.865 0.052 25485 2343 1 2 . 1 1 190 190 TYR C C 190 177.621 177.621 177.510 0.111 25485 2344 1 2 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.014 -0.206 25485 2345 1 2 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.986 1.783 25485 2346 1 2 . 1 1 191 191 ALA N N 191 120.352 120.352 121.202 -0.850 25485 2347 1 2 . 1 1 191 191 ALA HA H 191 4.315 4.315 3.988 0.327 25485 2348 1 2 . 1 1 191 191 ALA C C 191 180.252 180.252 178.806 1.446 25485 2349 1 2 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.594 0.588 25485 2350 1 2 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.517 0.625 25485 2351 1 2 . 1 1 191 191 ALA H H 191 7.993 7.993 8.971 -0.978 25485 2352 1 2 . 1 1 192 192 ALA N N 192 121.409 121.409 121.495 -0.086 25485 2353 1 2 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.048 0.009 25485 2354 1 2 . 1 1 192 192 ALA C C 192 178.575 178.575 179.665 -1.090 25485 2355 1 2 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.575 -0.390 25485 2356 1 2 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.146 -1.948 25485 2357 1 2 . 1 1 192 192 ALA H H 192 9.297 9.297 8.514 0.783 25485 2358 1 2 . 1 1 193 193 THR N N 193 116.996 116.996 113.995 3.001 25485 2359 1 2 . 1 1 193 193 THR HA H 193 3.833 3.833 4.131 -0.298 25485 2360 1 2 . 1 1 193 193 THR CA C 193 69.138 69.138 67.316 1.822 25485 2361 1 2 . 1 1 193 193 THR CB C 193 67.365 67.365 68.291 -0.926 25485 2362 1 2 . 1 1 193 193 THR H H 193 8.226 8.226 7.715 0.511 25485 2363 1 2 . 1 1 194 194 HIS N N 194 120.296 120.296 122.693 -2.397 25485 2364 1 2 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.209 0.027 25485 2365 1 2 . 1 1 194 194 HIS C C 194 175.962 175.962 176.796 -0.834 25485 2366 1 2 . 1 1 194 194 HIS CA C 194 59.747 59.747 59.279 0.468 25485 2367 1 2 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.921 -2.002 25485 2368 1 2 . 1 1 194 194 HIS H H 194 7.782 7.782 7.456 0.326 25485 2369 1 2 . 1 1 195 195 ALA N N 195 121.290 121.290 122.204 -0.914 25485 2370 1 2 . 1 1 195 195 ALA HA H 195 4.156 4.156 4.059 0.097 25485 2371 1 2 . 1 1 195 195 ALA CA C 195 55.964 55.964 55.011 0.953 25485 2372 1 2 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.679 0.031 25485 2373 1 2 . 1 1 195 195 ALA H H 195 8.690 8.690 8.455 0.235 25485 2374 1 2 . 1 1 196 196 LEU N N 196 114.899 114.899 117.718 -2.819 25485 2375 1 2 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.122 0.048 25485 2376 1 2 . 1 1 196 196 LEU C C 196 177.946 177.946 179.494 -1.548 25485 2377 1 2 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.358 -1.130 25485 2378 1 2 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.072 -1.296 25485 2379 1 2 . 1 1 196 196 LEU H H 196 8.715 8.715 8.937 -0.222 25485 2380 1 2 . 1 1 197 197 GLY N N 197 107.901 107.901 104.594 3.307 25485 2381 1 2 . 1 1 197 197 GLY C C 197 178.641 178.641 175.437 3.204 25485 2382 1 2 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.623 0.944 25485 2383 1 2 . 1 1 197 197 GLY H H 197 7.546 7.546 8.049 -0.503 25485 2384 1 2 . 1 1 198 198 HIS N N 198 122.017 122.017 119.494 2.523 25485 2385 1 2 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.475 0.382 25485 2386 1 2 . 1 1 198 198 HIS C C 198 179.874 179.874 178.258 1.616 25485 2387 1 2 . 1 1 198 198 HIS CA C 198 58.522 58.522 58.015 0.507 25485 2388 1 2 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.562 -2.016 25485 2389 1 2 . 1 1 198 198 HIS H H 198 7.196 7.196 7.348 -0.152 25485 2390 1 2 . 1 1 199 199 SER N N 199 118.486 118.486 114.943 3.543 25485 2391 1 2 . 1 1 199 199 SER HA H 199 4.490 4.490 4.451 0.039 25485 2392 1 2 . 1 1 199 199 SER C C 199 174.493 174.493 175.594 -1.101 25485 2393 1 2 . 1 1 199 199 SER CA C 199 58.173 58.173 60.268 -2.095 25485 2394 1 2 . 1 1 199 199 SER CB C 199 63.589 63.589 63.069 0.520 25485 2395 1 2 . 1 1 199 199 SER H H 199 7.884 7.884 7.749 0.135 25485 2396 1 2 . 1 1 200 200 LEU N N 200 114.686 114.686 117.415 -2.729 25485 2397 1 2 . 1 1 200 200 LEU C C 200 177.720 177.720 177.283 0.437 25485 2398 1 2 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.506 0.331 25485 2399 1 2 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.882 0.475 25485 2400 1 2 . 1 1 200 200 LEU H H 200 7.108 7.108 7.148 -0.040 25485 2401 1 2 . 1 1 201 201 GLY N N 201 108.363 108.363 106.161 2.202 25485 2402 1 2 . 1 1 201 201 GLY C C 201 174.008 174.008 174.334 -0.326 25485 2403 1 2 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.647 -1.233 25485 2404 1 2 . 1 1 201 201 GLY H H 201 8.195 8.195 7.915 0.280 25485 2405 1 2 . 1 1 202 202 MET N N 202 119.635 119.635 121.307 -1.672 25485 2406 1 2 . 1 1 202 202 MET HA H 202 4.473 4.473 4.368 0.105 25485 2407 1 2 . 1 1 202 202 MET C C 202 176.593 176.593 175.664 0.929 25485 2408 1 2 . 1 1 202 202 MET CA C 202 54.500 54.500 55.983 -1.484 25485 2409 1 2 . 1 1 202 202 MET CB C 202 32.161 32.161 33.184 -1.023 25485 2410 1 2 . 1 1 202 202 MET H H 202 8.182 8.182 7.153 1.029 25485 2411 1 2 . 1 1 203 203 GLY N N 203 109.749 109.749 111.359 -1.610 25485 2412 1 2 . 1 1 203 203 GLY C C 203 174.042 174.042 173.638 0.404 25485 2413 1 2 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.615 -0.611 25485 2414 1 2 . 1 1 203 203 GLY H H 203 8.405 8.405 8.266 0.139 25485 2415 1 2 . 1 1 204 204 HIS N N 204 115.732 115.732 118.121 -2.389 25485 2416 1 2 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.184 1.216 25485 2417 1 2 . 1 1 204 204 HIS C C 204 174.430 174.430 174.323 0.107 25485 2418 1 2 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.744 -1.930 25485 2419 1 2 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.616 -0.790 25485 2420 1 2 . 1 1 204 204 HIS H H 204 8.364 8.364 8.617 -0.253 25485 2421 1 2 . 1 1 205 205 SER N N 205 115.484 115.484 114.389 1.095 25485 2422 1 2 . 1 1 205 205 SER HA H 205 4.766 4.766 4.783 -0.017 25485 2423 1 2 . 1 1 205 205 SER C C 205 173.611 173.611 175.367 -1.756 25485 2424 1 2 . 1 1 205 205 SER CA C 205 54.729 54.729 56.058 -1.329 25485 2425 1 2 . 1 1 205 205 SER CB C 205 65.855 65.855 64.462 1.393 25485 2426 1 2 . 1 1 205 205 SER H H 205 7.231 7.231 8.168 -0.937 25485 2427 1 2 . 1 1 206 206 SER N N 206 119.263 119.263 121.131 -1.868 25485 2428 1 2 . 1 1 206 206 SER HA H 206 3.701 3.701 4.947 -1.246 25485 2429 1 2 . 1 1 206 206 SER C C 206 173.635 173.635 174.894 -1.259 25485 2430 1 2 . 1 1 206 206 SER CA C 206 63.846 63.846 58.959 4.887 25485 2431 1 2 . 1 1 206 206 SER CB C 206 63.764 63.764 63.780 -0.016 25485 2432 1 2 . 1 1 206 206 SER H H 206 8.289 8.289 8.899 -0.610 25485 2433 1 2 . 1 1 207 207 ASP N N 207 126.646 126.646 124.400 2.246 25485 2434 1 2 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.659 0.270 25485 2435 1 2 . 1 1 207 207 ASP C C 207 174.614 174.614 175.574 -0.960 25485 2436 1 2 . 1 1 207 207 ASP CA C 207 51.272 51.272 53.418 -2.146 25485 2437 1 2 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.318 -1.030 25485 2438 1 2 . 1 1 207 207 ASP H H 207 8.541 8.541 7.843 0.698 25485 2439 1 2 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.415 0.372 25485 2440 1 2 . 1 1 208 208 PRO C C 208 177.467 177.467 176.071 1.396 25485 2441 1 2 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.925 -1.089 25485 2442 1 2 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.173 -0.576 25485 2443 1 2 . 1 1 209 209 ASN N N 209 116.020 116.020 114.806 1.214 25485 2444 1 2 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.631 0.010 25485 2445 1 2 . 1 1 209 209 ASN C C 209 174.695 174.695 174.057 0.638 25485 2446 1 2 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.825 1.395 25485 2447 1 2 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.574 0.536 25485 2448 1 2 . 1 1 209 209 ASN H H 209 8.350 8.350 8.143 0.207 25485 2449 1 2 . 1 1 210 210 ALA N N 210 124.892 124.892 123.222 1.670 25485 2450 1 2 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.440 -0.345 25485 2451 1 2 . 1 1 210 210 ALA C C 210 179.495 179.495 178.334 1.161 25485 2452 1 2 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.596 1.458 25485 2453 1 2 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.874 -1.675 25485 2454 1 2 . 1 1 210 210 ALA H H 210 8.193 8.193 7.143 1.050 25485 2455 1 2 . 1 1 211 211 VAL N N 211 130.402 130.402 122.744 7.658 25485 2456 1 2 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.789 0.474 25485 2457 1 2 . 1 1 211 211 VAL C C 211 179.408 179.408 176.416 2.992 25485 2458 1 2 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.843 0.209 25485 2459 1 2 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.038 -1.055 25485 2460 1 2 . 1 1 211 211 VAL H H 211 11.592 11.592 8.766 2.826 25485 2461 1 2 . 1 1 212 212 MET N N 212 113.285 113.285 113.958 -0.673 25485 2462 1 2 . 1 1 212 212 MET C C 212 176.996 176.996 175.794 1.202 25485 2463 1 2 . 1 1 212 212 MET CA C 212 53.614 53.614 53.918 -0.304 25485 2464 1 2 . 1 1 212 212 MET CB C 212 26.975 26.975 30.647 -3.672 25485 2465 1 2 . 1 1 212 212 MET H H 212 7.724 7.724 7.666 0.058 25485 2466 1 2 . 1 1 213 213 TYR N N 213 129.919 129.919 125.742 4.177 25485 2467 1 2 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.624 1.072 25485 2468 1 2 . 1 1 213 213 TYR C C 213 178.411 178.411 175.282 3.129 25485 2469 1 2 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.098 0.033 25485 2470 1 2 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.309 0.859 25485 2471 1 2 . 1 1 213 213 TYR H H 213 7.902 7.902 7.351 0.551 25485 2472 1 2 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.265 -0.790 25485 2473 1 2 . 1 1 214 214 PRO C C 214 177.694 177.694 177.004 0.690 25485 2474 1 2 . 1 1 214 214 PRO CA C 214 66.028 66.028 63.945 2.083 25485 2475 1 2 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.790 1.034 25485 2476 1 2 . 1 1 215 215 THR N N 215 104.450 104.450 115.067 -10.617 25485 2477 1 2 . 1 1 215 215 THR HA H 215 4.444 4.444 4.468 -0.024 25485 2478 1 2 . 1 1 215 215 THR C C 215 173.429 173.429 173.452 -0.023 25485 2479 1 2 . 1 1 215 215 THR CA C 215 60.528 60.528 61.324 -0.796 25485 2480 1 2 . 1 1 215 215 THR CB C 215 69.614 69.614 67.332 2.282 25485 2481 1 2 . 1 1 215 215 THR H H 215 6.407 6.407 7.498 -1.091 25485 2482 1 2 . 1 1 216 216 TYR N N 216 124.618 124.618 124.627 -0.009 25485 2483 1 2 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.417 -0.185 25485 2484 1 2 . 1 1 216 216 TYR C C 216 175.669 175.669 175.802 -0.133 25485 2485 1 2 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.998 -0.411 25485 2486 1 2 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.824 2.067 25485 2487 1 2 . 1 1 216 216 TYR H H 216 8.331 8.331 7.635 0.696 25485 2488 1 2 . 1 1 217 217 GLY N N 217 116.089 116.089 115.490 0.599 25485 2489 1 2 . 1 1 217 217 GLY C C 217 173.560 173.560 173.498 0.062 25485 2490 1 2 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.943 -0.625 25485 2491 1 2 . 1 1 217 217 GLY H H 217 7.695 7.695 8.785 -1.090 25485 2492 1 2 . 1 1 218 218 ASN N N 218 120.167 120.167 115.684 4.483 25485 2493 1 2 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.315 0.351 25485 2494 1 2 . 1 1 218 218 ASN C C 218 175.343 175.343 175.137 0.206 25485 2495 1 2 . 1 1 218 218 ASN CA C 218 53.615 53.615 52.927 0.688 25485 2496 1 2 . 1 1 218 218 ASN CB C 218 38.546 38.546 39.696 -1.150 25485 2497 1 2 . 1 1 218 218 ASN H H 218 8.237 8.237 8.037 0.200 25485 2498 1 2 . 1 1 219 219 GLY N N 219 109.322 109.322 110.037 -0.715 25485 2499 1 2 . 1 1 219 219 GLY C C 219 172.842 172.842 173.414 -0.572 25485 2500 1 2 . 1 1 219 219 GLY CA C 219 44.718 44.718 45.125 -0.407 25485 2501 1 2 . 1 1 219 219 GLY H H 219 8.027 8.027 7.926 0.101 25485 2502 1 2 . 1 1 220 220 ASP N N 220 123.006 123.006 120.482 2.524 25485 2503 1 2 . 1 1 220 220 ASP H H 220 8.273 8.273 8.103 0.170 25485 2504 1 2 . 1 1 221 221 PRO C C 221 177.138 177.138 177.277 -0.139 25485 2505 1 2 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.882 -5.819 25485 2506 1 2 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.713 -1.017 25485 2507 1 2 . 1 1 222 222 GLN N N 222 116.718 116.718 122.715 -5.997 25485 2508 1 2 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.340 -0.004 25485 2509 1 2 . 1 1 222 222 GLN C C 222 176.321 176.321 176.913 -0.592 25485 2510 1 2 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.467 -0.324 25485 2511 1 2 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.168 0.329 25485 2512 1 2 . 1 1 222 222 GLN H H 222 8.240 8.240 8.658 -0.418 25485 2513 1 2 . 1 1 223 223 ASN N N 223 118.368 118.368 118.178 0.190 25485 2514 1 2 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.755 0.161 25485 2515 1 2 . 1 1 223 223 ASN C C 223 173.271 173.271 173.980 -0.709 25485 2516 1 2 . 1 1 223 223 ASN CA C 223 52.596 52.596 52.818 -0.222 25485 2517 1 2 . 1 1 223 223 ASN CB C 223 39.215 39.215 38.638 0.577 25485 2518 1 2 . 1 1 223 223 ASN H H 223 7.946 7.946 8.283 -0.337 25485 2519 1 2 . 1 1 224 224 PHE N N 224 118.429 118.429 118.059 0.370 25485 2520 1 2 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.820 -0.369 25485 2521 1 2 . 1 1 224 224 PHE C C 224 172.897 172.897 174.568 -1.671 25485 2522 1 2 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.270 1.139 25485 2523 1 2 . 1 1 224 224 PHE CB C 224 39.701 39.701 40.283 -0.582 25485 2524 1 2 . 1 1 224 224 PHE H H 224 6.992 6.992 7.764 -0.772 25485 2525 1 2 . 1 1 225 225 LYS N N 225 121.714 121.714 121.617 0.097 25485 2526 1 2 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.916 0.514 25485 2527 1 2 . 1 1 225 225 LYS C C 225 174.664 174.664 174.829 -0.165 25485 2528 1 2 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.007 0.305 25485 2529 1 2 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.976 -0.249 25485 2530 1 2 . 1 1 225 225 LYS H H 225 7.709 7.709 8.108 -0.399 25485 2531 1 2 . 1 1 226 226 LEU N N 226 119.026 119.026 120.596 -1.570 25485 2532 1 2 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.058 0.083 25485 2533 1 2 . 1 1 226 226 LEU C C 226 177.495 177.495 176.858 0.637 25485 2534 1 2 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.148 0.451 25485 2535 1 2 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.986 -0.705 25485 2536 1 2 . 1 1 226 226 LEU H H 226 8.015 8.015 8.203 -0.188 25485 2537 1 2 . 1 1 227 227 SER N N 227 120.320 120.320 116.304 4.016 25485 2538 1 2 . 1 1 227 227 SER HA H 227 4.600 4.600 4.565 0.035 25485 2539 1 2 . 1 1 227 227 SER C C 227 175.492 175.492 175.600 -0.108 25485 2540 1 2 . 1 1 227 227 SER CA C 227 57.239 57.239 57.232 0.007 25485 2541 1 2 . 1 1 227 227 SER CB C 227 66.278 66.278 65.221 1.057 25485 2542 1 2 . 1 1 227 227 SER H H 227 9.654 9.654 8.297 1.357 25485 2543 1 2 . 1 1 228 228 GLN N N 228 127.511 127.511 125.817 1.694 25485 2544 1 2 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.942 0.752 25485 2545 1 2 . 1 1 228 228 GLN H H 228 8.248 8.248 8.939 -0.691 25485 2546 1 2 . 1 1 229 229 ASP N N 229 124.358 124.358 118.633 5.725 25485 2547 1 2 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.346 0.028 25485 2548 1 2 . 1 1 229 229 ASP C C 229 178.793 178.793 178.419 0.374 25485 2549 1 2 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.153 0.989 25485 2550 1 2 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.053 3.189 25485 2551 1 2 . 1 1 229 229 ASP H H 229 8.138 8.138 8.561 -0.423 25485 2552 1 2 . 1 1 230 230 ASP N N 230 119.694 119.694 120.075 -0.381 25485 2553 1 2 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.505 -0.083 25485 2554 1 2 . 1 1 230 230 ASP C C 230 177.736 177.736 178.034 -0.298 25485 2555 1 2 . 1 1 230 230 ASP CA C 230 57.922 57.922 56.780 1.142 25485 2556 1 2 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.927 2.309 25485 2557 1 2 . 1 1 230 230 ASP H H 230 7.393 7.393 7.512 -0.119 25485 2558 1 2 . 1 1 231 231 ILE N N 231 120.364 120.364 119.853 0.511 25485 2559 1 2 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.709 -0.044 25485 2560 1 2 . 1 1 231 231 ILE C C 231 177.631 177.631 177.830 -0.199 25485 2561 1 2 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.456 0.043 25485 2562 1 2 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.988 0.525 25485 2563 1 2 . 1 1 231 231 ILE H H 231 8.115 8.115 7.993 0.122 25485 2564 1 2 . 1 1 232 232 LYS N N 232 119.156 119.156 120.059 -0.903 25485 2565 1 2 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.025 0.089 25485 2566 1 2 . 1 1 232 232 LYS C C 232 180.574 180.574 179.032 1.542 25485 2567 1 2 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.797 -0.237 25485 2568 1 2 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.672 0.125 25485 2569 1 2 . 1 1 232 232 LYS H H 232 8.607 8.607 8.368 0.239 25485 2570 1 2 . 1 1 233 233 GLY N N 233 106.425 106.425 108.030 -1.605 25485 2571 1 2 . 1 1 233 233 GLY C C 233 176.098 176.098 175.793 0.305 25485 2572 1 2 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.770 0.867 25485 2573 1 2 . 1 1 233 233 GLY H H 233 8.075 8.075 7.700 0.375 25485 2574 1 2 . 1 1 234 234 ILE N N 234 125.119 125.119 122.003 3.116 25485 2575 1 2 . 1 1 234 234 ILE C C 234 178.231 178.231 177.215 1.016 25485 2576 1 2 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.330 -1.737 25485 2577 1 2 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.315 -0.769 25485 2578 1 2 . 1 1 234 234 ILE H H 234 8.539 8.539 7.431 1.108 25485 2579 1 2 . 1 1 235 235 GLN N N 235 122.877 122.877 119.542 3.335 25485 2580 1 2 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.095 0.262 25485 2581 1 2 . 1 1 235 235 GLN C C 235 180.105 180.105 178.468 1.637 25485 2582 1 2 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.549 -1.662 25485 2583 1 2 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.671 -1.133 25485 2584 1 2 . 1 1 235 235 GLN H H 235 8.296 8.296 8.476 -0.180 25485 2585 1 2 . 1 1 236 236 LYS N N 236 123.678 123.678 118.534 5.144 25485 2586 1 2 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.269 -0.187 25485 2587 1 2 . 1 1 236 236 LYS C C 236 178.169 178.169 177.823 0.346 25485 2588 1 2 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.565 0.812 25485 2589 1 2 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.926 0.052 25485 2590 1 2 . 1 1 236 236 LYS H H 236 8.024 8.024 7.792 0.233 25485 2591 1 2 . 1 1 237 237 LEU N N 237 116.873 116.873 119.367 -2.494 25485 2592 1 2 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.350 -0.363 25485 2593 1 2 . 1 1 237 237 LEU C C 237 177.893 177.893 177.825 0.068 25485 2594 1 2 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.624 0.815 25485 2595 1 2 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.946 0.667 25485 2596 1 2 . 1 1 237 237 LEU H H 237 6.888 6.888 7.601 -0.713 25485 2597 1 2 . 1 1 238 238 TYR N N 238 112.237 112.237 117.565 -5.328 25485 2598 1 2 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.496 0.155 25485 2599 1 2 . 1 1 238 238 TYR C C 238 176.082 176.082 177.019 -0.937 25485 2600 1 2 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.374 -0.738 25485 2601 1 2 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.984 1.414 25485 2602 1 2 . 1 1 238 238 TYR H H 238 7.445 7.445 8.753 -1.308 25485 2603 1 2 . 1 1 239 239 GLY N N 239 110.906 110.906 105.781 5.125 25485 2604 1 2 . 1 1 239 239 GLY C C 239 171.269 171.269 172.683 -1.414 25485 2605 1 2 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.184 -1.298 25485 2606 1 2 . 1 1 239 239 GLY H H 239 8.443 8.443 8.133 0.310 25485 2607 1 2 . 1 1 240 240 LYS N N 240 114.281 114.281 122.728 -8.447 25485 2608 1 2 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.572 0.166 25485 2609 1 2 . 1 1 240 240 LYS C C 240 177.527 177.527 175.375 2.152 25485 2610 1 2 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.961 -1.003 25485 2611 1 2 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.156 1.119 25485 2612 1 2 . 1 1 240 240 LYS H H 240 7.873 7.873 8.488 -0.615 25485 2613 1 2 . 1 1 241 241 ARG N N 241 123.758 123.758 122.464 1.294 25485 2614 1 2 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.409 -0.412 25485 2615 1 2 . 1 1 241 241 ARG C C 241 176.026 176.026 174.368 1.658 25485 2616 1 2 . 1 1 241 241 ARG CA C 241 57.492 57.492 56.028 1.464 25485 2617 1 2 . 1 1 241 241 ARG CB C 241 30.371 30.371 32.871 -2.500 25485 2618 1 2 . 1 1 241 241 ARG H H 241 7.742 7.742 8.471 -0.729 25485 2619 1 2 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.363 -0.023 25485 2620 1 2 . 1 1 246 246 LYS C C 246 175.403 175.403 176.362 -0.959 25485 2621 1 2 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.562 0.947 25485 2622 1 2 . 1 1 246 246 LYS CB C 246 32.858 32.858 33.462 -0.604 25485 2623 1 3 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.540 -0.233 25485 2624 1 3 . 1 1 2 2 GLN C C 2 176.492 176.492 176.244 0.248 25485 2625 1 3 . 1 1 2 2 GLN CA C 2 56.749 56.749 55.615 1.134 25485 2626 1 3 . 1 1 2 2 GLN CB C 2 28.654 28.654 29.634 -0.980 25485 2627 1 3 . 1 1 3 3 GLU N N 3 121.668 121.668 121.177 0.491 25485 2628 1 3 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.143 -0.354 25485 2629 1 3 . 1 1 3 3 GLU C C 3 176.278 176.278 178.328 -2.050 25485 2630 1 3 . 1 1 3 3 GLU CA C 3 57.059 57.059 58.448 -1.389 25485 2631 1 3 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.029 0.662 25485 2632 1 3 . 1 1 3 3 GLU H H 3 8.331 8.331 8.527 -0.196 25485 2633 1 3 . 1 1 4 4 ALA N N 4 124.493 124.493 122.270 2.223 25485 2634 1 3 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.202 0.308 25485 2635 1 3 . 1 1 4 4 ALA C C 4 178.428 178.428 179.824 -1.396 25485 2636 1 3 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.718 -0.041 25485 2637 1 3 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.057 0.652 25485 2638 1 3 . 1 1 4 4 ALA H H 4 8.131 8.131 8.343 -0.212 25485 2639 1 3 . 1 1 5 5 GLY N N 5 108.204 108.204 106.048 2.156 25485 2640 1 3 . 1 1 5 5 GLY C C 5 174.858 174.858 175.616 -0.758 25485 2641 1 3 . 1 1 5 5 GLY CA C 5 47.661 47.661 45.804 1.857 25485 2642 1 3 . 1 1 5 5 GLY H H 5 8.279 8.279 8.691 -0.412 25485 2643 1 3 . 1 1 6 6 GLY N N 6 108.820 108.820 108.479 0.341 25485 2644 1 3 . 1 1 6 6 GLY C C 6 174.189 174.189 174.255 -0.066 25485 2645 1 3 . 1 1 6 6 GLY CA C 6 44.413 44.413 43.964 0.449 25485 2646 1 3 . 1 1 6 6 GLY H H 6 8.246 8.246 7.728 0.518 25485 2647 1 3 . 1 1 7 7 MET N N 7 119.938 119.938 119.925 0.013 25485 2648 1 3 . 1 1 7 7 MET HA H 7 4.659 4.659 4.680 -0.021 25485 2649 1 3 . 1 1 7 7 MET C C 7 176.191 176.191 175.730 0.461 25485 2650 1 3 . 1 1 7 7 MET CA C 7 54.799 54.799 55.569 -0.770 25485 2651 1 3 . 1 1 7 7 MET CB C 7 33.046 33.046 34.340 -1.294 25485 2652 1 3 . 1 1 7 7 MET H H 7 8.005 8.005 7.966 0.039 25485 2653 1 3 . 1 1 8 8 SER N N 8 118.919 118.919 116.007 2.912 25485 2654 1 3 . 1 1 8 8 SER HA H 8 4.239 4.239 4.661 -0.422 25485 2655 1 3 . 1 1 8 8 SER C C 8 174.949 174.949 175.513 -0.564 25485 2656 1 3 . 1 1 8 8 SER CA C 8 58.160 58.160 56.907 1.254 25485 2657 1 3 . 1 1 8 8 SER CB C 8 65.440 65.440 64.605 0.835 25485 2658 1 3 . 1 1 8 8 SER H H 8 8.731 8.731 8.336 0.395 25485 2659 1 3 . 1 1 9 9 GLU N N 9 122.442 122.442 122.446 -0.004 25485 2660 1 3 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.123 0.198 25485 2661 1 3 . 1 1 9 9 GLU C C 9 178.604 178.604 178.110 0.494 25485 2662 1 3 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.582 -0.115 25485 2663 1 3 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.406 -0.230 25485 2664 1 3 . 1 1 9 9 GLU H H 9 8.901 8.901 8.932 -0.031 25485 2665 1 3 . 1 1 10 10 LEU N N 10 120.568 120.568 119.183 1.385 25485 2666 1 3 . 1 1 10 10 LEU C C 10 179.307 179.307 179.055 0.252 25485 2667 1 3 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.113 -0.633 25485 2668 1 3 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.098 0.477 25485 2669 1 3 . 1 1 10 10 LEU H H 10 8.020 8.020 7.925 0.095 25485 2670 1 3 . 1 1 11 11 GLN N N 11 119.930 119.930 118.667 1.263 25485 2671 1 3 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.108 0.026 25485 2672 1 3 . 1 1 11 11 GLN C C 11 178.330 178.330 178.648 -0.318 25485 2673 1 3 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.896 -0.078 25485 2674 1 3 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.346 -0.482 25485 2675 1 3 . 1 1 11 11 GLN H H 11 7.811 7.811 7.862 -0.051 25485 2676 1 3 . 1 1 12 12 TRP N N 12 121.031 121.031 120.938 0.093 25485 2677 1 3 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.372 0.042 25485 2678 1 3 . 1 1 12 12 TRP C C 12 178.874 178.874 177.949 0.925 25485 2679 1 3 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.333 0.174 25485 2680 1 3 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.654 -0.267 25485 2681 1 3 . 1 1 12 12 TRP H H 12 8.205 8.205 7.849 0.356 25485 2682 1 3 . 1 1 13 13 GLU N N 13 121.877 121.877 120.204 1.673 25485 2683 1 3 . 1 1 13 13 GLU C C 13 179.425 179.425 178.685 0.740 25485 2684 1 3 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.621 0.416 25485 2685 1 3 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.670 -0.748 25485 2686 1 3 . 1 1 13 13 GLU H H 13 8.434 8.434 8.405 0.029 25485 2687 1 3 . 1 1 14 14 GLN N N 14 120.449 120.449 119.055 1.394 25485 2688 1 3 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.840 0.398 25485 2689 1 3 . 1 1 14 14 GLN C C 14 179.210 179.210 178.393 0.817 25485 2690 1 3 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.751 0.131 25485 2691 1 3 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.628 -0.878 25485 2692 1 3 . 1 1 14 14 GLN H H 14 8.124 8.124 8.405 -0.281 25485 2693 1 3 . 1 1 15 15 ALA N N 15 123.114 123.114 121.066 2.048 25485 2694 1 3 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.023 0.367 25485 2695 1 3 . 1 1 15 15 ALA C C 15 179.352 179.352 179.515 -0.163 25485 2696 1 3 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.268 -0.303 25485 2697 1 3 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.932 0.731 25485 2698 1 3 . 1 1 15 15 ALA H H 15 8.344 8.344 7.573 0.771 25485 2699 1 3 . 1 1 16 16 GLN N N 16 117.718 117.718 118.257 -0.539 25485 2700 1 3 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.936 -0.154 25485 2701 1 3 . 1 1 16 16 GLN C C 16 177.719 177.719 177.803 -0.084 25485 2702 1 3 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.680 1.601 25485 2703 1 3 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.593 -0.057 25485 2704 1 3 . 1 1 16 16 GLN H H 16 8.500 8.500 7.600 0.900 25485 2705 1 3 . 1 1 17 17 ASP N N 17 120.040 120.040 119.564 0.476 25485 2706 1 3 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.305 0.231 25485 2707 1 3 . 1 1 17 17 ASP C C 17 177.630 177.630 178.300 -0.670 25485 2708 1 3 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.341 0.464 25485 2709 1 3 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.910 0.954 25485 2710 1 3 . 1 1 17 17 ASP H H 17 7.871 7.871 8.266 -0.395 25485 2711 1 3 . 1 1 18 18 TYR N N 18 122.465 122.465 119.018 3.447 25485 2712 1 3 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.273 -0.083 25485 2713 1 3 . 1 1 18 18 TYR C C 18 178.439 178.439 177.941 0.498 25485 2714 1 3 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.380 1.466 25485 2715 1 3 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.337 1.603 25485 2716 1 3 . 1 1 18 18 TYR H H 18 8.244 8.244 8.287 -0.043 25485 2717 1 3 . 1 1 19 19 LEU N N 19 117.635 117.635 118.701 -1.066 25485 2718 1 3 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.109 0.023 25485 2719 1 3 . 1 1 19 19 LEU C C 19 180.940 180.940 178.189 2.751 25485 2720 1 3 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.876 0.629 25485 2721 1 3 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.316 -0.718 25485 2722 1 3 . 1 1 19 19 LEU H H 19 8.713 8.713 7.591 1.122 25485 2723 1 3 . 1 1 20 20 LYS N N 20 124.594 124.594 116.508 8.086 25485 2724 1 3 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.148 -0.064 25485 2725 1 3 . 1 1 20 20 LYS C C 20 178.387 178.387 177.976 0.411 25485 2726 1 3 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.031 0.774 25485 2727 1 3 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.264 0.192 25485 2728 1 3 . 1 1 20 20 LYS H H 20 8.815 8.815 7.439 1.376 25485 2729 1 3 . 1 1 21 21 ARG N N 21 117.535 117.535 117.514 0.021 25485 2730 1 3 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.169 -0.450 25485 2731 1 3 . 1 1 21 21 ARG C C 21 178.498 178.498 178.740 -0.242 25485 2732 1 3 . 1 1 21 21 ARG CA C 21 59.244 59.244 57.986 1.258 25485 2733 1 3 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.662 -0.221 25485 2734 1 3 . 1 1 21 21 ARG H H 21 7.810 7.810 7.300 0.510 25485 2735 1 3 . 1 1 22 22 PHE N N 22 112.113 112.113 121.273 -9.160 25485 2736 1 3 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.225 0.686 25485 2737 1 3 . 1 1 22 22 PHE C C 22 174.875 174.875 174.742 0.133 25485 2738 1 3 . 1 1 22 22 PHE CA C 22 57.475 57.475 61.180 -3.705 25485 2739 1 3 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.877 -0.708 25485 2740 1 3 . 1 1 22 22 PHE H H 22 8.010 8.010 8.036 -0.026 25485 2741 1 3 . 1 1 23 23 TYR N N 23 116.187 116.187 116.470 -0.283 25485 2742 1 3 . 1 1 23 23 TYR C C 23 173.455 173.455 175.580 -2.125 25485 2743 1 3 . 1 1 23 23 TYR CA C 23 58.427 58.427 56.616 1.811 25485 2744 1 3 . 1 1 23 23 TYR CB C 23 39.529 39.529 37.259 2.270 25485 2745 1 3 . 1 1 23 23 TYR H H 23 7.680 7.680 7.789 -0.109 25485 2746 1 3 . 1 1 24 24 LEU N N 24 115.570 115.570 118.437 -2.867 25485 2747 1 3 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.349 0.801 25485 2748 1 3 . 1 1 24 24 LEU C C 24 176.661 176.661 175.671 0.990 25485 2749 1 3 . 1 1 24 24 LEU CA C 24 56.152 56.152 57.322 -1.170 25485 2750 1 3 . 1 1 24 24 LEU CB C 24 36.863 36.863 40.735 -3.872 25485 2751 1 3 . 1 1 24 24 LEU H H 24 7.238 7.238 7.690 -0.452 25485 2752 1 3 . 1 1 25 25 TYR N N 25 119.901 119.901 119.166 0.735 25485 2753 1 3 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.832 -0.473 25485 2754 1 3 . 1 1 25 25 TYR C C 25 173.784 173.784 173.681 0.103 25485 2755 1 3 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.224 1.023 25485 2756 1 3 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.564 -0.485 25485 2757 1 3 . 1 1 25 25 TYR H H 25 7.845 7.845 8.237 -0.392 25485 2758 1 3 . 1 1 26 26 ASP N N 26 129.338 129.338 127.835 1.503 25485 2759 1 3 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.082 -0.631 25485 2760 1 3 . 1 1 26 26 ASP C C 26 175.282 175.282 176.585 -1.303 25485 2761 1 3 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.571 -1.138 25485 2762 1 3 . 1 1 26 26 ASP CB C 26 41.249 41.249 41.450 -0.201 25485 2763 1 3 . 1 1 26 26 ASP H H 26 8.108 8.108 8.245 -0.137 25485 2764 1 3 . 1 1 27 27 SER C C 27 175.204 175.204 175.846 -0.642 25485 2765 1 3 . 1 1 27 27 SER CA C 27 59.424 59.424 59.438 -0.014 25485 2766 1 3 . 1 1 27 27 SER CB C 27 63.535 63.535 63.765 -0.230 25485 2767 1 3 . 1 1 28 28 GLU N N 28 122.058 122.058 120.862 1.196 25485 2768 1 3 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.143 0.182 25485 2769 1 3 . 1 1 28 28 GLU C C 28 177.073 177.073 176.488 0.585 25485 2770 1 3 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.203 -0.991 25485 2771 1 3 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.368 0.202 25485 2772 1 3 . 1 1 28 28 GLU H H 28 8.255 8.255 8.723 -0.468 25485 2773 1 3 . 1 1 29 29 THR N N 29 114.161 114.161 109.610 4.551 25485 2774 1 3 . 1 1 29 29 THR HA H 29 4.260 4.260 4.281 -0.021 25485 2775 1 3 . 1 1 29 29 THR C C 29 174.591 174.591 175.029 -0.438 25485 2776 1 3 . 1 1 29 29 THR CA C 29 61.976 61.976 61.318 0.658 25485 2777 1 3 . 1 1 29 29 THR CB C 29 69.385 69.385 68.353 1.032 25485 2778 1 3 . 1 1 29 29 THR H H 29 7.498 7.498 7.422 0.076 25485 2779 1 3 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.165 0.053 25485 2780 1 3 . 1 1 30 30 LYS H H 30 8.218 8.218 7.602 0.616 25485 2781 1 3 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.452 -0.028 25485 2782 1 3 . 1 1 31 31 ASN CB C 31 39.133 39.133 38.914 0.219 25485 2783 1 3 . 1 1 32 32 ALA N N 32 126.484 126.484 123.311 3.173 25485 2784 1 3 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.186 0.110 25485 2785 1 3 . 1 1 32 32 ALA C C 32 178.012 178.012 178.636 -0.624 25485 2786 1 3 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.960 -1.200 25485 2787 1 3 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.154 -0.384 25485 2788 1 3 . 1 1 32 32 ALA H H 32 8.411 8.411 8.652 -0.241 25485 2789 1 3 . 1 1 33 33 ASN N N 33 116.885 116.885 116.785 0.100 25485 2790 1 3 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.463 0.235 25485 2791 1 3 . 1 1 33 33 ASN C C 33 176.240 176.240 177.438 -1.198 25485 2792 1 3 . 1 1 33 33 ASN CA C 33 54.187 54.187 56.087 -1.900 25485 2793 1 3 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.581 0.004 25485 2794 1 3 . 1 1 33 33 ASN H H 33 8.309 8.309 8.065 0.244 25485 2795 1 3 . 1 1 34 34 SER N N 34 116.836 116.836 114.962 1.874 25485 2796 1 3 . 1 1 34 34 SER HA H 34 4.544 4.544 4.433 0.111 25485 2797 1 3 . 1 1 34 34 SER C C 34 175.253 175.253 175.680 -0.427 25485 2798 1 3 . 1 1 34 34 SER CA C 34 59.583 59.583 60.603 -1.020 25485 2799 1 3 . 1 1 34 34 SER CB C 34 63.919 63.919 63.359 0.560 25485 2800 1 3 . 1 1 34 34 SER H H 34 8.115 8.115 7.936 0.179 25485 2801 1 3 . 1 1 35 35 LEU N N 35 125.355 125.355 124.646 0.709 25485 2802 1 3 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.068 -0.492 25485 2803 1 3 . 1 1 35 35 LEU C C 35 177.973 177.973 178.008 -0.035 25485 2804 1 3 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.363 0.134 25485 2805 1 3 . 1 1 35 35 LEU CB C 35 40.692 40.692 42.002 -1.310 25485 2806 1 3 . 1 1 35 35 LEU H H 35 8.312 8.312 7.468 0.844 25485 2807 1 3 . 1 1 36 36 GLU N N 36 119.201 119.201 118.946 0.255 25485 2808 1 3 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.994 -0.080 25485 2809 1 3 . 1 1 36 36 GLU C C 36 178.141 178.141 178.853 -0.712 25485 2810 1 3 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.185 0.474 25485 2811 1 3 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.875 0.438 25485 2812 1 3 . 1 1 36 36 GLU H H 36 8.225 8.225 8.074 0.151 25485 2813 1 3 . 1 1 37 37 ALA N N 37 120.746 120.746 122.519 -1.773 25485 2814 1 3 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.073 0.006 25485 2815 1 3 . 1 1 37 37 ALA C C 37 181.485 181.485 179.691 1.794 25485 2816 1 3 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.813 0.646 25485 2817 1 3 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.594 -0.427 25485 2818 1 3 . 1 1 37 37 ALA H H 37 7.917 7.917 7.618 0.299 25485 2819 1 3 . 1 1 38 38 LYS N N 38 119.326 119.326 118.881 0.445 25485 2820 1 3 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.027 0.304 25485 2821 1 3 . 1 1 38 38 LYS C C 38 177.946 177.946 178.772 -0.826 25485 2822 1 3 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.566 -0.862 25485 2823 1 3 . 1 1 38 38 LYS CB C 38 31.800 31.800 31.656 0.144 25485 2824 1 3 . 1 1 38 38 LYS H H 38 8.216 8.216 8.141 0.075 25485 2825 1 3 . 1 1 39 39 LEU N N 39 122.736 122.736 120.413 2.323 25485 2826 1 3 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.960 -0.019 25485 2827 1 3 . 1 1 39 39 LEU C C 39 178.819 178.819 178.777 0.042 25485 2828 1 3 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.156 -0.075 25485 2829 1 3 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.341 -0.713 25485 2830 1 3 . 1 1 39 39 LEU H H 39 8.666 8.666 8.230 0.436 25485 2831 1 3 . 1 1 40 40 LYS N N 40 118.411 118.411 118.607 -0.196 25485 2832 1 3 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.927 0.711 25485 2833 1 3 . 1 1 40 40 LYS C C 40 179.329 179.329 178.380 0.949 25485 2834 1 3 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.033 0.100 25485 2835 1 3 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.197 -0.412 25485 2836 1 3 . 1 1 40 40 LYS H H 40 8.227 8.227 7.606 0.621 25485 2837 1 3 . 1 1 41 41 GLU N N 41 121.329 121.329 118.136 3.193 25485 2838 1 3 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.131 -0.038 25485 2839 1 3 . 1 1 41 41 GLU C C 41 178.989 178.989 178.984 0.005 25485 2840 1 3 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.952 0.808 25485 2841 1 3 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.856 0.980 25485 2842 1 3 . 1 1 41 41 GLU H H 41 7.718 7.718 7.641 0.077 25485 2843 1 3 . 1 1 42 42 MET N N 42 123.817 123.817 120.559 3.258 25485 2844 1 3 . 1 1 42 42 MET HA H 42 4.107 4.107 4.353 -0.246 25485 2845 1 3 . 1 1 42 42 MET C C 42 177.719 177.719 177.981 -0.262 25485 2846 1 3 . 1 1 42 42 MET CA C 42 59.912 59.912 58.704 1.208 25485 2847 1 3 . 1 1 42 42 MET CB C 42 30.506 30.506 32.850 -2.344 25485 2848 1 3 . 1 1 42 42 MET H H 42 7.657 7.657 7.559 0.098 25485 2849 1 3 . 1 1 43 43 GLN N N 43 119.998 119.998 118.325 1.673 25485 2850 1 3 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.088 -0.283 25485 2851 1 3 . 1 1 43 43 GLN C C 43 177.604 177.604 178.908 -1.304 25485 2852 1 3 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.688 1.277 25485 2853 1 3 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.659 -1.103 25485 2854 1 3 . 1 1 43 43 GLN H H 43 8.910 8.910 7.935 0.975 25485 2855 1 3 . 1 1 44 44 LYS N N 44 119.165 119.165 118.204 0.961 25485 2856 1 3 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.228 -0.173 25485 2857 1 3 . 1 1 44 44 LYS C C 44 179.991 179.991 178.754 1.237 25485 2858 1 3 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.037 1.524 25485 2859 1 3 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.027 0.271 25485 2860 1 3 . 1 1 44 44 LYS H H 44 8.507 8.507 7.625 0.882 25485 2861 1 3 . 1 1 45 45 PHE N N 45 123.602 123.602 119.426 4.176 25485 2862 1 3 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.343 -0.443 25485 2863 1 3 . 1 1 45 45 PHE C C 45 177.606 177.606 176.481 1.125 25485 2864 1 3 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.643 2.391 25485 2865 1 3 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.322 0.544 25485 2866 1 3 . 1 1 45 45 PHE H H 45 8.445 8.445 7.528 0.917 25485 2867 1 3 . 1 1 46 46 PHE N N 46 112.715 112.715 115.110 -2.395 25485 2868 1 3 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.499 0.098 25485 2869 1 3 . 1 1 46 46 PHE C C 46 175.285 175.285 177.286 -2.001 25485 2870 1 3 . 1 1 46 46 PHE CA C 46 60.675 60.675 60.303 0.372 25485 2871 1 3 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.462 -1.003 25485 2872 1 3 . 1 1 46 46 PHE H H 46 8.272 8.272 8.181 0.091 25485 2873 1 3 . 1 1 47 47 GLY N N 47 110.438 110.438 106.956 3.482 25485 2874 1 3 . 1 1 47 47 GLY C C 47 174.935 174.935 174.444 0.491 25485 2875 1 3 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.285 1.726 25485 2876 1 3 . 1 1 47 47 GLY H H 47 7.926 7.926 8.576 -0.650 25485 2877 1 3 . 1 1 48 48 LEU N N 48 121.830 121.830 119.127 2.703 25485 2878 1 3 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.639 0.285 25485 2879 1 3 . 1 1 48 48 LEU C C 48 174.009 174.009 175.999 -1.990 25485 2880 1 3 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.736 -1.901 25485 2881 1 3 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.930 0.533 25485 2882 1 3 . 1 1 48 48 LEU H H 48 8.762 8.762 7.614 1.148 25485 2883 1 3 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.403 -0.165 25485 2884 1 3 . 1 1 49 49 PRO C C 49 176.874 176.874 176.760 0.114 25485 2885 1 3 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.824 -0.305 25485 2886 1 3 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.851 -0.772 25485 2887 1 3 . 1 1 50 50 ILE N N 50 126.859 126.859 118.701 8.158 25485 2888 1 3 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.047 0.054 25485 2889 1 3 . 1 1 50 50 ILE C C 50 176.540 176.540 175.599 0.941 25485 2890 1 3 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.924 -0.968 25485 2891 1 3 . 1 1 50 50 ILE CB C 50 36.393 36.393 36.338 0.055 25485 2892 1 3 . 1 1 50 50 ILE H H 50 8.548 8.548 7.898 0.650 25485 2893 1 3 . 1 1 51 51 THR N N 51 116.443 116.443 118.330 -1.887 25485 2894 1 3 . 1 1 51 51 THR HA H 51 4.584 4.584 4.515 0.069 25485 2895 1 3 . 1 1 51 51 THR C C 51 176.672 176.672 175.107 1.565 25485 2896 1 3 . 1 1 51 51 THR CA C 51 60.979 60.979 60.993 -0.014 25485 2897 1 3 . 1 1 51 51 THR CB C 51 71.505 71.505 70.587 0.918 25485 2898 1 3 . 1 1 51 51 THR H H 51 8.001 8.001 7.815 0.186 25485 2899 1 3 . 1 1 52 52 GLY N N 52 112.719 112.719 111.600 1.119 25485 2900 1 3 . 1 1 52 52 GLY C C 52 170.609 170.609 174.634 -4.025 25485 2901 1 3 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.936 0.810 25485 2902 1 3 . 1 1 52 52 GLY H H 52 9.499 9.499 8.636 0.863 25485 2903 1 3 . 1 1 53 53 MET N N 53 116.621 116.621 118.442 -1.821 25485 2904 1 3 . 1 1 53 53 MET HA H 53 4.023 4.023 4.549 -0.526 25485 2905 1 3 . 1 1 53 53 MET C C 53 174.695 174.695 174.769 -0.074 25485 2906 1 3 . 1 1 53 53 MET CA C 53 53.460 53.460 54.824 -1.364 25485 2907 1 3 . 1 1 53 53 MET CB C 53 35.408 35.408 34.436 0.972 25485 2908 1 3 . 1 1 53 53 MET H H 53 7.993 7.993 7.402 0.591 25485 2909 1 3 . 1 1 54 54 LEU N N 54 122.679 122.679 121.346 1.333 25485 2910 1 3 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.315 -0.564 25485 2911 1 3 . 1 1 54 54 LEU C C 54 174.784 174.784 174.806 -0.022 25485 2912 1 3 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.945 -0.644 25485 2913 1 3 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.371 -0.361 25485 2914 1 3 . 1 1 54 54 LEU H H 54 7.940 7.940 8.011 -0.071 25485 2915 1 3 . 1 1 55 55 ASN N N 55 115.797 115.797 118.463 -2.666 25485 2916 1 3 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.678 0.071 25485 2917 1 3 . 1 1 55 55 ASN C C 55 175.459 175.459 174.288 1.171 25485 2918 1 3 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.762 -1.919 25485 2919 1 3 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.697 1.660 25485 2920 1 3 . 1 1 55 55 ASN H H 55 6.543 6.543 8.121 -1.578 25485 2921 1 3 . 1 1 56 56 SER N N 56 121.507 121.507 115.137 6.370 25485 2922 1 3 . 1 1 56 56 SER HA H 56 4.638 4.638 4.399 0.239 25485 2923 1 3 . 1 1 56 56 SER C C 56 175.727 175.727 175.845 -0.118 25485 2924 1 3 . 1 1 56 56 SER CA C 56 57.932 57.932 59.418 -1.486 25485 2925 1 3 . 1 1 56 56 SER CB C 56 63.786 63.786 63.493 0.292 25485 2926 1 3 . 1 1 56 56 SER H H 56 8.213 8.213 8.019 0.194 25485 2927 1 3 . 1 1 57 57 ARG N N 57 122.951 122.951 120.654 2.297 25485 2928 1 3 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.542 -0.341 25485 2929 1 3 . 1 1 57 57 ARG C C 57 178.560 178.560 178.573 -0.013 25485 2930 1 3 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.078 0.354 25485 2931 1 3 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.865 -0.760 25485 2932 1 3 . 1 1 57 57 ARG H H 57 7.895 7.895 8.569 -0.674 25485 2933 1 3 . 1 1 58 58 VAL N N 58 118.778 118.778 119.400 -0.622 25485 2934 1 3 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.490 -0.159 25485 2935 1 3 . 1 1 58 58 VAL C C 58 177.370 177.370 177.154 0.216 25485 2936 1 3 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.157 0.225 25485 2937 1 3 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.420 0.789 25485 2938 1 3 . 1 1 58 58 VAL H H 58 7.583 7.583 7.874 -0.291 25485 2939 1 3 . 1 1 59 59 ILE N N 59 119.159 119.159 117.394 1.765 25485 2940 1 3 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.673 -0.260 25485 2941 1 3 . 1 1 59 59 ILE C C 59 177.067 177.067 177.841 -0.774 25485 2942 1 3 . 1 1 59 59 ILE CA C 59 63.633 63.633 62.544 1.089 25485 2943 1 3 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.719 -0.023 25485 2944 1 3 . 1 1 59 59 ILE H H 59 7.323 7.323 7.909 -0.586 25485 2945 1 3 . 1 1 60 60 GLU N N 60 119.367 119.367 119.611 -0.244 25485 2946 1 3 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.923 -0.185 25485 2947 1 3 . 1 1 60 60 GLU C C 60 179.978 179.978 178.996 0.982 25485 2948 1 3 . 1 1 60 60 GLU CA C 60 59.258 59.258 60.091 -0.833 25485 2949 1 3 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.380 0.009 25485 2950 1 3 . 1 1 60 60 GLU H H 60 7.879 7.879 7.489 0.390 25485 2951 1 3 . 1 1 61 61 ILE N N 61 118.816 118.816 115.518 3.298 25485 2952 1 3 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.785 -0.346 25485 2953 1 3 . 1 1 61 61 ILE C C 61 179.033 179.033 176.515 2.518 25485 2954 1 3 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.313 0.525 25485 2955 1 3 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.829 -0.930 25485 2956 1 3 . 1 1 61 61 ILE H H 61 7.246 7.246 7.320 -0.074 25485 2957 1 3 . 1 1 62 62 MET N N 62 119.986 119.986 116.435 3.551 25485 2958 1 3 . 1 1 62 62 MET HA H 62 3.444 3.444 4.076 -0.632 25485 2959 1 3 . 1 1 62 62 MET C C 62 176.185 176.185 178.030 -1.845 25485 2960 1 3 . 1 1 62 62 MET CA C 62 59.014 59.014 56.507 2.507 25485 2961 1 3 . 1 1 62 62 MET CB C 62 31.250 31.250 31.537 -0.287 25485 2962 1 3 . 1 1 62 62 MET H H 62 7.835 7.835 7.381 0.454 25485 2963 1 3 . 1 1 63 63 GLN N N 63 116.163 116.163 115.355 0.808 25485 2964 1 3 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.199 0.079 25485 2965 1 3 . 1 1 63 63 GLN C C 63 176.727 176.727 176.611 0.116 25485 2966 1 3 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.754 -0.616 25485 2967 1 3 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.270 -0.204 25485 2968 1 3 . 1 1 63 63 GLN H H 63 7.454 7.454 7.538 -0.084 25485 2969 1 3 . 1 1 64 64 LYS N N 64 121.430 121.430 121.091 0.339 25485 2970 1 3 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.416 0.127 25485 2971 1 3 . 1 1 64 64 LYS C C 64 174.724 174.724 174.199 0.525 25485 2972 1 3 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.303 1.214 25485 2973 1 3 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.620 -1.023 25485 2974 1 3 . 1 1 64 64 LYS H H 64 7.483 7.483 7.343 0.140 25485 2975 1 3 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.358 -1.922 25485 2976 1 3 . 1 1 65 65 PRO C C 65 176.158 176.158 175.618 0.540 25485 2977 1 3 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.216 -0.328 25485 2978 1 3 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.543 -0.710 25485 2979 1 3 . 1 1 66 66 ARG N N 66 112.697 112.697 121.376 -8.679 25485 2980 1 3 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.731 -0.323 25485 2981 1 3 . 1 1 66 66 ARG C C 66 174.478 174.478 175.275 -0.797 25485 2982 1 3 . 1 1 66 66 ARG CA C 66 54.636 54.636 54.012 0.624 25485 2983 1 3 . 1 1 66 66 ARG CB C 66 34.673 34.673 33.382 1.291 25485 2984 1 3 . 1 1 66 66 ARG H H 66 8.146 8.146 8.224 -0.078 25485 2985 1 3 . 1 1 67 67 CYS N N 67 121.740 121.740 118.532 3.208 25485 2986 1 3 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.433 0.007 25485 2987 1 3 . 1 1 67 67 CYS C C 67 175.659 175.659 175.948 -0.289 25485 2988 1 3 . 1 1 67 67 CYS CA C 67 59.195 59.195 59.042 0.153 25485 2989 1 3 . 1 1 67 67 CYS CB C 67 30.206 30.206 29.657 0.549 25485 2990 1 3 . 1 1 67 67 CYS H H 67 7.757 7.757 8.752 -0.995 25485 2991 1 3 . 1 1 68 68 GLY N N 68 116.217 116.217 111.800 4.417 25485 2992 1 3 . 1 1 68 68 GLY C C 68 172.210 172.210 173.820 -1.610 25485 2993 1 3 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.747 1.812 25485 2994 1 3 . 1 1 68 68 GLY H H 68 9.704 9.704 8.974 0.730 25485 2995 1 3 . 1 1 69 69 VAL N N 69 126.372 126.372 120.812 5.560 25485 2996 1 3 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.252 -0.421 25485 2997 1 3 . 1 1 69 69 VAL C C 69 173.538 173.538 173.726 -0.188 25485 2998 1 3 . 1 1 69 69 VAL CA C 69 61.368 61.368 57.858 3.510 25485 2999 1 3 . 1 1 69 69 VAL CB C 69 32.523 32.523 31.509 1.014 25485 3000 1 3 . 1 1 69 69 VAL H H 69 9.113 9.113 7.165 1.948 25485 3001 1 3 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.101 0.849 25485 3002 1 3 . 1 1 70 70 PRO C C 70 175.019 175.019 175.528 -0.509 25485 3003 1 3 . 1 1 70 70 PRO CA C 70 63.348 63.348 61.883 1.465 25485 3004 1 3 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.665 -0.307 25485 3005 1 3 . 1 1 71 71 ASP N N 71 118.986 118.986 117.961 1.025 25485 3006 1 3 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.608 -0.175 25485 3007 1 3 . 1 1 71 71 ASP C C 71 175.166 175.166 175.913 -0.747 25485 3008 1 3 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.463 1.905 25485 3009 1 3 . 1 1 71 71 ASP CB C 71 39.864 39.864 42.071 -2.207 25485 3010 1 3 . 1 1 71 71 ASP H H 71 8.054 8.054 7.891 0.163 25485 3011 1 3 . 1 1 72 72 VAL N N 72 112.953 112.953 115.470 -2.517 25485 3012 1 3 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.372 -0.076 25485 3013 1 3 . 1 1 72 72 VAL C C 72 174.330 174.330 174.500 -0.170 25485 3014 1 3 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.998 -1.353 25485 3015 1 3 . 1 1 72 72 VAL CB C 72 33.872 33.872 34.637 -0.765 25485 3016 1 3 . 1 1 72 72 VAL H H 72 6.430 6.430 7.297 -0.867 25485 3017 1 3 . 1 1 73 73 ALA N N 73 125.869 125.869 128.605 -2.736 25485 3018 1 3 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.548 -0.243 25485 3019 1 3 . 1 1 73 73 ALA C C 73 177.382 177.382 176.448 0.934 25485 3020 1 3 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.512 0.537 25485 3021 1 3 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.860 -0.909 25485 3022 1 3 . 1 1 73 73 ALA H H 73 8.177 8.177 8.058 0.119 25485 3023 1 3 . 1 1 74 74 GLU N N 74 120.724 120.724 118.454 2.270 25485 3024 1 3 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.397 -0.294 25485 3025 1 3 . 1 1 74 74 GLU C C 74 176.246 176.246 174.642 1.604 25485 3026 1 3 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.108 0.684 25485 3027 1 3 . 1 1 74 74 GLU CB C 74 29.785 29.785 30.575 -0.790 25485 3028 1 3 . 1 1 74 74 GLU H H 74 8.381 8.381 8.268 0.113 25485 3029 1 3 . 1 1 75 75 TYR N N 75 121.473 121.473 119.146 2.327 25485 3030 1 3 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.210 0.235 25485 3031 1 3 . 1 1 75 75 TYR C C 75 175.633 175.633 174.017 1.616 25485 3032 1 3 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.509 -0.182 25485 3033 1 3 . 1 1 75 75 TYR CB C 75 38.413 38.413 37.645 0.768 25485 3034 1 3 . 1 1 75 75 TYR H H 75 8.065 8.065 8.470 -0.405 25485 3035 1 3 . 1 1 76 76 SER N N 76 117.860 117.860 115.264 2.596 25485 3036 1 3 . 1 1 76 76 SER HA H 76 3.886 3.886 4.745 -0.859 25485 3037 1 3 . 1 1 76 76 SER C C 76 173.859 173.859 172.767 1.092 25485 3038 1 3 . 1 1 76 76 SER CA C 76 58.250 58.250 56.977 1.273 25485 3039 1 3 . 1 1 76 76 SER CB C 76 64.117 64.117 65.449 -1.332 25485 3040 1 3 . 1 1 76 76 SER H H 76 7.748 7.748 7.519 0.229 25485 3041 1 3 . 1 1 77 77 LEU N N 77 123.789 123.789 121.861 1.928 25485 3042 1 3 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.518 -0.372 25485 3043 1 3 . 1 1 77 77 LEU C C 77 176.451 176.451 176.219 0.232 25485 3044 1 3 . 1 1 77 77 LEU CA C 77 55.464 55.464 55.606 -0.142 25485 3045 1 3 . 1 1 77 77 LEU CB C 77 41.957 41.957 42.993 -1.036 25485 3046 1 3 . 1 1 77 77 LEU H H 77 7.979 7.979 8.712 -0.733 25485 3047 1 3 . 1 1 78 78 PHE N N 78 119.275 119.275 116.584 2.691 25485 3048 1 3 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.195 0.681 25485 3049 1 3 . 1 1 78 78 PHE C C 78 173.844 173.844 173.890 -0.046 25485 3050 1 3 . 1 1 78 78 PHE CA C 78 55.372 55.372 57.412 -2.040 25485 3051 1 3 . 1 1 78 78 PHE CB C 78 39.164 39.164 36.394 2.770 25485 3052 1 3 . 1 1 78 78 PHE H H 78 7.827 7.827 7.625 0.203 25485 3053 1 3 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.447 -0.091 25485 3054 1 3 . 1 1 79 79 PRO C C 79 176.433 176.433 176.144 0.289 25485 3055 1 3 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.239 1.611 25485 3056 1 3 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.503 -0.811 25485 3057 1 3 . 1 1 80 80 ASN N N 80 118.057 118.057 119.765 -1.708 25485 3058 1 3 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.628 0.019 25485 3059 1 3 . 1 1 80 80 ASN C C 80 174.305 174.305 174.943 -0.638 25485 3060 1 3 . 1 1 80 80 ASN CA C 80 52.860 52.860 53.489 -0.629 25485 3061 1 3 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.195 1.388 25485 3062 1 3 . 1 1 80 80 ASN H H 80 8.068 8.068 8.472 -0.404 25485 3063 1 3 . 1 1 81 81 SER HA H 81 4.565 4.565 4.238 0.327 25485 3064 1 3 . 1 1 81 81 SER CA C 81 56.800 56.800 58.329 -1.529 25485 3065 1 3 . 1 1 81 81 SER CB C 81 63.128 63.128 62.122 1.006 25485 3066 1 3 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.253 0.208 25485 3067 1 3 . 1 1 82 82 PRO C C 82 174.589 174.589 176.406 -1.817 25485 3068 1 3 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.397 -0.751 25485 3069 1 3 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.038 -0.784 25485 3070 1 3 . 1 1 83 83 LYS N N 83 114.578 114.578 117.757 -3.179 25485 3071 1 3 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.448 -0.295 25485 3072 1 3 . 1 1 83 83 LYS C C 83 175.308 175.308 176.105 -0.797 25485 3073 1 3 . 1 1 83 83 LYS CA C 83 54.407 54.407 54.241 0.166 25485 3074 1 3 . 1 1 83 83 LYS CB C 83 34.418 34.418 34.260 0.158 25485 3075 1 3 . 1 1 83 83 LYS H H 83 7.356 7.356 7.265 0.091 25485 3076 1 3 . 1 1 84 84 TRP N N 84 122.455 122.455 122.552 -0.097 25485 3077 1 3 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.545 -0.525 25485 3078 1 3 . 1 1 84 84 TRP C C 84 177.636 177.636 177.658 -0.022 25485 3079 1 3 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.610 -1.139 25485 3080 1 3 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.618 0.700 25485 3081 1 3 . 1 1 84 84 TRP H H 84 8.050 8.050 8.324 -0.274 25485 3082 1 3 . 1 1 85 85 THR N N 85 113.501 113.501 117.061 -3.560 25485 3083 1 3 . 1 1 85 85 THR HA H 85 4.573 4.573 4.380 0.193 25485 3084 1 3 . 1 1 85 85 THR C C 85 174.757 174.757 175.137 -0.380 25485 3085 1 3 . 1 1 85 85 THR CA C 85 62.130 62.130 61.347 0.783 25485 3086 1 3 . 1 1 85 85 THR CB C 85 69.107 69.107 69.188 -0.081 25485 3087 1 3 . 1 1 85 85 THR H H 85 8.861 8.861 8.630 0.231 25485 3088 1 3 . 1 1 86 86 SER N N 86 117.270 117.270 118.553 -1.283 25485 3089 1 3 . 1 1 86 86 SER HA H 86 4.741 4.741 4.569 0.172 25485 3090 1 3 . 1 1 86 86 SER C C 86 173.457 173.457 174.550 -1.093 25485 3091 1 3 . 1 1 86 86 SER CA C 86 56.739 56.739 59.382 -2.643 25485 3092 1 3 . 1 1 86 86 SER CB C 86 64.717 64.717 64.178 0.539 25485 3093 1 3 . 1 1 86 86 SER H H 86 7.743 7.743 8.312 -0.569 25485 3094 1 3 . 1 1 87 87 LYS N N 87 120.329 120.329 119.955 0.374 25485 3095 1 3 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.357 -0.128 25485 3096 1 3 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.193 0.399 25485 3097 1 3 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.930 -0.807 25485 3098 1 3 . 1 1 87 87 LYS H H 87 8.285 8.285 8.415 -0.130 25485 3099 1 3 . 1 1 88 88 VAL N N 88 117.531 117.531 117.360 0.171 25485 3100 1 3 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.481 0.174 25485 3101 1 3 . 1 1 88 88 VAL C C 88 174.868 174.868 174.070 0.798 25485 3102 1 3 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.959 -0.864 25485 3103 1 3 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.366 -1.671 25485 3104 1 3 . 1 1 88 88 VAL H H 88 7.428 7.428 7.147 0.281 25485 3105 1 3 . 1 1 89 89 VAL N N 89 131.452 131.452 126.641 4.811 25485 3106 1 3 . 1 1 89 89 VAL HA H 89 4.159 4.159 3.962 0.197 25485 3107 1 3 . 1 1 89 89 VAL C C 89 175.758 175.758 174.513 1.245 25485 3108 1 3 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.637 0.084 25485 3109 1 3 . 1 1 89 89 VAL CB C 89 34.173 34.173 33.937 0.236 25485 3110 1 3 . 1 1 89 89 VAL H H 89 8.603 8.603 8.613 -0.010 25485 3111 1 3 . 1 1 90 90 THR N N 90 118.206 118.206 116.521 1.685 25485 3112 1 3 . 1 1 90 90 THR HA H 90 5.649 5.649 5.464 0.185 25485 3113 1 3 . 1 1 90 90 THR C C 90 174.579 174.579 173.425 1.154 25485 3114 1 3 . 1 1 90 90 THR CA C 90 58.959 58.959 58.955 0.004 25485 3115 1 3 . 1 1 90 90 THR CB C 90 72.288 72.288 72.096 0.192 25485 3116 1 3 . 1 1 90 90 THR H H 90 9.021 9.021 8.150 0.871 25485 3117 1 3 . 1 1 91 91 TYR N N 91 118.117 118.117 116.150 1.967 25485 3118 1 3 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.515 0.183 25485 3119 1 3 . 1 1 91 91 TYR C C 91 171.233 171.233 172.688 -1.455 25485 3120 1 3 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.966 -0.534 25485 3121 1 3 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.118 1.142 25485 3122 1 3 . 1 1 91 91 TYR H H 91 8.555 8.555 8.254 0.301 25485 3123 1 3 . 1 1 92 92 ARG N N 92 120.252 120.252 120.457 -0.205 25485 3124 1 3 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.684 0.013 25485 3125 1 3 . 1 1 92 92 ARG C C 92 173.932 173.932 174.599 -0.667 25485 3126 1 3 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.714 0.127 25485 3127 1 3 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.594 0.092 25485 3128 1 3 . 1 1 92 92 ARG H H 92 8.520 8.520 8.736 -0.216 25485 3129 1 3 . 1 1 93 93 ILE N N 93 128.305 128.305 126.473 1.832 25485 3130 1 3 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.289 0.343 25485 3131 1 3 . 1 1 93 93 ILE C C 93 175.468 175.468 176.543 -1.075 25485 3132 1 3 . 1 1 93 93 ILE CA C 93 61.228 61.228 62.272 -1.044 25485 3133 1 3 . 1 1 93 93 ILE CB C 93 37.225 37.225 38.288 -1.063 25485 3134 1 3 . 1 1 93 93 ILE H H 93 8.886 8.886 8.782 0.104 25485 3135 1 3 . 1 1 94 94 VAL N N 94 126.647 126.647 126.411 0.236 25485 3136 1 3 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.161 -0.165 25485 3137 1 3 . 1 1 94 94 VAL C C 94 175.670 175.670 176.195 -0.525 25485 3138 1 3 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.392 0.022 25485 3139 1 3 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.671 0.348 25485 3140 1 3 . 1 1 94 94 VAL H H 94 9.517 9.517 8.864 0.653 25485 3141 1 3 . 1 1 95 95 SER N N 95 113.398 113.398 113.733 -0.335 25485 3142 1 3 . 1 1 95 95 SER HA H 95 4.701 4.701 4.726 -0.025 25485 3143 1 3 . 1 1 95 95 SER C C 95 170.684 170.684 172.740 -2.056 25485 3144 1 3 . 1 1 95 95 SER CA C 95 56.945 56.945 56.970 -0.025 25485 3145 1 3 . 1 1 95 95 SER CB C 95 65.276 65.276 65.491 -0.215 25485 3146 1 3 . 1 1 95 95 SER H H 95 7.463 7.463 7.637 -0.174 25485 3147 1 3 . 1 1 96 96 TYR N N 96 116.512 116.512 120.493 -3.981 25485 3148 1 3 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.761 -0.497 25485 3149 1 3 . 1 1 96 96 TYR C C 96 174.856 174.856 174.622 0.234 25485 3150 1 3 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.255 2.382 25485 3151 1 3 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.839 1.324 25485 3152 1 3 . 1 1 96 96 TYR H H 96 8.240 8.240 8.192 0.048 25485 3153 1 3 . 1 1 97 97 THR CA C 97 57.798 57.798 60.965 -3.167 25485 3154 1 3 . 1 1 97 97 THR CB C 97 67.420 67.420 69.196 -1.776 25485 3155 1 3 . 1 1 98 98 ARG N N 98 128.156 128.156 123.550 4.606 25485 3156 1 3 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.201 0.124 25485 3157 1 3 . 1 1 98 98 ARG C C 98 177.625 177.625 176.270 1.355 25485 3158 1 3 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.054 -0.840 25485 3159 1 3 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.958 -0.478 25485 3160 1 3 . 1 1 98 98 ARG H H 98 8.914 8.914 8.509 0.405 25485 3161 1 3 . 1 1 99 99 ASP N N 99 120.592 120.592 117.655 2.937 25485 3162 1 3 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.639 -0.258 25485 3163 1 3 . 1 1 99 99 ASP C C 99 175.679 175.679 175.274 0.405 25485 3164 1 3 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.718 1.718 25485 3165 1 3 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.725 0.645 25485 3166 1 3 . 1 1 99 99 ASP H H 99 8.708 8.708 8.085 0.623 25485 3167 1 3 . 1 1 100 100 LEU N N 100 116.829 116.829 119.336 -2.507 25485 3168 1 3 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.696 0.260 25485 3169 1 3 . 1 1 100 100 LEU C C 100 173.335 173.335 174.230 -0.895 25485 3170 1 3 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.790 -0.753 25485 3171 1 3 . 1 1 100 100 LEU CB C 100 46.267 46.267 43.423 2.844 25485 3172 1 3 . 1 1 100 100 LEU H H 100 6.916 6.916 7.157 -0.241 25485 3173 1 3 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.117 0.058 25485 3174 1 3 . 1 1 102 102 HIS C C 102 177.649 177.649 177.296 0.353 25485 3175 1 3 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.419 -0.746 25485 3176 1 3 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.206 -1.772 25485 3177 1 3 . 1 1 103 103 ILE N N 103 115.170 115.170 118.205 -3.035 25485 3178 1 3 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.887 0.286 25485 3179 1 3 . 1 1 103 103 ILE C C 103 177.214 177.214 176.906 0.308 25485 3180 1 3 . 1 1 103 103 ILE CA C 103 63.165 63.165 63.447 -0.282 25485 3181 1 3 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.526 0.239 25485 3182 1 3 . 1 1 103 103 ILE H H 103 8.234 8.234 8.064 0.170 25485 3183 1 3 . 1 1 104 104 THR N N 104 119.374 119.374 117.300 2.074 25485 3184 1 3 . 1 1 104 104 THR HA H 104 4.045 4.045 4.009 0.036 25485 3185 1 3 . 1 1 104 104 THR C C 104 175.612 175.612 176.610 -0.998 25485 3186 1 3 . 1 1 104 104 THR CA C 104 66.568 66.568 67.288 -0.720 25485 3187 1 3 . 1 1 104 104 THR CB C 104 68.077 68.077 68.456 -0.379 25485 3188 1 3 . 1 1 104 104 THR H H 104 6.947 6.947 7.619 -0.672 25485 3189 1 3 . 1 1 105 105 VAL N N 105 123.263 123.263 121.294 1.969 25485 3190 1 3 . 1 1 105 105 VAL HA H 105 3.438 3.438 2.812 0.626 25485 3191 1 3 . 1 1 105 105 VAL C C 105 177.322 177.322 176.939 0.383 25485 3192 1 3 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.341 0.606 25485 3193 1 3 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.560 -0.291 25485 3194 1 3 . 1 1 105 105 VAL H H 105 7.407 7.407 8.072 -0.665 25485 3195 1 3 . 1 1 106 106 ASP N N 106 119.972 119.972 119.465 0.507 25485 3196 1 3 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.495 -0.173 25485 3197 1 3 . 1 1 106 106 ASP C C 106 179.747 179.747 178.194 1.553 25485 3198 1 3 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.201 1.034 25485 3199 1 3 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.917 -0.555 25485 3200 1 3 . 1 1 106 106 ASP H H 106 8.627 8.627 7.787 0.840 25485 3201 1 3 . 1 1 107 107 ARG N N 107 121.033 121.033 119.317 1.716 25485 3202 1 3 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.142 0.036 25485 3203 1 3 . 1 1 107 107 ARG C C 107 179.485 179.485 178.483 1.002 25485 3204 1 3 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.629 0.951 25485 3205 1 3 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.394 0.814 25485 3206 1 3 . 1 1 107 107 ARG H H 107 8.356 8.356 7.889 0.467 25485 3207 1 3 . 1 1 108 108 LEU N N 108 121.463 121.463 120.813 0.650 25485 3208 1 3 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.173 0.132 25485 3209 1 3 . 1 1 108 108 LEU C C 108 178.852 178.852 178.822 0.030 25485 3210 1 3 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.587 0.295 25485 3211 1 3 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.263 0.052 25485 3212 1 3 . 1 1 108 108 LEU H H 108 8.790 8.790 7.774 1.016 25485 3213 1 3 . 1 1 109 109 VAL N N 109 120.233 120.233 116.402 3.831 25485 3214 1 3 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.647 -0.247 25485 3215 1 3 . 1 1 109 109 VAL C C 109 177.019 177.019 177.639 -0.620 25485 3216 1 3 . 1 1 109 109 VAL CA C 109 68.046 68.046 67.027 1.019 25485 3217 1 3 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.200 -0.011 25485 3218 1 3 . 1 1 109 109 VAL H H 109 8.787 8.787 7.774 1.013 25485 3219 1 3 . 1 1 110 110 SER N N 110 112.862 112.862 116.089 -3.227 25485 3220 1 3 . 1 1 110 110 SER HA H 110 4.300 4.300 4.043 0.257 25485 3221 1 3 . 1 1 110 110 SER C C 110 176.770 176.770 176.816 -0.046 25485 3222 1 3 . 1 1 110 110 SER CA C 110 61.744 61.744 61.467 0.278 25485 3223 1 3 . 1 1 110 110 SER CB C 110 62.742 62.742 62.803 -0.061 25485 3224 1 3 . 1 1 110 110 SER H H 110 7.605 7.605 7.957 -0.352 25485 3225 1 3 . 1 1 111 111 LYS N N 111 122.319 122.319 122.060 0.259 25485 3226 1 3 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.108 -0.047 25485 3227 1 3 . 1 1 111 111 LYS C C 111 178.309 178.309 178.303 0.006 25485 3228 1 3 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.222 0.592 25485 3229 1 3 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.629 -0.120 25485 3230 1 3 . 1 1 111 111 LYS H H 111 8.156 8.156 7.959 0.197 25485 3231 1 3 . 1 1 112 112 ALA N N 112 124.147 124.147 120.736 3.411 25485 3232 1 3 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.580 -0.481 25485 3233 1 3 . 1 1 112 112 ALA C C 112 179.445 179.445 179.038 0.407 25485 3234 1 3 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.401 0.825 25485 3235 1 3 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.327 0.647 25485 3236 1 3 . 1 1 112 112 ALA H H 112 8.278 8.278 7.525 0.753 25485 3237 1 3 . 1 1 113 113 LEU N N 113 116.195 116.195 120.352 -4.157 25485 3238 1 3 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.104 -0.353 25485 3239 1 3 . 1 1 113 113 LEU C C 113 179.537 179.537 177.918 1.619 25485 3240 1 3 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.078 -0.334 25485 3241 1 3 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.991 -1.436 25485 3242 1 3 . 1 1 113 113 LEU H H 113 8.021 8.021 8.615 -0.594 25485 3243 1 3 . 1 1 114 114 ASN N N 114 116.570 116.570 117.621 -1.051 25485 3244 1 3 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.132 0.414 25485 3245 1 3 . 1 1 114 114 ASN C C 114 177.136 177.136 177.189 -0.053 25485 3246 1 3 . 1 1 114 114 ASN CA C 114 55.764 55.764 55.940 -0.176 25485 3247 1 3 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.154 0.469 25485 3248 1 3 . 1 1 114 114 ASN H H 114 8.212 8.212 8.211 0.001 25485 3249 1 3 . 1 1 115 115 MET N N 115 122.055 122.055 119.618 2.437 25485 3250 1 3 . 1 1 115 115 MET HA H 115 4.010 4.010 4.083 -0.073 25485 3251 1 3 . 1 1 115 115 MET C C 115 177.681 177.681 178.033 -0.352 25485 3252 1 3 . 1 1 115 115 MET CA C 115 59.445 59.445 59.222 0.223 25485 3253 1 3 . 1 1 115 115 MET CB C 115 31.616 31.616 32.532 -0.916 25485 3254 1 3 . 1 1 115 115 MET H H 115 7.937 7.937 7.655 0.282 25485 3255 1 3 . 1 1 116 116 TRP N N 116 117.115 117.115 119.305 -2.190 25485 3256 1 3 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.307 0.211 25485 3257 1 3 . 1 1 116 116 TRP C C 116 179.054 179.054 179.524 -0.470 25485 3258 1 3 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.312 0.199 25485 3259 1 3 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.344 1.529 25485 3260 1 3 . 1 1 116 116 TRP H H 116 6.783 6.783 7.532 -0.749 25485 3261 1 3 . 1 1 117 117 GLY N N 117 104.511 104.511 106.156 -1.645 25485 3262 1 3 . 1 1 117 117 GLY C C 117 175.035 175.035 175.358 -0.323 25485 3263 1 3 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.375 0.622 25485 3264 1 3 . 1 1 117 117 GLY H H 117 9.302 9.302 7.618 1.684 25485 3265 1 3 . 1 1 118 118 LYS N N 118 118.580 118.580 120.117 -1.537 25485 3266 1 3 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.032 0.175 25485 3267 1 3 . 1 1 118 118 LYS C C 118 177.235 177.235 177.256 -0.021 25485 3268 1 3 . 1 1 118 118 LYS CA C 118 57.891 57.891 58.341 -0.450 25485 3269 1 3 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.941 -0.036 25485 3270 1 3 . 1 1 118 118 LYS H H 118 7.940 7.940 7.792 0.148 25485 3271 1 3 . 1 1 119 119 GLU N N 119 113.749 113.749 118.016 -4.267 25485 3272 1 3 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.406 0.432 25485 3273 1 3 . 1 1 119 119 GLU C C 119 178.024 178.024 175.148 2.876 25485 3274 1 3 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.631 -0.356 25485 3275 1 3 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.983 0.703 25485 3276 1 3 . 1 1 119 119 GLU H H 119 7.763 7.763 7.509 0.254 25485 3277 1 3 . 1 1 120 120 ILE N N 120 111.144 111.144 111.931 -0.787 25485 3278 1 3 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.702 0.669 25485 3279 1 3 . 1 1 120 120 ILE C C 120 174.033 174.033 173.629 0.404 25485 3280 1 3 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.499 0.955 25485 3281 1 3 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.919 2.010 25485 3282 1 3 . 1 1 120 120 ILE H H 120 7.518 7.518 7.620 -0.102 25485 3283 1 3 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.396 0.266 25485 3284 1 3 . 1 1 121 121 PRO C C 121 174.784 174.784 177.012 -2.228 25485 3285 1 3 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.578 -1.563 25485 3286 1 3 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.712 -2.327 25485 3287 1 3 . 1 1 122 122 LEU N N 122 121.531 121.531 118.991 2.540 25485 3288 1 3 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.315 0.024 25485 3289 1 3 . 1 1 122 122 LEU C C 122 173.977 173.977 176.358 -2.381 25485 3290 1 3 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.620 -1.062 25485 3291 1 3 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.941 2.458 25485 3292 1 3 . 1 1 122 122 LEU H H 122 6.847 6.847 7.660 -0.813 25485 3293 1 3 . 1 1 123 123 HIS N N 123 121.054 121.054 116.130 4.924 25485 3294 1 3 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.879 -0.272 25485 3295 1 3 . 1 1 123 123 HIS C C 123 172.820 172.820 173.328 -0.508 25485 3296 1 3 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.324 -0.815 25485 3297 1 3 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.953 0.157 25485 3298 1 3 . 1 1 123 123 HIS H H 123 7.760 7.760 8.374 -0.614 25485 3299 1 3 . 1 1 124 124 PHE N N 124 120.465 120.465 122.989 -2.524 25485 3300 1 3 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.481 0.353 25485 3301 1 3 . 1 1 124 124 PHE C C 124 175.677 175.677 175.194 0.483 25485 3302 1 3 . 1 1 124 124 PHE CA C 124 56.292 56.292 56.727 -0.435 25485 3303 1 3 . 1 1 124 124 PHE CB C 124 41.822 41.822 42.366 -0.544 25485 3304 1 3 . 1 1 124 124 PHE H H 124 8.306 8.306 8.683 -0.377 25485 3305 1 3 . 1 1 125 125 ARG N N 125 124.008 124.008 122.752 1.256 25485 3306 1 3 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.798 -0.087 25485 3307 1 3 . 1 1 125 125 ARG C C 125 172.901 172.901 175.179 -2.278 25485 3308 1 3 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.801 -0.527 25485 3309 1 3 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.493 -0.671 25485 3310 1 3 . 1 1 125 125 ARG H H 125 8.426 8.426 9.176 -0.750 25485 3311 1 3 . 1 1 126 126 LYS N N 126 130.004 130.004 123.855 6.149 25485 3312 1 3 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.215 -0.832 25485 3313 1 3 . 1 1 126 126 LYS C C 126 176.126 176.126 175.650 0.476 25485 3314 1 3 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.842 0.339 25485 3315 1 3 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.546 -0.519 25485 3316 1 3 . 1 1 126 126 LYS H H 126 8.481 8.481 8.592 -0.111 25485 3317 1 3 . 1 1 127 127 VAL N N 127 125.288 125.288 120.813 4.475 25485 3318 1 3 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.183 0.322 25485 3319 1 3 . 1 1 127 127 VAL C C 127 175.565 175.565 175.040 0.525 25485 3320 1 3 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.594 -1.645 25485 3321 1 3 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.087 2.275 25485 3322 1 3 . 1 1 127 127 VAL H H 127 8.721 8.721 8.251 0.470 25485 3323 1 3 . 1 1 128 128 VAL N N 128 117.467 117.467 120.719 -3.252 25485 3324 1 3 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.014 0.315 25485 3325 1 3 . 1 1 128 128 VAL C C 128 174.622 174.622 174.719 -0.097 25485 3326 1 3 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.749 0.368 25485 3327 1 3 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.723 0.787 25485 3328 1 3 . 1 1 128 128 VAL H H 128 8.406 8.406 8.042 0.364 25485 3329 1 3 . 1 1 129 129 TRP N N 129 119.986 119.986 121.198 -1.212 25485 3330 1 3 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.831 -0.115 25485 3331 1 3 . 1 1 129 129 TRP C C 129 174.536 174.536 176.266 -1.730 25485 3332 1 3 . 1 1 129 129 TRP CA C 129 55.917 55.917 57.159 -1.242 25485 3333 1 3 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.488 2.526 25485 3334 1 3 . 1 1 129 129 TRP H H 129 7.435 7.435 7.264 0.171 25485 3335 1 3 . 1 1 130 130 GLY N N 130 109.900 109.900 113.071 -3.171 25485 3336 1 3 . 1 1 130 130 GLY C C 130 173.187 173.187 174.037 -0.850 25485 3337 1 3 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.494 -0.014 25485 3338 1 3 . 1 1 130 130 GLY H H 130 8.006 8.006 8.355 -0.349 25485 3339 1 3 . 1 1 131 131 THR N N 131 116.142 116.142 117.283 -1.141 25485 3340 1 3 . 1 1 131 131 THR HA H 131 4.162 4.162 4.544 -0.382 25485 3341 1 3 . 1 1 131 131 THR C C 131 172.766 172.766 173.640 -0.874 25485 3342 1 3 . 1 1 131 131 THR CA C 131 63.212 63.212 61.675 1.538 25485 3343 1 3 . 1 1 131 131 THR CB C 131 69.308 69.308 70.472 -1.164 25485 3344 1 3 . 1 1 131 131 THR H H 131 8.233 8.233 8.235 -0.002 25485 3345 1 3 . 1 1 132 132 ALA N N 132 129.807 129.807 123.977 5.830 25485 3346 1 3 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.538 -0.022 25485 3347 1 3 . 1 1 132 132 ALA C C 132 175.358 175.358 176.622 -1.264 25485 3348 1 3 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.574 -1.208 25485 3349 1 3 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.565 1.233 25485 3350 1 3 . 1 1 132 132 ALA H H 132 7.962 7.962 8.082 -0.120 25485 3351 1 3 . 1 1 133 133 ASP N N 133 122.896 122.896 119.521 3.375 25485 3352 1 3 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.601 -0.180 25485 3353 1 3 . 1 1 133 133 ASP C C 133 177.314 177.314 177.150 0.164 25485 3354 1 3 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.229 1.690 25485 3355 1 3 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.555 -1.084 25485 3356 1 3 . 1 1 133 133 ASP H H 133 8.251 8.251 8.434 -0.183 25485 3357 1 3 . 1 1 134 134 ILE N N 134 125.472 125.472 121.611 3.861 25485 3358 1 3 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.432 -0.289 25485 3359 1 3 . 1 1 134 134 ILE C C 134 174.201 174.201 175.197 -0.996 25485 3360 1 3 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.201 0.070 25485 3361 1 3 . 1 1 134 134 ILE CB C 134 38.710 38.710 37.662 1.048 25485 3362 1 3 . 1 1 134 134 ILE H H 134 8.802 8.802 8.146 0.656 25485 3363 1 3 . 1 1 135 135 MET N N 135 127.265 127.265 128.240 -0.975 25485 3364 1 3 . 1 1 135 135 MET HA H 135 5.192 5.192 5.291 -0.099 25485 3365 1 3 . 1 1 135 135 MET C C 135 176.206 176.206 175.808 0.398 25485 3366 1 3 . 1 1 135 135 MET CA C 135 53.626 53.626 55.011 -1.385 25485 3367 1 3 . 1 1 135 135 MET CB C 135 32.639 32.639 34.529 -1.890 25485 3368 1 3 . 1 1 135 135 MET H H 135 7.418 7.418 8.220 -0.802 25485 3369 1 3 . 1 1 136 136 ILE N N 136 125.440 125.440 124.033 1.407 25485 3370 1 3 . 1 1 136 136 ILE HA H 136 5.589 5.589 5.066 0.523 25485 3371 1 3 . 1 1 136 136 ILE C C 136 175.190 175.190 175.969 -0.779 25485 3372 1 3 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.494 1.614 25485 3373 1 3 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.571 4.370 25485 3374 1 3 . 1 1 136 136 ILE H H 136 9.124 9.124 8.940 0.184 25485 3375 1 3 . 1 1 137 137 GLY N N 137 112.211 112.211 114.877 -2.666 25485 3376 1 3 . 1 1 137 137 GLY C C 137 170.855 170.855 171.900 -1.045 25485 3377 1 3 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.742 1.663 25485 3378 1 3 . 1 1 137 137 GLY H H 137 8.594 8.594 8.116 0.478 25485 3379 1 3 . 1 1 138 138 PHE N N 138 119.463 119.463 120.327 -0.864 25485 3380 1 3 . 1 1 138 138 PHE HA H 138 5.496 5.496 4.931 0.565 25485 3381 1 3 . 1 1 138 138 PHE C C 138 175.186 175.186 175.541 -0.355 25485 3382 1 3 . 1 1 138 138 PHE CA C 138 55.995 55.995 57.751 -1.756 25485 3383 1 3 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.782 -0.340 25485 3384 1 3 . 1 1 138 138 PHE H H 138 7.857 7.857 8.409 -0.552 25485 3385 1 3 . 1 1 139 139 ALA N N 139 123.914 123.914 124.370 -0.456 25485 3386 1 3 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.534 0.197 25485 3387 1 3 . 1 1 139 139 ALA C C 139 174.613 174.613 175.051 -0.438 25485 3388 1 3 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.286 -1.251 25485 3389 1 3 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.400 2.072 25485 3390 1 3 . 1 1 139 139 ALA H H 139 8.955 8.955 8.354 0.601 25485 3391 1 3 . 1 1 140 140 ARG N N 140 118.339 118.339 120.577 -2.238 25485 3392 1 3 . 1 1 140 140 ARG HA H 140 5.106 5.106 5.015 0.091 25485 3393 1 3 . 1 1 140 140 ARG C C 140 176.201 176.201 178.418 -2.217 25485 3394 1 3 . 1 1 140 140 ARG CA C 140 54.166 54.166 55.077 -0.911 25485 3395 1 3 . 1 1 140 140 ARG CB C 140 33.469 33.469 33.046 0.423 25485 3396 1 3 . 1 1 140 140 ARG H H 140 8.546 8.546 8.481 0.065 25485 3397 1 3 . 1 1 141 141 GLY N N 141 108.916 108.916 109.489 -0.573 25485 3398 1 3 . 1 1 141 141 GLY C C 141 175.595 175.595 175.827 -0.232 25485 3399 1 3 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.441 -1.151 25485 3400 1 3 . 1 1 141 141 GLY H H 141 8.989 8.989 9.182 -0.193 25485 3401 1 3 . 1 1 142 142 ALA N N 142 121.448 121.448 123.309 -1.861 25485 3402 1 3 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.207 0.201 25485 3403 1 3 . 1 1 142 142 ALA C C 142 177.027 177.027 178.184 -1.157 25485 3404 1 3 . 1 1 142 142 ALA CA C 142 53.277 53.277 53.599 -0.322 25485 3405 1 3 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.199 -0.235 25485 3406 1 3 . 1 1 142 142 ALA H H 142 8.642 8.642 8.387 0.255 25485 3407 1 3 . 1 1 143 143 HIS N N 143 120.356 120.356 114.894 5.462 25485 3408 1 3 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.444 0.713 25485 3409 1 3 . 1 1 143 143 HIS C C 143 174.303 174.303 176.320 -2.017 25485 3410 1 3 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.225 -0.772 25485 3411 1 3 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.770 -1.979 25485 3412 1 3 . 1 1 143 143 HIS H H 143 8.990 8.990 8.177 0.813 25485 3413 1 3 . 1 1 144 144 GLY N N 144 112.517 112.517 107.969 4.548 25485 3414 1 3 . 1 1 144 144 GLY C C 144 173.758 173.758 173.034 0.724 25485 3415 1 3 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.352 1.743 25485 3416 1 3 . 1 1 144 144 GLY H H 144 5.175 5.175 7.526 -2.351 25485 3417 1 3 . 1 1 145 145 ASP N N 145 117.762 117.762 120.713 -2.951 25485 3418 1 3 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.794 -0.096 25485 3419 1 3 . 1 1 145 145 ASP C C 145 175.851 175.851 175.420 0.431 25485 3420 1 3 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.760 -0.801 25485 3421 1 3 . 1 1 145 145 ASP CB C 145 41.799 41.799 43.822 -2.022 25485 3422 1 3 . 1 1 145 145 ASP H H 145 7.096 7.096 7.727 -0.631 25485 3423 1 3 . 1 1 146 146 SER N N 146 125.540 125.540 118.204 7.336 25485 3424 1 3 . 1 1 146 146 SER HA H 146 4.204 4.204 4.054 0.150 25485 3425 1 3 . 1 1 146 146 SER C C 146 172.319 172.319 173.985 -1.666 25485 3426 1 3 . 1 1 146 146 SER CA C 146 58.862 58.862 58.459 0.403 25485 3427 1 3 . 1 1 146 146 SER CB C 146 62.933 62.933 63.225 -0.292 25485 3428 1 3 . 1 1 146 146 SER H H 146 8.261 8.261 8.045 0.216 25485 3429 1 3 . 1 1 147 147 TYR N N 147 120.757 120.757 116.748 4.009 25485 3430 1 3 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.283 0.539 25485 3431 1 3 . 1 1 147 147 TYR C C 147 170.372 170.372 173.732 -3.360 25485 3432 1 3 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.444 -4.176 25485 3433 1 3 . 1 1 147 147 TYR CB C 147 38.296 38.296 36.939 1.357 25485 3434 1 3 . 1 1 147 147 TYR H H 147 7.450 7.450 8.215 -0.765 25485 3435 1 3 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.558 0.314 25485 3436 1 3 . 1 1 148 148 PRO C C 148 179.009 179.009 176.905 2.104 25485 3437 1 3 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.594 0.781 25485 3438 1 3 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.557 -1.649 25485 3439 1 3 . 1 1 149 149 PHE N N 149 120.514 120.514 122.746 -2.232 25485 3440 1 3 . 1 1 149 149 PHE C C 149 176.813 176.813 175.920 0.893 25485 3441 1 3 . 1 1 149 149 PHE CA C 149 58.453 58.453 58.994 -0.541 25485 3442 1 3 . 1 1 149 149 PHE CB C 149 38.573 38.573 39.499 -0.926 25485 3443 1 3 . 1 1 149 149 PHE H H 149 8.024 8.024 8.663 -0.639 25485 3444 1 3 . 1 1 150 150 ASP N N 150 115.555 115.555 116.749 -1.194 25485 3445 1 3 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.477 0.362 25485 3446 1 3 . 1 1 150 150 ASP C C 150 177.007 177.007 176.366 0.641 25485 3447 1 3 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.390 -0.519 25485 3448 1 3 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.607 2.329 25485 3449 1 3 . 1 1 150 150 ASP H H 150 7.511 7.511 8.451 -0.940 25485 3450 1 3 . 1 1 151 151 GLY N N 151 110.650 110.650 109.639 1.011 25485 3451 1 3 . 1 1 151 151 GLY C C 151 170.281 170.281 172.093 -1.812 25485 3452 1 3 . 1 1 151 151 GLY CA C 151 44.398 44.398 45.294 -0.895 25485 3453 1 3 . 1 1 151 151 GLY H H 151 9.080 9.080 8.200 0.880 25485 3454 1 3 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.221 -0.165 25485 3455 1 3 . 1 1 152 152 PRO C C 152 178.300 178.300 176.741 1.559 25485 3456 1 3 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.386 0.464 25485 3457 1 3 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.895 -0.635 25485 3458 1 3 . 1 1 153 153 GLY N N 153 118.783 118.783 112.187 6.596 25485 3459 1 3 . 1 1 153 153 GLY C C 153 174.098 174.098 173.367 0.731 25485 3460 1 3 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.312 -0.706 25485 3461 1 3 . 1 1 153 153 GLY H H 153 11.431 11.431 8.086 3.345 25485 3462 1 3 . 1 1 154 154 ASN N N 154 120.679 120.679 121.268 -0.589 25485 3463 1 3 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.312 -0.068 25485 3464 1 3 . 1 1 154 154 ASN C C 154 174.636 174.636 174.871 -0.235 25485 3465 1 3 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.413 2.255 25485 3466 1 3 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.341 -1.370 25485 3467 1 3 . 1 1 154 154 ASN H H 154 9.247 9.247 8.452 0.795 25485 3468 1 3 . 1 1 155 155 THR N N 155 118.252 118.252 111.759 6.493 25485 3469 1 3 . 1 1 155 155 THR HA H 155 5.577 5.577 4.178 1.399 25485 3470 1 3 . 1 1 155 155 THR C C 155 176.596 176.596 172.961 3.635 25485 3471 1 3 . 1 1 155 155 THR CA C 155 61.731 61.731 62.745 -1.014 25485 3472 1 3 . 1 1 155 155 THR CB C 155 71.325 71.325 69.049 2.276 25485 3473 1 3 . 1 1 155 155 THR H H 155 9.501 9.501 8.317 1.184 25485 3474 1 3 . 1 1 156 156 LEU N N 156 122.598 122.598 124.356 -1.758 25485 3475 1 3 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.532 0.339 25485 3476 1 3 . 1 1 156 156 LEU C C 156 175.655 175.655 175.262 0.393 25485 3477 1 3 . 1 1 156 156 LEU CA C 156 55.538 55.538 55.615 -0.077 25485 3478 1 3 . 1 1 156 156 LEU CB C 156 44.511 44.511 44.296 0.215 25485 3479 1 3 . 1 1 156 156 LEU H H 156 8.492 8.492 8.823 -0.331 25485 3480 1 3 . 1 1 157 157 ALA N N 157 115.389 115.389 116.796 -1.407 25485 3481 1 3 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.793 0.242 25485 3482 1 3 . 1 1 157 157 ALA C C 157 175.739 175.739 174.872 0.867 25485 3483 1 3 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.667 -0.729 25485 3484 1 3 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.461 1.993 25485 3485 1 3 . 1 1 157 157 ALA H H 157 7.567 7.567 7.896 -0.329 25485 3486 1 3 . 1 1 158 158 HIS N N 158 111.900 111.900 118.400 -6.500 25485 3487 1 3 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.815 -0.210 25485 3488 1 3 . 1 1 158 158 HIS C C 158 170.186 170.186 172.251 -2.065 25485 3489 1 3 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.214 1.861 25485 3490 1 3 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.301 -1.115 25485 3491 1 3 . 1 1 158 158 HIS H H 158 8.757 8.757 8.163 0.594 25485 3492 1 3 . 1 1 159 159 ALA N N 159 118.286 118.286 126.154 -7.868 25485 3493 1 3 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.028 0.626 25485 3494 1 3 . 1 1 159 159 ALA C C 159 174.036 174.036 175.564 -1.528 25485 3495 1 3 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.401 0.732 25485 3496 1 3 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.478 2.559 25485 3497 1 3 . 1 1 159 159 ALA H H 159 6.110 6.110 8.219 -2.109 25485 3498 1 3 . 1 1 160 160 PHE N N 160 117.937 117.937 119.959 -2.022 25485 3499 1 3 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.638 -0.135 25485 3500 1 3 . 1 1 160 160 PHE C C 160 174.455 174.455 175.067 -0.612 25485 3501 1 3 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.526 1.287 25485 3502 1 3 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.285 0.909 25485 3503 1 3 . 1 1 160 160 PHE H H 160 7.912 7.912 8.113 -0.201 25485 3504 1 3 . 1 1 161 161 ALA N N 161 123.531 123.531 123.601 -0.070 25485 3505 1 3 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.563 -0.072 25485 3506 1 3 . 1 1 161 161 ALA C C 161 175.503 175.503 175.937 -0.434 25485 3507 1 3 . 1 1 161 161 ALA CA C 161 50.633 50.633 48.956 1.677 25485 3508 1 3 . 1 1 161 161 ALA CB C 161 16.556 16.556 18.882 -2.326 25485 3509 1 3 . 1 1 161 161 ALA H H 161 8.107 8.107 8.373 -0.266 25485 3510 1 3 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.394 -0.484 25485 3511 1 3 . 1 1 162 162 PRO C C 162 173.465 173.465 175.428 -1.963 25485 3512 1 3 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.362 1.895 25485 3513 1 3 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.025 2.217 25485 3514 1 3 . 1 1 163 163 GLY N N 163 107.206 107.206 110.437 -3.231 25485 3515 1 3 . 1 1 163 163 GLY C C 163 172.092 172.092 172.668 -0.576 25485 3516 1 3 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.431 -0.438 25485 3517 1 3 . 1 1 163 163 GLY H H 163 5.997 5.997 7.919 -1.922 25485 3518 1 3 . 1 1 165 165 GLY N N 165 103.110 103.110 108.151 -5.041 25485 3519 1 3 . 1 1 165 165 GLY C C 165 177.158 177.158 175.852 1.306 25485 3520 1 3 . 1 1 165 165 GLY CA C 165 44.243 44.243 46.094 -1.851 25485 3521 1 3 . 1 1 165 165 GLY H H 165 9.145 9.145 8.459 0.686 25485 3522 1 3 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.309 -0.130 25485 3523 1 3 . 1 1 166 166 LEU C C 166 176.437 176.437 177.245 -0.808 25485 3524 1 3 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.719 0.481 25485 3525 1 3 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.405 -0.571 25485 3526 1 3 . 1 1 167 167 GLY N N 167 103.318 103.318 103.798 -0.480 25485 3527 1 3 . 1 1 167 167 GLY C C 167 174.803 174.803 174.340 0.463 25485 3528 1 3 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.743 2.490 25485 3529 1 3 . 1 1 167 167 GLY H H 167 7.768 7.768 7.509 0.259 25485 3530 1 3 . 1 1 168 168 GLY N N 168 121.051 121.051 108.682 12.369 25485 3531 1 3 . 1 1 168 168 GLY C C 168 172.122 172.122 173.831 -1.709 25485 3532 1 3 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.044 1.558 25485 3533 1 3 . 1 1 168 168 GLY H H 168 7.698 7.698 8.533 -0.835 25485 3534 1 3 . 1 1 169 169 ASP N N 169 123.641 123.641 120.793 2.848 25485 3535 1 3 . 1 1 169 169 ASP C C 169 173.942 173.942 174.018 -0.076 25485 3536 1 3 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.619 2.223 25485 3537 1 3 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.782 -2.913 25485 3538 1 3 . 1 1 169 169 ASP H H 169 8.595 8.595 7.984 0.611 25485 3539 1 3 . 1 1 170 170 ALA N N 170 119.366 119.366 120.893 -1.527 25485 3540 1 3 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.391 0.339 25485 3541 1 3 . 1 1 170 170 ALA C C 170 174.593 174.593 175.227 -0.634 25485 3542 1 3 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.726 0.398 25485 3543 1 3 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.192 1.143 25485 3544 1 3 . 1 1 170 170 ALA H H 170 8.324 8.324 8.412 -0.088 25485 3545 1 3 . 1 1 171 171 HIS N N 171 120.239 120.239 120.649 -0.410 25485 3546 1 3 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.385 0.363 25485 3547 1 3 . 1 1 171 171 HIS C C 171 172.949 172.949 173.956 -1.007 25485 3548 1 3 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.352 -2.628 25485 3549 1 3 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.741 0.800 25485 3550 1 3 . 1 1 171 171 HIS H H 171 8.499 8.499 7.736 0.763 25485 3551 1 3 . 1 1 172 172 PHE N N 172 121.125 121.125 118.428 2.697 25485 3552 1 3 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.396 0.132 25485 3553 1 3 . 1 1 172 172 PHE C C 172 173.875 173.875 173.611 0.264 25485 3554 1 3 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.970 -0.050 25485 3555 1 3 . 1 1 172 172 PHE CB C 172 41.903 41.903 42.042 -0.139 25485 3556 1 3 . 1 1 172 172 PHE H H 172 8.445 8.445 7.809 0.636 25485 3557 1 3 . 1 1 173 173 ASP N N 173 124.014 124.014 123.285 0.729 25485 3558 1 3 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.221 -0.307 25485 3559 1 3 . 1 1 173 173 ASP C C 173 178.613 178.613 177.561 1.052 25485 3560 1 3 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.248 1.550 25485 3561 1 3 . 1 1 173 173 ASP CB C 173 40.743 40.743 40.557 0.186 25485 3562 1 3 . 1 1 173 173 ASP H H 173 7.927 7.927 8.661 -0.734 25485 3563 1 3 . 1 1 174 174 GLU N N 174 132.469 132.469 126.364 6.105 25485 3564 1 3 . 1 1 174 174 GLU C C 174 176.442 176.442 177.360 -0.918 25485 3565 1 3 . 1 1 174 174 GLU CA C 174 57.184 57.184 59.026 -1.843 25485 3566 1 3 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.691 0.594 25485 3567 1 3 . 1 1 174 174 GLU H H 174 9.528 9.528 8.594 0.934 25485 3568 1 3 . 1 1 175 175 ASP N N 175 117.394 117.394 117.751 -0.357 25485 3569 1 3 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.681 0.112 25485 3570 1 3 . 1 1 175 175 ASP C C 175 176.645 176.645 176.737 -0.092 25485 3571 1 3 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.257 0.674 25485 3572 1 3 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.705 -1.564 25485 3573 1 3 . 1 1 175 175 ASP H H 175 8.768 8.768 8.414 0.354 25485 3574 1 3 . 1 1 176 176 GLU N N 176 116.493 116.493 118.375 -1.882 25485 3575 1 3 . 1 1 176 176 GLU C C 176 175.038 175.038 176.063 -1.025 25485 3576 1 3 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.826 -2.161 25485 3577 1 3 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.476 -4.253 25485 3578 1 3 . 1 1 176 176 GLU H H 176 7.159 7.159 8.159 -1.000 25485 3579 1 3 . 1 1 177 177 ARG N N 177 122.186 122.186 118.497 3.689 25485 3580 1 3 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.454 0.235 25485 3581 1 3 . 1 1 177 177 ARG C C 177 174.482 174.482 174.327 0.155 25485 3582 1 3 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.871 -1.184 25485 3583 1 3 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.234 -1.150 25485 3584 1 3 . 1 1 177 177 ARG H H 177 7.560 7.560 8.158 -0.598 25485 3585 1 3 . 1 1 178 178 TRP N N 178 129.179 129.179 124.638 4.541 25485 3586 1 3 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.405 -0.305 25485 3587 1 3 . 1 1 178 178 TRP C C 178 176.298 176.298 176.540 -0.242 25485 3588 1 3 . 1 1 178 178 TRP CA C 178 56.813 56.813 55.958 0.855 25485 3589 1 3 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.195 -0.998 25485 3590 1 3 . 1 1 178 178 TRP H H 178 8.807 8.807 8.628 0.179 25485 3591 1 3 . 1 1 179 179 THR N N 179 112.792 112.792 114.535 -1.743 25485 3592 1 3 . 1 1 179 179 THR HA H 179 4.985 4.985 4.832 0.153 25485 3593 1 3 . 1 1 179 179 THR C C 179 172.765 172.765 172.393 0.372 25485 3594 1 3 . 1 1 179 179 THR CA C 179 59.106 59.106 61.263 -2.157 25485 3595 1 3 . 1 1 179 179 THR CB C 179 71.786 71.786 69.956 1.830 25485 3596 1 3 . 1 1 179 179 THR H H 179 8.974 8.974 8.666 0.308 25485 3597 1 3 . 1 1 180 180 ASP N N 180 122.074 122.074 124.709 -2.635 25485 3598 1 3 . 1 1 180 180 ASP HA H 180 4.463 4.463 4.969 -0.506 25485 3599 1 3 . 1 1 180 180 ASP C C 180 176.366 176.366 178.480 -2.114 25485 3600 1 3 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.247 -2.204 25485 3601 1 3 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.383 -0.655 25485 3602 1 3 . 1 1 180 180 ASP H H 180 8.485 8.485 8.917 -0.432 25485 3603 1 3 . 1 1 181 181 GLY N N 181 110.123 110.123 108.884 1.239 25485 3604 1 3 . 1 1 181 181 GLY C C 181 174.325 174.325 175.666 -1.341 25485 3605 1 3 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.749 0.912 25485 3606 1 3 . 1 1 181 181 GLY H H 181 8.569 8.569 8.575 -0.006 25485 3607 1 3 . 1 1 182 182 SER N N 182 115.562 115.562 115.684 -0.122 25485 3608 1 3 . 1 1 182 182 SER HA H 182 4.519 4.519 4.581 -0.062 25485 3609 1 3 . 1 1 182 182 SER C C 182 173.783 173.783 174.327 -0.544 25485 3610 1 3 . 1 1 182 182 SER CA C 182 57.965 57.965 57.814 0.151 25485 3611 1 3 . 1 1 182 182 SER CB C 182 64.166 64.166 64.161 0.005 25485 3612 1 3 . 1 1 182 182 SER H H 182 8.160 8.160 7.696 0.464 25485 3613 1 3 . 1 1 183 183 SER N N 183 117.153 117.153 116.199 0.954 25485 3614 1 3 . 1 1 183 183 SER HA H 183 4.275 4.275 4.318 -0.043 25485 3615 1 3 . 1 1 183 183 SER C C 183 173.333 173.333 174.481 -1.148 25485 3616 1 3 . 1 1 183 183 SER CA C 183 59.902 59.902 58.943 0.959 25485 3617 1 3 . 1 1 183 183 SER CB C 183 64.941 64.941 62.508 2.433 25485 3618 1 3 . 1 1 183 183 SER H H 183 7.796 7.796 7.878 -0.082 25485 3619 1 3 . 1 1 184 184 LEU N N 184 122.351 122.351 119.389 2.962 25485 3620 1 3 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.503 -0.111 25485 3621 1 3 . 1 1 184 184 LEU C C 184 176.250 176.250 177.298 -1.048 25485 3622 1 3 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.794 -0.219 25485 3623 1 3 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.106 -1.025 25485 3624 1 3 . 1 1 184 184 LEU H H 184 8.092 8.092 8.069 0.024 25485 3625 1 3 . 1 1 185 185 GLY N N 185 108.871 108.871 106.762 2.109 25485 3626 1 3 . 1 1 185 185 GLY C C 185 172.375 172.375 173.915 -1.540 25485 3627 1 3 . 1 1 185 185 GLY CA C 185 44.380 44.380 43.599 0.781 25485 3628 1 3 . 1 1 185 185 GLY H H 185 7.960 7.960 7.668 0.292 25485 3629 1 3 . 1 1 186 186 ILE N N 186 123.096 123.096 121.052 2.044 25485 3630 1 3 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.103 -0.262 25485 3631 1 3 . 1 1 186 186 ILE C C 186 175.350 175.350 175.955 -0.605 25485 3632 1 3 . 1 1 186 186 ILE CA C 186 58.401 58.401 58.974 -0.573 25485 3633 1 3 . 1 1 186 186 ILE CB C 186 35.456 35.456 34.850 0.606 25485 3634 1 3 . 1 1 186 186 ILE H H 186 8.893 8.893 8.345 0.548 25485 3635 1 3 . 1 1 187 187 ASN N N 187 127.167 127.167 127.129 0.038 25485 3636 1 3 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.935 -0.582 25485 3637 1 3 . 1 1 187 187 ASN C C 187 175.849 175.849 176.965 -1.116 25485 3638 1 3 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.313 1.401 25485 3639 1 3 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.713 0.417 25485 3640 1 3 . 1 1 187 187 ASN H H 187 8.580 8.580 8.375 0.205 25485 3641 1 3 . 1 1 188 188 PHE N N 188 129.985 129.985 127.830 2.155 25485 3642 1 3 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.292 0.281 25485 3643 1 3 . 1 1 188 188 PHE C C 188 175.578 175.578 177.705 -2.127 25485 3644 1 3 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.861 -1.133 25485 3645 1 3 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.529 -0.097 25485 3646 1 3 . 1 1 188 188 PHE H H 188 9.361 9.361 8.226 1.135 25485 3647 1 3 . 1 1 189 189 LEU N N 189 119.113 119.113 118.744 0.369 25485 3648 1 3 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.114 -0.313 25485 3649 1 3 . 1 1 189 189 LEU C C 189 179.601 179.601 177.838 1.763 25485 3650 1 3 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.009 0.500 25485 3651 1 3 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.468 -1.591 25485 3652 1 3 . 1 1 189 189 LEU H H 189 8.562 8.562 8.185 0.377 25485 3653 1 3 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.605 0.312 25485 3654 1 3 . 1 1 190 190 TYR C C 190 177.621 177.621 176.984 0.637 25485 3655 1 3 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.325 0.483 25485 3656 1 3 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.488 2.281 25485 3657 1 3 . 1 1 191 191 ALA N N 191 120.352 120.352 120.670 -0.318 25485 3658 1 3 . 1 1 191 191 ALA HA H 191 4.315 4.315 3.867 0.448 25485 3659 1 3 . 1 1 191 191 ALA C C 191 180.252 180.252 178.751 1.501 25485 3660 1 3 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.327 0.855 25485 3661 1 3 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.516 0.626 25485 3662 1 3 . 1 1 191 191 ALA H H 191 7.993 7.993 8.779 -0.786 25485 3663 1 3 . 1 1 192 192 ALA N N 192 121.409 121.409 121.703 -0.294 25485 3664 1 3 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.060 -0.003 25485 3665 1 3 . 1 1 192 192 ALA C C 192 178.575 178.575 179.516 -0.941 25485 3666 1 3 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.447 -0.262 25485 3667 1 3 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.154 -1.956 25485 3668 1 3 . 1 1 192 192 ALA H H 192 9.297 9.297 8.236 1.061 25485 3669 1 3 . 1 1 193 193 THR N N 193 116.996 116.996 115.082 1.914 25485 3670 1 3 . 1 1 193 193 THR HA H 193 3.833 3.833 4.063 -0.230 25485 3671 1 3 . 1 1 193 193 THR CA C 193 69.138 69.138 68.215 0.923 25485 3672 1 3 . 1 1 193 193 THR CB C 193 67.365 67.365 68.321 -0.956 25485 3673 1 3 . 1 1 193 193 THR H H 193 8.226 8.226 7.560 0.666 25485 3674 1 3 . 1 1 194 194 HIS N N 194 120.296 120.296 121.175 -0.879 25485 3675 1 3 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.130 0.106 25485 3676 1 3 . 1 1 194 194 HIS C C 194 175.962 175.962 176.610 -0.648 25485 3677 1 3 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.826 0.921 25485 3678 1 3 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.830 -1.911 25485 3679 1 3 . 1 1 194 194 HIS H H 194 7.782 7.782 7.438 0.344 25485 3680 1 3 . 1 1 195 195 ALA N N 195 121.290 121.290 122.180 -0.890 25485 3681 1 3 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.994 0.162 25485 3682 1 3 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.830 1.134 25485 3683 1 3 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.685 0.025 25485 3684 1 3 . 1 1 195 195 ALA H H 195 8.690 8.690 8.348 0.342 25485 3685 1 3 . 1 1 196 196 LEU N N 196 114.899 114.899 117.994 -3.095 25485 3686 1 3 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.076 0.094 25485 3687 1 3 . 1 1 196 196 LEU C C 196 177.946 177.946 179.886 -1.940 25485 3688 1 3 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.503 -1.275 25485 3689 1 3 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.904 -1.128 25485 3690 1 3 . 1 1 196 196 LEU H H 196 8.715 8.715 8.958 -0.243 25485 3691 1 3 . 1 1 197 197 GLY N N 197 107.901 107.901 105.404 2.497 25485 3692 1 3 . 1 1 197 197 GLY C C 197 178.641 178.641 175.368 3.273 25485 3693 1 3 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.702 0.865 25485 3694 1 3 . 1 1 197 197 GLY H H 197 7.546 7.546 8.246 -0.700 25485 3695 1 3 . 1 1 198 198 HIS N N 198 122.017 122.017 119.727 2.290 25485 3696 1 3 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.531 0.326 25485 3697 1 3 . 1 1 198 198 HIS C C 198 179.874 179.874 178.277 1.597 25485 3698 1 3 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.052 1.470 25485 3699 1 3 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.504 -1.958 25485 3700 1 3 . 1 1 198 198 HIS H H 198 7.196 7.196 7.536 -0.340 25485 3701 1 3 . 1 1 199 199 SER N N 199 118.486 118.486 114.804 3.682 25485 3702 1 3 . 1 1 199 199 SER HA H 199 4.490 4.490 4.486 0.004 25485 3703 1 3 . 1 1 199 199 SER C C 199 174.493 174.493 175.518 -1.025 25485 3704 1 3 . 1 1 199 199 SER CA C 199 58.173 58.173 60.008 -1.835 25485 3705 1 3 . 1 1 199 199 SER CB C 199 63.589 63.589 63.201 0.388 25485 3706 1 3 . 1 1 199 199 SER H H 199 7.884 7.884 7.743 0.141 25485 3707 1 3 . 1 1 200 200 LEU N N 200 114.686 114.686 117.132 -2.446 25485 3708 1 3 . 1 1 200 200 LEU C C 200 177.720 177.720 177.136 0.584 25485 3709 1 3 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.545 0.292 25485 3710 1 3 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.989 0.368 25485 3711 1 3 . 1 1 200 200 LEU H H 200 7.108 7.108 7.043 0.065 25485 3712 1 3 . 1 1 201 201 GLY N N 201 108.363 108.363 106.218 2.145 25485 3713 1 3 . 1 1 201 201 GLY C C 201 174.008 174.008 174.572 -0.564 25485 3714 1 3 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.200 -0.786 25485 3715 1 3 . 1 1 201 201 GLY H H 201 8.195 8.195 7.473 0.722 25485 3716 1 3 . 1 1 202 202 MET N N 202 119.635 119.635 121.394 -1.759 25485 3717 1 3 . 1 1 202 202 MET HA H 202 4.473 4.473 4.549 -0.076 25485 3718 1 3 . 1 1 202 202 MET C C 202 176.593 176.593 175.177 1.416 25485 3719 1 3 . 1 1 202 202 MET CA C 202 54.500 54.500 54.899 -0.399 25485 3720 1 3 . 1 1 202 202 MET CB C 202 32.161 32.161 33.732 -1.571 25485 3721 1 3 . 1 1 202 202 MET H H 202 8.182 8.182 7.467 0.715 25485 3722 1 3 . 1 1 203 203 GLY N N 203 109.749 109.749 112.469 -2.720 25485 3723 1 3 . 1 1 203 203 GLY C C 203 174.042 174.042 173.512 0.530 25485 3724 1 3 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.682 -0.678 25485 3725 1 3 . 1 1 203 203 GLY H H 203 8.405 8.405 8.352 0.053 25485 3726 1 3 . 1 1 204 204 HIS N N 204 115.732 115.732 118.334 -2.602 25485 3727 1 3 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.344 1.056 25485 3728 1 3 . 1 1 204 204 HIS C C 204 174.430 174.430 174.963 -0.533 25485 3729 1 3 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.065 -1.251 25485 3730 1 3 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.289 -0.463 25485 3731 1 3 . 1 1 204 204 HIS H H 204 8.364 8.364 8.307 0.057 25485 3732 1 3 . 1 1 205 205 SER N N 205 115.484 115.484 116.288 -0.804 25485 3733 1 3 . 1 1 205 205 SER HA H 205 4.766 4.766 4.777 -0.011 25485 3734 1 3 . 1 1 205 205 SER C C 205 173.611 173.611 174.917 -1.306 25485 3735 1 3 . 1 1 205 205 SER CA C 205 54.729 54.729 56.375 -1.646 25485 3736 1 3 . 1 1 205 205 SER CB C 205 65.855 65.855 65.079 0.776 25485 3737 1 3 . 1 1 205 205 SER H H 205 7.231 7.231 8.262 -1.031 25485 3738 1 3 . 1 1 206 206 SER N N 206 119.263 119.263 118.111 1.152 25485 3739 1 3 . 1 1 206 206 SER HA H 206 3.701 3.701 5.003 -1.302 25485 3740 1 3 . 1 1 206 206 SER C C 206 173.635 173.635 174.597 -0.962 25485 3741 1 3 . 1 1 206 206 SER CA C 206 63.846 63.846 58.304 5.542 25485 3742 1 3 . 1 1 206 206 SER CB C 206 63.764 63.764 63.833 -0.069 25485 3743 1 3 . 1 1 206 206 SER H H 206 8.289 8.289 8.889 -0.600 25485 3744 1 3 . 1 1 207 207 ASP N N 207 126.646 126.646 124.891 1.755 25485 3745 1 3 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.973 -0.044 25485 3746 1 3 . 1 1 207 207 ASP C C 207 174.614 174.614 175.546 -0.932 25485 3747 1 3 . 1 1 207 207 ASP CA C 207 51.272 51.272 53.543 -2.271 25485 3748 1 3 . 1 1 207 207 ASP CB C 207 41.288 41.288 41.178 0.110 25485 3749 1 3 . 1 1 207 207 ASP H H 207 8.541 8.541 7.812 0.729 25485 3750 1 3 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.663 0.124 25485 3751 1 3 . 1 1 208 208 PRO C C 208 177.467 177.467 175.683 1.784 25485 3752 1 3 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.446 -0.610 25485 3753 1 3 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.338 -0.741 25485 3754 1 3 . 1 1 209 209 ASN N N 209 116.020 116.020 114.816 1.204 25485 3755 1 3 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.744 -0.103 25485 3756 1 3 . 1 1 209 209 ASN C C 209 174.695 174.695 173.582 1.113 25485 3757 1 3 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.975 1.245 25485 3758 1 3 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.730 0.380 25485 3759 1 3 . 1 1 209 209 ASN H H 209 8.350 8.350 8.027 0.323 25485 3760 1 3 . 1 1 210 210 ALA N N 210 124.892 124.892 122.720 2.172 25485 3761 1 3 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.545 -0.450 25485 3762 1 3 . 1 1 210 210 ALA C C 210 179.495 179.495 178.377 1.118 25485 3763 1 3 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.553 1.501 25485 3764 1 3 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.596 -1.397 25485 3765 1 3 . 1 1 210 210 ALA H H 210 8.193 8.193 7.223 0.970 25485 3766 1 3 . 1 1 211 211 VAL N N 211 130.402 130.402 122.031 8.371 25485 3767 1 3 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.764 0.499 25485 3768 1 3 . 1 1 211 211 VAL C C 211 179.408 179.408 176.031 3.377 25485 3769 1 3 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.006 0.046 25485 3770 1 3 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.341 -1.358 25485 3771 1 3 . 1 1 211 211 VAL H H 211 11.592 11.592 8.789 2.803 25485 3772 1 3 . 1 1 212 212 MET N N 212 113.285 113.285 111.424 1.861 25485 3773 1 3 . 1 1 212 212 MET C C 212 176.996 176.996 175.135 1.861 25485 3774 1 3 . 1 1 212 212 MET CA C 212 53.614 53.614 52.467 1.147 25485 3775 1 3 . 1 1 212 212 MET CB C 212 26.975 26.975 30.859 -3.884 25485 3776 1 3 . 1 1 212 212 MET H H 212 7.724 7.724 7.306 0.418 25485 3777 1 3 . 1 1 213 213 TYR N N 213 129.919 129.919 126.046 3.873 25485 3778 1 3 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.303 1.393 25485 3779 1 3 . 1 1 213 213 TYR C C 213 178.411 178.411 175.461 2.950 25485 3780 1 3 . 1 1 213 213 TYR CA C 213 57.131 57.131 56.919 0.212 25485 3781 1 3 . 1 1 213 213 TYR CB C 213 39.167 39.167 39.153 0.014 25485 3782 1 3 . 1 1 213 213 TYR H H 213 7.902 7.902 7.295 0.607 25485 3783 1 3 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.274 -0.799 25485 3784 1 3 . 1 1 214 214 PRO C C 214 177.694 177.694 176.669 1.025 25485 3785 1 3 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.033 1.995 25485 3786 1 3 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.939 0.884 25485 3787 1 3 . 1 1 215 215 THR N N 215 104.450 104.450 114.524 -10.074 25485 3788 1 3 . 1 1 215 215 THR HA H 215 4.444 4.444 4.449 -0.005 25485 3789 1 3 . 1 1 215 215 THR C C 215 173.429 173.429 173.506 -0.077 25485 3790 1 3 . 1 1 215 215 THR CA C 215 60.528 60.528 61.482 -0.954 25485 3791 1 3 . 1 1 215 215 THR CB C 215 69.614 69.614 66.913 2.700 25485 3792 1 3 . 1 1 215 215 THR H H 215 6.407 6.407 7.558 -1.151 25485 3793 1 3 . 1 1 216 216 TYR N N 216 124.618 124.618 125.134 -0.516 25485 3794 1 3 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.531 -0.299 25485 3795 1 3 . 1 1 216 216 TYR C C 216 175.669 175.669 175.300 0.369 25485 3796 1 3 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.661 -0.074 25485 3797 1 3 . 1 1 216 216 TYR CB C 216 40.891 40.891 39.230 1.661 25485 3798 1 3 . 1 1 216 216 TYR H H 216 8.331 8.331 7.773 0.558 25485 3799 1 3 . 1 1 217 217 GLY N N 217 116.089 116.089 115.037 1.052 25485 3800 1 3 . 1 1 217 217 GLY C C 217 173.560 173.560 172.903 0.657 25485 3801 1 3 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.779 0.539 25485 3802 1 3 . 1 1 217 217 GLY H H 217 7.695 7.695 8.586 -0.891 25485 3803 1 3 . 1 1 218 218 ASN N N 218 120.167 120.167 118.153 2.014 25485 3804 1 3 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.532 0.134 25485 3805 1 3 . 1 1 218 218 ASN C C 218 175.343 175.343 175.604 -0.261 25485 3806 1 3 . 1 1 218 218 ASN CA C 218 53.615 53.615 52.272 1.343 25485 3807 1 3 . 1 1 218 218 ASN CB C 218 38.546 38.546 39.555 -1.009 25485 3808 1 3 . 1 1 218 218 ASN H H 218 8.237 8.237 8.108 0.129 25485 3809 1 3 . 1 1 219 219 GLY N N 219 109.322 109.322 110.786 -1.464 25485 3810 1 3 . 1 1 219 219 GLY C C 219 172.842 172.842 173.449 -0.607 25485 3811 1 3 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.924 -0.206 25485 3812 1 3 . 1 1 219 219 GLY H H 219 8.027 8.027 8.584 -0.557 25485 3813 1 3 . 1 1 220 220 ASP N N 220 123.006 123.006 122.988 0.018 25485 3814 1 3 . 1 1 220 220 ASP H H 220 8.273 8.273 8.412 -0.139 25485 3815 1 3 . 1 1 221 221 PRO C C 221 177.138 177.138 176.233 0.905 25485 3816 1 3 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.686 -5.623 25485 3817 1 3 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.639 -0.944 25485 3818 1 3 . 1 1 222 222 GLN N N 222 116.718 116.718 119.770 -3.052 25485 3819 1 3 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.232 0.104 25485 3820 1 3 . 1 1 222 222 GLN C C 222 176.321 176.321 176.699 -0.378 25485 3821 1 3 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.906 -0.763 25485 3822 1 3 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.146 0.351 25485 3823 1 3 . 1 1 222 222 GLN H H 222 8.240 8.240 8.685 -0.445 25485 3824 1 3 . 1 1 223 223 ASN N N 223 118.368 118.368 114.694 3.674 25485 3825 1 3 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.799 0.117 25485 3826 1 3 . 1 1 223 223 ASN C C 223 173.271 173.271 174.268 -0.997 25485 3827 1 3 . 1 1 223 223 ASN CA C 223 52.596 52.596 52.943 -0.347 25485 3828 1 3 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.592 -0.377 25485 3829 1 3 . 1 1 223 223 ASN H H 223 7.946 7.946 7.987 -0.041 25485 3830 1 3 . 1 1 224 224 PHE N N 224 118.429 118.429 117.834 0.595 25485 3831 1 3 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.325 0.126 25485 3832 1 3 . 1 1 224 224 PHE C C 224 172.897 172.897 173.289 -0.392 25485 3833 1 3 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.301 0.108 25485 3834 1 3 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.134 0.567 25485 3835 1 3 . 1 1 224 224 PHE H H 224 6.992 6.992 7.695 -0.703 25485 3836 1 3 . 1 1 225 225 LYS N N 225 121.714 121.714 124.645 -2.931 25485 3837 1 3 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.901 0.529 25485 3838 1 3 . 1 1 225 225 LYS C C 225 174.664 174.664 174.452 0.212 25485 3839 1 3 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.938 0.374 25485 3840 1 3 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.999 -0.272 25485 3841 1 3 . 1 1 225 225 LYS H H 225 7.709 7.709 8.097 -0.388 25485 3842 1 3 . 1 1 226 226 LEU N N 226 119.026 119.026 122.363 -3.337 25485 3843 1 3 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.180 -0.040 25485 3844 1 3 . 1 1 226 226 LEU C C 226 177.495 177.495 176.724 0.771 25485 3845 1 3 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.175 0.424 25485 3846 1 3 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.525 -1.244 25485 3847 1 3 . 1 1 226 226 LEU H H 226 8.015 8.015 8.125 -0.110 25485 3848 1 3 . 1 1 227 227 SER N N 227 120.320 120.320 115.111 5.209 25485 3849 1 3 . 1 1 227 227 SER HA H 227 4.600 4.600 4.523 0.077 25485 3850 1 3 . 1 1 227 227 SER C C 227 175.492 175.492 175.375 0.117 25485 3851 1 3 . 1 1 227 227 SER CA C 227 57.239 57.239 57.238 0.001 25485 3852 1 3 . 1 1 227 227 SER CB C 227 66.278 66.278 64.695 1.583 25485 3853 1 3 . 1 1 227 227 SER H H 227 9.654 9.654 7.978 1.676 25485 3854 1 3 . 1 1 228 228 GLN N N 228 127.511 127.511 124.975 2.536 25485 3855 1 3 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.966 0.728 25485 3856 1 3 . 1 1 228 228 GLN H H 228 8.248 8.248 8.786 -0.538 25485 3857 1 3 . 1 1 229 229 ASP N N 229 124.358 124.358 118.380 5.978 25485 3858 1 3 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.344 0.030 25485 3859 1 3 . 1 1 229 229 ASP C C 229 178.793 178.793 178.184 0.609 25485 3860 1 3 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.313 0.829 25485 3861 1 3 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.690 2.552 25485 3862 1 3 . 1 1 229 229 ASP H H 229 8.138 8.138 8.491 -0.353 25485 3863 1 3 . 1 1 230 230 ASP N N 230 119.694 119.694 119.807 -0.113 25485 3864 1 3 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.479 -0.057 25485 3865 1 3 . 1 1 230 230 ASP C C 230 177.736 177.736 178.048 -0.312 25485 3866 1 3 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.096 0.826 25485 3867 1 3 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.097 2.139 25485 3868 1 3 . 1 1 230 230 ASP H H 230 7.393 7.393 7.430 -0.037 25485 3869 1 3 . 1 1 231 231 ILE N N 231 120.364 120.364 120.093 0.271 25485 3870 1 3 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.702 -0.037 25485 3871 1 3 . 1 1 231 231 ILE C C 231 177.631 177.631 177.849 -0.218 25485 3872 1 3 . 1 1 231 231 ILE CA C 231 65.499 65.499 64.995 0.504 25485 3873 1 3 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.966 0.547 25485 3874 1 3 . 1 1 231 231 ILE H H 231 8.115 8.115 7.821 0.294 25485 3875 1 3 . 1 1 232 232 LYS N N 232 119.156 119.156 120.213 -1.057 25485 3876 1 3 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.109 0.005 25485 3877 1 3 . 1 1 232 232 LYS C C 232 180.574 180.574 179.120 1.454 25485 3878 1 3 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.527 0.033 25485 3879 1 3 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.742 0.055 25485 3880 1 3 . 1 1 232 232 LYS H H 232 8.607 8.607 8.357 0.250 25485 3881 1 3 . 1 1 233 233 GLY N N 233 106.425 106.425 108.233 -1.808 25485 3882 1 3 . 1 1 233 233 GLY C C 233 176.098 176.098 175.875 0.223 25485 3883 1 3 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.873 0.764 25485 3884 1 3 . 1 1 233 233 GLY H H 233 8.075 8.075 7.873 0.202 25485 3885 1 3 . 1 1 234 234 ILE N N 234 125.119 125.119 122.015 3.104 25485 3886 1 3 . 1 1 234 234 ILE C C 234 178.231 178.231 177.394 0.837 25485 3887 1 3 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.486 -1.893 25485 3888 1 3 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.421 -0.875 25485 3889 1 3 . 1 1 234 234 ILE H H 234 8.539 8.539 7.517 1.022 25485 3890 1 3 . 1 1 235 235 GLN N N 235 122.877 122.877 119.055 3.822 25485 3891 1 3 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.170 0.187 25485 3892 1 3 . 1 1 235 235 GLN C C 235 180.105 180.105 178.525 1.580 25485 3893 1 3 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.173 -1.286 25485 3894 1 3 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.676 -1.139 25485 3895 1 3 . 1 1 235 235 GLN H H 235 8.296 8.296 8.064 0.232 25485 3896 1 3 . 1 1 236 236 LYS N N 236 123.678 123.678 119.996 3.682 25485 3897 1 3 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.283 -0.201 25485 3898 1 3 . 1 1 236 236 LYS C C 236 178.169 178.169 177.568 0.601 25485 3899 1 3 . 1 1 236 236 LYS CA C 236 59.376 59.376 59.006 0.370 25485 3900 1 3 . 1 1 236 236 LYS CB C 236 31.978 31.978 32.145 -0.167 25485 3901 1 3 . 1 1 236 236 LYS H H 236 8.024 8.024 7.897 0.127 25485 3902 1 3 . 1 1 237 237 LEU N N 237 116.873 116.873 118.757 -1.884 25485 3903 1 3 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.217 -0.230 25485 3904 1 3 . 1 1 237 237 LEU C C 237 177.893 177.893 177.431 0.462 25485 3905 1 3 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.382 1.057 25485 3906 1 3 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.523 1.090 25485 3907 1 3 . 1 1 237 237 LEU H H 237 6.888 6.888 7.273 -0.385 25485 3908 1 3 . 1 1 238 238 TYR N N 238 112.237 112.237 116.462 -4.225 25485 3909 1 3 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.449 0.202 25485 3910 1 3 . 1 1 238 238 TYR C C 238 176.082 176.082 176.996 -0.914 25485 3911 1 3 . 1 1 238 238 TYR CA C 238 59.636 59.636 59.999 -0.363 25485 3912 1 3 . 1 1 238 238 TYR CB C 238 41.398 41.398 40.000 1.398 25485 3913 1 3 . 1 1 238 238 TYR H H 238 7.445 7.445 8.266 -0.821 25485 3914 1 3 . 1 1 239 239 GLY N N 239 110.906 110.906 106.674 4.232 25485 3915 1 3 . 1 1 239 239 GLY C C 239 171.269 171.269 172.496 -1.227 25485 3916 1 3 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.222 -1.336 25485 3917 1 3 . 1 1 239 239 GLY H H 239 8.443 8.443 7.991 0.452 25485 3918 1 3 . 1 1 240 240 LYS N N 240 114.281 114.281 122.012 -7.731 25485 3919 1 3 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.569 0.169 25485 3920 1 3 . 1 1 240 240 LYS C C 240 177.527 177.527 175.694 1.833 25485 3921 1 3 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.967 -1.009 25485 3922 1 3 . 1 1 240 240 LYS CB C 240 34.275 34.275 34.282 -0.007 25485 3923 1 3 . 1 1 240 240 LYS H H 240 7.873 7.873 8.327 -0.454 25485 3924 1 3 . 1 1 241 241 ARG N N 241 123.758 123.758 120.258 3.500 25485 3925 1 3 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.585 -0.588 25485 3926 1 3 . 1 1 241 241 ARG C C 241 176.026 176.026 175.764 0.262 25485 3927 1 3 . 1 1 241 241 ARG CA C 241 57.492 57.492 56.033 1.458 25485 3928 1 3 . 1 1 241 241 ARG CB C 241 30.371 30.371 31.194 -0.823 25485 3929 1 3 . 1 1 241 241 ARG H H 241 7.742 7.742 8.360 -0.618 25485 3930 1 3 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.420 -0.080 25485 3931 1 3 . 1 1 246 246 LYS C C 246 175.403 175.403 174.654 0.749 25485 3932 1 3 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.406 0.103 25485 3933 1 3 . 1 1 246 246 LYS CB C 246 32.858 32.858 35.026 -2.168 25485 3934 1 4 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.505 -0.198 25485 3935 1 4 . 1 1 2 2 GLN C C 2 176.492 176.492 176.012 0.480 25485 3936 1 4 . 1 1 2 2 GLN CA C 2 56.749 56.749 55.681 1.068 25485 3937 1 4 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.934 -0.281 25485 3938 1 4 . 1 1 3 3 GLU N N 3 121.668 121.668 122.884 -1.216 25485 3939 1 4 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.404 -0.615 25485 3940 1 4 . 1 1 3 3 GLU C C 3 176.278 176.278 177.643 -1.365 25485 3941 1 4 . 1 1 3 3 GLU CA C 3 57.059 57.059 56.876 0.183 25485 3942 1 4 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.954 -0.263 25485 3943 1 4 . 1 1 3 3 GLU H H 3 8.331 8.331 8.814 -0.483 25485 3944 1 4 . 1 1 4 4 ALA N N 4 124.493 124.493 124.248 0.245 25485 3945 1 4 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.315 0.195 25485 3946 1 4 . 1 1 4 4 ALA C C 4 178.428 178.428 179.910 -1.482 25485 3947 1 4 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.752 -0.075 25485 3948 1 4 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.161 0.548 25485 3949 1 4 . 1 1 4 4 ALA H H 4 8.131 8.131 8.446 -0.315 25485 3950 1 4 . 1 1 5 5 GLY N N 5 108.204 108.204 108.204 0.000 25485 3951 1 4 . 1 1 5 5 GLY C C 5 174.858 174.858 175.493 -0.635 25485 3952 1 4 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.262 1.399 25485 3953 1 4 . 1 1 5 5 GLY H H 5 8.279 8.279 8.581 -0.302 25485 3954 1 4 . 1 1 6 6 GLY N N 6 108.820 108.820 107.414 1.406 25485 3955 1 4 . 1 1 6 6 GLY C C 6 174.189 174.189 174.058 0.131 25485 3956 1 4 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.551 -0.138 25485 3957 1 4 . 1 1 6 6 GLY H H 6 8.246 8.246 7.750 0.496 25485 3958 1 4 . 1 1 7 7 MET N N 7 119.938 119.938 120.823 -0.885 25485 3959 1 4 . 1 1 7 7 MET HA H 7 4.659 4.659 4.482 0.177 25485 3960 1 4 . 1 1 7 7 MET C C 7 176.191 176.191 176.133 0.058 25485 3961 1 4 . 1 1 7 7 MET CA C 7 54.799 54.799 54.489 0.310 25485 3962 1 4 . 1 1 7 7 MET CB C 7 33.046 33.046 33.704 -0.658 25485 3963 1 4 . 1 1 7 7 MET H H 7 8.005 8.005 7.583 0.422 25485 3964 1 4 . 1 1 8 8 SER N N 8 118.919 118.919 115.707 3.212 25485 3965 1 4 . 1 1 8 8 SER HA H 8 4.239 4.239 4.734 -0.495 25485 3966 1 4 . 1 1 8 8 SER C C 8 174.949 174.949 175.034 -0.085 25485 3967 1 4 . 1 1 8 8 SER CA C 8 58.160 58.160 57.272 0.888 25485 3968 1 4 . 1 1 8 8 SER CB C 8 65.440 65.440 64.430 1.010 25485 3969 1 4 . 1 1 8 8 SER H H 8 8.731 8.731 8.144 0.587 25485 3970 1 4 . 1 1 9 9 GLU N N 9 122.442 122.442 120.639 1.803 25485 3971 1 4 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.080 0.241 25485 3972 1 4 . 1 1 9 9 GLU C C 9 178.604 178.604 178.537 0.067 25485 3973 1 4 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.655 -0.188 25485 3974 1 4 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.161 0.015 25485 3975 1 4 . 1 1 9 9 GLU H H 9 8.901 8.901 8.890 0.011 25485 3976 1 4 . 1 1 10 10 LEU N N 10 120.568 120.568 118.398 2.170 25485 3977 1 4 . 1 1 10 10 LEU C C 10 179.307 179.307 178.645 0.662 25485 3978 1 4 . 1 1 10 10 LEU CA C 10 57.480 57.480 57.525 -0.045 25485 3979 1 4 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.148 0.427 25485 3980 1 4 . 1 1 10 10 LEU H H 10 8.020 8.020 8.171 -0.151 25485 3981 1 4 . 1 1 11 11 GLN N N 11 119.930 119.930 119.051 0.879 25485 3982 1 4 . 1 1 11 11 GLN HA H 11 4.134 4.134 3.978 0.156 25485 3983 1 4 . 1 1 11 11 GLN C C 11 178.330 178.330 177.883 0.447 25485 3984 1 4 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.129 -0.311 25485 3985 1 4 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.864 -1.000 25485 3986 1 4 . 1 1 11 11 GLN H H 11 7.811 7.811 7.891 -0.080 25485 3987 1 4 . 1 1 12 12 TRP N N 12 121.031 121.031 121.623 -0.592 25485 3988 1 4 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.380 0.034 25485 3989 1 4 . 1 1 12 12 TRP C C 12 178.874 178.874 178.208 0.666 25485 3990 1 4 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.355 0.152 25485 3991 1 4 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.424 -0.037 25485 3992 1 4 . 1 1 12 12 TRP H H 12 8.205 8.205 7.652 0.553 25485 3993 1 4 . 1 1 13 13 GLU N N 13 121.877 121.877 119.749 2.128 25485 3994 1 4 . 1 1 13 13 GLU C C 13 179.425 179.425 178.951 0.474 25485 3995 1 4 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.246 0.791 25485 3996 1 4 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.277 -0.355 25485 3997 1 4 . 1 1 13 13 GLU H H 13 8.434 8.434 8.506 -0.072 25485 3998 1 4 . 1 1 14 14 GLN N N 14 120.449 120.449 119.004 1.445 25485 3999 1 4 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.944 0.294 25485 4000 1 4 . 1 1 14 14 GLN C C 14 179.210 179.210 178.023 1.187 25485 4001 1 4 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.444 0.438 25485 4002 1 4 . 1 1 14 14 GLN CB C 14 27.750 27.750 27.790 -0.040 25485 4003 1 4 . 1 1 14 14 GLN H H 14 8.124 8.124 7.960 0.164 25485 4004 1 4 . 1 1 15 15 ALA N N 15 123.114 123.114 120.945 2.169 25485 4005 1 4 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.598 0.792 25485 4006 1 4 . 1 1 15 15 ALA C C 15 179.352 179.352 179.196 0.156 25485 4007 1 4 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.563 -0.598 25485 4008 1 4 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.795 0.868 25485 4009 1 4 . 1 1 15 15 ALA H H 15 8.344 8.344 7.426 0.918 25485 4010 1 4 . 1 1 16 16 GLN N N 16 117.718 117.718 116.992 0.726 25485 4011 1 4 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.975 -0.193 25485 4012 1 4 . 1 1 16 16 GLN C C 16 177.719 177.719 178.105 -0.386 25485 4013 1 4 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.341 1.940 25485 4014 1 4 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.325 0.211 25485 4015 1 4 . 1 1 16 16 GLN H H 16 8.500 8.500 7.791 0.709 25485 4016 1 4 . 1 1 17 17 ASP N N 17 120.040 120.040 120.370 -0.330 25485 4017 1 4 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.383 0.153 25485 4018 1 4 . 1 1 17 17 ASP C C 17 177.630 177.630 178.820 -1.190 25485 4019 1 4 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.740 0.065 25485 4020 1 4 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.794 1.070 25485 4021 1 4 . 1 1 17 17 ASP H H 17 7.871 7.871 8.036 -0.165 25485 4022 1 4 . 1 1 18 18 TYR N N 18 122.465 122.465 118.760 3.705 25485 4023 1 4 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.183 0.007 25485 4024 1 4 . 1 1 18 18 TYR C C 18 178.439 178.439 177.462 0.977 25485 4025 1 4 . 1 1 18 18 TYR CA C 18 61.846 61.846 59.391 2.455 25485 4026 1 4 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.131 1.809 25485 4027 1 4 . 1 1 18 18 TYR H H 18 8.244 8.244 8.401 -0.157 25485 4028 1 4 . 1 1 19 19 LEU N N 19 117.635 117.635 117.646 -0.011 25485 4029 1 4 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.692 0.440 25485 4030 1 4 . 1 1 19 19 LEU C C 19 180.940 180.940 178.219 2.721 25485 4031 1 4 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.995 0.510 25485 4032 1 4 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.024 -0.426 25485 4033 1 4 . 1 1 19 19 LEU H H 19 8.713 8.713 7.511 1.202 25485 4034 1 4 . 1 1 20 20 LYS N N 20 124.594 124.594 116.926 7.668 25485 4035 1 4 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.113 -0.029 25485 4036 1 4 . 1 1 20 20 LYS C C 20 178.387 178.387 178.096 0.291 25485 4037 1 4 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.119 0.686 25485 4038 1 4 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.240 0.216 25485 4039 1 4 . 1 1 20 20 LYS H H 20 8.815 8.815 7.405 1.410 25485 4040 1 4 . 1 1 21 21 ARG N N 21 117.535 117.535 117.762 -0.227 25485 4041 1 4 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.382 -0.663 25485 4042 1 4 . 1 1 21 21 ARG C C 21 178.498 178.498 178.895 -0.397 25485 4043 1 4 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.094 1.150 25485 4044 1 4 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.649 -0.208 25485 4045 1 4 . 1 1 21 21 ARG H H 21 7.810 7.810 7.241 0.569 25485 4046 1 4 . 1 1 22 22 PHE N N 22 112.113 112.113 121.207 -9.094 25485 4047 1 4 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.142 0.769 25485 4048 1 4 . 1 1 22 22 PHE C C 22 174.875 174.875 175.512 -0.637 25485 4049 1 4 . 1 1 22 22 PHE CA C 22 57.475 57.475 61.601 -4.126 25485 4050 1 4 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.198 -0.029 25485 4051 1 4 . 1 1 22 22 PHE H H 22 8.010 8.010 7.838 0.172 25485 4052 1 4 . 1 1 23 23 TYR N N 23 116.187 116.187 115.237 0.950 25485 4053 1 4 . 1 1 23 23 TYR C C 23 173.455 173.455 175.674 -2.219 25485 4054 1 4 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.230 3.197 25485 4055 1 4 . 1 1 23 23 TYR CB C 23 39.529 39.529 36.559 2.970 25485 4056 1 4 . 1 1 23 23 TYR H H 23 7.680 7.680 7.431 0.249 25485 4057 1 4 . 1 1 24 24 LEU N N 24 115.570 115.570 118.190 -2.620 25485 4058 1 4 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.925 0.225 25485 4059 1 4 . 1 1 24 24 LEU C C 24 176.661 176.661 175.872 0.789 25485 4060 1 4 . 1 1 24 24 LEU CA C 24 56.152 56.152 57.603 -1.451 25485 4061 1 4 . 1 1 24 24 LEU CB C 24 36.863 36.863 40.763 -3.900 25485 4062 1 4 . 1 1 24 24 LEU H H 24 7.238 7.238 7.850 -0.612 25485 4063 1 4 . 1 1 25 25 TYR N N 25 119.901 119.901 118.528 1.373 25485 4064 1 4 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.886 -0.527 25485 4065 1 4 . 1 1 25 25 TYR C C 25 173.784 173.784 173.708 0.076 25485 4066 1 4 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.239 1.008 25485 4067 1 4 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.918 -0.839 25485 4068 1 4 . 1 1 25 25 TYR H H 25 7.845 7.845 8.201 -0.356 25485 4069 1 4 . 1 1 26 26 ASP N N 26 129.338 129.338 128.308 1.030 25485 4070 1 4 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.038 -0.588 25485 4071 1 4 . 1 1 26 26 ASP C C 26 175.282 175.282 175.626 -0.344 25485 4072 1 4 . 1 1 26 26 ASP CA C 26 52.433 52.433 54.070 -1.637 25485 4073 1 4 . 1 1 26 26 ASP CB C 26 41.249 41.249 40.554 0.695 25485 4074 1 4 . 1 1 26 26 ASP H H 26 8.108 8.108 8.686 -0.578 25485 4075 1 4 . 1 1 27 27 SER C C 27 175.204 175.204 176.413 -1.209 25485 4076 1 4 . 1 1 27 27 SER CA C 27 59.424 59.424 60.274 -0.850 25485 4077 1 4 . 1 1 27 27 SER CB C 27 63.535 63.535 63.708 -0.173 25485 4078 1 4 . 1 1 28 28 GLU N N 28 122.058 122.058 120.840 1.218 25485 4079 1 4 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.009 0.316 25485 4080 1 4 . 1 1 28 28 GLU C C 28 177.073 177.073 177.131 -0.058 25485 4081 1 4 . 1 1 28 28 GLU CA C 28 57.212 57.212 59.349 -2.137 25485 4082 1 4 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.553 0.017 25485 4083 1 4 . 1 1 28 28 GLU H H 28 8.255 8.255 8.916 -0.661 25485 4084 1 4 . 1 1 29 29 THR N N 29 114.161 114.161 106.845 7.316 25485 4085 1 4 . 1 1 29 29 THR HA H 29 4.260 4.260 4.258 0.002 25485 4086 1 4 . 1 1 29 29 THR C C 29 174.591 174.591 174.880 -0.289 25485 4087 1 4 . 1 1 29 29 THR CA C 29 61.976 61.976 61.675 0.301 25485 4088 1 4 . 1 1 29 29 THR CB C 29 69.385 69.385 68.945 0.440 25485 4089 1 4 . 1 1 29 29 THR H H 29 7.498 7.498 7.888 -0.390 25485 4090 1 4 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.022 0.196 25485 4091 1 4 . 1 1 30 30 LYS H H 30 8.218 8.218 7.760 0.458 25485 4092 1 4 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.734 -0.310 25485 4093 1 4 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.977 -1.844 25485 4094 1 4 . 1 1 32 32 ALA N N 32 126.484 126.484 122.985 3.499 25485 4095 1 4 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.236 0.060 25485 4096 1 4 . 1 1 32 32 ALA C C 32 178.012 178.012 178.597 -0.585 25485 4097 1 4 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.857 -1.097 25485 4098 1 4 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.110 -0.340 25485 4099 1 4 . 1 1 32 32 ALA H H 32 8.411 8.411 8.687 -0.276 25485 4100 1 4 . 1 1 33 33 ASN N N 33 116.885 116.885 115.378 1.507 25485 4101 1 4 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.644 0.054 25485 4102 1 4 . 1 1 33 33 ASN C C 33 176.240 176.240 177.579 -1.339 25485 4103 1 4 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.085 -0.898 25485 4104 1 4 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.472 0.112 25485 4105 1 4 . 1 1 33 33 ASN H H 33 8.309 8.309 8.407 -0.098 25485 4106 1 4 . 1 1 34 34 SER N N 34 116.836 116.836 116.507 0.329 25485 4107 1 4 . 1 1 34 34 SER HA H 34 4.544 4.544 4.247 0.297 25485 4108 1 4 . 1 1 34 34 SER C C 34 175.253 175.253 175.839 -0.586 25485 4109 1 4 . 1 1 34 34 SER CA C 34 59.583 59.583 60.779 -1.196 25485 4110 1 4 . 1 1 34 34 SER CB C 34 63.919 63.919 62.658 1.261 25485 4111 1 4 . 1 1 34 34 SER H H 34 8.115 8.115 8.478 -0.363 25485 4112 1 4 . 1 1 35 35 LEU N N 35 125.355 125.355 123.261 2.094 25485 4113 1 4 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.051 -0.475 25485 4114 1 4 . 1 1 35 35 LEU C C 35 177.973 177.973 178.096 -0.123 25485 4115 1 4 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.280 0.217 25485 4116 1 4 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.915 -1.223 25485 4117 1 4 . 1 1 35 35 LEU H H 35 8.312 8.312 7.672 0.640 25485 4118 1 4 . 1 1 36 36 GLU N N 36 119.201 119.201 118.489 0.712 25485 4119 1 4 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.964 -0.050 25485 4120 1 4 . 1 1 36 36 GLU C C 36 178.141 178.141 178.793 -0.652 25485 4121 1 4 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.380 0.279 25485 4122 1 4 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.132 0.181 25485 4123 1 4 . 1 1 36 36 GLU H H 36 8.225 8.225 7.811 0.414 25485 4124 1 4 . 1 1 37 37 ALA N N 37 120.746 120.746 122.193 -1.447 25485 4125 1 4 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.055 0.024 25485 4126 1 4 . 1 1 37 37 ALA C C 37 181.485 181.485 179.647 1.838 25485 4127 1 4 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.156 0.303 25485 4128 1 4 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.403 -0.236 25485 4129 1 4 . 1 1 37 37 ALA H H 37 7.917 7.917 7.599 0.318 25485 4130 1 4 . 1 1 38 38 LYS N N 38 119.326 119.326 118.263 1.063 25485 4131 1 4 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.086 0.245 25485 4132 1 4 . 1 1 38 38 LYS C C 38 177.946 177.946 178.871 -0.925 25485 4133 1 4 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.780 -1.076 25485 4134 1 4 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.089 -0.289 25485 4135 1 4 . 1 1 38 38 LYS H H 38 8.216 8.216 8.275 -0.059 25485 4136 1 4 . 1 1 39 39 LEU N N 39 122.736 122.736 121.315 1.421 25485 4137 1 4 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.972 -0.031 25485 4138 1 4 . 1 1 39 39 LEU C C 39 178.819 178.819 178.862 -0.043 25485 4139 1 4 . 1 1 39 39 LEU CA C 39 58.081 58.081 57.935 0.146 25485 4140 1 4 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.432 -0.805 25485 4141 1 4 . 1 1 39 39 LEU H H 39 8.666 8.666 8.112 0.554 25485 4142 1 4 . 1 1 40 40 LYS N N 40 118.411 118.411 118.922 -0.511 25485 4143 1 4 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.898 0.740 25485 4144 1 4 . 1 1 40 40 LYS C C 40 179.329 179.329 178.330 0.999 25485 4145 1 4 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.238 -0.105 25485 4146 1 4 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.291 -0.506 25485 4147 1 4 . 1 1 40 40 LYS H H 40 8.227 8.227 7.622 0.605 25485 4148 1 4 . 1 1 41 41 GLU N N 41 121.329 121.329 118.690 2.639 25485 4149 1 4 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.113 -0.020 25485 4150 1 4 . 1 1 41 41 GLU C C 41 178.989 178.989 179.044 -0.055 25485 4151 1 4 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.041 0.719 25485 4152 1 4 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.929 0.907 25485 4153 1 4 . 1 1 41 41 GLU H H 41 7.718 7.718 7.671 0.047 25485 4154 1 4 . 1 1 42 42 MET N N 42 123.817 123.817 120.436 3.381 25485 4155 1 4 . 1 1 42 42 MET HA H 42 4.107 4.107 4.503 -0.396 25485 4156 1 4 . 1 1 42 42 MET C C 42 177.719 177.719 178.189 -0.470 25485 4157 1 4 . 1 1 42 42 MET CA C 42 59.912 59.912 58.012 1.900 25485 4158 1 4 . 1 1 42 42 MET CB C 42 30.506 30.506 32.440 -1.934 25485 4159 1 4 . 1 1 42 42 MET H H 42 7.657 7.657 7.573 0.084 25485 4160 1 4 . 1 1 43 43 GLN N N 43 119.998 119.998 118.528 1.470 25485 4161 1 4 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.119 -0.314 25485 4162 1 4 . 1 1 43 43 GLN C C 43 177.604 177.604 178.997 -1.393 25485 4163 1 4 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.823 1.142 25485 4164 1 4 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.689 -1.134 25485 4165 1 4 . 1 1 43 43 GLN H H 43 8.910 8.910 7.931 0.979 25485 4166 1 4 . 1 1 44 44 LYS N N 44 119.165 119.165 119.184 -0.019 25485 4167 1 4 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.249 -0.194 25485 4168 1 4 . 1 1 44 44 LYS C C 44 179.991 179.991 178.756 1.235 25485 4169 1 4 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.423 1.138 25485 4170 1 4 . 1 1 44 44 LYS CB C 44 32.298 32.298 31.970 0.328 25485 4171 1 4 . 1 1 44 44 LYS H H 44 8.507 8.507 7.604 0.903 25485 4172 1 4 . 1 1 45 45 PHE N N 45 123.602 123.602 120.522 3.080 25485 4173 1 4 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.287 -0.386 25485 4174 1 4 . 1 1 45 45 PHE C C 45 177.606 177.606 176.610 0.996 25485 4175 1 4 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.969 2.065 25485 4176 1 4 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.316 0.550 25485 4177 1 4 . 1 1 45 45 PHE H H 45 8.445 8.445 7.574 0.871 25485 4178 1 4 . 1 1 46 46 PHE N N 46 112.715 112.715 115.593 -2.878 25485 4179 1 4 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.557 0.040 25485 4180 1 4 . 1 1 46 46 PHE C C 46 175.285 175.285 177.408 -2.123 25485 4181 1 4 . 1 1 46 46 PHE CA C 46 60.675 60.675 60.627 0.048 25485 4182 1 4 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.593 -1.134 25485 4183 1 4 . 1 1 46 46 PHE H H 46 8.272 8.272 8.303 -0.031 25485 4184 1 4 . 1 1 47 47 GLY N N 47 110.438 110.438 107.229 3.209 25485 4185 1 4 . 1 1 47 47 GLY C C 47 174.935 174.935 174.359 0.576 25485 4186 1 4 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.300 1.711 25485 4187 1 4 . 1 1 47 47 GLY H H 47 7.926 7.926 8.535 -0.609 25485 4188 1 4 . 1 1 48 48 LEU N N 48 121.830 121.830 119.294 2.536 25485 4189 1 4 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.654 0.270 25485 4190 1 4 . 1 1 48 48 LEU C C 48 174.009 174.009 176.052 -2.043 25485 4191 1 4 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.717 -1.882 25485 4192 1 4 . 1 1 48 48 LEU CB C 48 41.463 41.463 41.001 0.462 25485 4193 1 4 . 1 1 48 48 LEU H H 48 8.762 8.762 7.670 1.092 25485 4194 1 4 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.396 -0.158 25485 4195 1 4 . 1 1 49 49 PRO C C 49 176.874 176.874 176.953 -0.079 25485 4196 1 4 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.841 -0.323 25485 4197 1 4 . 1 1 49 49 PRO CB C 49 31.079 31.079 32.014 -0.935 25485 4198 1 4 . 1 1 50 50 ILE N N 50 126.859 126.859 117.304 9.555 25485 4199 1 4 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.022 0.079 25485 4200 1 4 . 1 1 50 50 ILE C C 50 176.540 176.540 175.370 1.170 25485 4201 1 4 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.080 -1.124 25485 4202 1 4 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.007 -0.614 25485 4203 1 4 . 1 1 50 50 ILE H H 50 8.548 8.548 7.947 0.601 25485 4204 1 4 . 1 1 51 51 THR N N 51 116.443 116.443 118.168 -1.725 25485 4205 1 4 . 1 1 51 51 THR HA H 51 4.584 4.584 4.522 0.062 25485 4206 1 4 . 1 1 51 51 THR C C 51 176.672 176.672 175.269 1.403 25485 4207 1 4 . 1 1 51 51 THR CA C 51 60.979 60.979 60.848 0.131 25485 4208 1 4 . 1 1 51 51 THR CB C 51 71.505 71.505 70.569 0.936 25485 4209 1 4 . 1 1 51 51 THR H H 51 8.001 8.001 7.816 0.185 25485 4210 1 4 . 1 1 52 52 GLY N N 52 112.719 112.719 110.302 2.417 25485 4211 1 4 . 1 1 52 52 GLY C C 52 170.609 170.609 174.507 -3.898 25485 4212 1 4 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.786 0.960 25485 4213 1 4 . 1 1 52 52 GLY H H 52 9.499 9.499 8.487 1.012 25485 4214 1 4 . 1 1 53 53 MET N N 53 116.621 116.621 119.306 -2.685 25485 4215 1 4 . 1 1 53 53 MET HA H 53 4.023 4.023 4.560 -0.537 25485 4216 1 4 . 1 1 53 53 MET C C 53 174.695 174.695 174.662 0.033 25485 4217 1 4 . 1 1 53 53 MET CA C 53 53.460 53.460 54.858 -1.397 25485 4218 1 4 . 1 1 53 53 MET CB C 53 35.408 35.408 34.580 0.828 25485 4219 1 4 . 1 1 53 53 MET H H 53 7.993 7.993 7.565 0.428 25485 4220 1 4 . 1 1 54 54 LEU N N 54 122.679 122.679 122.575 0.104 25485 4221 1 4 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.431 -0.680 25485 4222 1 4 . 1 1 54 54 LEU C C 54 174.784 174.784 174.522 0.262 25485 4223 1 4 . 1 1 54 54 LEU CA C 54 55.301 55.301 56.037 -0.736 25485 4224 1 4 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.983 -0.973 25485 4225 1 4 . 1 1 54 54 LEU H H 54 7.940 7.940 8.347 -0.407 25485 4226 1 4 . 1 1 55 55 ASN N N 55 115.797 115.797 118.236 -2.439 25485 4227 1 4 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.709 0.040 25485 4228 1 4 . 1 1 55 55 ASN C C 55 175.459 175.459 174.969 0.490 25485 4229 1 4 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.892 -2.049 25485 4230 1 4 . 1 1 55 55 ASN CB C 55 40.357 40.357 39.013 1.344 25485 4231 1 4 . 1 1 55 55 ASN H H 55 6.543 6.543 8.305 -1.762 25485 4232 1 4 . 1 1 56 56 SER N N 56 121.507 121.507 115.137 6.370 25485 4233 1 4 . 1 1 56 56 SER HA H 56 4.638 4.638 4.341 0.297 25485 4234 1 4 . 1 1 56 56 SER C C 56 175.727 175.727 175.893 -0.166 25485 4235 1 4 . 1 1 56 56 SER CA C 56 57.932 57.932 60.059 -2.127 25485 4236 1 4 . 1 1 56 56 SER CB C 56 63.786 63.786 63.483 0.303 25485 4237 1 4 . 1 1 56 56 SER H H 56 8.213 8.213 8.043 0.170 25485 4238 1 4 . 1 1 57 57 ARG N N 57 122.951 122.951 123.272 -0.321 25485 4239 1 4 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.240 -0.039 25485 4240 1 4 . 1 1 57 57 ARG C C 57 178.560 178.560 177.942 0.618 25485 4241 1 4 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.391 0.041 25485 4242 1 4 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.673 -0.568 25485 4243 1 4 . 1 1 57 57 ARG H H 57 7.895 7.895 8.787 -0.892 25485 4244 1 4 . 1 1 58 58 VAL N N 58 118.778 118.778 119.534 -0.756 25485 4245 1 4 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.547 -0.216 25485 4246 1 4 . 1 1 58 58 VAL C C 58 177.370 177.370 177.720 -0.350 25485 4247 1 4 . 1 1 58 58 VAL CA C 58 66.382 66.382 65.677 0.705 25485 4248 1 4 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.628 0.581 25485 4249 1 4 . 1 1 58 58 VAL H H 58 7.583 7.583 7.961 -0.378 25485 4250 1 4 . 1 1 59 59 ILE N N 59 119.159 119.159 117.275 1.884 25485 4251 1 4 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.582 -0.169 25485 4252 1 4 . 1 1 59 59 ILE C C 59 177.067 177.067 177.812 -0.745 25485 4253 1 4 . 1 1 59 59 ILE CA C 59 63.633 63.633 62.963 0.670 25485 4254 1 4 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.772 -0.076 25485 4255 1 4 . 1 1 59 59 ILE H H 59 7.323 7.323 7.882 -0.559 25485 4256 1 4 . 1 1 60 60 GLU N N 60 119.367 119.367 120.135 -0.768 25485 4257 1 4 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.883 -0.145 25485 4258 1 4 . 1 1 60 60 GLU C C 60 179.978 179.978 179.022 0.956 25485 4259 1 4 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.765 -0.507 25485 4260 1 4 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.551 -0.163 25485 4261 1 4 . 1 1 60 60 GLU H H 60 7.879 7.879 7.450 0.429 25485 4262 1 4 . 1 1 61 61 ILE N N 61 118.816 118.816 114.969 3.847 25485 4263 1 4 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.834 -0.395 25485 4264 1 4 . 1 1 61 61 ILE C C 61 179.033 179.033 176.371 2.662 25485 4265 1 4 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.440 0.398 25485 4266 1 4 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.895 -0.996 25485 4267 1 4 . 1 1 61 61 ILE H H 61 7.246 7.246 7.429 -0.183 25485 4268 1 4 . 1 1 62 62 MET N N 62 119.986 119.986 114.916 5.070 25485 4269 1 4 . 1 1 62 62 MET HA H 62 3.444 3.444 4.308 -0.864 25485 4270 1 4 . 1 1 62 62 MET C C 62 176.185 176.185 177.737 -1.552 25485 4271 1 4 . 1 1 62 62 MET CA C 62 59.014 59.014 56.580 2.434 25485 4272 1 4 . 1 1 62 62 MET CB C 62 31.250 31.250 32.123 -0.873 25485 4273 1 4 . 1 1 62 62 MET H H 62 7.835 7.835 7.357 0.478 25485 4274 1 4 . 1 1 63 63 GLN N N 63 116.163 116.163 114.929 1.234 25485 4275 1 4 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.277 0.001 25485 4276 1 4 . 1 1 63 63 GLN C C 63 176.727 176.727 176.708 0.019 25485 4277 1 4 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.537 -0.399 25485 4278 1 4 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.304 -0.238 25485 4279 1 4 . 1 1 63 63 GLN H H 63 7.454 7.454 7.339 0.115 25485 4280 1 4 . 1 1 64 64 LYS N N 64 121.430 121.430 122.205 -0.775 25485 4281 1 4 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.502 0.041 25485 4282 1 4 . 1 1 64 64 LYS C C 64 174.724 174.724 175.008 -0.284 25485 4283 1 4 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.508 1.008 25485 4284 1 4 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.718 -1.121 25485 4285 1 4 . 1 1 64 64 LYS H H 64 7.483 7.483 7.843 -0.360 25485 4286 1 4 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.604 -2.168 25485 4287 1 4 . 1 1 65 65 PRO C C 65 176.158 176.158 176.564 -0.406 25485 4288 1 4 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.104 -0.216 25485 4289 1 4 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.467 -0.634 25485 4290 1 4 . 1 1 66 66 ARG N N 66 112.697 112.697 119.430 -6.733 25485 4291 1 4 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.516 -0.108 25485 4292 1 4 . 1 1 66 66 ARG C C 66 174.478 174.478 174.251 0.227 25485 4293 1 4 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.911 -2.275 25485 4294 1 4 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.276 3.397 25485 4295 1 4 . 1 1 66 66 ARG H H 66 8.146 8.146 8.776 -0.630 25485 4296 1 4 . 1 1 67 67 CYS N N 67 121.740 121.740 115.335 6.405 25485 4297 1 4 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.722 -0.282 25485 4298 1 4 . 1 1 67 67 CYS C C 67 175.659 175.659 174.865 0.794 25485 4299 1 4 . 1 1 67 67 CYS CA C 67 59.195 59.195 56.035 3.160 25485 4300 1 4 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.673 -1.467 25485 4301 1 4 . 1 1 67 67 CYS H H 67 7.757 7.757 7.663 0.094 25485 4302 1 4 . 1 1 68 68 GLY N N 68 116.217 116.217 110.030 6.187 25485 4303 1 4 . 1 1 68 68 GLY C C 68 172.210 172.210 173.838 -1.628 25485 4304 1 4 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.724 1.835 25485 4305 1 4 . 1 1 68 68 GLY H H 68 9.704 9.704 9.021 0.683 25485 4306 1 4 . 1 1 69 69 VAL N N 69 126.372 126.372 120.170 6.202 25485 4307 1 4 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.263 -0.432 25485 4308 1 4 . 1 1 69 69 VAL C C 69 173.538 173.538 174.506 -0.968 25485 4309 1 4 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.512 2.856 25485 4310 1 4 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.286 0.237 25485 4311 1 4 . 1 1 69 69 VAL H H 69 9.113 9.113 7.512 1.601 25485 4312 1 4 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.578 0.372 25485 4313 1 4 . 1 1 70 70 PRO C C 70 175.019 175.019 176.327 -1.308 25485 4314 1 4 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.546 0.802 25485 4315 1 4 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.478 -0.120 25485 4316 1 4 . 1 1 71 71 ASP N N 71 118.986 118.986 118.534 0.452 25485 4317 1 4 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.848 -0.415 25485 4318 1 4 . 1 1 71 71 ASP C C 71 175.166 175.166 175.701 -0.535 25485 4319 1 4 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.607 1.761 25485 4320 1 4 . 1 1 71 71 ASP CB C 71 39.864 39.864 42.664 -2.800 25485 4321 1 4 . 1 1 71 71 ASP H H 71 8.054 8.054 8.246 -0.192 25485 4322 1 4 . 1 1 72 72 VAL N N 72 112.953 112.953 114.842 -1.889 25485 4323 1 4 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.415 -0.119 25485 4324 1 4 . 1 1 72 72 VAL C C 72 174.330 174.330 174.536 -0.206 25485 4325 1 4 . 1 1 72 72 VAL CA C 72 59.645 59.645 61.117 -1.472 25485 4326 1 4 . 1 1 72 72 VAL CB C 72 33.872 33.872 34.767 -0.895 25485 4327 1 4 . 1 1 72 72 VAL H H 72 6.430 6.430 7.491 -1.061 25485 4328 1 4 . 1 1 73 73 ALA N N 73 125.869 125.869 129.373 -3.504 25485 4329 1 4 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.695 -0.390 25485 4330 1 4 . 1 1 73 73 ALA C C 73 177.382 177.382 175.798 1.584 25485 4331 1 4 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.685 0.364 25485 4332 1 4 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.896 -0.945 25485 4333 1 4 . 1 1 73 73 ALA H H 73 8.177 8.177 8.385 -0.208 25485 4334 1 4 . 1 1 74 74 GLU N N 74 120.724 120.724 118.756 1.968 25485 4335 1 4 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.428 -0.325 25485 4336 1 4 . 1 1 74 74 GLU C C 74 176.246 176.246 174.746 1.500 25485 4337 1 4 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.435 0.357 25485 4338 1 4 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.360 -1.575 25485 4339 1 4 . 1 1 74 74 GLU H H 74 8.381 8.381 8.592 -0.211 25485 4340 1 4 . 1 1 75 75 TYR N N 75 121.473 121.473 119.749 1.724 25485 4341 1 4 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.231 0.214 25485 4342 1 4 . 1 1 75 75 TYR C C 75 175.633 175.633 175.114 0.519 25485 4343 1 4 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.925 -0.598 25485 4344 1 4 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.683 -0.270 25485 4345 1 4 . 1 1 75 75 TYR H H 75 8.065 8.065 8.443 -0.378 25485 4346 1 4 . 1 1 76 76 SER N N 76 117.860 117.860 116.583 1.277 25485 4347 1 4 . 1 1 76 76 SER HA H 76 3.886 3.886 4.185 -0.299 25485 4348 1 4 . 1 1 76 76 SER C C 76 173.859 173.859 174.649 -0.790 25485 4349 1 4 . 1 1 76 76 SER CA C 76 58.250 58.250 58.281 -0.031 25485 4350 1 4 . 1 1 76 76 SER CB C 76 64.117 64.117 63.140 0.977 25485 4351 1 4 . 1 1 76 76 SER H H 76 7.748 7.748 8.367 -0.619 25485 4352 1 4 . 1 1 77 77 LEU N N 77 123.789 123.789 121.762 2.027 25485 4353 1 4 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.410 0.736 25485 4354 1 4 . 1 1 77 77 LEU C C 77 176.451 176.451 175.044 1.407 25485 4355 1 4 . 1 1 77 77 LEU CA C 77 55.464 55.464 57.057 -1.593 25485 4356 1 4 . 1 1 77 77 LEU CB C 77 41.957 41.957 41.302 0.655 25485 4357 1 4 . 1 1 77 77 LEU H H 77 7.979 7.979 8.140 -0.161 25485 4358 1 4 . 1 1 78 78 PHE N N 78 119.275 119.275 113.978 5.297 25485 4359 1 4 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.220 0.656 25485 4360 1 4 . 1 1 78 78 PHE C C 78 173.844 173.844 173.578 0.266 25485 4361 1 4 . 1 1 78 78 PHE CA C 78 55.372 55.372 56.738 -1.366 25485 4362 1 4 . 1 1 78 78 PHE CB C 78 39.164 39.164 36.092 3.072 25485 4363 1 4 . 1 1 78 78 PHE H H 78 7.827 7.827 7.937 -0.110 25485 4364 1 4 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.250 0.106 25485 4365 1 4 . 1 1 79 79 PRO C C 79 176.433 176.433 176.170 0.263 25485 4366 1 4 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.365 1.485 25485 4367 1 4 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.602 -0.910 25485 4368 1 4 . 1 1 80 80 ASN N N 80 118.057 118.057 119.027 -0.970 25485 4369 1 4 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.866 -0.219 25485 4370 1 4 . 1 1 80 80 ASN C C 80 174.305 174.305 174.531 -0.226 25485 4371 1 4 . 1 1 80 80 ASN CA C 80 52.860 52.860 52.832 0.028 25485 4372 1 4 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.907 0.676 25485 4373 1 4 . 1 1 80 80 ASN H H 80 8.068 8.068 8.483 -0.415 25485 4374 1 4 . 1 1 81 81 SER HA H 81 4.565 4.565 4.243 0.322 25485 4375 1 4 . 1 1 81 81 SER CA C 81 56.800 56.800 58.382 -1.582 25485 4376 1 4 . 1 1 81 81 SER CB C 81 63.128 63.128 62.753 0.375 25485 4377 1 4 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.303 0.158 25485 4378 1 4 . 1 1 82 82 PRO C C 82 174.589 174.589 176.317 -1.728 25485 4379 1 4 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.587 -0.941 25485 4380 1 4 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.096 -0.842 25485 4381 1 4 . 1 1 83 83 LYS N N 83 114.578 114.578 118.964 -4.386 25485 4382 1 4 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.272 -0.119 25485 4383 1 4 . 1 1 83 83 LYS C C 83 175.308 175.308 177.034 -1.726 25485 4384 1 4 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.714 -1.307 25485 4385 1 4 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.338 1.080 25485 4386 1 4 . 1 1 83 83 LYS H H 83 7.356 7.356 7.537 -0.181 25485 4387 1 4 . 1 1 84 84 TRP N N 84 122.455 122.455 120.097 2.358 25485 4388 1 4 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.539 -0.519 25485 4389 1 4 . 1 1 84 84 TRP C C 84 177.636 177.636 178.141 -0.505 25485 4390 1 4 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.714 -1.243 25485 4391 1 4 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.968 0.350 25485 4392 1 4 . 1 1 84 84 TRP H H 84 8.050 8.050 8.454 -0.404 25485 4393 1 4 . 1 1 85 85 THR N N 85 113.501 113.501 116.985 -3.484 25485 4394 1 4 . 1 1 85 85 THR HA H 85 4.573 4.573 4.403 0.170 25485 4395 1 4 . 1 1 85 85 THR C C 85 174.757 174.757 175.214 -0.457 25485 4396 1 4 . 1 1 85 85 THR CA C 85 62.130 62.130 62.027 0.103 25485 4397 1 4 . 1 1 85 85 THR CB C 85 69.107 69.107 69.591 -0.484 25485 4398 1 4 . 1 1 85 85 THR H H 85 8.861 8.861 8.793 0.068 25485 4399 1 4 . 1 1 86 86 SER N N 86 117.270 117.270 119.065 -1.795 25485 4400 1 4 . 1 1 86 86 SER HA H 86 4.741 4.741 4.587 0.154 25485 4401 1 4 . 1 1 86 86 SER C C 86 173.457 173.457 174.649 -1.192 25485 4402 1 4 . 1 1 86 86 SER CA C 86 56.739 56.739 58.925 -2.186 25485 4403 1 4 . 1 1 86 86 SER CB C 86 64.717 64.717 64.339 0.378 25485 4404 1 4 . 1 1 86 86 SER H H 86 7.743 7.743 8.311 -0.568 25485 4405 1 4 . 1 1 87 87 LYS N N 87 120.329 120.329 119.520 0.809 25485 4406 1 4 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.390 -0.161 25485 4407 1 4 . 1 1 87 87 LYS CA C 87 57.592 57.592 56.561 1.031 25485 4408 1 4 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.969 -0.846 25485 4409 1 4 . 1 1 87 87 LYS H H 87 8.285 8.285 8.378 -0.093 25485 4410 1 4 . 1 1 88 88 VAL N N 88 117.531 117.531 117.370 0.161 25485 4411 1 4 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.441 0.214 25485 4412 1 4 . 1 1 88 88 VAL C C 88 174.868 174.868 173.657 1.211 25485 4413 1 4 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.397 -0.302 25485 4414 1 4 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.526 -1.831 25485 4415 1 4 . 1 1 88 88 VAL H H 88 7.428 7.428 7.251 0.177 25485 4416 1 4 . 1 1 89 89 VAL N N 89 131.452 131.452 126.675 4.777 25485 4417 1 4 . 1 1 89 89 VAL HA H 89 4.159 4.159 3.907 0.252 25485 4418 1 4 . 1 1 89 89 VAL C C 89 175.758 175.758 174.899 0.859 25485 4419 1 4 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.055 0.666 25485 4420 1 4 . 1 1 89 89 VAL CB C 89 34.173 34.173 33.234 0.939 25485 4421 1 4 . 1 1 89 89 VAL H H 89 8.603 8.603 8.349 0.254 25485 4422 1 4 . 1 1 90 90 THR N N 90 118.206 118.206 117.521 0.685 25485 4423 1 4 . 1 1 90 90 THR HA H 90 5.649 5.649 5.352 0.297 25485 4424 1 4 . 1 1 90 90 THR C C 90 174.579 174.579 173.894 0.685 25485 4425 1 4 . 1 1 90 90 THR CA C 90 58.959 58.959 59.591 -0.632 25485 4426 1 4 . 1 1 90 90 THR CB C 90 72.288 72.288 72.256 0.032 25485 4427 1 4 . 1 1 90 90 THR H H 90 9.021 9.021 7.935 1.086 25485 4428 1 4 . 1 1 91 91 TYR N N 91 118.117 118.117 116.267 1.850 25485 4429 1 4 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.654 0.044 25485 4430 1 4 . 1 1 91 91 TYR C C 91 171.233 171.233 172.772 -1.539 25485 4431 1 4 . 1 1 91 91 TYR CA C 91 55.432 55.432 56.066 -0.634 25485 4432 1 4 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.309 0.951 25485 4433 1 4 . 1 1 91 91 TYR H H 91 8.555 8.555 8.332 0.223 25485 4434 1 4 . 1 1 92 92 ARG N N 92 120.252 120.252 119.808 0.444 25485 4435 1 4 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.639 0.058 25485 4436 1 4 . 1 1 92 92 ARG C C 92 173.932 173.932 174.382 -0.450 25485 4437 1 4 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.743 0.098 25485 4438 1 4 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.644 0.042 25485 4439 1 4 . 1 1 92 92 ARG H H 92 8.520 8.520 9.091 -0.571 25485 4440 1 4 . 1 1 93 93 ILE N N 93 128.305 128.305 127.559 0.746 25485 4441 1 4 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.466 0.166 25485 4442 1 4 . 1 1 93 93 ILE C C 93 175.468 175.468 176.224 -0.756 25485 4443 1 4 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.321 0.907 25485 4444 1 4 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.828 0.397 25485 4445 1 4 . 1 1 93 93 ILE H H 93 8.886 8.886 8.828 0.058 25485 4446 1 4 . 1 1 94 94 VAL N N 94 126.647 126.647 128.194 -1.547 25485 4447 1 4 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.193 -0.197 25485 4448 1 4 . 1 1 94 94 VAL C C 94 175.670 175.670 176.457 -0.787 25485 4449 1 4 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.023 0.391 25485 4450 1 4 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.377 0.642 25485 4451 1 4 . 1 1 94 94 VAL H H 94 9.517 9.517 8.630 0.887 25485 4452 1 4 . 1 1 95 95 SER N N 95 113.398 113.398 113.261 0.137 25485 4453 1 4 . 1 1 95 95 SER HA H 95 4.701 4.701 4.747 -0.046 25485 4454 1 4 . 1 1 95 95 SER C C 95 170.684 170.684 172.836 -2.152 25485 4455 1 4 . 1 1 95 95 SER CA C 95 56.945 56.945 57.077 -0.132 25485 4456 1 4 . 1 1 95 95 SER CB C 95 65.276 65.276 65.015 0.261 25485 4457 1 4 . 1 1 95 95 SER H H 95 7.463 7.463 7.614 -0.151 25485 4458 1 4 . 1 1 96 96 TYR N N 96 116.512 116.512 120.037 -3.525 25485 4459 1 4 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.672 -0.408 25485 4460 1 4 . 1 1 96 96 TYR C C 96 174.856 174.856 174.617 0.239 25485 4461 1 4 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.240 2.397 25485 4462 1 4 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.766 1.397 25485 4463 1 4 . 1 1 96 96 TYR H H 96 8.240 8.240 8.251 -0.011 25485 4464 1 4 . 1 1 97 97 THR CA C 97 57.798 57.798 60.445 -2.647 25485 4465 1 4 . 1 1 97 97 THR CB C 97 67.420 67.420 69.468 -2.048 25485 4466 1 4 . 1 1 98 98 ARG N N 98 128.156 128.156 123.719 4.437 25485 4467 1 4 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.091 0.234 25485 4468 1 4 . 1 1 98 98 ARG C C 98 177.625 177.625 176.107 1.518 25485 4469 1 4 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.075 -0.861 25485 4470 1 4 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.531 -0.051 25485 4471 1 4 . 1 1 98 98 ARG H H 98 8.914 8.914 8.407 0.507 25485 4472 1 4 . 1 1 99 99 ASP N N 99 120.592 120.592 117.538 3.054 25485 4473 1 4 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.620 -0.239 25485 4474 1 4 . 1 1 99 99 ASP C C 99 175.679 175.679 175.292 0.387 25485 4475 1 4 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.827 1.609 25485 4476 1 4 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.670 0.700 25485 4477 1 4 . 1 1 99 99 ASP H H 99 8.708 8.708 8.154 0.554 25485 4478 1 4 . 1 1 100 100 LEU N N 100 116.829 116.829 119.552 -2.723 25485 4479 1 4 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.683 0.273 25485 4480 1 4 . 1 1 100 100 LEU C C 100 173.335 173.335 174.191 -0.856 25485 4481 1 4 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.981 -0.944 25485 4482 1 4 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.024 2.243 25485 4483 1 4 . 1 1 100 100 LEU H H 100 6.916 6.916 7.154 -0.238 25485 4484 1 4 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.172 0.003 25485 4485 1 4 . 1 1 102 102 HIS C C 102 177.649 177.649 177.543 0.106 25485 4486 1 4 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.162 -0.489 25485 4487 1 4 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.136 -1.702 25485 4488 1 4 . 1 1 103 103 ILE N N 103 115.170 115.170 118.326 -3.156 25485 4489 1 4 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.807 0.366 25485 4490 1 4 . 1 1 103 103 ILE C C 103 177.214 177.214 177.115 0.099 25485 4491 1 4 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.170 -1.005 25485 4492 1 4 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.961 -0.196 25485 4493 1 4 . 1 1 103 103 ILE H H 103 8.234 8.234 8.226 0.008 25485 4494 1 4 . 1 1 104 104 THR N N 104 119.374 119.374 117.307 2.067 25485 4495 1 4 . 1 1 104 104 THR HA H 104 4.045 4.045 3.973 0.072 25485 4496 1 4 . 1 1 104 104 THR C C 104 175.612 175.612 176.171 -0.559 25485 4497 1 4 . 1 1 104 104 THR CA C 104 66.568 66.568 66.997 -0.429 25485 4498 1 4 . 1 1 104 104 THR CB C 104 68.077 68.077 68.824 -0.747 25485 4499 1 4 . 1 1 104 104 THR H H 104 6.947 6.947 7.684 -0.737 25485 4500 1 4 . 1 1 105 105 VAL N N 105 123.263 123.263 121.448 1.815 25485 4501 1 4 . 1 1 105 105 VAL HA H 105 3.438 3.438 2.947 0.491 25485 4502 1 4 . 1 1 105 105 VAL C C 105 177.322 177.322 177.056 0.266 25485 4503 1 4 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.266 0.681 25485 4504 1 4 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.533 -0.264 25485 4505 1 4 . 1 1 105 105 VAL H H 105 7.407 7.407 8.014 -0.607 25485 4506 1 4 . 1 1 106 106 ASP N N 106 119.972 119.972 119.475 0.497 25485 4507 1 4 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.520 -0.198 25485 4508 1 4 . 1 1 106 106 ASP C C 106 179.747 179.747 178.392 1.355 25485 4509 1 4 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.170 1.065 25485 4510 1 4 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.960 -0.598 25485 4511 1 4 . 1 1 106 106 ASP H H 106 8.627 8.627 7.807 0.820 25485 4512 1 4 . 1 1 107 107 ARG N N 107 121.033 121.033 119.005 2.028 25485 4513 1 4 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.107 0.071 25485 4514 1 4 . 1 1 107 107 ARG C C 107 179.485 179.485 178.450 1.035 25485 4515 1 4 . 1 1 107 107 ARG CA C 107 59.580 59.580 59.110 0.470 25485 4516 1 4 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.778 0.430 25485 4517 1 4 . 1 1 107 107 ARG H H 107 8.356 8.356 8.018 0.338 25485 4518 1 4 . 1 1 108 108 LEU N N 108 121.463 121.463 120.942 0.521 25485 4519 1 4 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.201 0.104 25485 4520 1 4 . 1 1 108 108 LEU C C 108 178.852 178.852 178.922 -0.070 25485 4521 1 4 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.577 0.305 25485 4522 1 4 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.236 0.079 25485 4523 1 4 . 1 1 108 108 LEU H H 108 8.790 8.790 7.983 0.807 25485 4524 1 4 . 1 1 109 109 VAL N N 109 120.233 120.233 117.175 3.058 25485 4525 1 4 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.751 -0.351 25485 4526 1 4 . 1 1 109 109 VAL C C 109 177.019 177.019 177.717 -0.698 25485 4527 1 4 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.297 1.749 25485 4528 1 4 . 1 1 109 109 VAL CB C 109 31.189 31.189 30.555 0.634 25485 4529 1 4 . 1 1 109 109 VAL H H 109 8.787 8.787 7.745 1.042 25485 4530 1 4 . 1 1 110 110 SER N N 110 112.862 112.862 116.005 -3.143 25485 4531 1 4 . 1 1 110 110 SER HA H 110 4.300 4.300 3.898 0.402 25485 4532 1 4 . 1 1 110 110 SER C C 110 176.770 176.770 176.734 0.036 25485 4533 1 4 . 1 1 110 110 SER CA C 110 61.744 61.744 61.608 0.136 25485 4534 1 4 . 1 1 110 110 SER CB C 110 62.742 62.742 62.710 0.032 25485 4535 1 4 . 1 1 110 110 SER H H 110 7.605 7.605 7.841 -0.236 25485 4536 1 4 . 1 1 111 111 LYS N N 111 122.319 122.319 121.933 0.386 25485 4537 1 4 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.022 0.039 25485 4538 1 4 . 1 1 111 111 LYS C C 111 178.309 178.309 178.365 -0.056 25485 4539 1 4 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.190 0.624 25485 4540 1 4 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.542 -0.033 25485 4541 1 4 . 1 1 111 111 LYS H H 111 8.156 8.156 8.040 0.116 25485 4542 1 4 . 1 1 112 112 ALA N N 112 124.147 124.147 120.788 3.359 25485 4543 1 4 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.355 -0.256 25485 4544 1 4 . 1 1 112 112 ALA C C 112 179.445 179.445 179.218 0.227 25485 4545 1 4 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.210 1.016 25485 4546 1 4 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.078 0.896 25485 4547 1 4 . 1 1 112 112 ALA H H 112 8.278 8.278 7.469 0.809 25485 4548 1 4 . 1 1 113 113 LEU N N 113 116.195 116.195 120.153 -3.958 25485 4549 1 4 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.074 -0.323 25485 4550 1 4 . 1 1 113 113 LEU C C 113 179.537 179.537 177.790 1.747 25485 4551 1 4 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.920 -0.177 25485 4552 1 4 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.947 -1.392 25485 4553 1 4 . 1 1 113 113 LEU H H 113 8.021 8.021 8.527 -0.506 25485 4554 1 4 . 1 1 114 114 ASN N N 114 116.570 116.570 117.438 -0.868 25485 4555 1 4 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.004 0.542 25485 4556 1 4 . 1 1 114 114 ASN C C 114 177.136 177.136 177.198 -0.062 25485 4557 1 4 . 1 1 114 114 ASN CA C 114 55.764 55.764 55.548 0.216 25485 4558 1 4 . 1 1 114 114 ASN CB C 114 38.623 38.623 37.992 0.631 25485 4559 1 4 . 1 1 114 114 ASN H H 114 8.212 8.212 8.100 0.112 25485 4560 1 4 . 1 1 115 115 MET N N 115 122.055 122.055 118.914 3.141 25485 4561 1 4 . 1 1 115 115 MET HA H 115 4.010 4.010 3.950 0.060 25485 4562 1 4 . 1 1 115 115 MET C C 115 177.681 177.681 177.656 0.025 25485 4563 1 4 . 1 1 115 115 MET CA C 115 59.445 59.445 59.104 0.341 25485 4564 1 4 . 1 1 115 115 MET CB C 115 31.616 31.616 32.181 -0.565 25485 4565 1 4 . 1 1 115 115 MET H H 115 7.937 7.937 7.484 0.453 25485 4566 1 4 . 1 1 116 116 TRP N N 116 117.115 117.115 118.681 -1.566 25485 4567 1 4 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.254 0.264 25485 4568 1 4 . 1 1 116 116 TRP C C 116 179.054 179.054 179.278 -0.224 25485 4569 1 4 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.041 0.470 25485 4570 1 4 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.299 1.574 25485 4571 1 4 . 1 1 116 116 TRP H H 116 6.783 6.783 7.263 -0.480 25485 4572 1 4 . 1 1 117 117 GLY N N 117 104.511 104.511 106.666 -2.155 25485 4573 1 4 . 1 1 117 117 GLY C C 117 175.035 175.035 176.103 -1.068 25485 4574 1 4 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.797 0.200 25485 4575 1 4 . 1 1 117 117 GLY H H 117 9.302 9.302 7.584 1.718 25485 4576 1 4 . 1 1 118 118 LYS N N 118 118.580 118.580 119.676 -1.096 25485 4577 1 4 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.063 0.144 25485 4578 1 4 . 1 1 118 118 LYS C C 118 177.235 177.235 177.393 -0.158 25485 4579 1 4 . 1 1 118 118 LYS CA C 118 57.891 57.891 58.030 -0.139 25485 4580 1 4 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.422 -0.517 25485 4581 1 4 . 1 1 118 118 LYS H H 118 7.940 7.940 7.753 0.187 25485 4582 1 4 . 1 1 119 119 GLU N N 119 113.749 113.749 116.807 -3.058 25485 4583 1 4 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.451 0.387 25485 4584 1 4 . 1 1 119 119 GLU C C 119 178.024 178.024 175.688 2.336 25485 4585 1 4 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.659 -0.384 25485 4586 1 4 . 1 1 119 119 GLU CB C 119 30.686 30.686 30.028 0.658 25485 4587 1 4 . 1 1 119 119 GLU H H 119 7.763 7.763 7.676 0.087 25485 4588 1 4 . 1 1 120 120 ILE N N 120 111.144 111.144 113.201 -2.057 25485 4589 1 4 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.741 0.630 25485 4590 1 4 . 1 1 120 120 ILE C C 120 174.033 174.033 173.568 0.465 25485 4591 1 4 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.563 0.891 25485 4592 1 4 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.607 2.322 25485 4593 1 4 . 1 1 120 120 ILE H H 120 7.518 7.518 7.574 -0.056 25485 4594 1 4 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.402 0.260 25485 4595 1 4 . 1 1 121 121 PRO C C 121 174.784 174.784 177.010 -2.226 25485 4596 1 4 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.629 -1.614 25485 4597 1 4 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.769 -2.384 25485 4598 1 4 . 1 1 122 122 LEU N N 122 121.531 121.531 119.697 1.834 25485 4599 1 4 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.188 0.151 25485 4600 1 4 . 1 1 122 122 LEU C C 122 173.977 173.977 176.539 -2.562 25485 4601 1 4 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.615 -1.057 25485 4602 1 4 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.790 2.609 25485 4603 1 4 . 1 1 122 122 LEU H H 122 6.847 6.847 7.691 -0.844 25485 4604 1 4 . 1 1 123 123 HIS N N 123 121.054 121.054 115.607 5.447 25485 4605 1 4 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.807 -0.200 25485 4606 1 4 . 1 1 123 123 HIS C C 123 172.820 172.820 173.366 -0.546 25485 4607 1 4 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.566 -1.057 25485 4608 1 4 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.709 0.401 25485 4609 1 4 . 1 1 123 123 HIS H H 123 7.760 7.760 8.241 -0.481 25485 4610 1 4 . 1 1 124 124 PHE N N 124 120.465 120.465 121.763 -1.298 25485 4611 1 4 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.302 0.532 25485 4612 1 4 . 1 1 124 124 PHE C C 124 175.677 175.677 175.003 0.674 25485 4613 1 4 . 1 1 124 124 PHE CA C 124 56.292 56.292 56.939 -0.647 25485 4614 1 4 . 1 1 124 124 PHE CB C 124 41.822 41.822 42.761 -0.940 25485 4615 1 4 . 1 1 124 124 PHE H H 124 8.306 8.306 8.504 -0.198 25485 4616 1 4 . 1 1 125 125 ARG N N 125 124.008 124.008 123.193 0.815 25485 4617 1 4 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.872 -0.161 25485 4618 1 4 . 1 1 125 125 ARG C C 125 172.901 172.901 175.103 -2.202 25485 4619 1 4 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.818 -0.544 25485 4620 1 4 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.511 -0.689 25485 4621 1 4 . 1 1 125 125 ARG H H 125 8.426 8.426 8.638 -0.212 25485 4622 1 4 . 1 1 126 126 LYS N N 126 130.004 130.004 125.149 4.855 25485 4623 1 4 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.254 -0.871 25485 4624 1 4 . 1 1 126 126 LYS C C 126 176.126 176.126 175.556 0.570 25485 4625 1 4 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.915 0.266 25485 4626 1 4 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.097 -0.070 25485 4627 1 4 . 1 1 126 126 LYS H H 126 8.481 8.481 8.532 -0.051 25485 4628 1 4 . 1 1 127 127 VAL N N 127 125.288 125.288 120.894 4.394 25485 4629 1 4 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.226 0.279 25485 4630 1 4 . 1 1 127 127 VAL C C 127 175.565 175.565 175.365 0.200 25485 4631 1 4 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.410 -1.461 25485 4632 1 4 . 1 1 127 127 VAL CB C 127 34.362 34.362 33.262 1.100 25485 4633 1 4 . 1 1 127 127 VAL H H 127 8.721 8.721 7.928 0.793 25485 4634 1 4 . 1 1 128 128 VAL N N 128 117.467 117.467 117.906 -0.439 25485 4635 1 4 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.060 0.269 25485 4636 1 4 . 1 1 128 128 VAL C C 128 174.622 174.622 174.448 0.174 25485 4637 1 4 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.434 0.684 25485 4638 1 4 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.942 0.567 25485 4639 1 4 . 1 1 128 128 VAL H H 128 8.406 8.406 7.909 0.497 25485 4640 1 4 . 1 1 129 129 TRP N N 129 119.986 119.986 121.448 -1.462 25485 4641 1 4 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.882 -0.166 25485 4642 1 4 . 1 1 129 129 TRP C C 129 174.536 174.536 176.440 -1.904 25485 4643 1 4 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.874 -0.957 25485 4644 1 4 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.644 2.370 25485 4645 1 4 . 1 1 129 129 TRP H H 129 7.435 7.435 7.378 0.057 25485 4646 1 4 . 1 1 130 130 GLY N N 130 109.900 109.900 112.838 -2.938 25485 4647 1 4 . 1 1 130 130 GLY C C 130 173.187 173.187 173.868 -0.681 25485 4648 1 4 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.480 0.000 25485 4649 1 4 . 1 1 130 130 GLY H H 130 8.006 8.006 8.439 -0.433 25485 4650 1 4 . 1 1 131 131 THR N N 131 116.142 116.142 114.862 1.280 25485 4651 1 4 . 1 1 131 131 THR HA H 131 4.162 4.162 4.474 -0.312 25485 4652 1 4 . 1 1 131 131 THR C C 131 172.766 172.766 173.343 -0.577 25485 4653 1 4 . 1 1 131 131 THR CA C 131 63.212 63.212 61.200 2.012 25485 4654 1 4 . 1 1 131 131 THR CB C 131 69.308 69.308 70.365 -1.057 25485 4655 1 4 . 1 1 131 131 THR H H 131 8.233 8.233 8.090 0.143 25485 4656 1 4 . 1 1 132 132 ALA N N 132 129.807 129.807 123.938 5.869 25485 4657 1 4 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.460 0.056 25485 4658 1 4 . 1 1 132 132 ALA C C 132 175.358 175.358 176.207 -0.849 25485 4659 1 4 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.781 -1.415 25485 4660 1 4 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.291 1.507 25485 4661 1 4 . 1 1 132 132 ALA H H 132 7.962 7.962 8.508 -0.546 25485 4662 1 4 . 1 1 133 133 ASP N N 133 122.896 122.896 120.190 2.706 25485 4663 1 4 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.593 -0.172 25485 4664 1 4 . 1 1 133 133 ASP C C 133 177.314 177.314 176.950 0.364 25485 4665 1 4 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.916 1.003 25485 4666 1 4 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.559 -1.088 25485 4667 1 4 . 1 1 133 133 ASP H H 133 8.251 8.251 8.184 0.067 25485 4668 1 4 . 1 1 134 134 ILE N N 134 125.472 125.472 120.807 4.665 25485 4669 1 4 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.414 -0.271 25485 4670 1 4 . 1 1 134 134 ILE C C 134 174.201 174.201 175.139 -0.938 25485 4671 1 4 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.466 -0.195 25485 4672 1 4 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.132 -0.422 25485 4673 1 4 . 1 1 134 134 ILE H H 134 8.802 8.802 8.187 0.615 25485 4674 1 4 . 1 1 135 135 MET N N 135 127.265 127.265 126.335 0.930 25485 4675 1 4 . 1 1 135 135 MET HA H 135 5.192 5.192 5.474 -0.282 25485 4676 1 4 . 1 1 135 135 MET C C 135 176.206 176.206 175.669 0.537 25485 4677 1 4 . 1 1 135 135 MET CA C 135 53.626 53.626 52.370 1.256 25485 4678 1 4 . 1 1 135 135 MET CB C 135 32.639 32.639 33.866 -1.227 25485 4679 1 4 . 1 1 135 135 MET H H 135 7.418 7.418 8.384 -0.966 25485 4680 1 4 . 1 1 136 136 ILE N N 136 125.440 125.440 124.224 1.216 25485 4681 1 4 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.906 0.683 25485 4682 1 4 . 1 1 136 136 ILE C C 136 175.190 175.190 175.876 -0.686 25485 4683 1 4 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.995 1.113 25485 4684 1 4 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.713 4.227 25485 4685 1 4 . 1 1 136 136 ILE H H 136 9.124 9.124 9.072 0.052 25485 4686 1 4 . 1 1 137 137 GLY N N 137 112.211 112.211 114.468 -2.257 25485 4687 1 4 . 1 1 137 137 GLY C C 137 170.855 170.855 171.755 -0.900 25485 4688 1 4 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.973 1.432 25485 4689 1 4 . 1 1 137 137 GLY H H 137 8.594 8.594 8.020 0.574 25485 4690 1 4 . 1 1 138 138 PHE N N 138 119.463 119.463 119.415 0.048 25485 4691 1 4 . 1 1 138 138 PHE HA H 138 5.496 5.496 4.916 0.580 25485 4692 1 4 . 1 1 138 138 PHE C C 138 175.186 175.186 175.742 -0.556 25485 4693 1 4 . 1 1 138 138 PHE CA C 138 55.995 55.995 57.864 -1.869 25485 4694 1 4 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.998 -0.556 25485 4695 1 4 . 1 1 138 138 PHE H H 138 7.857 7.857 8.483 -0.626 25485 4696 1 4 . 1 1 139 139 ALA N N 139 123.914 123.914 125.405 -1.491 25485 4697 1 4 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.589 0.142 25485 4698 1 4 . 1 1 139 139 ALA C C 139 174.613 174.613 175.229 -0.616 25485 4699 1 4 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.560 -1.525 25485 4700 1 4 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.897 1.575 25485 4701 1 4 . 1 1 139 139 ALA H H 139 8.955 8.955 8.363 0.592 25485 4702 1 4 . 1 1 140 140 ARG N N 140 118.339 118.339 120.310 -1.971 25485 4703 1 4 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.840 0.266 25485 4704 1 4 . 1 1 140 140 ARG C C 140 176.201 176.201 178.317 -2.116 25485 4705 1 4 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.952 -0.786 25485 4706 1 4 . 1 1 140 140 ARG CB C 140 33.469 33.469 33.008 0.461 25485 4707 1 4 . 1 1 140 140 ARG H H 140 8.546 8.546 8.498 0.048 25485 4708 1 4 . 1 1 141 141 GLY N N 141 108.916 108.916 108.749 0.167 25485 4709 1 4 . 1 1 141 141 GLY C C 141 175.595 175.595 174.869 0.726 25485 4710 1 4 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.279 -0.989 25485 4711 1 4 . 1 1 141 141 GLY H H 141 8.989 8.989 8.954 0.035 25485 4712 1 4 . 1 1 142 142 ALA N N 142 121.448 121.448 121.654 -0.206 25485 4713 1 4 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.481 -0.073 25485 4714 1 4 . 1 1 142 142 ALA C C 142 177.027 177.027 177.722 -0.695 25485 4715 1 4 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.102 1.175 25485 4716 1 4 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.132 -0.168 25485 4717 1 4 . 1 1 142 142 ALA H H 142 8.642 8.642 8.208 0.434 25485 4718 1 4 . 1 1 143 143 HIS N N 143 120.356 120.356 116.162 4.194 25485 4719 1 4 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.440 0.717 25485 4720 1 4 . 1 1 143 143 HIS C C 143 174.303 174.303 176.376 -2.073 25485 4721 1 4 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.698 -1.245 25485 4722 1 4 . 1 1 143 143 HIS CB C 143 27.791 27.791 30.087 -2.296 25485 4723 1 4 . 1 1 143 143 HIS H H 143 8.990 8.990 8.140 0.850 25485 4724 1 4 . 1 1 144 144 GLY N N 144 112.517 112.517 107.411 5.106 25485 4725 1 4 . 1 1 144 144 GLY C C 144 173.758 173.758 172.895 0.863 25485 4726 1 4 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.649 1.446 25485 4727 1 4 . 1 1 144 144 GLY H H 144 5.175 5.175 7.503 -2.328 25485 4728 1 4 . 1 1 145 145 ASP N N 145 117.762 117.762 119.033 -1.271 25485 4729 1 4 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.776 -0.078 25485 4730 1 4 . 1 1 145 145 ASP C C 145 175.851 175.851 174.817 1.034 25485 4731 1 4 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.795 -0.836 25485 4732 1 4 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.729 -0.930 25485 4733 1 4 . 1 1 145 145 ASP H H 145 7.096 7.096 7.505 -0.409 25485 4734 1 4 . 1 1 146 146 SER N N 146 125.540 125.540 114.999 10.541 25485 4735 1 4 . 1 1 146 146 SER HA H 146 4.204 4.204 4.303 -0.099 25485 4736 1 4 . 1 1 146 146 SER C C 146 172.319 172.319 173.717 -1.398 25485 4737 1 4 . 1 1 146 146 SER CA C 146 58.862 58.862 58.529 0.333 25485 4738 1 4 . 1 1 146 146 SER CB C 146 62.933 62.933 63.557 -0.624 25485 4739 1 4 . 1 1 146 146 SER H H 146 8.261 8.261 8.291 -0.030 25485 4740 1 4 . 1 1 147 147 TYR N N 147 120.757 120.757 119.052 1.705 25485 4741 1 4 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.205 0.617 25485 4742 1 4 . 1 1 147 147 TYR C C 147 170.372 170.372 173.660 -3.288 25485 4743 1 4 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.467 -4.199 25485 4744 1 4 . 1 1 147 147 TYR CB C 147 38.296 38.296 38.163 0.133 25485 4745 1 4 . 1 1 147 147 TYR H H 147 7.450 7.450 8.384 -0.934 25485 4746 1 4 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.202 0.670 25485 4747 1 4 . 1 1 148 148 PRO C C 148 179.009 179.009 176.100 2.909 25485 4748 1 4 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.115 1.260 25485 4749 1 4 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.012 -1.103 25485 4750 1 4 . 1 1 149 149 PHE N N 149 120.514 120.514 118.122 2.392 25485 4751 1 4 . 1 1 149 149 PHE C C 149 176.813 176.813 175.894 0.919 25485 4752 1 4 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.407 -0.954 25485 4753 1 4 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.547 0.026 25485 4754 1 4 . 1 1 149 149 PHE H H 149 8.024 8.024 7.466 0.558 25485 4755 1 4 . 1 1 150 150 ASP N N 150 115.555 115.555 116.176 -0.621 25485 4756 1 4 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.285 0.554 25485 4757 1 4 . 1 1 150 150 ASP C C 150 177.007 177.007 176.006 1.001 25485 4758 1 4 . 1 1 150 150 ASP CA C 150 53.871 53.871 55.102 -1.231 25485 4759 1 4 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.341 2.595 25485 4760 1 4 . 1 1 150 150 ASP H H 150 7.511 7.511 7.829 -0.318 25485 4761 1 4 . 1 1 151 151 GLY N N 151 110.650 110.650 109.150 1.500 25485 4762 1 4 . 1 1 151 151 GLY C C 151 170.281 170.281 172.140 -1.859 25485 4763 1 4 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.660 -0.262 25485 4764 1 4 . 1 1 151 151 GLY H H 151 9.080 9.080 8.391 0.689 25485 4765 1 4 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.148 -0.092 25485 4766 1 4 . 1 1 152 152 PRO C C 152 178.300 178.300 176.672 1.628 25485 4767 1 4 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.281 0.569 25485 4768 1 4 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.889 -0.629 25485 4769 1 4 . 1 1 153 153 GLY N N 153 118.783 118.783 113.148 5.635 25485 4770 1 4 . 1 1 153 153 GLY C C 153 174.098 174.098 173.106 0.992 25485 4771 1 4 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.415 -0.809 25485 4772 1 4 . 1 1 153 153 GLY H H 153 11.431 11.431 8.093 3.338 25485 4773 1 4 . 1 1 154 154 ASN N N 154 120.679 120.679 121.772 -1.093 25485 4774 1 4 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.493 -0.249 25485 4775 1 4 . 1 1 154 154 ASN C C 154 174.636 174.636 175.369 -0.733 25485 4776 1 4 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.590 2.078 25485 4777 1 4 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.599 -1.628 25485 4778 1 4 . 1 1 154 154 ASN H H 154 9.247 9.247 8.488 0.759 25485 4779 1 4 . 1 1 155 155 THR N N 155 118.252 118.252 111.852 6.400 25485 4780 1 4 . 1 1 155 155 THR HA H 155 5.577 5.577 4.043 1.534 25485 4781 1 4 . 1 1 155 155 THR C C 155 176.596 176.596 172.873 3.723 25485 4782 1 4 . 1 1 155 155 THR CA C 155 61.731 61.731 62.427 -0.696 25485 4783 1 4 . 1 1 155 155 THR CB C 155 71.325 71.325 68.722 2.603 25485 4784 1 4 . 1 1 155 155 THR H H 155 9.501 9.501 8.431 1.070 25485 4785 1 4 . 1 1 156 156 LEU N N 156 122.598 122.598 124.988 -2.390 25485 4786 1 4 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.450 0.421 25485 4787 1 4 . 1 1 156 156 LEU C C 156 175.655 175.655 175.960 -0.305 25485 4788 1 4 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.286 -0.748 25485 4789 1 4 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.730 1.781 25485 4790 1 4 . 1 1 156 156 LEU H H 156 8.492 8.492 8.395 0.097 25485 4791 1 4 . 1 1 157 157 ALA N N 157 115.389 115.389 115.295 0.094 25485 4792 1 4 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.462 0.573 25485 4793 1 4 . 1 1 157 157 ALA C C 157 175.739 175.739 175.036 0.703 25485 4794 1 4 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.482 -0.543 25485 4795 1 4 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.700 1.754 25485 4796 1 4 . 1 1 157 157 ALA H H 157 7.567 7.567 7.640 -0.073 25485 4797 1 4 . 1 1 158 158 HIS N N 158 111.900 111.900 118.297 -6.397 25485 4798 1 4 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.876 -0.271 25485 4799 1 4 . 1 1 158 158 HIS C C 158 170.186 170.186 172.472 -2.286 25485 4800 1 4 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.099 1.976 25485 4801 1 4 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.801 -1.615 25485 4802 1 4 . 1 1 158 158 HIS H H 158 8.757 8.757 7.910 0.847 25485 4803 1 4 . 1 1 159 159 ALA N N 159 118.286 118.286 126.232 -7.946 25485 4804 1 4 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.027 0.627 25485 4805 1 4 . 1 1 159 159 ALA C C 159 174.036 174.036 175.264 -1.228 25485 4806 1 4 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.374 0.759 25485 4807 1 4 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.715 2.322 25485 4808 1 4 . 1 1 159 159 ALA H H 159 6.110 6.110 8.276 -2.166 25485 4809 1 4 . 1 1 160 160 PHE N N 160 117.937 117.937 117.398 0.539 25485 4810 1 4 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.753 -0.250 25485 4811 1 4 . 1 1 160 160 PHE C C 160 174.455 174.455 174.855 -0.400 25485 4812 1 4 . 1 1 160 160 PHE CA C 160 56.813 56.813 54.431 2.382 25485 4813 1 4 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.336 0.858 25485 4814 1 4 . 1 1 160 160 PHE H H 160 7.912 7.912 7.794 0.118 25485 4815 1 4 . 1 1 161 161 ALA N N 161 123.531 123.531 122.460 1.071 25485 4816 1 4 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.561 -0.070 25485 4817 1 4 . 1 1 161 161 ALA C C 161 175.503 175.503 176.339 -0.836 25485 4818 1 4 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.583 1.050 25485 4819 1 4 . 1 1 161 161 ALA CB C 161 16.556 16.556 18.963 -2.407 25485 4820 1 4 . 1 1 161 161 ALA H H 161 8.107 8.107 8.439 -0.332 25485 4821 1 4 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.387 -0.477 25485 4822 1 4 . 1 1 162 162 PRO C C 162 173.465 173.465 175.444 -1.979 25485 4823 1 4 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.197 2.060 25485 4824 1 4 . 1 1 162 162 PRO CB C 162 31.242 31.242 28.924 2.318 25485 4825 1 4 . 1 1 163 163 GLY N N 163 107.206 107.206 110.286 -3.080 25485 4826 1 4 . 1 1 163 163 GLY C C 163 172.092 172.092 173.174 -1.082 25485 4827 1 4 . 1 1 163 163 GLY CA C 163 43.993 43.993 43.770 0.223 25485 4828 1 4 . 1 1 163 163 GLY H H 163 5.997 5.997 7.782 -1.785 25485 4829 1 4 . 1 1 165 165 GLY N N 165 103.110 103.110 116.018 -12.908 25485 4830 1 4 . 1 1 165 165 GLY C C 165 177.158 177.158 173.874 3.284 25485 4831 1 4 . 1 1 165 165 GLY CA C 165 44.243 44.243 44.621 -0.378 25485 4832 1 4 . 1 1 165 165 GLY H H 165 9.145 9.145 7.575 1.570 25485 4833 1 4 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.280 -0.101 25485 4834 1 4 . 1 1 166 166 LEU C C 166 176.437 176.437 177.100 -0.663 25485 4835 1 4 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.102 0.098 25485 4836 1 4 . 1 1 166 166 LEU CB C 166 41.834 41.834 40.848 0.986 25485 4837 1 4 . 1 1 167 167 GLY N N 167 103.318 103.318 105.975 -2.657 25485 4838 1 4 . 1 1 167 167 GLY C C 167 174.803 174.803 174.717 0.086 25485 4839 1 4 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.779 2.454 25485 4840 1 4 . 1 1 167 167 GLY H H 167 7.768 7.768 7.489 0.279 25485 4841 1 4 . 1 1 168 168 GLY N N 168 121.051 121.051 109.078 11.973 25485 4842 1 4 . 1 1 168 168 GLY C C 168 172.122 172.122 173.711 -1.589 25485 4843 1 4 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.114 1.488 25485 4844 1 4 . 1 1 168 168 GLY H H 168 7.698 7.698 8.066 -0.368 25485 4845 1 4 . 1 1 169 169 ASP N N 169 123.641 123.641 120.892 2.749 25485 4846 1 4 . 1 1 169 169 ASP C C 169 173.942 173.942 173.654 0.288 25485 4847 1 4 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.318 2.524 25485 4848 1 4 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.851 -2.981 25485 4849 1 4 . 1 1 169 169 ASP H H 169 8.595 8.595 7.967 0.628 25485 4850 1 4 . 1 1 170 170 ALA N N 170 119.366 119.366 121.235 -1.869 25485 4851 1 4 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.303 0.427 25485 4852 1 4 . 1 1 170 170 ALA C C 170 174.593 174.593 175.091 -0.498 25485 4853 1 4 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.708 0.416 25485 4854 1 4 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.151 1.184 25485 4855 1 4 . 1 1 170 170 ALA H H 170 8.324 8.324 8.548 -0.224 25485 4856 1 4 . 1 1 171 171 HIS N N 171 120.239 120.239 121.020 -0.781 25485 4857 1 4 . 1 1 171 171 HIS HA H 171 5.748 5.748 4.883 0.865 25485 4858 1 4 . 1 1 171 171 HIS C C 171 172.949 172.949 173.621 -0.672 25485 4859 1 4 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.310 -2.587 25485 4860 1 4 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.689 1.852 25485 4861 1 4 . 1 1 171 171 HIS H H 171 8.499 8.499 7.578 0.921 25485 4862 1 4 . 1 1 172 172 PHE N N 172 121.125 121.125 121.074 0.051 25485 4863 1 4 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.390 0.138 25485 4864 1 4 . 1 1 172 172 PHE C C 172 173.875 173.875 174.162 -0.287 25485 4865 1 4 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.658 0.261 25485 4866 1 4 . 1 1 172 172 PHE CB C 172 41.903 41.903 40.592 1.311 25485 4867 1 4 . 1 1 172 172 PHE H H 172 8.445 8.445 7.905 0.540 25485 4868 1 4 . 1 1 173 173 ASP N N 173 124.014 124.014 122.663 1.351 25485 4869 1 4 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.878 -0.964 25485 4870 1 4 . 1 1 173 173 ASP C C 173 178.613 178.613 177.998 0.615 25485 4871 1 4 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.364 1.434 25485 4872 1 4 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.054 -0.311 25485 4873 1 4 . 1 1 173 173 ASP H H 173 7.927 7.927 8.538 -0.611 25485 4874 1 4 . 1 1 174 174 GLU N N 174 132.469 132.469 127.002 5.467 25485 4875 1 4 . 1 1 174 174 GLU C C 174 176.442 176.442 177.287 -0.845 25485 4876 1 4 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.883 -1.699 25485 4877 1 4 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.228 1.057 25485 4878 1 4 . 1 1 174 174 GLU H H 174 9.528 9.528 8.679 0.849 25485 4879 1 4 . 1 1 175 175 ASP N N 175 117.394 117.394 118.816 -1.422 25485 4880 1 4 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.699 0.094 25485 4881 1 4 . 1 1 175 175 ASP C C 175 176.645 176.645 176.826 -0.181 25485 4882 1 4 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.388 0.543 25485 4883 1 4 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.580 -1.439 25485 4884 1 4 . 1 1 175 175 ASP H H 175 8.768 8.768 8.668 0.100 25485 4885 1 4 . 1 1 176 176 GLU N N 176 116.493 116.493 118.428 -1.935 25485 4886 1 4 . 1 1 176 176 GLU C C 176 175.038 175.038 175.918 -0.880 25485 4887 1 4 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.900 -2.235 25485 4888 1 4 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.734 -4.511 25485 4889 1 4 . 1 1 176 176 GLU H H 176 7.159 7.159 8.512 -1.353 25485 4890 1 4 . 1 1 177 177 ARG N N 177 122.186 122.186 118.784 3.402 25485 4891 1 4 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.517 0.172 25485 4892 1 4 . 1 1 177 177 ARG C C 177 174.482 174.482 174.310 0.172 25485 4893 1 4 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.827 -1.140 25485 4894 1 4 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.298 -1.214 25485 4895 1 4 . 1 1 177 177 ARG H H 177 7.560 7.560 8.216 -0.656 25485 4896 1 4 . 1 1 178 178 TRP N N 178 129.179 129.179 124.363 4.816 25485 4897 1 4 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.380 -0.280 25485 4898 1 4 . 1 1 178 178 TRP C C 178 176.298 176.298 176.248 0.050 25485 4899 1 4 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.156 0.657 25485 4900 1 4 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.289 -1.092 25485 4901 1 4 . 1 1 178 178 TRP H H 178 8.807 8.807 8.631 0.176 25485 4902 1 4 . 1 1 179 179 THR N N 179 112.792 112.792 114.200 -1.408 25485 4903 1 4 . 1 1 179 179 THR HA H 179 4.985 4.985 4.838 0.147 25485 4904 1 4 . 1 1 179 179 THR C C 179 172.765 172.765 172.514 0.251 25485 4905 1 4 . 1 1 179 179 THR CA C 179 59.106 59.106 61.802 -2.696 25485 4906 1 4 . 1 1 179 179 THR CB C 179 71.786 71.786 71.360 0.426 25485 4907 1 4 . 1 1 179 179 THR H H 179 8.974 8.974 8.293 0.681 25485 4908 1 4 . 1 1 180 180 ASP N N 180 122.074 122.074 125.057 -2.983 25485 4909 1 4 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.288 -0.825 25485 4910 1 4 . 1 1 180 180 ASP C C 180 176.366 176.366 178.590 -2.224 25485 4911 1 4 . 1 1 180 180 ASP CA C 180 53.043 53.043 54.677 -1.634 25485 4912 1 4 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.102 -0.374 25485 4913 1 4 . 1 1 180 180 ASP H H 180 8.485 8.485 8.982 -0.497 25485 4914 1 4 . 1 1 181 181 GLY N N 181 110.123 110.123 108.703 1.420 25485 4915 1 4 . 1 1 181 181 GLY C C 181 174.325 174.325 175.677 -1.352 25485 4916 1 4 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.815 0.846 25485 4917 1 4 . 1 1 181 181 GLY H H 181 8.569 8.569 8.572 -0.003 25485 4918 1 4 . 1 1 182 182 SER N N 182 115.562 115.562 115.519 0.043 25485 4919 1 4 . 1 1 182 182 SER HA H 182 4.519 4.519 4.585 -0.066 25485 4920 1 4 . 1 1 182 182 SER C C 182 173.783 173.783 174.244 -0.461 25485 4921 1 4 . 1 1 182 182 SER CA C 182 57.965 57.965 58.096 -0.131 25485 4922 1 4 . 1 1 182 182 SER CB C 182 64.166 64.166 64.237 -0.071 25485 4923 1 4 . 1 1 182 182 SER H H 182 8.160 8.160 7.753 0.407 25485 4924 1 4 . 1 1 183 183 SER N N 183 117.153 117.153 114.240 2.913 25485 4925 1 4 . 1 1 183 183 SER HA H 183 4.275 4.275 4.195 0.080 25485 4926 1 4 . 1 1 183 183 SER C C 183 173.333 173.333 174.793 -1.460 25485 4927 1 4 . 1 1 183 183 SER CA C 183 59.902 59.902 58.997 0.905 25485 4928 1 4 . 1 1 183 183 SER CB C 183 64.941 64.941 62.593 2.349 25485 4929 1 4 . 1 1 183 183 SER H H 183 7.796 7.796 7.857 -0.061 25485 4930 1 4 . 1 1 184 184 LEU N N 184 122.351 122.351 120.082 2.269 25485 4931 1 4 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.556 -0.164 25485 4932 1 4 . 1 1 184 184 LEU C C 184 176.250 176.250 176.959 -0.709 25485 4933 1 4 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.548 0.027 25485 4934 1 4 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.730 -0.649 25485 4935 1 4 . 1 1 184 184 LEU H H 184 8.092 8.092 8.057 0.035 25485 4936 1 4 . 1 1 185 185 GLY N N 185 108.871 108.871 105.677 3.194 25485 4937 1 4 . 1 1 185 185 GLY C C 185 172.375 172.375 173.900 -1.525 25485 4938 1 4 . 1 1 185 185 GLY CA C 185 44.380 44.380 43.786 0.594 25485 4939 1 4 . 1 1 185 185 GLY H H 185 7.960 7.960 7.575 0.385 25485 4940 1 4 . 1 1 186 186 ILE N N 186 123.096 123.096 121.630 1.466 25485 4941 1 4 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.042 -0.201 25485 4942 1 4 . 1 1 186 186 ILE C C 186 175.350 175.350 176.050 -0.700 25485 4943 1 4 . 1 1 186 186 ILE CA C 186 58.401 58.401 58.964 -0.563 25485 4944 1 4 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.184 0.272 25485 4945 1 4 . 1 1 186 186 ILE H H 186 8.893 8.893 8.264 0.629 25485 4946 1 4 . 1 1 187 187 ASN N N 187 127.167 127.167 126.847 0.320 25485 4947 1 4 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.892 -0.539 25485 4948 1 4 . 1 1 187 187 ASN C C 187 175.849 175.849 177.008 -1.159 25485 4949 1 4 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.861 0.853 25485 4950 1 4 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.839 0.291 25485 4951 1 4 . 1 1 187 187 ASN H H 187 8.580 8.580 8.209 0.371 25485 4952 1 4 . 1 1 188 188 PHE N N 188 129.985 129.985 126.877 3.108 25485 4953 1 4 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.359 0.214 25485 4954 1 4 . 1 1 188 188 PHE C C 188 175.578 175.578 177.737 -2.159 25485 4955 1 4 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.679 -0.951 25485 4956 1 4 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.500 -0.068 25485 4957 1 4 . 1 1 188 188 PHE H H 188 9.361 9.361 8.432 0.929 25485 4958 1 4 . 1 1 189 189 LEU N N 189 119.113 119.113 118.661 0.452 25485 4959 1 4 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.202 -0.401 25485 4960 1 4 . 1 1 189 189 LEU C C 189 179.601 179.601 178.226 1.375 25485 4961 1 4 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.008 0.501 25485 4962 1 4 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.448 -1.571 25485 4963 1 4 . 1 1 189 189 LEU H H 189 8.562 8.562 8.515 0.047 25485 4964 1 4 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.704 0.213 25485 4965 1 4 . 1 1 190 190 TYR C C 190 177.621 177.621 177.817 -0.196 25485 4966 1 4 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.297 -0.489 25485 4967 1 4 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.149 2.620 25485 4968 1 4 . 1 1 191 191 ALA N N 191 120.352 120.352 120.483 -0.131 25485 4969 1 4 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.042 0.273 25485 4970 1 4 . 1 1 191 191 ALA C C 191 180.252 180.252 178.918 1.334 25485 4971 1 4 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.261 0.920 25485 4972 1 4 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.517 0.625 25485 4973 1 4 . 1 1 191 191 ALA H H 191 7.993 7.993 8.859 -0.866 25485 4974 1 4 . 1 1 192 192 ALA N N 192 121.409 121.409 121.715 -0.306 25485 4975 1 4 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.086 -0.029 25485 4976 1 4 . 1 1 192 192 ALA C C 192 178.575 178.575 179.584 -1.009 25485 4977 1 4 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.503 -0.318 25485 4978 1 4 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.241 -2.043 25485 4979 1 4 . 1 1 192 192 ALA H H 192 9.297 9.297 8.393 0.904 25485 4980 1 4 . 1 1 193 193 THR N N 193 116.996 116.996 113.703 3.293 25485 4981 1 4 . 1 1 193 193 THR HA H 193 3.833 3.833 4.128 -0.295 25485 4982 1 4 . 1 1 193 193 THR CA C 193 69.138 69.138 67.768 1.370 25485 4983 1 4 . 1 1 193 193 THR CB C 193 67.365 67.365 68.299 -0.934 25485 4984 1 4 . 1 1 193 193 THR H H 193 8.226 8.226 7.946 0.280 25485 4985 1 4 . 1 1 194 194 HIS N N 194 120.296 120.296 121.380 -1.084 25485 4986 1 4 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.203 0.033 25485 4987 1 4 . 1 1 194 194 HIS C C 194 175.962 175.962 176.745 -0.783 25485 4988 1 4 . 1 1 194 194 HIS CA C 194 59.747 59.747 59.297 0.450 25485 4989 1 4 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.747 -1.828 25485 4990 1 4 . 1 1 194 194 HIS H H 194 7.782 7.782 7.618 0.164 25485 4991 1 4 . 1 1 195 195 ALA N N 195 121.290 121.290 122.171 -0.881 25485 4992 1 4 . 1 1 195 195 ALA HA H 195 4.156 4.156 4.044 0.112 25485 4993 1 4 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.974 0.990 25485 4994 1 4 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.677 0.033 25485 4995 1 4 . 1 1 195 195 ALA H H 195 8.690 8.690 8.490 0.200 25485 4996 1 4 . 1 1 196 196 LEU N N 196 114.899 114.899 117.694 -2.795 25485 4997 1 4 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.151 0.019 25485 4998 1 4 . 1 1 196 196 LEU C C 196 177.946 177.946 179.990 -2.044 25485 4999 1 4 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.457 -1.229 25485 5000 1 4 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.990 -1.214 25485 5001 1 4 . 1 1 196 196 LEU H H 196 8.715 8.715 8.993 -0.278 25485 5002 1 4 . 1 1 197 197 GLY N N 197 107.901 107.901 105.486 2.415 25485 5003 1 4 . 1 1 197 197 GLY C C 197 178.641 178.641 175.239 3.402 25485 5004 1 4 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.630 0.937 25485 5005 1 4 . 1 1 197 197 GLY H H 197 7.546 7.546 8.200 -0.654 25485 5006 1 4 . 1 1 198 198 HIS N N 198 122.017 122.017 119.612 2.405 25485 5007 1 4 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.565 0.292 25485 5008 1 4 . 1 1 198 198 HIS C C 198 179.874 179.874 178.346 1.528 25485 5009 1 4 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.585 0.937 25485 5010 1 4 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.306 -1.760 25485 5011 1 4 . 1 1 198 198 HIS H H 198 7.196 7.196 7.473 -0.277 25485 5012 1 4 . 1 1 199 199 SER N N 199 118.486 118.486 114.261 4.225 25485 5013 1 4 . 1 1 199 199 SER HA H 199 4.490 4.490 4.444 0.046 25485 5014 1 4 . 1 1 199 199 SER C C 199 174.493 174.493 174.916 -0.423 25485 5015 1 4 . 1 1 199 199 SER CA C 199 58.173 58.173 61.233 -3.061 25485 5016 1 4 . 1 1 199 199 SER CB C 199 63.589 63.589 63.301 0.288 25485 5017 1 4 . 1 1 199 199 SER H H 199 7.884 7.884 7.722 0.162 25485 5018 1 4 . 1 1 200 200 LEU N N 200 114.686 114.686 116.010 -1.324 25485 5019 1 4 . 1 1 200 200 LEU C C 200 177.720 177.720 177.420 0.300 25485 5020 1 4 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.294 0.543 25485 5021 1 4 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.937 0.420 25485 5022 1 4 . 1 1 200 200 LEU H H 200 7.108 7.108 7.079 0.029 25485 5023 1 4 . 1 1 201 201 GLY N N 201 108.363 108.363 106.986 1.377 25485 5024 1 4 . 1 1 201 201 GLY C C 201 174.008 174.008 175.053 -1.045 25485 5025 1 4 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.696 -1.282 25485 5026 1 4 . 1 1 201 201 GLY H H 201 8.195 8.195 7.946 0.249 25485 5027 1 4 . 1 1 202 202 MET N N 202 119.635 119.635 121.109 -1.474 25485 5028 1 4 . 1 1 202 202 MET HA H 202 4.473 4.473 4.237 0.236 25485 5029 1 4 . 1 1 202 202 MET C C 202 176.593 176.593 175.928 0.665 25485 5030 1 4 . 1 1 202 202 MET CA C 202 54.500 54.500 56.345 -1.845 25485 5031 1 4 . 1 1 202 202 MET CB C 202 32.161 32.161 32.073 0.088 25485 5032 1 4 . 1 1 202 202 MET H H 202 8.182 8.182 7.310 0.872 25485 5033 1 4 . 1 1 203 203 GLY N N 203 109.749 109.749 110.593 -0.844 25485 5034 1 4 . 1 1 203 203 GLY C C 203 174.042 174.042 173.501 0.541 25485 5035 1 4 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.341 -0.337 25485 5036 1 4 . 1 1 203 203 GLY H H 203 8.405 8.405 8.503 -0.098 25485 5037 1 4 . 1 1 204 204 HIS N N 204 115.732 115.732 118.627 -2.895 25485 5038 1 4 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.369 1.031 25485 5039 1 4 . 1 1 204 204 HIS C C 204 174.430 174.430 174.384 0.046 25485 5040 1 4 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.022 -1.208 25485 5041 1 4 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.228 -0.402 25485 5042 1 4 . 1 1 204 204 HIS H H 204 8.364 8.364 8.409 -0.045 25485 5043 1 4 . 1 1 205 205 SER N N 205 115.484 115.484 114.948 0.536 25485 5044 1 4 . 1 1 205 205 SER HA H 205 4.766 4.766 4.631 0.135 25485 5045 1 4 . 1 1 205 205 SER C C 205 173.611 173.611 174.841 -1.230 25485 5046 1 4 . 1 1 205 205 SER CA C 205 54.729 54.729 57.404 -2.675 25485 5047 1 4 . 1 1 205 205 SER CB C 205 65.855 65.855 65.975 -0.119 25485 5048 1 4 . 1 1 205 205 SER H H 205 7.231 7.231 8.410 -1.179 25485 5049 1 4 . 1 1 206 206 SER N N 206 119.263 119.263 117.509 1.754 25485 5050 1 4 . 1 1 206 206 SER HA H 206 3.701 3.701 4.794 -1.093 25485 5051 1 4 . 1 1 206 206 SER C C 206 173.635 173.635 174.038 -0.403 25485 5052 1 4 . 1 1 206 206 SER CA C 206 63.846 63.846 59.276 4.570 25485 5053 1 4 . 1 1 206 206 SER CB C 206 63.764 63.764 64.078 -0.314 25485 5054 1 4 . 1 1 206 206 SER H H 206 8.289 8.289 8.653 -0.364 25485 5055 1 4 . 1 1 207 207 ASP N N 207 126.646 126.646 122.939 3.707 25485 5056 1 4 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.762 0.167 25485 5057 1 4 . 1 1 207 207 ASP C C 207 174.614 174.614 175.449 -0.835 25485 5058 1 4 . 1 1 207 207 ASP CA C 207 51.272 51.272 53.529 -2.256 25485 5059 1 4 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.350 -1.062 25485 5060 1 4 . 1 1 207 207 ASP H H 207 8.541 8.541 8.125 0.416 25485 5061 1 4 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.550 0.237 25485 5062 1 4 . 1 1 208 208 PRO C C 208 177.467 177.467 175.480 1.987 25485 5063 1 4 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.440 -0.604 25485 5064 1 4 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.975 -0.378 25485 5065 1 4 . 1 1 209 209 ASN N N 209 116.020 116.020 114.274 1.746 25485 5066 1 4 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.718 -0.077 25485 5067 1 4 . 1 1 209 209 ASN C C 209 174.695 174.695 173.410 1.285 25485 5068 1 4 . 1 1 209 209 ASN CA C 209 53.220 53.220 52.069 1.151 25485 5069 1 4 . 1 1 209 209 ASN CB C 209 39.110 39.110 39.006 0.104 25485 5070 1 4 . 1 1 209 209 ASN H H 209 8.350 8.350 8.081 0.269 25485 5071 1 4 . 1 1 210 210 ALA N N 210 124.892 124.892 122.413 2.479 25485 5072 1 4 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.530 -0.435 25485 5073 1 4 . 1 1 210 210 ALA C C 210 179.495 179.495 178.340 1.155 25485 5074 1 4 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.861 1.193 25485 5075 1 4 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.765 -1.566 25485 5076 1 4 . 1 1 210 210 ALA H H 210 8.193 8.193 7.283 0.910 25485 5077 1 4 . 1 1 211 211 VAL N N 211 130.402 130.402 123.200 7.202 25485 5078 1 4 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.767 0.496 25485 5079 1 4 . 1 1 211 211 VAL C C 211 179.408 179.408 176.446 2.962 25485 5080 1 4 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.009 0.043 25485 5081 1 4 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.385 -1.402 25485 5082 1 4 . 1 1 211 211 VAL H H 211 11.592 11.592 8.734 2.858 25485 5083 1 4 . 1 1 212 212 MET N N 212 113.285 113.285 113.898 -0.613 25485 5084 1 4 . 1 1 212 212 MET C C 212 176.996 176.996 175.602 1.394 25485 5085 1 4 . 1 1 212 212 MET CA C 212 53.614 53.614 54.208 -0.594 25485 5086 1 4 . 1 1 212 212 MET CB C 212 26.975 26.975 31.366 -4.391 25485 5087 1 4 . 1 1 212 212 MET H H 212 7.724 7.724 7.539 0.185 25485 5088 1 4 . 1 1 213 213 TYR N N 213 129.919 129.919 125.150 4.769 25485 5089 1 4 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.483 1.213 25485 5090 1 4 . 1 1 213 213 TYR C C 213 178.411 178.411 175.168 3.243 25485 5091 1 4 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.102 0.029 25485 5092 1 4 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.631 0.536 25485 5093 1 4 . 1 1 213 213 TYR H H 213 7.902 7.902 7.431 0.471 25485 5094 1 4 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.408 -0.933 25485 5095 1 4 . 1 1 214 214 PRO C C 214 177.694 177.694 176.874 0.820 25485 5096 1 4 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.183 1.845 25485 5097 1 4 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.819 1.004 25485 5098 1 4 . 1 1 215 215 THR N N 215 104.450 104.450 115.177 -10.727 25485 5099 1 4 . 1 1 215 215 THR HA H 215 4.444 4.444 4.442 0.002 25485 5100 1 4 . 1 1 215 215 THR C C 215 173.429 173.429 173.390 0.039 25485 5101 1 4 . 1 1 215 215 THR CA C 215 60.528 60.528 60.961 -0.433 25485 5102 1 4 . 1 1 215 215 THR CB C 215 69.614 69.614 66.791 2.823 25485 5103 1 4 . 1 1 215 215 THR H H 215 6.407 6.407 7.653 -1.246 25485 5104 1 4 . 1 1 216 216 TYR N N 216 124.618 124.618 124.747 -0.129 25485 5105 1 4 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.377 -0.145 25485 5106 1 4 . 1 1 216 216 TYR C C 216 175.669 175.669 175.260 0.409 25485 5107 1 4 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.445 -0.858 25485 5108 1 4 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.703 2.188 25485 5109 1 4 . 1 1 216 216 TYR H H 216 8.331 8.331 7.852 0.479 25485 5110 1 4 . 1 1 217 217 GLY N N 217 116.089 116.089 116.639 -0.550 25485 5111 1 4 . 1 1 217 217 GLY C C 217 173.560 173.560 173.767 -0.207 25485 5112 1 4 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.245 0.073 25485 5113 1 4 . 1 1 217 217 GLY H H 217 7.695 7.695 8.722 -1.027 25485 5114 1 4 . 1 1 218 218 ASN N N 218 120.167 120.167 122.087 -1.920 25485 5115 1 4 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.785 -0.119 25485 5116 1 4 . 1 1 218 218 ASN C C 218 175.343 175.343 175.884 -0.541 25485 5117 1 4 . 1 1 218 218 ASN CA C 218 53.615 53.615 52.477 1.139 25485 5118 1 4 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.426 0.120 25485 5119 1 4 . 1 1 218 218 ASN H H 218 8.237 8.237 8.476 -0.239 25485 5120 1 4 . 1 1 219 219 GLY N N 219 109.322 109.322 107.577 1.745 25485 5121 1 4 . 1 1 219 219 GLY C C 219 172.842 172.842 173.320 -0.478 25485 5122 1 4 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.873 -0.155 25485 5123 1 4 . 1 1 219 219 GLY H H 219 8.027 8.027 8.393 -0.366 25485 5124 1 4 . 1 1 220 220 ASP N N 220 123.006 123.006 124.994 -1.988 25485 5125 1 4 . 1 1 220 220 ASP H H 220 8.273 8.273 8.262 0.011 25485 5126 1 4 . 1 1 221 221 PRO C C 221 177.138 177.138 177.896 -0.758 25485 5127 1 4 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.636 -5.573 25485 5128 1 4 . 1 1 221 221 PRO CB C 221 31.696 31.696 33.128 -1.432 25485 5129 1 4 . 1 1 222 222 GLN N N 222 116.718 116.718 119.772 -3.054 25485 5130 1 4 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.268 0.068 25485 5131 1 4 . 1 1 222 222 GLN C C 222 176.321 176.321 177.010 -0.689 25485 5132 1 4 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.423 -1.280 25485 5133 1 4 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.753 0.744 25485 5134 1 4 . 1 1 222 222 GLN H H 222 8.240 8.240 8.767 -0.527 25485 5135 1 4 . 1 1 223 223 ASN N N 223 118.368 118.368 115.674 2.694 25485 5136 1 4 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.736 0.180 25485 5137 1 4 . 1 1 223 223 ASN C C 223 173.271 173.271 174.267 -0.996 25485 5138 1 4 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.338 -0.742 25485 5139 1 4 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.259 -0.044 25485 5140 1 4 . 1 1 223 223 ASN H H 223 7.946 7.946 8.085 -0.139 25485 5141 1 4 . 1 1 224 224 PHE N N 224 118.429 118.429 119.150 -0.721 25485 5142 1 4 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.180 0.271 25485 5143 1 4 . 1 1 224 224 PHE C C 224 172.897 172.897 173.723 -0.826 25485 5144 1 4 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.742 0.667 25485 5145 1 4 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.234 1.467 25485 5146 1 4 . 1 1 224 224 PHE H H 224 6.992 6.992 7.912 -0.920 25485 5147 1 4 . 1 1 225 225 LYS N N 225 121.714 121.714 125.362 -3.648 25485 5148 1 4 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.824 0.606 25485 5149 1 4 . 1 1 225 225 LYS C C 225 174.664 174.664 174.966 -0.302 25485 5150 1 4 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.960 0.352 25485 5151 1 4 . 1 1 225 225 LYS CB C 225 34.727 34.727 35.388 -0.661 25485 5152 1 4 . 1 1 225 225 LYS H H 225 7.709 7.709 8.000 -0.291 25485 5153 1 4 . 1 1 226 226 LEU N N 226 119.026 119.026 121.191 -2.165 25485 5154 1 4 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.994 0.146 25485 5155 1 4 . 1 1 226 226 LEU C C 226 177.495 177.495 176.967 0.528 25485 5156 1 4 . 1 1 226 226 LEU CA C 226 55.599 55.599 54.972 0.627 25485 5157 1 4 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.036 -0.755 25485 5158 1 4 . 1 1 226 226 LEU H H 226 8.015 8.015 8.073 -0.058 25485 5159 1 4 . 1 1 227 227 SER N N 227 120.320 120.320 116.886 3.434 25485 5160 1 4 . 1 1 227 227 SER HA H 227 4.600 4.600 4.505 0.095 25485 5161 1 4 . 1 1 227 227 SER C C 227 175.492 175.492 175.508 -0.016 25485 5162 1 4 . 1 1 227 227 SER CA C 227 57.239 57.239 57.401 -0.162 25485 5163 1 4 . 1 1 227 227 SER CB C 227 66.278 66.278 64.775 1.503 25485 5164 1 4 . 1 1 227 227 SER H H 227 9.654 9.654 8.304 1.350 25485 5165 1 4 . 1 1 228 228 GLN N N 228 127.511 127.511 125.395 2.116 25485 5166 1 4 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.983 0.711 25485 5167 1 4 . 1 1 228 228 GLN H H 228 8.248 8.248 8.855 -0.607 25485 5168 1 4 . 1 1 229 229 ASP N N 229 124.358 124.358 118.921 5.437 25485 5169 1 4 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.385 -0.011 25485 5170 1 4 . 1 1 229 229 ASP C C 229 178.793 178.793 178.517 0.276 25485 5171 1 4 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.442 0.700 25485 5172 1 4 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.522 2.720 25485 5173 1 4 . 1 1 229 229 ASP H H 229 8.138 8.138 8.533 -0.395 25485 5174 1 4 . 1 1 230 230 ASP N N 230 119.694 119.694 119.985 -0.291 25485 5175 1 4 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.542 -0.120 25485 5176 1 4 . 1 1 230 230 ASP C C 230 177.736 177.736 178.427 -0.691 25485 5177 1 4 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.135 0.788 25485 5178 1 4 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.987 2.249 25485 5179 1 4 . 1 1 230 230 ASP H H 230 7.393 7.393 7.444 -0.051 25485 5180 1 4 . 1 1 231 231 ILE N N 231 120.364 120.364 119.910 0.454 25485 5181 1 4 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.817 -0.152 25485 5182 1 4 . 1 1 231 231 ILE C C 231 177.631 177.631 177.850 -0.219 25485 5183 1 4 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.421 0.078 25485 5184 1 4 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.087 0.426 25485 5185 1 4 . 1 1 231 231 ILE H H 231 8.115 8.115 8.031 0.084 25485 5186 1 4 . 1 1 232 232 LYS N N 232 119.156 119.156 120.021 -0.865 25485 5187 1 4 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.010 0.104 25485 5188 1 4 . 1 1 232 232 LYS C C 232 180.574 180.574 179.076 1.498 25485 5189 1 4 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.905 -0.345 25485 5190 1 4 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.687 0.110 25485 5191 1 4 . 1 1 232 232 LYS H H 232 8.607 8.607 8.521 0.086 25485 5192 1 4 . 1 1 233 233 GLY N N 233 106.425 106.425 108.027 -1.602 25485 5193 1 4 . 1 1 233 233 GLY C C 233 176.098 176.098 175.769 0.329 25485 5194 1 4 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.745 0.892 25485 5195 1 4 . 1 1 233 233 GLY H H 233 8.075 8.075 7.667 0.408 25485 5196 1 4 . 1 1 234 234 ILE N N 234 125.119 125.119 122.014 3.105 25485 5197 1 4 . 1 1 234 234 ILE C C 234 178.231 178.231 177.383 0.848 25485 5198 1 4 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.303 -1.710 25485 5199 1 4 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.324 -0.778 25485 5200 1 4 . 1 1 234 234 ILE H H 234 8.539 8.539 7.397 1.142 25485 5201 1 4 . 1 1 235 235 GLN N N 235 122.877 122.877 119.266 3.611 25485 5202 1 4 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.126 0.231 25485 5203 1 4 . 1 1 235 235 GLN C C 235 180.105 180.105 178.545 1.560 25485 5204 1 4 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.448 -1.561 25485 5205 1 4 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.582 -1.045 25485 5206 1 4 . 1 1 235 235 GLN H H 235 8.296 8.296 8.546 -0.250 25485 5207 1 4 . 1 1 236 236 LYS N N 236 123.678 123.678 118.136 5.542 25485 5208 1 4 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.375 -0.293 25485 5209 1 4 . 1 1 236 236 LYS C C 236 178.169 178.169 177.433 0.736 25485 5210 1 4 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.378 0.998 25485 5211 1 4 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.855 0.123 25485 5212 1 4 . 1 1 236 236 LYS H H 236 8.024 8.024 7.741 0.283 25485 5213 1 4 . 1 1 237 237 LEU N N 237 116.873 116.873 119.553 -2.680 25485 5214 1 4 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.373 -0.386 25485 5215 1 4 . 1 1 237 237 LEU C C 237 177.893 177.893 177.928 -0.035 25485 5216 1 4 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.941 0.498 25485 5217 1 4 . 1 1 237 237 LEU CB C 237 43.613 43.613 43.097 0.516 25485 5218 1 4 . 1 1 237 237 LEU H H 237 6.888 6.888 7.581 -0.693 25485 5219 1 4 . 1 1 238 238 TYR N N 238 112.237 112.237 117.274 -5.037 25485 5220 1 4 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.496 0.155 25485 5221 1 4 . 1 1 238 238 TYR C C 238 176.082 176.082 177.238 -1.156 25485 5222 1 4 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.358 -0.722 25485 5223 1 4 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.439 1.959 25485 5224 1 4 . 1 1 238 238 TYR H H 238 7.445 7.445 8.952 -1.507 25485 5225 1 4 . 1 1 239 239 GLY N N 239 110.906 110.906 106.398 4.508 25485 5226 1 4 . 1 1 239 239 GLY C C 239 171.269 171.269 173.105 -1.836 25485 5227 1 4 . 1 1 239 239 GLY CA C 239 43.886 43.886 44.878 -0.992 25485 5228 1 4 . 1 1 239 239 GLY H H 239 8.443 8.443 7.958 0.485 25485 5229 1 4 . 1 1 240 240 LYS N N 240 114.281 114.281 121.658 -7.377 25485 5230 1 4 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.672 0.066 25485 5231 1 4 . 1 1 240 240 LYS C C 240 177.527 177.527 177.328 0.199 25485 5232 1 4 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.421 -0.463 25485 5233 1 4 . 1 1 240 240 LYS CB C 240 34.275 34.275 34.438 -0.163 25485 5234 1 4 . 1 1 240 240 LYS H H 240 7.873 7.873 8.433 -0.560 25485 5235 1 4 . 1 1 241 241 ARG N N 241 123.758 123.758 125.483 -1.725 25485 5236 1 4 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.122 -0.125 25485 5237 1 4 . 1 1 241 241 ARG C C 241 176.026 176.026 175.825 0.201 25485 5238 1 4 . 1 1 241 241 ARG CA C 241 57.492 57.492 57.690 -0.198 25485 5239 1 4 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.404 -0.033 25485 5240 1 4 . 1 1 241 241 ARG H H 241 7.742 7.742 8.933 -1.191 25485 5241 1 4 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.469 -0.129 25485 5242 1 4 . 1 1 246 246 LYS C C 246 175.403 175.403 175.806 -0.403 25485 5243 1 4 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.869 0.640 25485 5244 1 4 . 1 1 246 246 LYS CB C 246 32.858 32.858 34.098 -1.240 25485 5245 1 5 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.636 -0.329 25485 5246 1 5 . 1 1 2 2 GLN C C 2 176.492 176.492 175.363 1.129 25485 5247 1 5 . 1 1 2 2 GLN CA C 2 56.749 56.749 55.764 0.985 25485 5248 1 5 . 1 1 2 2 GLN CB C 2 28.654 28.654 30.970 -2.316 25485 5249 1 5 . 1 1 3 3 GLU N N 3 121.668 121.668 121.327 0.341 25485 5250 1 5 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.492 -0.703 25485 5251 1 5 . 1 1 3 3 GLU C C 3 176.278 176.278 177.822 -1.544 25485 5252 1 5 . 1 1 3 3 GLU CA C 3 57.059 57.059 56.924 0.135 25485 5253 1 5 . 1 1 3 3 GLU CB C 3 29.691 29.691 30.128 -0.437 25485 5254 1 5 . 1 1 3 3 GLU H H 3 8.331 8.331 8.985 -0.654 25485 5255 1 5 . 1 1 4 4 ALA N N 4 124.493 124.493 123.049 1.444 25485 5256 1 5 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.152 0.358 25485 5257 1 5 . 1 1 4 4 ALA C C 4 178.428 178.428 179.560 -1.132 25485 5258 1 5 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.971 -0.294 25485 5259 1 5 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.134 0.575 25485 5260 1 5 . 1 1 4 4 ALA H H 4 8.131 8.131 8.044 0.087 25485 5261 1 5 . 1 1 5 5 GLY N N 5 108.204 108.204 106.296 1.908 25485 5262 1 5 . 1 1 5 5 GLY C C 5 174.858 174.858 175.704 -0.846 25485 5263 1 5 . 1 1 5 5 GLY CA C 5 47.661 47.661 45.750 1.911 25485 5264 1 5 . 1 1 5 5 GLY H H 5 8.279 8.279 8.639 -0.360 25485 5265 1 5 . 1 1 6 6 GLY N N 6 108.820 108.820 108.339 0.481 25485 5266 1 5 . 1 1 6 6 GLY C C 6 174.189 174.189 174.335 -0.146 25485 5267 1 5 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.224 0.189 25485 5268 1 5 . 1 1 6 6 GLY H H 6 8.246 8.246 7.875 0.371 25485 5269 1 5 . 1 1 7 7 MET N N 7 119.938 119.938 120.126 -0.188 25485 5270 1 5 . 1 1 7 7 MET HA H 7 4.659 4.659 4.883 -0.224 25485 5271 1 5 . 1 1 7 7 MET C C 7 176.191 176.191 175.526 0.665 25485 5272 1 5 . 1 1 7 7 MET CA C 7 54.799 54.799 54.242 0.557 25485 5273 1 5 . 1 1 7 7 MET CB C 7 33.046 33.046 34.007 -0.961 25485 5274 1 5 . 1 1 7 7 MET H H 7 8.005 8.005 7.987 0.018 25485 5275 1 5 . 1 1 8 8 SER N N 8 118.919 118.919 115.927 2.992 25485 5276 1 5 . 1 1 8 8 SER HA H 8 4.239 4.239 4.734 -0.495 25485 5277 1 5 . 1 1 8 8 SER C C 8 174.949 174.949 175.127 -0.178 25485 5278 1 5 . 1 1 8 8 SER CA C 8 58.160 58.160 56.994 1.166 25485 5279 1 5 . 1 1 8 8 SER CB C 8 65.440 65.440 65.618 -0.178 25485 5280 1 5 . 1 1 8 8 SER H H 8 8.731 8.731 8.476 0.255 25485 5281 1 5 . 1 1 9 9 GLU N N 9 122.442 122.442 122.748 -0.306 25485 5282 1 5 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.176 0.145 25485 5283 1 5 . 1 1 9 9 GLU C C 9 178.604 178.604 178.938 -0.334 25485 5284 1 5 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.383 0.084 25485 5285 1 5 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.499 -0.323 25485 5286 1 5 . 1 1 9 9 GLU H H 9 8.901 8.901 8.896 0.005 25485 5287 1 5 . 1 1 10 10 LEU N N 10 120.568 120.568 118.941 1.627 25485 5288 1 5 . 1 1 10 10 LEU C C 10 179.307 179.307 179.279 0.028 25485 5289 1 5 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.475 -0.995 25485 5290 1 5 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.908 -0.334 25485 5291 1 5 . 1 1 10 10 LEU H H 10 8.020 8.020 8.309 -0.289 25485 5292 1 5 . 1 1 11 11 GLN N N 11 119.930 119.930 118.505 1.425 25485 5293 1 5 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.071 0.063 25485 5294 1 5 . 1 1 11 11 GLN C C 11 178.330 178.330 178.460 -0.130 25485 5295 1 5 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.736 -0.918 25485 5296 1 5 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.657 -0.793 25485 5297 1 5 . 1 1 11 11 GLN H H 11 7.811 7.811 7.711 0.100 25485 5298 1 5 . 1 1 12 12 TRP N N 12 121.031 121.031 120.879 0.152 25485 5299 1 5 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.396 0.018 25485 5300 1 5 . 1 1 12 12 TRP C C 12 178.874 178.874 178.177 0.697 25485 5301 1 5 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.319 0.188 25485 5302 1 5 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.863 -0.476 25485 5303 1 5 . 1 1 12 12 TRP H H 12 8.205 8.205 8.334 -0.129 25485 5304 1 5 . 1 1 13 13 GLU N N 13 121.877 121.877 119.662 2.215 25485 5305 1 5 . 1 1 13 13 GLU C C 13 179.425 179.425 178.780 0.645 25485 5306 1 5 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.516 0.521 25485 5307 1 5 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.702 -0.780 25485 5308 1 5 . 1 1 13 13 GLU H H 13 8.434 8.434 8.514 -0.080 25485 5309 1 5 . 1 1 14 14 GLN N N 14 120.449 120.449 119.079 1.370 25485 5310 1 5 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.852 0.386 25485 5311 1 5 . 1 1 14 14 GLN C C 14 179.210 179.210 178.315 0.895 25485 5312 1 5 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.516 0.366 25485 5313 1 5 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.602 -0.852 25485 5314 1 5 . 1 1 14 14 GLN H H 14 8.124 8.124 8.324 -0.200 25485 5315 1 5 . 1 1 15 15 ALA N N 15 123.114 123.114 121.701 1.413 25485 5316 1 5 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.186 0.204 25485 5317 1 5 . 1 1 15 15 ALA C C 15 179.352 179.352 179.208 0.144 25485 5318 1 5 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.214 -0.249 25485 5319 1 5 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.121 0.542 25485 5320 1 5 . 1 1 15 15 ALA H H 15 8.344 8.344 7.841 0.503 25485 5321 1 5 . 1 1 16 16 GLN N N 16 117.718 117.718 117.553 0.165 25485 5322 1 5 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.914 -0.132 25485 5323 1 5 . 1 1 16 16 GLN C C 16 177.719 177.719 177.806 -0.087 25485 5324 1 5 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.692 1.589 25485 5325 1 5 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.628 -0.092 25485 5326 1 5 . 1 1 16 16 GLN H H 16 8.500 8.500 7.490 1.010 25485 5327 1 5 . 1 1 17 17 ASP N N 17 120.040 120.040 118.702 1.338 25485 5328 1 5 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.462 0.074 25485 5329 1 5 . 1 1 17 17 ASP C C 17 177.630 177.630 178.741 -1.111 25485 5330 1 5 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.493 0.312 25485 5331 1 5 . 1 1 17 17 ASP CB C 17 41.864 41.864 41.108 0.756 25485 5332 1 5 . 1 1 17 17 ASP H H 17 7.871 7.871 7.622 0.249 25485 5333 1 5 . 1 1 18 18 TYR N N 18 122.465 122.465 120.687 1.778 25485 5334 1 5 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.255 -0.065 25485 5335 1 5 . 1 1 18 18 TYR C C 18 178.439 178.439 177.733 0.706 25485 5336 1 5 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.215 1.631 25485 5337 1 5 . 1 1 18 18 TYR CB C 18 39.940 39.940 37.830 2.111 25485 5338 1 5 . 1 1 18 18 TYR H H 18 8.244 8.244 8.398 -0.154 25485 5339 1 5 . 1 1 19 19 LEU N N 19 117.635 117.635 118.390 -0.755 25485 5340 1 5 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.920 0.212 25485 5341 1 5 . 1 1 19 19 LEU C C 19 180.940 180.940 178.099 2.841 25485 5342 1 5 . 1 1 19 19 LEU CA C 19 57.505 57.505 57.251 0.254 25485 5343 1 5 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.503 -0.905 25485 5344 1 5 . 1 1 19 19 LEU H H 19 8.713 8.713 7.872 0.841 25485 5345 1 5 . 1 1 20 20 LYS N N 20 124.594 124.594 117.516 7.078 25485 5346 1 5 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.512 -0.428 25485 5347 1 5 . 1 1 20 20 LYS C C 20 178.387 178.387 177.485 0.902 25485 5348 1 5 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.083 1.722 25485 5349 1 5 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.307 0.149 25485 5350 1 5 . 1 1 20 20 LYS H H 20 8.815 8.815 7.863 0.952 25485 5351 1 5 . 1 1 21 21 ARG N N 21 117.535 117.535 117.554 -0.019 25485 5352 1 5 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.201 -0.482 25485 5353 1 5 . 1 1 21 21 ARG C C 21 178.498 178.498 177.622 0.876 25485 5354 1 5 . 1 1 21 21 ARG CA C 21 59.244 59.244 57.809 1.435 25485 5355 1 5 . 1 1 21 21 ARG CB C 21 29.441 29.441 30.162 -0.721 25485 5356 1 5 . 1 1 21 21 ARG H H 21 7.810 7.810 7.665 0.145 25485 5357 1 5 . 1 1 22 22 PHE N N 22 112.113 112.113 118.517 -6.404 25485 5358 1 5 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.180 0.731 25485 5359 1 5 . 1 1 22 22 PHE C C 22 174.875 174.875 175.612 -0.737 25485 5360 1 5 . 1 1 22 22 PHE CA C 22 57.475 57.475 61.096 -3.622 25485 5361 1 5 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.428 -0.259 25485 5362 1 5 . 1 1 22 22 PHE H H 22 8.010 8.010 7.925 0.085 25485 5363 1 5 . 1 1 23 23 TYR N N 23 116.187 116.187 116.438 -0.251 25485 5364 1 5 . 1 1 23 23 TYR C C 23 173.455 173.455 176.322 -2.867 25485 5365 1 5 . 1 1 23 23 TYR CA C 23 58.427 58.427 59.702 -1.275 25485 5366 1 5 . 1 1 23 23 TYR CB C 23 39.529 39.529 39.843 -0.314 25485 5367 1 5 . 1 1 23 23 TYR H H 23 7.680 7.680 7.362 0.318 25485 5368 1 5 . 1 1 24 24 LEU N N 24 115.570 115.570 113.580 1.990 25485 5369 1 5 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.454 -0.304 25485 5370 1 5 . 1 1 24 24 LEU C C 24 176.661 176.661 174.679 1.982 25485 5371 1 5 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.822 0.330 25485 5372 1 5 . 1 1 24 24 LEU CB C 24 36.863 36.863 44.675 -7.812 25485 5373 1 5 . 1 1 24 24 LEU H H 24 7.238 7.238 7.573 -0.335 25485 5374 1 5 . 1 1 25 25 TYR N N 25 119.901 119.901 118.913 0.988 25485 5375 1 5 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.750 -0.391 25485 5376 1 5 . 1 1 25 25 TYR C C 25 173.784 173.784 173.603 0.181 25485 5377 1 5 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.222 1.025 25485 5378 1 5 . 1 1 25 25 TYR CB C 25 39.079 39.079 40.248 -1.169 25485 5379 1 5 . 1 1 25 25 TYR H H 25 7.845 7.845 7.964 -0.119 25485 5380 1 5 . 1 1 26 26 ASP N N 26 129.338 129.338 127.489 1.849 25485 5381 1 5 . 1 1 26 26 ASP HA H 26 4.451 4.451 4.842 -0.391 25485 5382 1 5 . 1 1 26 26 ASP C C 26 175.282 175.282 175.246 0.036 25485 5383 1 5 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.606 -1.173 25485 5384 1 5 . 1 1 26 26 ASP CB C 26 41.249 41.249 40.732 0.517 25485 5385 1 5 . 1 1 26 26 ASP H H 26 8.108 8.108 8.714 -0.606 25485 5386 1 5 . 1 1 27 27 SER C C 27 175.204 175.204 175.964 -0.760 25485 5387 1 5 . 1 1 27 27 SER CA C 27 59.424 59.424 60.165 -0.741 25485 5388 1 5 . 1 1 27 27 SER CB C 27 63.535 63.535 63.389 0.146 25485 5389 1 5 . 1 1 28 28 GLU N N 28 122.058 122.058 119.988 2.070 25485 5390 1 5 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.166 0.159 25485 5391 1 5 . 1 1 28 28 GLU C C 28 177.073 177.073 177.035 0.038 25485 5392 1 5 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.463 -1.251 25485 5393 1 5 . 1 1 28 28 GLU CB C 28 29.570 29.570 28.435 1.135 25485 5394 1 5 . 1 1 28 28 GLU H H 28 8.255 8.255 8.621 -0.366 25485 5395 1 5 . 1 1 29 29 THR N N 29 114.161 114.161 114.497 -0.336 25485 5396 1 5 . 1 1 29 29 THR HA H 29 4.260 4.260 4.187 0.073 25485 5397 1 5 . 1 1 29 29 THR C C 29 174.591 174.591 173.964 0.627 25485 5398 1 5 . 1 1 29 29 THR CA C 29 61.976 61.976 63.173 -1.197 25485 5399 1 5 . 1 1 29 29 THR CB C 29 69.385 69.385 68.920 0.465 25485 5400 1 5 . 1 1 29 29 THR H H 29 7.498 7.498 7.767 -0.269 25485 5401 1 5 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.022 0.196 25485 5402 1 5 . 1 1 30 30 LYS H H 30 8.218 8.218 7.517 0.701 25485 5403 1 5 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.712 -0.288 25485 5404 1 5 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.876 -1.743 25485 5405 1 5 . 1 1 32 32 ALA N N 32 126.484 126.484 122.971 3.513 25485 5406 1 5 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.304 -0.008 25485 5407 1 5 . 1 1 32 32 ALA C C 32 178.012 178.012 178.671 -0.659 25485 5408 1 5 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.946 -1.186 25485 5409 1 5 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.110 -0.340 25485 5410 1 5 . 1 1 32 32 ALA H H 32 8.411 8.411 8.655 -0.244 25485 5411 1 5 . 1 1 33 33 ASN N N 33 116.885 116.885 116.156 0.729 25485 5412 1 5 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.708 -0.010 25485 5413 1 5 . 1 1 33 33 ASN C C 33 176.240 176.240 176.967 -0.727 25485 5414 1 5 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.208 -1.021 25485 5415 1 5 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.199 0.386 25485 5416 1 5 . 1 1 33 33 ASN H H 33 8.309 8.309 8.542 -0.233 25485 5417 1 5 . 1 1 34 34 SER N N 34 116.836 116.836 115.820 1.016 25485 5418 1 5 . 1 1 34 34 SER HA H 34 4.544 4.544 4.230 0.314 25485 5419 1 5 . 1 1 34 34 SER C C 34 175.253 175.253 176.028 -0.775 25485 5420 1 5 . 1 1 34 34 SER CA C 34 59.583 59.583 61.203 -1.619 25485 5421 1 5 . 1 1 34 34 SER CB C 34 63.919 63.919 62.490 1.429 25485 5422 1 5 . 1 1 34 34 SER H H 34 8.115 8.115 8.495 -0.380 25485 5423 1 5 . 1 1 35 35 LEU N N 35 125.355 125.355 122.733 2.622 25485 5424 1 5 . 1 1 35 35 LEU HA H 35 3.576 3.576 3.994 -0.418 25485 5425 1 5 . 1 1 35 35 LEU C C 35 177.973 177.973 177.839 0.134 25485 5426 1 5 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.585 -0.088 25485 5427 1 5 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.869 -1.177 25485 5428 1 5 . 1 1 35 35 LEU H H 35 8.312 8.312 7.599 0.713 25485 5429 1 5 . 1 1 36 36 GLU N N 36 119.201 119.201 118.859 0.342 25485 5430 1 5 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.929 -0.015 25485 5431 1 5 . 1 1 36 36 GLU C C 36 178.141 178.141 178.853 -0.712 25485 5432 1 5 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.417 0.242 25485 5433 1 5 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.158 0.155 25485 5434 1 5 . 1 1 36 36 GLU H H 36 8.225 8.225 7.873 0.352 25485 5435 1 5 . 1 1 37 37 ALA N N 37 120.746 120.746 122.959 -2.213 25485 5436 1 5 . 1 1 37 37 ALA HA H 37 4.079 4.079 3.875 0.204 25485 5437 1 5 . 1 1 37 37 ALA C C 37 181.485 181.485 179.327 2.158 25485 5438 1 5 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.362 0.097 25485 5439 1 5 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.143 0.024 25485 5440 1 5 . 1 1 37 37 ALA H H 37 7.917 7.917 7.603 0.314 25485 5441 1 5 . 1 1 38 38 LYS N N 38 119.326 119.326 118.997 0.329 25485 5442 1 5 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.054 0.277 25485 5443 1 5 . 1 1 38 38 LYS C C 38 177.946 177.946 178.929 -0.983 25485 5444 1 5 . 1 1 38 38 LYS CA C 38 57.704 57.704 59.199 -1.495 25485 5445 1 5 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.475 -0.675 25485 5446 1 5 . 1 1 38 38 LYS H H 38 8.216 8.216 8.116 0.100 25485 5447 1 5 . 1 1 39 39 LEU N N 39 122.736 122.736 119.427 3.309 25485 5448 1 5 . 1 1 39 39 LEU HA H 39 3.941 3.941 4.020 -0.079 25485 5449 1 5 . 1 1 39 39 LEU C C 39 178.819 178.819 178.817 0.002 25485 5450 1 5 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.555 -0.474 25485 5451 1 5 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.075 -0.447 25485 5452 1 5 . 1 1 39 39 LEU H H 39 8.666 8.666 8.518 0.148 25485 5453 1 5 . 1 1 40 40 LYS N N 40 118.411 118.411 119.720 -1.309 25485 5454 1 5 . 1 1 40 40 LYS HA H 40 4.638 4.638 4.307 0.331 25485 5455 1 5 . 1 1 40 40 LYS C C 40 179.329 179.329 178.945 0.384 25485 5456 1 5 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.793 0.340 25485 5457 1 5 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.148 -0.363 25485 5458 1 5 . 1 1 40 40 LYS H H 40 8.227 8.227 7.945 0.282 25485 5459 1 5 . 1 1 41 41 GLU N N 41 121.329 121.329 118.722 2.607 25485 5460 1 5 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.152 -0.059 25485 5461 1 5 . 1 1 41 41 GLU C C 41 178.989 178.989 179.115 -0.126 25485 5462 1 5 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.935 0.825 25485 5463 1 5 . 1 1 41 41 GLU CB C 41 29.836 29.836 29.131 0.705 25485 5464 1 5 . 1 1 41 41 GLU H H 41 7.718 7.718 7.683 0.035 25485 5465 1 5 . 1 1 42 42 MET N N 42 123.817 123.817 121.306 2.511 25485 5466 1 5 . 1 1 42 42 MET HA H 42 4.107 4.107 4.513 -0.406 25485 5467 1 5 . 1 1 42 42 MET C C 42 177.719 177.719 178.442 -0.723 25485 5468 1 5 . 1 1 42 42 MET CA C 42 59.912 59.912 58.452 1.460 25485 5469 1 5 . 1 1 42 42 MET CB C 42 30.506 30.506 32.773 -2.267 25485 5470 1 5 . 1 1 42 42 MET H H 42 7.657 7.657 8.122 -0.465 25485 5471 1 5 . 1 1 43 43 GLN N N 43 119.998 119.998 118.848 1.150 25485 5472 1 5 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.990 -0.185 25485 5473 1 5 . 1 1 43 43 GLN C C 43 177.604 177.604 178.696 -1.092 25485 5474 1 5 . 1 1 43 43 GLN CA C 43 59.965 59.965 59.335 0.630 25485 5475 1 5 . 1 1 43 43 GLN CB C 43 26.555 26.555 28.467 -1.912 25485 5476 1 5 . 1 1 43 43 GLN H H 43 8.910 8.910 8.699 0.211 25485 5477 1 5 . 1 1 44 44 LYS N N 44 119.165 119.165 118.637 0.528 25485 5478 1 5 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.192 -0.137 25485 5479 1 5 . 1 1 44 44 LYS C C 44 179.991 179.991 178.366 1.625 25485 5480 1 5 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.379 1.182 25485 5481 1 5 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.217 0.081 25485 5482 1 5 . 1 1 44 44 LYS H H 44 8.507 8.507 7.782 0.725 25485 5483 1 5 . 1 1 45 45 PHE N N 45 123.602 123.602 119.812 3.790 25485 5484 1 5 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.336 -0.435 25485 5485 1 5 . 1 1 45 45 PHE C C 45 177.606 177.606 177.189 0.417 25485 5486 1 5 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.855 2.179 25485 5487 1 5 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.260 0.606 25485 5488 1 5 . 1 1 45 45 PHE H H 45 8.445 8.445 7.572 0.873 25485 5489 1 5 . 1 1 46 46 PHE N N 46 112.715 112.715 116.663 -3.948 25485 5490 1 5 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.434 0.163 25485 5491 1 5 . 1 1 46 46 PHE C C 46 175.285 175.285 177.212 -1.927 25485 5492 1 5 . 1 1 46 46 PHE CA C 46 60.675 60.675 60.355 0.320 25485 5493 1 5 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.192 -0.733 25485 5494 1 5 . 1 1 46 46 PHE H H 46 8.272 8.272 7.931 0.341 25485 5495 1 5 . 1 1 47 47 GLY N N 47 110.438 110.438 107.027 3.411 25485 5496 1 5 . 1 1 47 47 GLY C C 47 174.935 174.935 174.432 0.503 25485 5497 1 5 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.237 1.774 25485 5498 1 5 . 1 1 47 47 GLY H H 47 7.926 7.926 8.248 -0.322 25485 5499 1 5 . 1 1 48 48 LEU N N 48 121.830 121.830 119.464 2.366 25485 5500 1 5 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.662 0.262 25485 5501 1 5 . 1 1 48 48 LEU C C 48 174.009 174.009 176.116 -2.107 25485 5502 1 5 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.754 -1.919 25485 5503 1 5 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.892 0.571 25485 5504 1 5 . 1 1 48 48 LEU H H 48 8.762 8.762 7.629 1.133 25485 5505 1 5 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.375 -0.137 25485 5506 1 5 . 1 1 49 49 PRO C C 49 176.874 176.874 176.911 -0.037 25485 5507 1 5 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.924 -0.406 25485 5508 1 5 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.861 -0.782 25485 5509 1 5 . 1 1 50 50 ILE N N 50 126.859 126.859 117.952 8.907 25485 5510 1 5 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.017 0.084 25485 5511 1 5 . 1 1 50 50 ILE C C 50 176.540 176.540 175.464 1.076 25485 5512 1 5 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.027 -1.071 25485 5513 1 5 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.197 -0.804 25485 5514 1 5 . 1 1 50 50 ILE H H 50 8.548 8.548 7.798 0.750 25485 5515 1 5 . 1 1 51 51 THR N N 51 116.443 116.443 122.665 -6.222 25485 5516 1 5 . 1 1 51 51 THR HA H 51 4.584 4.584 4.546 0.038 25485 5517 1 5 . 1 1 51 51 THR C C 51 176.672 176.672 175.345 1.327 25485 5518 1 5 . 1 1 51 51 THR CA C 51 60.979 60.979 60.361 0.618 25485 5519 1 5 . 1 1 51 51 THR CB C 51 71.505 71.505 70.508 0.997 25485 5520 1 5 . 1 1 51 51 THR H H 51 8.001 8.001 7.750 0.251 25485 5521 1 5 . 1 1 52 52 GLY N N 52 112.719 112.719 114.288 -1.569 25485 5522 1 5 . 1 1 52 52 GLY C C 52 170.609 170.609 173.803 -3.194 25485 5523 1 5 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.932 0.814 25485 5524 1 5 . 1 1 52 52 GLY H H 52 9.499 9.499 9.116 0.383 25485 5525 1 5 . 1 1 53 53 MET N N 53 116.621 116.621 117.601 -0.980 25485 5526 1 5 . 1 1 53 53 MET HA H 53 4.023 4.023 4.605 -0.582 25485 5527 1 5 . 1 1 53 53 MET C C 53 174.695 174.695 174.419 0.276 25485 5528 1 5 . 1 1 53 53 MET CA C 53 53.460 53.460 53.902 -0.442 25485 5529 1 5 . 1 1 53 53 MET CB C 53 35.408 35.408 36.145 -0.737 25485 5530 1 5 . 1 1 53 53 MET H H 53 7.993 7.993 7.359 0.634 25485 5531 1 5 . 1 1 54 54 LEU N N 54 122.679 122.679 121.500 1.179 25485 5532 1 5 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.542 -0.791 25485 5533 1 5 . 1 1 54 54 LEU C C 54 174.784 174.784 174.448 0.336 25485 5534 1 5 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.975 -0.674 25485 5535 1 5 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.647 -0.637 25485 5536 1 5 . 1 1 54 54 LEU H H 54 7.940 7.940 8.504 -0.564 25485 5537 1 5 . 1 1 55 55 ASN N N 55 115.797 115.797 119.535 -3.738 25485 5538 1 5 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.664 0.085 25485 5539 1 5 . 1 1 55 55 ASN C C 55 175.459 175.459 174.815 0.644 25485 5540 1 5 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.400 -1.557 25485 5541 1 5 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.361 1.996 25485 5542 1 5 . 1 1 55 55 ASN H H 55 6.543 6.543 8.539 -1.996 25485 5543 1 5 . 1 1 56 56 SER N N 56 121.507 121.507 116.219 5.288 25485 5544 1 5 . 1 1 56 56 SER HA H 56 4.638 4.638 4.293 0.345 25485 5545 1 5 . 1 1 56 56 SER C C 56 175.727 175.727 175.676 0.051 25485 5546 1 5 . 1 1 56 56 SER CA C 56 57.932 57.932 59.665 -1.733 25485 5547 1 5 . 1 1 56 56 SER CB C 56 63.786 63.786 63.404 0.382 25485 5548 1 5 . 1 1 56 56 SER H H 56 8.213 8.213 8.002 0.211 25485 5549 1 5 . 1 1 57 57 ARG N N 57 122.951 122.951 122.925 0.026 25485 5550 1 5 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.516 -0.315 25485 5551 1 5 . 1 1 57 57 ARG C C 57 178.560 178.560 177.896 0.664 25485 5552 1 5 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.348 0.084 25485 5553 1 5 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.999 -0.894 25485 5554 1 5 . 1 1 57 57 ARG H H 57 7.895 7.895 8.662 -0.767 25485 5555 1 5 . 1 1 58 58 VAL N N 58 118.778 118.778 120.220 -1.442 25485 5556 1 5 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.485 -0.153 25485 5557 1 5 . 1 1 58 58 VAL C C 58 177.370 177.370 177.689 -0.319 25485 5558 1 5 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.124 0.258 25485 5559 1 5 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.473 0.736 25485 5560 1 5 . 1 1 58 58 VAL H H 58 7.583 7.583 8.083 -0.500 25485 5561 1 5 . 1 1 59 59 ILE N N 59 119.159 119.159 117.321 1.838 25485 5562 1 5 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.626 -0.213 25485 5563 1 5 . 1 1 59 59 ILE C C 59 177.067 177.067 177.777 -0.710 25485 5564 1 5 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.011 0.622 25485 5565 1 5 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.832 -0.136 25485 5566 1 5 . 1 1 59 59 ILE H H 59 7.323 7.323 7.928 -0.605 25485 5567 1 5 . 1 1 60 60 GLU N N 60 119.367 119.367 120.081 -0.714 25485 5568 1 5 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.905 -0.167 25485 5569 1 5 . 1 1 60 60 GLU C C 60 179.978 179.978 179.132 0.846 25485 5570 1 5 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.888 -0.630 25485 5571 1 5 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.634 -0.246 25485 5572 1 5 . 1 1 60 60 GLU H H 60 7.879 7.879 7.396 0.483 25485 5573 1 5 . 1 1 61 61 ILE N N 61 118.816 118.816 115.591 3.225 25485 5574 1 5 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.838 -0.399 25485 5575 1 5 . 1 1 61 61 ILE C C 61 179.033 179.033 176.395 2.638 25485 5576 1 5 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.222 0.616 25485 5577 1 5 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.921 -1.022 25485 5578 1 5 . 1 1 61 61 ILE H H 61 7.246 7.246 7.521 -0.275 25485 5579 1 5 . 1 1 62 62 MET N N 62 119.986 119.986 115.285 4.701 25485 5580 1 5 . 1 1 62 62 MET HA H 62 3.444 3.444 4.117 -0.673 25485 5581 1 5 . 1 1 62 62 MET C C 62 176.185 176.185 177.643 -1.458 25485 5582 1 5 . 1 1 62 62 MET CA C 62 59.014 59.014 57.089 1.925 25485 5583 1 5 . 1 1 62 62 MET CB C 62 31.250 31.250 32.028 -0.778 25485 5584 1 5 . 1 1 62 62 MET H H 62 7.835 7.835 7.308 0.527 25485 5585 1 5 . 1 1 63 63 GLN N N 63 116.163 116.163 115.859 0.304 25485 5586 1 5 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.255 0.023 25485 5587 1 5 . 1 1 63 63 GLN C C 63 176.727 176.727 176.799 -0.072 25485 5588 1 5 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.313 -0.175 25485 5589 1 5 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.105 -0.039 25485 5590 1 5 . 1 1 63 63 GLN H H 63 7.454 7.454 7.319 0.135 25485 5591 1 5 . 1 1 64 64 LYS N N 64 121.430 121.430 122.384 -0.954 25485 5592 1 5 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.506 0.037 25485 5593 1 5 . 1 1 64 64 LYS C C 64 174.724 174.724 174.955 -0.231 25485 5594 1 5 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.412 1.105 25485 5595 1 5 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.704 -1.107 25485 5596 1 5 . 1 1 64 64 LYS H H 64 7.483 7.483 7.675 -0.192 25485 5597 1 5 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.460 -2.024 25485 5598 1 5 . 1 1 65 65 PRO C C 65 176.158 176.158 175.800 0.358 25485 5599 1 5 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.358 -0.470 25485 5600 1 5 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.711 -0.878 25485 5601 1 5 . 1 1 66 66 ARG N N 66 112.697 112.697 119.994 -7.297 25485 5602 1 5 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.504 -0.096 25485 5603 1 5 . 1 1 66 66 ARG C C 66 174.478 174.478 174.554 -0.076 25485 5604 1 5 . 1 1 66 66 ARG CA C 66 54.636 54.636 57.093 -2.457 25485 5605 1 5 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.621 3.052 25485 5606 1 5 . 1 1 66 66 ARG H H 66 8.146 8.146 8.741 -0.595 25485 5607 1 5 . 1 1 67 67 CYS N N 67 121.740 121.740 117.181 4.559 25485 5608 1 5 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.716 -0.276 25485 5609 1 5 . 1 1 67 67 CYS C C 67 175.659 175.659 175.565 0.094 25485 5610 1 5 . 1 1 67 67 CYS CA C 67 59.195 59.195 56.293 2.902 25485 5611 1 5 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.194 -0.988 25485 5612 1 5 . 1 1 67 67 CYS H H 67 7.757 7.757 7.779 -0.022 25485 5613 1 5 . 1 1 68 68 GLY N N 68 116.217 116.217 111.239 4.978 25485 5614 1 5 . 1 1 68 68 GLY C C 68 172.210 172.210 173.457 -1.247 25485 5615 1 5 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.985 1.574 25485 5616 1 5 . 1 1 68 68 GLY H H 68 9.704 9.704 9.266 0.438 25485 5617 1 5 . 1 1 69 69 VAL N N 69 126.372 126.372 120.578 5.794 25485 5618 1 5 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.369 -0.538 25485 5619 1 5 . 1 1 69 69 VAL C C 69 173.538 173.538 173.760 -0.222 25485 5620 1 5 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.329 3.039 25485 5621 1 5 . 1 1 69 69 VAL CB C 69 32.523 32.523 35.488 -2.965 25485 5622 1 5 . 1 1 69 69 VAL H H 69 9.113 9.113 7.262 1.851 25485 5623 1 5 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.575 0.375 25485 5624 1 5 . 1 1 70 70 PRO C C 70 175.019 175.019 176.152 -1.133 25485 5625 1 5 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.688 0.660 25485 5626 1 5 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.682 -0.324 25485 5627 1 5 . 1 1 71 71 ASP N N 71 118.986 118.986 117.380 1.606 25485 5628 1 5 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.784 -0.351 25485 5629 1 5 . 1 1 71 71 ASP C C 71 175.166 175.166 175.813 -0.647 25485 5630 1 5 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.543 1.825 25485 5631 1 5 . 1 1 71 71 ASP CB C 71 39.864 39.864 42.061 -2.197 25485 5632 1 5 . 1 1 71 71 ASP H H 71 8.054 8.054 8.198 -0.144 25485 5633 1 5 . 1 1 72 72 VAL N N 72 112.953 112.953 117.877 -4.924 25485 5634 1 5 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.412 -0.116 25485 5635 1 5 . 1 1 72 72 VAL C C 72 174.330 174.330 174.200 0.130 25485 5636 1 5 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.529 -0.884 25485 5637 1 5 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.934 -0.062 25485 5638 1 5 . 1 1 72 72 VAL H H 72 6.430 6.430 7.373 -0.943 25485 5639 1 5 . 1 1 73 73 ALA N N 73 125.869 125.869 128.138 -2.269 25485 5640 1 5 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.695 -0.390 25485 5641 1 5 . 1 1 73 73 ALA C C 73 177.382 177.382 176.264 1.118 25485 5642 1 5 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.460 0.589 25485 5643 1 5 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.688 -0.737 25485 5644 1 5 . 1 1 73 73 ALA H H 73 8.177 8.177 7.912 0.265 25485 5645 1 5 . 1 1 74 74 GLU N N 74 120.724 120.724 118.613 2.111 25485 5646 1 5 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.562 -0.459 25485 5647 1 5 . 1 1 74 74 GLU C C 74 176.246 176.246 174.872 1.374 25485 5648 1 5 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.030 0.762 25485 5649 1 5 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.328 -1.543 25485 5650 1 5 . 1 1 74 74 GLU H H 74 8.381 8.381 8.590 -0.209 25485 5651 1 5 . 1 1 75 75 TYR N N 75 121.473 121.473 120.688 0.785 25485 5652 1 5 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.158 0.287 25485 5653 1 5 . 1 1 75 75 TYR C C 75 175.633 175.633 173.952 1.681 25485 5654 1 5 . 1 1 75 75 TYR CA C 75 58.327 58.327 59.395 -1.068 25485 5655 1 5 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.582 -0.169 25485 5656 1 5 . 1 1 75 75 TYR H H 75 8.065 8.065 8.712 -0.647 25485 5657 1 5 . 1 1 76 76 SER N N 76 117.860 117.860 114.378 3.482 25485 5658 1 5 . 1 1 76 76 SER HA H 76 3.886 3.886 3.915 -0.029 25485 5659 1 5 . 1 1 76 76 SER C C 76 173.859 173.859 173.479 0.380 25485 5660 1 5 . 1 1 76 76 SER CA C 76 58.250 58.250 57.954 0.296 25485 5661 1 5 . 1 1 76 76 SER CB C 76 64.117 64.117 62.968 1.149 25485 5662 1 5 . 1 1 76 76 SER H H 76 7.748 7.748 7.334 0.414 25485 5663 1 5 . 1 1 77 77 LEU N N 77 123.789 123.789 124.393 -0.604 25485 5664 1 5 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.192 -0.046 25485 5665 1 5 . 1 1 77 77 LEU C C 77 176.451 176.451 175.946 0.505 25485 5666 1 5 . 1 1 77 77 LEU CA C 77 55.464 55.464 54.131 1.333 25485 5667 1 5 . 1 1 77 77 LEU CB C 77 41.957 41.957 40.332 1.625 25485 5668 1 5 . 1 1 77 77 LEU H H 77 7.979 7.979 8.210 -0.231 25485 5669 1 5 . 1 1 78 78 PHE N N 78 119.275 119.275 122.536 -3.261 25485 5670 1 5 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.289 0.587 25485 5671 1 5 . 1 1 78 78 PHE C C 78 173.844 173.844 175.503 -1.659 25485 5672 1 5 . 1 1 78 78 PHE CA C 78 55.372 55.372 57.673 -2.301 25485 5673 1 5 . 1 1 78 78 PHE CB C 78 39.164 39.164 38.321 0.843 25485 5674 1 5 . 1 1 78 78 PHE H H 78 7.827 7.827 7.736 0.091 25485 5675 1 5 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.375 -0.019 25485 5676 1 5 . 1 1 79 79 PRO C C 79 176.433 176.433 175.958 0.475 25485 5677 1 5 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.435 1.415 25485 5678 1 5 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.592 -0.900 25485 5679 1 5 . 1 1 80 80 ASN N N 80 118.057 118.057 120.032 -1.975 25485 5680 1 5 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.538 0.109 25485 5681 1 5 . 1 1 80 80 ASN C C 80 174.305 174.305 174.834 -0.529 25485 5682 1 5 . 1 1 80 80 ASN CA C 80 52.860 52.860 53.758 -0.898 25485 5683 1 5 . 1 1 80 80 ASN CB C 80 39.583 39.583 37.820 1.763 25485 5684 1 5 . 1 1 80 80 ASN H H 80 8.068 8.068 8.527 -0.460 25485 5685 1 5 . 1 1 81 81 SER HA H 81 4.565 4.565 4.157 0.408 25485 5686 1 5 . 1 1 81 81 SER CA C 81 56.800 56.800 58.663 -1.863 25485 5687 1 5 . 1 1 81 81 SER CB C 81 63.128 63.128 63.632 -0.504 25485 5688 1 5 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.223 0.238 25485 5689 1 5 . 1 1 82 82 PRO C C 82 174.589 174.589 176.070 -1.481 25485 5690 1 5 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.056 -0.410 25485 5691 1 5 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.034 -0.780 25485 5692 1 5 . 1 1 83 83 LYS N N 83 114.578 114.578 117.935 -3.357 25485 5693 1 5 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.458 -0.305 25485 5694 1 5 . 1 1 83 83 LYS C C 83 175.308 175.308 176.554 -1.246 25485 5695 1 5 . 1 1 83 83 LYS CA C 83 54.407 54.407 54.952 -0.545 25485 5696 1 5 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.309 1.109 25485 5697 1 5 . 1 1 83 83 LYS H H 83 7.356 7.356 7.413 -0.057 25485 5698 1 5 . 1 1 84 84 TRP N N 84 122.455 122.455 123.440 -0.985 25485 5699 1 5 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.556 -0.536 25485 5700 1 5 . 1 1 84 84 TRP C C 84 177.636 177.636 177.565 0.071 25485 5701 1 5 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.900 -1.429 25485 5702 1 5 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.709 0.609 25485 5703 1 5 . 1 1 84 84 TRP H H 84 8.050 8.050 8.531 -0.481 25485 5704 1 5 . 1 1 85 85 THR N N 85 113.501 113.501 115.158 -1.657 25485 5705 1 5 . 1 1 85 85 THR HA H 85 4.573 4.573 4.438 0.135 25485 5706 1 5 . 1 1 85 85 THR C C 85 174.757 174.757 175.437 -0.680 25485 5707 1 5 . 1 1 85 85 THR CA C 85 62.130 62.130 61.998 0.132 25485 5708 1 5 . 1 1 85 85 THR CB C 85 69.107 69.107 69.612 -0.505 25485 5709 1 5 . 1 1 85 85 THR H H 85 8.861 8.861 8.645 0.216 25485 5710 1 5 . 1 1 86 86 SER N N 86 117.270 117.270 118.552 -1.282 25485 5711 1 5 . 1 1 86 86 SER HA H 86 4.741 4.741 4.504 0.237 25485 5712 1 5 . 1 1 86 86 SER C C 86 173.457 173.457 175.237 -1.780 25485 5713 1 5 . 1 1 86 86 SER CA C 86 56.739 56.739 58.851 -2.112 25485 5714 1 5 . 1 1 86 86 SER CB C 86 64.717 64.717 64.506 0.211 25485 5715 1 5 . 1 1 86 86 SER H H 86 7.743 7.743 8.374 -0.631 25485 5716 1 5 . 1 1 87 87 LYS N N 87 120.329 120.329 119.729 0.600 25485 5717 1 5 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.461 -0.232 25485 5718 1 5 . 1 1 87 87 LYS CA C 87 57.592 57.592 56.912 0.680 25485 5719 1 5 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.884 -0.761 25485 5720 1 5 . 1 1 87 87 LYS H H 87 8.285 8.285 8.479 -0.194 25485 5721 1 5 . 1 1 88 88 VAL N N 88 117.531 117.531 117.312 0.219 25485 5722 1 5 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.578 0.077 25485 5723 1 5 . 1 1 88 88 VAL C C 88 174.868 174.868 174.121 0.747 25485 5724 1 5 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.795 -0.701 25485 5725 1 5 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.055 -1.360 25485 5726 1 5 . 1 1 88 88 VAL H H 88 7.428 7.428 7.203 0.225 25485 5727 1 5 . 1 1 89 89 VAL N N 89 131.452 131.452 127.748 3.704 25485 5728 1 5 . 1 1 89 89 VAL HA H 89 4.159 4.159 3.907 0.252 25485 5729 1 5 . 1 1 89 89 VAL C C 89 175.758 175.758 174.277 1.481 25485 5730 1 5 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.441 0.280 25485 5731 1 5 . 1 1 89 89 VAL CB C 89 34.173 34.173 33.631 0.542 25485 5732 1 5 . 1 1 89 89 VAL H H 89 8.603 8.603 8.731 -0.128 25485 5733 1 5 . 1 1 90 90 THR N N 90 118.206 118.206 117.319 0.887 25485 5734 1 5 . 1 1 90 90 THR HA H 90 5.649 5.649 5.256 0.393 25485 5735 1 5 . 1 1 90 90 THR C C 90 174.579 174.579 173.421 1.158 25485 5736 1 5 . 1 1 90 90 THR CA C 90 58.959 58.959 59.213 -0.254 25485 5737 1 5 . 1 1 90 90 THR CB C 90 72.288 72.288 72.173 0.115 25485 5738 1 5 . 1 1 90 90 THR H H 90 9.021 9.021 8.177 0.844 25485 5739 1 5 . 1 1 91 91 TYR N N 91 118.117 118.117 115.780 2.337 25485 5740 1 5 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.607 0.091 25485 5741 1 5 . 1 1 91 91 TYR C C 91 171.233 171.233 172.798 -1.565 25485 5742 1 5 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.980 -0.548 25485 5743 1 5 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.265 0.995 25485 5744 1 5 . 1 1 91 91 TYR H H 91 8.555 8.555 8.061 0.494 25485 5745 1 5 . 1 1 92 92 ARG N N 92 120.252 120.252 120.160 0.092 25485 5746 1 5 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.690 0.007 25485 5747 1 5 . 1 1 92 92 ARG C C 92 173.932 173.932 174.711 -0.779 25485 5748 1 5 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.768 0.073 25485 5749 1 5 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.543 0.143 25485 5750 1 5 . 1 1 92 92 ARG H H 92 8.520 8.520 9.050 -0.530 25485 5751 1 5 . 1 1 93 93 ILE N N 93 128.305 128.305 127.346 0.959 25485 5752 1 5 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.293 0.339 25485 5753 1 5 . 1 1 93 93 ILE C C 93 175.468 175.468 176.409 -0.941 25485 5754 1 5 . 1 1 93 93 ILE CA C 93 61.228 61.228 62.261 -1.033 25485 5755 1 5 . 1 1 93 93 ILE CB C 93 37.225 37.225 38.119 -0.894 25485 5756 1 5 . 1 1 93 93 ILE H H 93 8.886 8.886 8.748 0.138 25485 5757 1 5 . 1 1 94 94 VAL N N 94 126.647 126.647 129.191 -2.544 25485 5758 1 5 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.043 -0.047 25485 5759 1 5 . 1 1 94 94 VAL C C 94 175.670 175.670 176.301 -0.631 25485 5760 1 5 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.713 -1.298 25485 5761 1 5 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.499 0.520 25485 5762 1 5 . 1 1 94 94 VAL H H 94 9.517 9.517 8.669 0.848 25485 5763 1 5 . 1 1 95 95 SER N N 95 113.398 113.398 111.406 1.992 25485 5764 1 5 . 1 1 95 95 SER HA H 95 4.701 4.701 4.648 0.053 25485 5765 1 5 . 1 1 95 95 SER C C 95 170.684 170.684 172.543 -1.859 25485 5766 1 5 . 1 1 95 95 SER CA C 95 56.945 56.945 57.619 -0.674 25485 5767 1 5 . 1 1 95 95 SER CB C 95 65.276 65.276 64.734 0.542 25485 5768 1 5 . 1 1 95 95 SER H H 95 7.463 7.463 7.666 -0.203 25485 5769 1 5 . 1 1 96 96 TYR N N 96 116.512 116.512 118.268 -1.756 25485 5770 1 5 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.969 -0.705 25485 5771 1 5 . 1 1 96 96 TYR C C 96 174.856 174.856 173.877 0.979 25485 5772 1 5 . 1 1 96 96 TYR CA C 96 58.637 58.637 55.898 2.739 25485 5773 1 5 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.385 0.778 25485 5774 1 5 . 1 1 96 96 TYR H H 96 8.240 8.240 8.003 0.237 25485 5775 1 5 . 1 1 97 97 THR CA C 97 57.798 57.798 59.893 -2.095 25485 5776 1 5 . 1 1 97 97 THR CB C 97 67.420 67.420 70.056 -2.636 25485 5777 1 5 . 1 1 98 98 ARG N N 98 128.156 128.156 126.853 1.303 25485 5778 1 5 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.022 0.303 25485 5779 1 5 . 1 1 98 98 ARG C C 98 177.625 177.625 176.500 1.125 25485 5780 1 5 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.337 -1.123 25485 5781 1 5 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.505 -0.025 25485 5782 1 5 . 1 1 98 98 ARG H H 98 8.914 8.914 8.565 0.349 25485 5783 1 5 . 1 1 99 99 ASP N N 99 120.592 120.592 119.981 0.611 25485 5784 1 5 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.483 -0.102 25485 5785 1 5 . 1 1 99 99 ASP C C 99 175.679 175.679 175.846 -0.167 25485 5786 1 5 . 1 1 99 99 ASP CA C 99 56.436 56.436 56.391 0.045 25485 5787 1 5 . 1 1 99 99 ASP CB C 99 42.370 42.370 42.108 0.262 25485 5788 1 5 . 1 1 99 99 ASP H H 99 8.708 8.708 7.614 1.094 25485 5789 1 5 . 1 1 100 100 LEU N N 100 116.829 116.829 117.369 -0.540 25485 5790 1 5 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.673 0.283 25485 5791 1 5 . 1 1 100 100 LEU C C 100 173.335 173.335 173.859 -0.524 25485 5792 1 5 . 1 1 100 100 LEU CA C 100 51.037 51.037 52.191 -1.154 25485 5793 1 5 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.516 1.751 25485 5794 1 5 . 1 1 100 100 LEU H H 100 6.916 6.916 7.699 -0.783 25485 5795 1 5 . 1 1 102 102 HIS HA H 102 4.175 4.175 3.984 0.191 25485 5796 1 5 . 1 1 102 102 HIS C C 102 177.649 177.649 177.375 0.274 25485 5797 1 5 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.059 -0.386 25485 5798 1 5 . 1 1 102 102 HIS CB C 102 28.434 28.434 29.767 -1.333 25485 5799 1 5 . 1 1 103 103 ILE N N 103 115.170 115.170 118.177 -3.007 25485 5800 1 5 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.786 0.387 25485 5801 1 5 . 1 1 103 103 ILE C C 103 177.214 177.214 177.174 0.040 25485 5802 1 5 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.113 -0.948 25485 5803 1 5 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.996 -0.231 25485 5804 1 5 . 1 1 103 103 ILE H H 103 8.234 8.234 8.035 0.199 25485 5805 1 5 . 1 1 104 104 THR N N 104 119.374 119.374 117.231 2.143 25485 5806 1 5 . 1 1 104 104 THR HA H 104 4.045 4.045 4.001 0.044 25485 5807 1 5 . 1 1 104 104 THR C C 104 175.612 175.612 176.744 -1.132 25485 5808 1 5 . 1 1 104 104 THR CA C 104 66.568 66.568 66.882 -0.314 25485 5809 1 5 . 1 1 104 104 THR CB C 104 68.077 68.077 68.576 -0.499 25485 5810 1 5 . 1 1 104 104 THR H H 104 6.947 6.947 7.597 -0.650 25485 5811 1 5 . 1 1 105 105 VAL N N 105 123.263 123.263 121.448 1.815 25485 5812 1 5 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.064 0.374 25485 5813 1 5 . 1 1 105 105 VAL C C 105 177.322 177.322 177.051 0.271 25485 5814 1 5 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.230 0.717 25485 5815 1 5 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.651 -0.382 25485 5816 1 5 . 1 1 105 105 VAL H H 105 7.407 7.407 8.138 -0.731 25485 5817 1 5 . 1 1 106 106 ASP N N 106 119.972 119.972 119.434 0.538 25485 5818 1 5 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.426 -0.104 25485 5819 1 5 . 1 1 106 106 ASP C C 106 179.747 179.747 178.234 1.513 25485 5820 1 5 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.382 0.853 25485 5821 1 5 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.814 -0.452 25485 5822 1 5 . 1 1 106 106 ASP H H 106 8.627 8.627 8.050 0.577 25485 5823 1 5 . 1 1 107 107 ARG N N 107 121.033 121.033 118.499 2.534 25485 5824 1 5 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.095 0.083 25485 5825 1 5 . 1 1 107 107 ARG C C 107 179.485 179.485 178.510 0.975 25485 5826 1 5 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.916 0.664 25485 5827 1 5 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.754 0.454 25485 5828 1 5 . 1 1 107 107 ARG H H 107 8.356 8.356 7.865 0.491 25485 5829 1 5 . 1 1 108 108 LEU N N 108 121.463 121.463 120.656 0.807 25485 5830 1 5 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.160 0.145 25485 5831 1 5 . 1 1 108 108 LEU C C 108 178.852 178.852 179.083 -0.231 25485 5832 1 5 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.491 0.391 25485 5833 1 5 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.441 -0.126 25485 5834 1 5 . 1 1 108 108 LEU H H 108 8.790 8.790 7.804 0.986 25485 5835 1 5 . 1 1 109 109 VAL N N 109 120.233 120.233 116.341 3.892 25485 5836 1 5 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.682 -0.282 25485 5837 1 5 . 1 1 109 109 VAL C C 109 177.019 177.019 177.728 -0.709 25485 5838 1 5 . 1 1 109 109 VAL CA C 109 68.046 68.046 67.189 0.857 25485 5839 1 5 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.529 -0.340 25485 5840 1 5 . 1 1 109 109 VAL H H 109 8.787 8.787 7.974 0.813 25485 5841 1 5 . 1 1 110 110 SER N N 110 112.862 112.862 115.307 -2.445 25485 5842 1 5 . 1 1 110 110 SER HA H 110 4.300 4.300 4.012 0.288 25485 5843 1 5 . 1 1 110 110 SER C C 110 176.770 176.770 176.642 0.128 25485 5844 1 5 . 1 1 110 110 SER CA C 110 61.744 61.744 61.721 0.022 25485 5845 1 5 . 1 1 110 110 SER CB C 110 62.742 62.742 62.968 -0.226 25485 5846 1 5 . 1 1 110 110 SER H H 110 7.605 7.605 7.805 -0.200 25485 5847 1 5 . 1 1 111 111 LYS N N 111 122.319 122.319 121.918 0.401 25485 5848 1 5 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.030 0.031 25485 5849 1 5 . 1 1 111 111 LYS C C 111 178.309 178.309 177.953 0.356 25485 5850 1 5 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.166 0.648 25485 5851 1 5 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.549 -0.040 25485 5852 1 5 . 1 1 111 111 LYS H H 111 8.156 8.156 7.881 0.275 25485 5853 1 5 . 1 1 112 112 ALA N N 112 124.147 124.147 120.161 3.986 25485 5854 1 5 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.440 -0.341 25485 5855 1 5 . 1 1 112 112 ALA C C 112 179.445 179.445 179.136 0.309 25485 5856 1 5 . 1 1 112 112 ALA CA C 112 55.226 55.226 53.966 1.260 25485 5857 1 5 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.349 0.625 25485 5858 1 5 . 1 1 112 112 ALA H H 112 8.278 8.278 7.427 0.851 25485 5859 1 5 . 1 1 113 113 LEU N N 113 116.195 116.195 120.378 -4.183 25485 5860 1 5 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.044 -0.293 25485 5861 1 5 . 1 1 113 113 LEU C C 113 179.537 179.537 177.858 1.679 25485 5862 1 5 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.006 -0.262 25485 5863 1 5 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.952 -1.397 25485 5864 1 5 . 1 1 113 113 LEU H H 113 8.021 8.021 8.574 -0.553 25485 5865 1 5 . 1 1 114 114 ASN N N 114 116.570 116.570 117.872 -1.302 25485 5866 1 5 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.088 0.458 25485 5867 1 5 . 1 1 114 114 ASN C C 114 177.136 177.136 177.424 -0.288 25485 5868 1 5 . 1 1 114 114 ASN CA C 114 55.764 55.764 55.865 -0.102 25485 5869 1 5 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.079 0.544 25485 5870 1 5 . 1 1 114 114 ASN H H 114 8.212 8.212 8.087 0.125 25485 5871 1 5 . 1 1 115 115 MET N N 115 122.055 122.055 118.968 3.087 25485 5872 1 5 . 1 1 115 115 MET HA H 115 4.010 4.010 3.949 0.061 25485 5873 1 5 . 1 1 115 115 MET C C 115 177.681 177.681 178.189 -0.508 25485 5874 1 5 . 1 1 115 115 MET CA C 115 59.445 59.445 58.910 0.535 25485 5875 1 5 . 1 1 115 115 MET CB C 115 31.616 31.616 32.147 -0.531 25485 5876 1 5 . 1 1 115 115 MET H H 115 7.937 7.937 7.272 0.665 25485 5877 1 5 . 1 1 116 116 TRP N N 116 117.115 117.115 118.623 -1.508 25485 5878 1 5 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.274 0.244 25485 5879 1 5 . 1 1 116 116 TRP C C 116 179.054 179.054 178.726 0.328 25485 5880 1 5 . 1 1 116 116 TRP CA C 116 59.511 59.511 58.894 0.617 25485 5881 1 5 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.541 1.332 25485 5882 1 5 . 1 1 116 116 TRP H H 116 6.783 6.783 7.433 -0.650 25485 5883 1 5 . 1 1 117 117 GLY N N 117 104.511 104.511 105.602 -1.091 25485 5884 1 5 . 1 1 117 117 GLY C C 117 175.035 175.035 175.215 -0.180 25485 5885 1 5 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.085 0.912 25485 5886 1 5 . 1 1 117 117 GLY H H 117 9.302 9.302 7.565 1.737 25485 5887 1 5 . 1 1 118 118 LYS N N 118 118.580 118.580 119.882 -1.302 25485 5888 1 5 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.016 0.191 25485 5889 1 5 . 1 1 118 118 LYS C C 118 177.235 177.235 177.065 0.170 25485 5890 1 5 . 1 1 118 118 LYS CA C 118 57.891 57.891 58.283 -0.392 25485 5891 1 5 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.890 0.015 25485 5892 1 5 . 1 1 118 118 LYS H H 118 7.940 7.940 7.723 0.217 25485 5893 1 5 . 1 1 119 119 GLU N N 119 113.749 113.749 117.476 -3.727 25485 5894 1 5 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.376 0.462 25485 5895 1 5 . 1 1 119 119 GLU C C 119 178.024 178.024 175.533 2.491 25485 5896 1 5 . 1 1 119 119 GLU CA C 119 55.275 55.275 56.069 -0.793 25485 5897 1 5 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.895 0.791 25485 5898 1 5 . 1 1 119 119 GLU H H 119 7.763 7.763 7.493 0.270 25485 5899 1 5 . 1 1 120 120 ILE N N 120 111.144 111.144 112.539 -1.395 25485 5900 1 5 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.716 0.655 25485 5901 1 5 . 1 1 120 120 ILE C C 120 174.033 174.033 173.572 0.461 25485 5902 1 5 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.577 0.877 25485 5903 1 5 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.589 2.340 25485 5904 1 5 . 1 1 120 120 ILE H H 120 7.518 7.518 7.604 -0.086 25485 5905 1 5 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.382 0.280 25485 5906 1 5 . 1 1 121 121 PRO C C 121 174.784 174.784 176.997 -2.213 25485 5907 1 5 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.575 -1.560 25485 5908 1 5 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.715 -2.330 25485 5909 1 5 . 1 1 122 122 LEU N N 122 121.531 121.531 119.710 1.821 25485 5910 1 5 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.183 0.156 25485 5911 1 5 . 1 1 122 122 LEU C C 122 173.977 173.977 176.517 -2.540 25485 5912 1 5 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.564 -1.006 25485 5913 1 5 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.765 2.634 25485 5914 1 5 . 1 1 122 122 LEU H H 122 6.847 6.847 7.704 -0.857 25485 5915 1 5 . 1 1 123 123 HIS N N 123 121.054 121.054 115.750 5.304 25485 5916 1 5 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.835 -0.228 25485 5917 1 5 . 1 1 123 123 HIS C C 123 172.820 172.820 173.444 -0.624 25485 5918 1 5 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.565 -1.056 25485 5919 1 5 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.610 0.500 25485 5920 1 5 . 1 1 123 123 HIS H H 123 7.760 7.760 8.319 -0.559 25485 5921 1 5 . 1 1 124 124 PHE N N 124 120.465 120.465 122.770 -2.305 25485 5922 1 5 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.536 0.298 25485 5923 1 5 . 1 1 124 124 PHE C C 124 175.677 175.677 175.253 0.424 25485 5924 1 5 . 1 1 124 124 PHE CA C 124 56.292 56.292 56.651 -0.359 25485 5925 1 5 . 1 1 124 124 PHE CB C 124 41.822 41.822 42.359 -0.537 25485 5926 1 5 . 1 1 124 124 PHE H H 124 8.306 8.306 8.637 -0.331 25485 5927 1 5 . 1 1 125 125 ARG N N 125 124.008 124.008 122.827 1.181 25485 5928 1 5 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.787 -0.076 25485 5929 1 5 . 1 1 125 125 ARG C C 125 172.901 172.901 175.303 -2.402 25485 5930 1 5 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.811 -0.537 25485 5931 1 5 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.304 -0.482 25485 5932 1 5 . 1 1 125 125 ARG H H 125 8.426 8.426 8.730 -0.304 25485 5933 1 5 . 1 1 126 126 LYS N N 126 130.004 130.004 124.152 5.852 25485 5934 1 5 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.228 -0.845 25485 5935 1 5 . 1 1 126 126 LYS C C 126 176.126 176.126 175.473 0.653 25485 5936 1 5 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.764 0.417 25485 5937 1 5 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.596 -0.569 25485 5938 1 5 . 1 1 126 126 LYS H H 126 8.481 8.481 8.558 -0.077 25485 5939 1 5 . 1 1 127 127 VAL N N 127 125.288 125.288 120.281 5.007 25485 5940 1 5 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.188 0.317 25485 5941 1 5 . 1 1 127 127 VAL C C 127 175.565 175.565 175.357 0.208 25485 5942 1 5 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.309 -1.360 25485 5943 1 5 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.155 2.207 25485 5944 1 5 . 1 1 127 127 VAL H H 127 8.721 8.721 8.021 0.700 25485 5945 1 5 . 1 1 128 128 VAL N N 128 117.467 117.467 120.457 -2.990 25485 5946 1 5 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.023 0.306 25485 5947 1 5 . 1 1 128 128 VAL C C 128 174.622 174.622 174.783 -0.161 25485 5948 1 5 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.809 0.308 25485 5949 1 5 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.833 0.677 25485 5950 1 5 . 1 1 128 128 VAL H H 128 8.406 8.406 8.052 0.354 25485 5951 1 5 . 1 1 129 129 TRP N N 129 119.986 119.986 121.309 -1.323 25485 5952 1 5 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.836 -0.120 25485 5953 1 5 . 1 1 129 129 TRP C C 129 174.536 174.536 176.280 -1.744 25485 5954 1 5 . 1 1 129 129 TRP CA C 129 55.917 55.917 57.094 -1.177 25485 5955 1 5 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.514 2.500 25485 5956 1 5 . 1 1 129 129 TRP H H 129 7.435 7.435 7.282 0.153 25485 5957 1 5 . 1 1 130 130 GLY N N 130 109.900 109.900 112.871 -2.971 25485 5958 1 5 . 1 1 130 130 GLY C C 130 173.187 173.187 173.753 -0.566 25485 5959 1 5 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.446 0.034 25485 5960 1 5 . 1 1 130 130 GLY H H 130 8.006 8.006 8.362 -0.356 25485 5961 1 5 . 1 1 131 131 THR N N 131 116.142 116.142 114.502 1.640 25485 5962 1 5 . 1 1 131 131 THR HA H 131 4.162 4.162 4.489 -0.327 25485 5963 1 5 . 1 1 131 131 THR C C 131 172.766 172.766 173.420 -0.654 25485 5964 1 5 . 1 1 131 131 THR CA C 131 63.212 63.212 60.904 2.308 25485 5965 1 5 . 1 1 131 131 THR CB C 131 69.308 69.308 70.138 -0.830 25485 5966 1 5 . 1 1 131 131 THR H H 131 8.233 8.233 8.156 0.077 25485 5967 1 5 . 1 1 132 132 ALA N N 132 129.807 129.807 124.132 5.675 25485 5968 1 5 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.549 -0.033 25485 5969 1 5 . 1 1 132 132 ALA C C 132 175.358 175.358 176.364 -1.006 25485 5970 1 5 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.985 -1.619 25485 5971 1 5 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.478 1.320 25485 5972 1 5 . 1 1 132 132 ALA H H 132 7.962 7.962 8.409 -0.447 25485 5973 1 5 . 1 1 133 133 ASP N N 133 122.896 122.896 120.182 2.714 25485 5974 1 5 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.621 -0.200 25485 5975 1 5 . 1 1 133 133 ASP C C 133 177.314 177.314 177.030 0.284 25485 5976 1 5 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.858 1.061 25485 5977 1 5 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.567 -1.096 25485 5978 1 5 . 1 1 133 133 ASP H H 133 8.251 8.251 8.453 -0.202 25485 5979 1 5 . 1 1 134 134 ILE N N 134 125.472 125.472 120.740 4.732 25485 5980 1 5 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.548 -0.405 25485 5981 1 5 . 1 1 134 134 ILE C C 134 174.201 174.201 175.158 -0.957 25485 5982 1 5 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.294 -0.023 25485 5983 1 5 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.169 -0.459 25485 5984 1 5 . 1 1 134 134 ILE H H 134 8.802 8.802 8.051 0.751 25485 5985 1 5 . 1 1 135 135 MET N N 135 127.265 127.265 126.229 1.036 25485 5986 1 5 . 1 1 135 135 MET HA H 135 5.192 5.192 5.480 -0.288 25485 5987 1 5 . 1 1 135 135 MET C C 135 176.206 176.206 175.682 0.524 25485 5988 1 5 . 1 1 135 135 MET CA C 135 53.626 53.626 52.241 1.385 25485 5989 1 5 . 1 1 135 135 MET CB C 135 32.639 32.639 33.935 -1.296 25485 5990 1 5 . 1 1 135 135 MET H H 135 7.418 7.418 9.022 -1.604 25485 5991 1 5 . 1 1 136 136 ILE N N 136 125.440 125.440 124.185 1.255 25485 5992 1 5 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.955 0.634 25485 5993 1 5 . 1 1 136 136 ILE C C 136 175.190 175.190 175.978 -0.788 25485 5994 1 5 . 1 1 136 136 ILE CA C 136 60.108 60.108 59.008 1.100 25485 5995 1 5 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.690 4.250 25485 5996 1 5 . 1 1 136 136 ILE H H 136 9.124 9.124 8.964 0.160 25485 5997 1 5 . 1 1 137 137 GLY N N 137 112.211 112.211 114.214 -2.003 25485 5998 1 5 . 1 1 137 137 GLY C C 137 170.855 170.855 171.813 -0.958 25485 5999 1 5 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.958 1.447 25485 6000 1 5 . 1 1 137 137 GLY H H 137 8.594 8.594 8.072 0.522 25485 6001 1 5 . 1 1 138 138 PHE N N 138 119.463 119.463 119.199 0.264 25485 6002 1 5 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.175 0.321 25485 6003 1 5 . 1 1 138 138 PHE C C 138 175.186 175.186 175.531 -0.345 25485 6004 1 5 . 1 1 138 138 PHE CA C 138 55.995 55.995 56.971 -0.976 25485 6005 1 5 . 1 1 138 138 PHE CB C 138 41.442 41.442 40.989 0.453 25485 6006 1 5 . 1 1 138 138 PHE H H 138 7.857 7.857 8.596 -0.739 25485 6007 1 5 . 1 1 139 139 ALA N N 139 123.914 123.914 126.712 -2.798 25485 6008 1 5 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.686 0.045 25485 6009 1 5 . 1 1 139 139 ALA C C 139 174.613 174.613 175.318 -0.705 25485 6010 1 5 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.133 -1.098 25485 6011 1 5 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.835 1.637 25485 6012 1 5 . 1 1 139 139 ALA H H 139 8.955 8.955 8.814 0.141 25485 6013 1 5 . 1 1 140 140 ARG N N 140 118.339 118.339 120.546 -2.207 25485 6014 1 5 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.852 0.254 25485 6015 1 5 . 1 1 140 140 ARG C C 140 176.201 176.201 177.165 -0.964 25485 6016 1 5 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.728 -0.562 25485 6017 1 5 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.059 1.410 25485 6018 1 5 . 1 1 140 140 ARG H H 140 8.546 8.546 8.475 0.071 25485 6019 1 5 . 1 1 141 141 GLY N N 141 108.916 108.916 107.302 1.614 25485 6020 1 5 . 1 1 141 141 GLY C C 141 175.595 175.595 174.992 0.603 25485 6021 1 5 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.003 -0.713 25485 6022 1 5 . 1 1 141 141 GLY H H 141 8.989 8.989 9.214 -0.225 25485 6023 1 5 . 1 1 142 142 ALA N N 142 121.448 121.448 121.547 -0.099 25485 6024 1 5 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.373 0.035 25485 6025 1 5 . 1 1 142 142 ALA C C 142 177.027 177.027 177.595 -0.568 25485 6026 1 5 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.521 0.756 25485 6027 1 5 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.159 -0.195 25485 6028 1 5 . 1 1 142 142 ALA H H 142 8.642 8.642 8.216 0.426 25485 6029 1 5 . 1 1 143 143 HIS N N 143 120.356 120.356 114.779 5.577 25485 6030 1 5 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.544 0.613 25485 6031 1 5 . 1 1 143 143 HIS C C 143 174.303 174.303 176.071 -1.768 25485 6032 1 5 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.030 0.423 25485 6033 1 5 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.326 -1.535 25485 6034 1 5 . 1 1 143 143 HIS H H 143 8.990 8.990 7.979 1.011 25485 6035 1 5 . 1 1 144 144 GLY N N 144 112.517 112.517 108.210 4.307 25485 6036 1 5 . 1 1 144 144 GLY C C 144 173.758 173.758 173.297 0.461 25485 6037 1 5 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.987 1.108 25485 6038 1 5 . 1 1 144 144 GLY H H 144 5.175 5.175 7.748 -2.573 25485 6039 1 5 . 1 1 145 145 ASP N N 145 117.762 117.762 118.813 -1.051 25485 6040 1 5 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.672 0.026 25485 6041 1 5 . 1 1 145 145 ASP C C 145 175.851 175.851 174.860 0.991 25485 6042 1 5 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.780 -0.821 25485 6043 1 5 . 1 1 145 145 ASP CB C 145 41.799 41.799 41.285 0.514 25485 6044 1 5 . 1 1 145 145 ASP H H 145 7.096 7.096 7.566 -0.470 25485 6045 1 5 . 1 1 146 146 SER N N 146 125.540 125.540 114.137 11.403 25485 6046 1 5 . 1 1 146 146 SER HA H 146 4.204 4.204 4.312 -0.108 25485 6047 1 5 . 1 1 146 146 SER C C 146 172.319 172.319 173.539 -1.220 25485 6048 1 5 . 1 1 146 146 SER CA C 146 58.862 58.862 58.225 0.637 25485 6049 1 5 . 1 1 146 146 SER CB C 146 62.933 62.933 63.297 -0.364 25485 6050 1 5 . 1 1 146 146 SER H H 146 8.261 8.261 8.140 0.121 25485 6051 1 5 . 1 1 147 147 TYR N N 147 120.757 120.757 115.788 4.969 25485 6052 1 5 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.203 0.619 25485 6053 1 5 . 1 1 147 147 TYR C C 147 170.372 170.372 173.914 -3.542 25485 6054 1 5 . 1 1 147 147 TYR CA C 147 53.268 53.268 56.430 -3.162 25485 6055 1 5 . 1 1 147 147 TYR CB C 147 38.296 38.296 36.582 1.714 25485 6056 1 5 . 1 1 147 147 TYR H H 147 7.450 7.450 8.232 -0.781 25485 6057 1 5 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.277 0.595 25485 6058 1 5 . 1 1 148 148 PRO C C 148 179.009 179.009 176.599 2.410 25485 6059 1 5 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.184 1.191 25485 6060 1 5 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.074 -1.165 25485 6061 1 5 . 1 1 149 149 PHE N N 149 120.514 120.514 118.661 1.853 25485 6062 1 5 . 1 1 149 149 PHE C C 149 176.813 176.813 175.631 1.182 25485 6063 1 5 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.408 -0.955 25485 6064 1 5 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.444 0.129 25485 6065 1 5 . 1 1 149 149 PHE H H 149 8.024 8.024 7.553 0.471 25485 6066 1 5 . 1 1 150 150 ASP N N 150 115.555 115.555 116.139 -0.584 25485 6067 1 5 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.369 0.470 25485 6068 1 5 . 1 1 150 150 ASP C C 150 177.007 177.007 176.089 0.918 25485 6069 1 5 . 1 1 150 150 ASP CA C 150 53.871 53.871 55.228 -1.357 25485 6070 1 5 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.533 2.403 25485 6071 1 5 . 1 1 150 150 ASP H H 150 7.511 7.511 7.874 -0.363 25485 6072 1 5 . 1 1 151 151 GLY N N 151 110.650 110.650 109.361 1.289 25485 6073 1 5 . 1 1 151 151 GLY C C 151 170.281 170.281 172.278 -1.997 25485 6074 1 5 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.696 -0.298 25485 6075 1 5 . 1 1 151 151 GLY H H 151 9.080 9.080 8.421 0.659 25485 6076 1 5 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.260 -0.204 25485 6077 1 5 . 1 1 152 152 PRO C C 152 178.300 178.300 176.882 1.418 25485 6078 1 5 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.276 0.574 25485 6079 1 5 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.967 -0.707 25485 6080 1 5 . 1 1 153 153 GLY N N 153 118.783 118.783 112.696 6.087 25485 6081 1 5 . 1 1 153 153 GLY C C 153 174.098 174.098 173.156 0.942 25485 6082 1 5 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.364 -0.758 25485 6083 1 5 . 1 1 153 153 GLY H H 153 11.431 11.431 8.075 3.356 25485 6084 1 5 . 1 1 154 154 ASN N N 154 120.679 120.679 122.409 -1.730 25485 6085 1 5 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.354 -0.110 25485 6086 1 5 . 1 1 154 154 ASN C C 154 174.636 174.636 174.484 0.152 25485 6087 1 5 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.556 2.112 25485 6088 1 5 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.341 -1.370 25485 6089 1 5 . 1 1 154 154 ASN H H 154 9.247 9.247 8.457 0.790 25485 6090 1 5 . 1 1 155 155 THR N N 155 118.252 118.252 111.514 6.738 25485 6091 1 5 . 1 1 155 155 THR HA H 155 5.577 5.577 3.998 1.579 25485 6092 1 5 . 1 1 155 155 THR C C 155 176.596 176.596 172.815 3.781 25485 6093 1 5 . 1 1 155 155 THR CA C 155 61.731 61.731 62.891 -1.160 25485 6094 1 5 . 1 1 155 155 THR CB C 155 71.325 71.325 68.880 2.445 25485 6095 1 5 . 1 1 155 155 THR H H 155 9.501 9.501 8.315 1.186 25485 6096 1 5 . 1 1 156 156 LEU N N 156 122.598 122.598 121.537 1.061 25485 6097 1 5 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.576 0.295 25485 6098 1 5 . 1 1 156 156 LEU C C 156 175.655 175.655 175.754 -0.099 25485 6099 1 5 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.262 -0.724 25485 6100 1 5 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.931 1.580 25485 6101 1 5 . 1 1 156 156 LEU H H 156 8.492 8.492 8.322 0.170 25485 6102 1 5 . 1 1 157 157 ALA N N 157 115.389 115.389 115.723 -0.334 25485 6103 1 5 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.483 0.552 25485 6104 1 5 . 1 1 157 157 ALA C C 157 175.739 175.739 175.092 0.647 25485 6105 1 5 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.504 -0.565 25485 6106 1 5 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.900 1.554 25485 6107 1 5 . 1 1 157 157 ALA H H 157 7.567 7.567 7.760 -0.193 25485 6108 1 5 . 1 1 158 158 HIS N N 158 111.900 111.900 118.355 -6.455 25485 6109 1 5 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.911 -0.306 25485 6110 1 5 . 1 1 158 158 HIS C C 158 170.186 170.186 172.459 -2.273 25485 6111 1 5 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.019 2.056 25485 6112 1 5 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.413 -1.227 25485 6113 1 5 . 1 1 158 158 HIS H H 158 8.757 8.757 7.775 0.982 25485 6114 1 5 . 1 1 159 159 ALA N N 159 118.286 118.286 125.829 -7.543 25485 6115 1 5 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.060 0.594 25485 6116 1 5 . 1 1 159 159 ALA C C 159 174.036 174.036 175.443 -1.407 25485 6117 1 5 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.290 0.843 25485 6118 1 5 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.641 2.396 25485 6119 1 5 . 1 1 159 159 ALA H H 159 6.110 6.110 8.387 -2.277 25485 6120 1 5 . 1 1 160 160 PHE N N 160 117.937 117.937 119.265 -1.328 25485 6121 1 5 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.832 -0.329 25485 6122 1 5 . 1 1 160 160 PHE C C 160 174.455 174.455 175.040 -0.585 25485 6123 1 5 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.330 1.483 25485 6124 1 5 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.705 0.489 25485 6125 1 5 . 1 1 160 160 PHE H H 160 7.912 7.912 8.119 -0.207 25485 6126 1 5 . 1 1 161 161 ALA N N 161 123.531 123.531 122.104 1.427 25485 6127 1 5 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.608 -0.117 25485 6128 1 5 . 1 1 161 161 ALA C C 161 175.503 175.503 175.923 -0.420 25485 6129 1 5 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.106 1.527 25485 6130 1 5 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.542 -2.986 25485 6131 1 5 . 1 1 161 161 ALA H H 161 8.107 8.107 8.492 -0.385 25485 6132 1 5 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.939 -1.029 25485 6133 1 5 . 1 1 162 162 PRO C C 162 173.465 173.465 175.583 -2.118 25485 6134 1 5 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.627 1.630 25485 6135 1 5 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.186 2.055 25485 6136 1 5 . 1 1 163 163 GLY N N 163 107.206 107.206 110.600 -3.394 25485 6137 1 5 . 1 1 163 163 GLY C C 163 172.092 172.092 173.848 -1.756 25485 6138 1 5 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.854 -0.861 25485 6139 1 5 . 1 1 163 163 GLY H H 163 5.997 5.997 7.858 -1.861 25485 6140 1 5 . 1 1 165 165 GLY N N 165 103.110 103.110 108.783 -5.673 25485 6141 1 5 . 1 1 165 165 GLY C C 165 177.158 177.158 174.150 3.008 25485 6142 1 5 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.114 -0.871 25485 6143 1 5 . 1 1 165 165 GLY H H 165 9.145 9.145 8.136 1.009 25485 6144 1 5 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.256 -0.077 25485 6145 1 5 . 1 1 166 166 LEU C C 166 176.437 176.437 177.567 -1.130 25485 6146 1 5 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.157 0.043 25485 6147 1 5 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.330 -0.496 25485 6148 1 5 . 1 1 167 167 GLY N N 167 103.318 103.318 104.372 -1.054 25485 6149 1 5 . 1 1 167 167 GLY C C 167 174.803 174.803 174.518 0.285 25485 6150 1 5 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.821 2.412 25485 6151 1 5 . 1 1 167 167 GLY H H 167 7.768 7.768 7.505 0.263 25485 6152 1 5 . 1 1 168 168 GLY N N 168 121.051 121.051 106.901 14.150 25485 6153 1 5 . 1 1 168 168 GLY C C 168 172.122 172.122 174.070 -1.948 25485 6154 1 5 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.397 1.205 25485 6155 1 5 . 1 1 168 168 GLY H H 168 7.698 7.698 8.130 -0.432 25485 6156 1 5 . 1 1 169 169 ASP N N 169 123.641 123.641 119.865 3.776 25485 6157 1 5 . 1 1 169 169 ASP C C 169 173.942 173.942 173.943 -0.001 25485 6158 1 5 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.284 2.558 25485 6159 1 5 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.621 -2.751 25485 6160 1 5 . 1 1 169 169 ASP H H 169 8.595 8.595 7.630 0.965 25485 6161 1 5 . 1 1 170 170 ALA N N 170 119.366 119.366 119.808 -0.442 25485 6162 1 5 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.448 0.282 25485 6163 1 5 . 1 1 170 170 ALA C C 170 174.593 174.593 175.073 -0.480 25485 6164 1 5 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.841 0.283 25485 6165 1 5 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.497 0.838 25485 6166 1 5 . 1 1 170 170 ALA H H 170 8.324 8.324 8.455 -0.131 25485 6167 1 5 . 1 1 171 171 HIS N N 171 120.239 120.239 121.085 -0.846 25485 6168 1 5 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.225 0.523 25485 6169 1 5 . 1 1 171 171 HIS C C 171 172.949 172.949 173.714 -0.765 25485 6170 1 5 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.231 -2.507 25485 6171 1 5 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.947 1.594 25485 6172 1 5 . 1 1 171 171 HIS H H 171 8.499 8.499 7.782 0.717 25485 6173 1 5 . 1 1 172 172 PHE N N 172 121.125 121.125 121.053 0.072 25485 6174 1 5 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.512 0.016 25485 6175 1 5 . 1 1 172 172 PHE C C 172 173.875 173.875 173.916 -0.041 25485 6176 1 5 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.621 0.299 25485 6177 1 5 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.130 0.773 25485 6178 1 5 . 1 1 172 172 PHE H H 172 8.445 8.445 8.320 0.125 25485 6179 1 5 . 1 1 173 173 ASP N N 173 124.014 124.014 122.834 1.180 25485 6180 1 5 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.940 -1.026 25485 6181 1 5 . 1 1 173 173 ASP C C 173 178.613 178.613 177.915 0.698 25485 6182 1 5 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.450 1.348 25485 6183 1 5 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.127 -0.383 25485 6184 1 5 . 1 1 173 173 ASP H H 173 7.927 7.927 8.553 -0.626 25485 6185 1 5 . 1 1 174 174 GLU N N 174 132.469 132.469 127.375 5.094 25485 6186 1 5 . 1 1 174 174 GLU C C 174 176.442 176.442 177.328 -0.886 25485 6187 1 5 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.888 -1.704 25485 6188 1 5 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.186 1.099 25485 6189 1 5 . 1 1 174 174 GLU H H 174 9.528 9.528 8.669 0.859 25485 6190 1 5 . 1 1 175 175 ASP N N 175 117.394 117.394 118.731 -1.337 25485 6191 1 5 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.708 0.085 25485 6192 1 5 . 1 1 175 175 ASP C C 175 176.645 176.645 176.815 -0.170 25485 6193 1 5 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.422 0.509 25485 6194 1 5 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.672 -1.531 25485 6195 1 5 . 1 1 175 175 ASP H H 175 8.768 8.768 8.692 0.076 25485 6196 1 5 . 1 1 176 176 GLU N N 176 116.493 116.493 118.571 -2.078 25485 6197 1 5 . 1 1 176 176 GLU C C 176 175.038 175.038 175.997 -0.959 25485 6198 1 5 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.724 -2.059 25485 6199 1 5 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.631 -4.408 25485 6200 1 5 . 1 1 176 176 GLU H H 176 7.159 7.159 8.362 -1.203 25485 6201 1 5 . 1 1 177 177 ARG N N 177 122.186 122.186 118.070 4.116 25485 6202 1 5 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.498 0.191 25485 6203 1 5 . 1 1 177 177 ARG C C 177 174.482 174.482 174.315 0.167 25485 6204 1 5 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.704 -1.017 25485 6205 1 5 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.692 -1.607 25485 6206 1 5 . 1 1 177 177 ARG H H 177 7.560 7.560 8.121 -0.561 25485 6207 1 5 . 1 1 178 178 TRP N N 178 129.179 129.179 124.513 4.666 25485 6208 1 5 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.360 -0.260 25485 6209 1 5 . 1 1 178 178 TRP C C 178 176.298 176.298 176.658 -0.360 25485 6210 1 5 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.032 0.781 25485 6211 1 5 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.109 -0.912 25485 6212 1 5 . 1 1 178 178 TRP H H 178 8.807 8.807 8.437 0.370 25485 6213 1 5 . 1 1 179 179 THR N N 179 112.792 112.792 113.071 -0.279 25485 6214 1 5 . 1 1 179 179 THR HA H 179 4.985 4.985 4.578 0.407 25485 6215 1 5 . 1 1 179 179 THR C C 179 172.765 172.765 172.082 0.683 25485 6216 1 5 . 1 1 179 179 THR CA C 179 59.106 59.106 61.890 -2.784 25485 6217 1 5 . 1 1 179 179 THR CB C 179 71.786 71.786 69.858 1.928 25485 6218 1 5 . 1 1 179 179 THR H H 179 8.974 8.974 8.913 0.061 25485 6219 1 5 . 1 1 180 180 ASP N N 180 122.074 122.074 124.921 -2.847 25485 6220 1 5 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.192 -0.729 25485 6221 1 5 . 1 1 180 180 ASP C C 180 176.366 176.366 178.542 -2.176 25485 6222 1 5 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.445 -2.402 25485 6223 1 5 . 1 1 180 180 ASP CB C 180 41.728 41.728 41.930 -0.202 25485 6224 1 5 . 1 1 180 180 ASP H H 180 8.485 8.485 8.799 -0.314 25485 6225 1 5 . 1 1 181 181 GLY N N 181 110.123 110.123 109.101 1.022 25485 6226 1 5 . 1 1 181 181 GLY C C 181 174.325 174.325 175.578 -1.253 25485 6227 1 5 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.734 0.927 25485 6228 1 5 . 1 1 181 181 GLY H H 181 8.569 8.569 8.579 -0.010 25485 6229 1 5 . 1 1 182 182 SER N N 182 115.562 115.562 115.273 0.289 25485 6230 1 5 . 1 1 182 182 SER HA H 182 4.519 4.519 4.613 -0.094 25485 6231 1 5 . 1 1 182 182 SER C C 182 173.783 173.783 173.737 0.046 25485 6232 1 5 . 1 1 182 182 SER CA C 182 57.965 57.965 58.068 -0.103 25485 6233 1 5 . 1 1 182 182 SER CB C 182 64.166 64.166 63.993 0.173 25485 6234 1 5 . 1 1 182 182 SER H H 182 8.160 8.160 7.701 0.459 25485 6235 1 5 . 1 1 183 183 SER N N 183 117.153 117.153 114.947 2.206 25485 6236 1 5 . 1 1 183 183 SER HA H 183 4.275 4.275 4.205 0.070 25485 6237 1 5 . 1 1 183 183 SER C C 183 173.333 173.333 174.783 -1.450 25485 6238 1 5 . 1 1 183 183 SER CA C 183 59.902 59.902 59.069 0.833 25485 6239 1 5 . 1 1 183 183 SER CB C 183 64.941 64.941 62.173 2.768 25485 6240 1 5 . 1 1 183 183 SER H H 183 7.796 7.796 7.723 0.073 25485 6241 1 5 . 1 1 184 184 LEU N N 184 122.351 122.351 119.468 2.883 25485 6242 1 5 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.523 -0.131 25485 6243 1 5 . 1 1 184 184 LEU C C 184 176.250 176.250 176.626 -0.376 25485 6244 1 5 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.895 -0.320 25485 6245 1 5 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.867 -0.785 25485 6246 1 5 . 1 1 184 184 LEU H H 184 8.092 8.092 7.911 0.181 25485 6247 1 5 . 1 1 185 185 GLY N N 185 108.871 108.871 105.083 3.788 25485 6248 1 5 . 1 1 185 185 GLY C C 185 172.375 172.375 173.912 -1.537 25485 6249 1 5 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.027 0.353 25485 6250 1 5 . 1 1 185 185 GLY H H 185 7.960 7.960 7.506 0.454 25485 6251 1 5 . 1 1 186 186 ILE N N 186 123.096 123.096 121.621 1.475 25485 6252 1 5 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.098 -0.257 25485 6253 1 5 . 1 1 186 186 ILE C C 186 175.350 175.350 176.176 -0.826 25485 6254 1 5 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.014 -0.613 25485 6255 1 5 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.060 0.396 25485 6256 1 5 . 1 1 186 186 ILE H H 186 8.893 8.893 8.283 0.610 25485 6257 1 5 . 1 1 187 187 ASN N N 187 127.167 127.167 126.836 0.331 25485 6258 1 5 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.947 -0.594 25485 6259 1 5 . 1 1 187 187 ASN C C 187 175.849 175.849 176.919 -1.070 25485 6260 1 5 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.530 1.184 25485 6261 1 5 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.901 0.229 25485 6262 1 5 . 1 1 187 187 ASN H H 187 8.580 8.580 8.237 0.343 25485 6263 1 5 . 1 1 188 188 PHE N N 188 129.985 129.985 127.366 2.619 25485 6264 1 5 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.377 0.196 25485 6265 1 5 . 1 1 188 188 PHE C C 188 175.578 175.578 177.593 -2.015 25485 6266 1 5 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.141 -0.413 25485 6267 1 5 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.529 -0.097 25485 6268 1 5 . 1 1 188 188 PHE H H 188 9.361 9.361 8.617 0.744 25485 6269 1 5 . 1 1 189 189 LEU N N 189 119.113 119.113 118.732 0.381 25485 6270 1 5 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.177 -0.376 25485 6271 1 5 . 1 1 189 189 LEU C C 189 179.601 179.601 178.405 1.196 25485 6272 1 5 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.358 0.151 25485 6273 1 5 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.281 -1.404 25485 6274 1 5 . 1 1 189 189 LEU H H 189 8.562 8.562 7.867 0.695 25485 6275 1 5 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.691 0.226 25485 6276 1 5 . 1 1 190 190 TYR C C 190 177.621 177.621 177.364 0.257 25485 6277 1 5 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.501 0.307 25485 6278 1 5 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.931 1.838 25485 6279 1 5 . 1 1 191 191 ALA N N 191 120.352 120.352 121.532 -1.180 25485 6280 1 5 . 1 1 191 191 ALA HA H 191 4.315 4.315 3.834 0.481 25485 6281 1 5 . 1 1 191 191 ALA C C 191 180.252 180.252 178.605 1.647 25485 6282 1 5 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.512 0.670 25485 6283 1 5 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.388 0.754 25485 6284 1 5 . 1 1 191 191 ALA H H 191 7.993 7.993 9.009 -1.016 25485 6285 1 5 . 1 1 192 192 ALA N N 192 121.409 121.409 121.417 -0.008 25485 6286 1 5 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.012 0.045 25485 6287 1 5 . 1 1 192 192 ALA C C 192 178.575 178.575 179.556 -0.981 25485 6288 1 5 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.490 -0.305 25485 6289 1 5 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.162 -1.964 25485 6290 1 5 . 1 1 192 192 ALA H H 192 9.297 9.297 8.443 0.854 25485 6291 1 5 . 1 1 193 193 THR N N 193 116.996 116.996 114.152 2.844 25485 6292 1 5 . 1 1 193 193 THR HA H 193 3.833 3.833 4.027 -0.194 25485 6293 1 5 . 1 1 193 193 THR CA C 193 69.138 69.138 67.095 2.043 25485 6294 1 5 . 1 1 193 193 THR CB C 193 67.365 67.365 68.531 -1.167 25485 6295 1 5 . 1 1 193 193 THR H H 193 8.226 8.226 7.644 0.582 25485 6296 1 5 . 1 1 194 194 HIS N N 194 120.296 120.296 121.801 -1.505 25485 6297 1 5 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.020 0.216 25485 6298 1 5 . 1 1 194 194 HIS C C 194 175.962 175.962 176.569 -0.607 25485 6299 1 5 . 1 1 194 194 HIS CA C 194 59.747 59.747 59.506 0.241 25485 6300 1 5 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.802 -1.883 25485 6301 1 5 . 1 1 194 194 HIS H H 194 7.782 7.782 7.361 0.421 25485 6302 1 5 . 1 1 195 195 ALA N N 195 121.290 121.290 122.049 -0.759 25485 6303 1 5 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.925 0.231 25485 6304 1 5 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.991 0.973 25485 6305 1 5 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.495 0.215 25485 6306 1 5 . 1 1 195 195 ALA H H 195 8.690 8.690 8.407 0.283 25485 6307 1 5 . 1 1 196 196 LEU N N 196 114.899 114.899 117.907 -3.008 25485 6308 1 5 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.090 0.080 25485 6309 1 5 . 1 1 196 196 LEU C C 196 177.946 177.946 179.451 -1.505 25485 6310 1 5 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.347 -1.119 25485 6311 1 5 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.993 -1.217 25485 6312 1 5 . 1 1 196 196 LEU H H 196 8.715 8.715 8.858 -0.143 25485 6313 1 5 . 1 1 197 197 GLY N N 197 107.901 107.901 104.952 2.949 25485 6314 1 5 . 1 1 197 197 GLY C C 197 178.641 178.641 175.672 2.969 25485 6315 1 5 . 1 1 197 197 GLY CA C 197 47.567 47.567 47.029 0.538 25485 6316 1 5 . 1 1 197 197 GLY H H 197 7.546 7.546 8.111 -0.565 25485 6317 1 5 . 1 1 198 198 HIS N N 198 122.017 122.017 119.805 2.212 25485 6318 1 5 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.529 0.328 25485 6319 1 5 . 1 1 198 198 HIS C C 198 179.874 179.874 178.403 1.471 25485 6320 1 5 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.645 0.877 25485 6321 1 5 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.324 -1.778 25485 6322 1 5 . 1 1 198 198 HIS H H 198 7.196 7.196 7.295 -0.099 25485 6323 1 5 . 1 1 199 199 SER N N 199 118.486 118.486 114.480 4.006 25485 6324 1 5 . 1 1 199 199 SER HA H 199 4.490 4.490 4.522 -0.032 25485 6325 1 5 . 1 1 199 199 SER C C 199 174.493 174.493 175.454 -0.961 25485 6326 1 5 . 1 1 199 199 SER CA C 199 58.173 58.173 60.114 -1.940 25485 6327 1 5 . 1 1 199 199 SER CB C 199 63.589 63.589 62.984 0.605 25485 6328 1 5 . 1 1 199 199 SER H H 199 7.884 7.884 7.796 0.088 25485 6329 1 5 . 1 1 200 200 LEU N N 200 114.686 114.686 116.361 -1.675 25485 6330 1 5 . 1 1 200 200 LEU C C 200 177.720 177.720 177.197 0.523 25485 6331 1 5 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.589 0.248 25485 6332 1 5 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.983 0.374 25485 6333 1 5 . 1 1 200 200 LEU H H 200 7.108 7.108 7.071 0.037 25485 6334 1 5 . 1 1 201 201 GLY N N 201 108.363 108.363 106.117 2.246 25485 6335 1 5 . 1 1 201 201 GLY C C 201 174.008 174.008 173.621 0.387 25485 6336 1 5 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.279 -0.865 25485 6337 1 5 . 1 1 201 201 GLY H H 201 8.195 8.195 7.882 0.313 25485 6338 1 5 . 1 1 202 202 MET N N 202 119.635 119.635 120.539 -0.904 25485 6339 1 5 . 1 1 202 202 MET HA H 202 4.473 4.473 4.649 -0.176 25485 6340 1 5 . 1 1 202 202 MET C C 202 176.593 176.593 175.030 1.563 25485 6341 1 5 . 1 1 202 202 MET CA C 202 54.500 54.500 54.305 0.195 25485 6342 1 5 . 1 1 202 202 MET CB C 202 32.161 32.161 33.913 -1.752 25485 6343 1 5 . 1 1 202 202 MET H H 202 8.182 8.182 7.497 0.685 25485 6344 1 5 . 1 1 203 203 GLY N N 203 109.749 109.749 111.081 -1.332 25485 6345 1 5 . 1 1 203 203 GLY C C 203 174.042 174.042 173.654 0.388 25485 6346 1 5 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.394 -0.390 25485 6347 1 5 . 1 1 203 203 GLY H H 203 8.405 8.405 8.316 0.089 25485 6348 1 5 . 1 1 204 204 HIS N N 204 115.732 115.732 117.463 -1.731 25485 6349 1 5 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.533 0.867 25485 6350 1 5 . 1 1 204 204 HIS C C 204 174.430 174.430 174.459 -0.029 25485 6351 1 5 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.540 -1.726 25485 6352 1 5 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.763 -0.937 25485 6353 1 5 . 1 1 204 204 HIS H H 204 8.364 8.364 8.725 -0.361 25485 6354 1 5 . 1 1 205 205 SER N N 205 115.484 115.484 114.631 0.853 25485 6355 1 5 . 1 1 205 205 SER HA H 205 4.766 4.766 4.599 0.167 25485 6356 1 5 . 1 1 205 205 SER C C 205 173.611 173.611 175.391 -1.780 25485 6357 1 5 . 1 1 205 205 SER CA C 205 54.729 54.729 56.639 -1.910 25485 6358 1 5 . 1 1 205 205 SER CB C 205 65.855 65.855 65.042 0.813 25485 6359 1 5 . 1 1 205 205 SER H H 205 7.231 7.231 8.346 -1.115 25485 6360 1 5 . 1 1 206 206 SER N N 206 119.263 119.263 119.930 -0.667 25485 6361 1 5 . 1 1 206 206 SER HA H 206 3.701 3.701 4.878 -1.177 25485 6362 1 5 . 1 1 206 206 SER C C 206 173.635 173.635 174.866 -1.231 25485 6363 1 5 . 1 1 206 206 SER CA C 206 63.846 63.846 59.431 4.415 25485 6364 1 5 . 1 1 206 206 SER CB C 206 63.764 63.764 63.629 0.135 25485 6365 1 5 . 1 1 206 206 SER H H 206 8.289 8.289 8.755 -0.466 25485 6366 1 5 . 1 1 207 207 ASP N N 207 126.646 126.646 123.637 3.009 25485 6367 1 5 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.647 0.282 25485 6368 1 5 . 1 1 207 207 ASP C C 207 174.614 174.614 175.116 -0.502 25485 6369 1 5 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.682 -1.410 25485 6370 1 5 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.464 -1.176 25485 6371 1 5 . 1 1 207 207 ASP H H 207 8.541 8.541 8.059 0.482 25485 6372 1 5 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.616 0.171 25485 6373 1 5 . 1 1 208 208 PRO C C 208 177.467 177.467 175.614 1.853 25485 6374 1 5 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.602 -0.766 25485 6375 1 5 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.897 -0.300 25485 6376 1 5 . 1 1 209 209 ASN N N 209 116.020 116.020 114.002 2.018 25485 6377 1 5 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.671 -0.030 25485 6378 1 5 . 1 1 209 209 ASN C C 209 174.695 174.695 173.895 0.800 25485 6379 1 5 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.310 1.910 25485 6380 1 5 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.081 1.029 25485 6381 1 5 . 1 1 209 209 ASN H H 209 8.350 8.350 7.915 0.435 25485 6382 1 5 . 1 1 210 210 ALA N N 210 124.892 124.892 121.733 3.159 25485 6383 1 5 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.453 -0.358 25485 6384 1 5 . 1 1 210 210 ALA C C 210 179.495 179.495 178.230 1.265 25485 6385 1 5 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.912 1.142 25485 6386 1 5 . 1 1 210 210 ALA CB C 210 19.199 19.199 21.075 -1.876 25485 6387 1 5 . 1 1 210 210 ALA H H 210 8.193 8.193 7.133 1.060 25485 6388 1 5 . 1 1 211 211 VAL N N 211 130.402 130.402 123.497 6.905 25485 6389 1 5 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.880 0.383 25485 6390 1 5 . 1 1 211 211 VAL C C 211 179.408 179.408 175.900 3.508 25485 6391 1 5 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.372 -0.320 25485 6392 1 5 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.154 -1.171 25485 6393 1 5 . 1 1 211 211 VAL H H 211 11.592 11.592 8.886 2.706 25485 6394 1 5 . 1 1 212 212 MET N N 212 113.285 113.285 115.971 -2.686 25485 6395 1 5 . 1 1 212 212 MET C C 212 176.996 176.996 174.426 2.570 25485 6396 1 5 . 1 1 212 212 MET CA C 212 53.614 53.614 53.804 -0.190 25485 6397 1 5 . 1 1 212 212 MET CB C 212 26.975 26.975 31.661 -4.686 25485 6398 1 5 . 1 1 212 212 MET H H 212 7.724 7.724 7.570 0.154 25485 6399 1 5 . 1 1 213 213 TYR N N 213 129.919 129.919 122.988 6.931 25485 6400 1 5 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.492 1.204 25485 6401 1 5 . 1 1 213 213 TYR C C 213 178.411 178.411 175.840 2.571 25485 6402 1 5 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.018 0.113 25485 6403 1 5 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.613 0.554 25485 6404 1 5 . 1 1 213 213 TYR H H 213 7.902 7.902 7.374 0.528 25485 6405 1 5 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.587 -1.112 25485 6406 1 5 . 1 1 214 214 PRO C C 214 177.694 177.694 176.767 0.927 25485 6407 1 5 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.303 1.725 25485 6408 1 5 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.980 0.843 25485 6409 1 5 . 1 1 215 215 THR N N 215 104.450 104.450 115.074 -10.624 25485 6410 1 5 . 1 1 215 215 THR HA H 215 4.444 4.444 4.407 0.037 25485 6411 1 5 . 1 1 215 215 THR C C 215 173.429 173.429 173.292 0.137 25485 6412 1 5 . 1 1 215 215 THR CA C 215 60.528 60.528 61.265 -0.737 25485 6413 1 5 . 1 1 215 215 THR CB C 215 69.614 69.614 66.838 2.776 25485 6414 1 5 . 1 1 215 215 THR H H 215 6.407 6.407 7.529 -1.122 25485 6415 1 5 . 1 1 216 216 TYR N N 216 124.618 124.618 125.578 -0.960 25485 6416 1 5 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.453 -0.221 25485 6417 1 5 . 1 1 216 216 TYR C C 216 175.669 175.669 175.302 0.367 25485 6418 1 5 . 1 1 216 216 TYR CA C 216 58.587 58.587 57.887 0.700 25485 6419 1 5 . 1 1 216 216 TYR CB C 216 40.891 40.891 39.076 1.815 25485 6420 1 5 . 1 1 216 216 TYR H H 216 8.331 8.331 7.924 0.407 25485 6421 1 5 . 1 1 217 217 GLY N N 217 116.089 116.089 116.258 -0.169 25485 6422 1 5 . 1 1 217 217 GLY C C 217 173.560 173.560 172.380 1.180 25485 6423 1 5 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.031 0.287 25485 6424 1 5 . 1 1 217 217 GLY H H 217 7.695 7.695 8.654 -0.959 25485 6425 1 5 . 1 1 218 218 ASN N N 218 120.167 120.167 118.379 1.788 25485 6426 1 5 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.769 -0.103 25485 6427 1 5 . 1 1 218 218 ASN C C 218 175.343 175.343 174.679 0.664 25485 6428 1 5 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.711 -0.096 25485 6429 1 5 . 1 1 218 218 ASN CB C 218 38.546 38.546 39.852 -1.306 25485 6430 1 5 . 1 1 218 218 ASN H H 218 8.237 8.237 8.285 -0.048 25485 6431 1 5 . 1 1 219 219 GLY N N 219 109.322 109.322 108.281 1.041 25485 6432 1 5 . 1 1 219 219 GLY C C 219 172.842 172.842 171.968 0.874 25485 6433 1 5 . 1 1 219 219 GLY CA C 219 44.718 44.718 45.227 -0.509 25485 6434 1 5 . 1 1 219 219 GLY H H 219 8.027 8.027 7.686 0.341 25485 6435 1 5 . 1 1 220 220 ASP N N 220 123.006 123.006 121.722 1.284 25485 6436 1 5 . 1 1 220 220 ASP H H 220 8.273 8.273 8.180 0.093 25485 6437 1 5 . 1 1 221 221 PRO C C 221 177.138 177.138 177.512 -0.374 25485 6438 1 5 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.779 -5.716 25485 6439 1 5 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.893 -1.197 25485 6440 1 5 . 1 1 222 222 GLN N N 222 116.718 116.718 122.371 -5.653 25485 6441 1 5 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.280 0.056 25485 6442 1 5 . 1 1 222 222 GLN C C 222 176.321 176.321 175.993 0.328 25485 6443 1 5 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.681 -0.538 25485 6444 1 5 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.245 0.252 25485 6445 1 5 . 1 1 222 222 GLN H H 222 8.240 8.240 8.683 -0.443 25485 6446 1 5 . 1 1 223 223 ASN N N 223 118.368 118.368 116.275 2.093 25485 6447 1 5 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.923 -0.007 25485 6448 1 5 . 1 1 223 223 ASN C C 223 173.271 173.271 174.087 -0.816 25485 6449 1 5 . 1 1 223 223 ASN CA C 223 52.596 52.596 52.239 0.357 25485 6450 1 5 . 1 1 223 223 ASN CB C 223 39.215 39.215 38.687 0.528 25485 6451 1 5 . 1 1 223 223 ASN H H 223 7.946 7.946 8.142 -0.196 25485 6452 1 5 . 1 1 224 224 PHE N N 224 118.429 118.429 118.880 -0.451 25485 6453 1 5 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.501 -0.050 25485 6454 1 5 . 1 1 224 224 PHE C C 224 172.897 172.897 175.123 -2.226 25485 6455 1 5 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.359 0.050 25485 6456 1 5 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.665 0.036 25485 6457 1 5 . 1 1 224 224 PHE H H 224 6.992 6.992 7.654 -0.662 25485 6458 1 5 . 1 1 225 225 LYS N N 225 121.714 121.714 121.586 0.128 25485 6459 1 5 . 1 1 225 225 LYS HA H 225 4.430 4.430 4.027 0.403 25485 6460 1 5 . 1 1 225 225 LYS C C 225 174.664 174.664 175.267 -0.603 25485 6461 1 5 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.490 -0.178 25485 6462 1 5 . 1 1 225 225 LYS CB C 225 34.727 34.727 35.457 -0.730 25485 6463 1 5 . 1 1 225 225 LYS H H 225 7.709 7.709 8.146 -0.437 25485 6464 1 5 . 1 1 226 226 LEU N N 226 119.026 119.026 121.909 -2.883 25485 6465 1 5 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.114 0.026 25485 6466 1 5 . 1 1 226 226 LEU C C 226 177.495 177.495 176.566 0.929 25485 6467 1 5 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.484 0.115 25485 6468 1 5 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.458 -1.177 25485 6469 1 5 . 1 1 226 226 LEU H H 226 8.015 8.015 8.145 -0.130 25485 6470 1 5 . 1 1 227 227 SER N N 227 120.320 120.320 115.974 4.346 25485 6471 1 5 . 1 1 227 227 SER HA H 227 4.600 4.600 4.550 0.050 25485 6472 1 5 . 1 1 227 227 SER C C 227 175.492 175.492 175.581 -0.089 25485 6473 1 5 . 1 1 227 227 SER CA C 227 57.239 57.239 57.077 0.162 25485 6474 1 5 . 1 1 227 227 SER CB C 227 66.278 66.278 64.550 1.728 25485 6475 1 5 . 1 1 227 227 SER H H 227 9.654 9.654 7.971 1.683 25485 6476 1 5 . 1 1 228 228 GLN N N 228 127.511 127.511 124.347 3.164 25485 6477 1 5 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.995 0.699 25485 6478 1 5 . 1 1 228 228 GLN H H 228 8.248 8.248 8.853 -0.605 25485 6479 1 5 . 1 1 229 229 ASP N N 229 124.358 124.358 118.499 5.859 25485 6480 1 5 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.389 -0.015 25485 6481 1 5 . 1 1 229 229 ASP C C 229 178.793 178.793 178.012 0.781 25485 6482 1 5 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.218 0.924 25485 6483 1 5 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.550 2.692 25485 6484 1 5 . 1 1 229 229 ASP H H 229 8.138 8.138 8.469 -0.331 25485 6485 1 5 . 1 1 230 230 ASP N N 230 119.694 119.694 119.713 -0.019 25485 6486 1 5 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.515 -0.093 25485 6487 1 5 . 1 1 230 230 ASP C C 230 177.736 177.736 178.661 -0.925 25485 6488 1 5 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.793 0.129 25485 6489 1 5 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.296 1.940 25485 6490 1 5 . 1 1 230 230 ASP H H 230 7.393 7.393 7.491 -0.098 25485 6491 1 5 . 1 1 231 231 ILE N N 231 120.364 120.364 119.918 0.446 25485 6492 1 5 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.852 -0.187 25485 6493 1 5 . 1 1 231 231 ILE C C 231 177.631 177.631 177.630 0.001 25485 6494 1 5 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.459 0.040 25485 6495 1 5 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.012 0.501 25485 6496 1 5 . 1 1 231 231 ILE H H 231 8.115 8.115 8.080 0.035 25485 6497 1 5 . 1 1 232 232 LYS N N 232 119.156 119.156 120.323 -1.167 25485 6498 1 5 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.054 0.060 25485 6499 1 5 . 1 1 232 232 LYS C C 232 180.574 180.574 179.123 1.451 25485 6500 1 5 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.751 -0.191 25485 6501 1 5 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.655 0.142 25485 6502 1 5 . 1 1 232 232 LYS H H 232 8.607 8.607 8.569 0.038 25485 6503 1 5 . 1 1 233 233 GLY N N 233 106.425 106.425 108.098 -1.673 25485 6504 1 5 . 1 1 233 233 GLY C C 233 176.098 176.098 175.834 0.264 25485 6505 1 5 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.825 0.812 25485 6506 1 5 . 1 1 233 233 GLY H H 233 8.075 8.075 7.742 0.333 25485 6507 1 5 . 1 1 234 234 ILE N N 234 125.119 125.119 121.934 3.185 25485 6508 1 5 . 1 1 234 234 ILE C C 234 178.231 178.231 177.431 0.800 25485 6509 1 5 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.457 -1.864 25485 6510 1 5 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.290 -0.744 25485 6511 1 5 . 1 1 234 234 ILE H H 234 8.539 8.539 7.426 1.113 25485 6512 1 5 . 1 1 235 235 GLN N N 235 122.877 122.877 119.384 3.493 25485 6513 1 5 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.160 0.197 25485 6514 1 5 . 1 1 235 235 GLN C C 235 180.105 180.105 178.438 1.667 25485 6515 1 5 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.417 -1.530 25485 6516 1 5 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.839 -1.302 25485 6517 1 5 . 1 1 235 235 GLN H H 235 8.296 8.296 8.338 -0.042 25485 6518 1 5 . 1 1 236 236 LYS N N 236 123.678 123.678 118.350 5.328 25485 6519 1 5 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.330 -0.248 25485 6520 1 5 . 1 1 236 236 LYS C C 236 178.169 178.169 176.916 1.253 25485 6521 1 5 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.686 0.690 25485 6522 1 5 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.819 0.159 25485 6523 1 5 . 1 1 236 236 LYS H H 236 8.024 8.024 7.932 0.092 25485 6524 1 5 . 1 1 237 237 LEU N N 237 116.873 116.873 118.493 -1.620 25485 6525 1 5 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.300 -0.313 25485 6526 1 5 . 1 1 237 237 LEU C C 237 177.893 177.893 177.706 0.187 25485 6527 1 5 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.356 1.083 25485 6528 1 5 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.267 1.346 25485 6529 1 5 . 1 1 237 237 LEU H H 237 6.888 6.888 7.325 -0.437 25485 6530 1 5 . 1 1 238 238 TYR N N 238 112.237 112.237 117.619 -5.382 25485 6531 1 5 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.495 0.156 25485 6532 1 5 . 1 1 238 238 TYR C C 238 176.082 176.082 177.087 -1.005 25485 6533 1 5 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.267 -0.631 25485 6534 1 5 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.887 1.511 25485 6535 1 5 . 1 1 238 238 TYR H H 238 7.445 7.445 8.464 -1.019 25485 6536 1 5 . 1 1 239 239 GLY N N 239 110.906 110.906 106.826 4.080 25485 6537 1 5 . 1 1 239 239 GLY C C 239 171.269 171.269 172.915 -1.646 25485 6538 1 5 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.125 -1.239 25485 6539 1 5 . 1 1 239 239 GLY H H 239 8.443 8.443 8.066 0.377 25485 6540 1 5 . 1 1 240 240 LYS N N 240 114.281 114.281 122.510 -8.229 25485 6541 1 5 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.543 0.195 25485 6542 1 5 . 1 1 240 240 LYS C C 240 177.527 177.527 177.118 0.409 25485 6543 1 5 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.655 -0.697 25485 6544 1 5 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.709 0.566 25485 6545 1 5 . 1 1 240 240 LYS H H 240 7.873 7.873 8.297 -0.424 25485 6546 1 5 . 1 1 241 241 ARG N N 241 123.758 123.758 123.239 0.519 25485 6547 1 5 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.528 -0.531 25485 6548 1 5 . 1 1 241 241 ARG C C 241 176.026 176.026 175.325 0.701 25485 6549 1 5 . 1 1 241 241 ARG CA C 241 57.492 57.492 56.026 1.466 25485 6550 1 5 . 1 1 241 241 ARG CB C 241 30.371 30.371 31.123 -0.752 25485 6551 1 5 . 1 1 241 241 ARG H H 241 7.742 7.742 8.683 -0.941 25485 6552 1 5 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.646 -0.306 25485 6553 1 5 . 1 1 246 246 LYS C C 246 175.403 175.403 175.316 0.087 25485 6554 1 5 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.308 1.201 25485 6555 1 5 . 1 1 246 246 LYS CB C 246 32.858 32.858 34.330 -1.472 25485 6556 1 6 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.361 -0.054 25485 6557 1 6 . 1 1 2 2 GLN C C 2 176.492 176.492 175.365 1.127 25485 6558 1 6 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.141 0.608 25485 6559 1 6 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.227 0.427 25485 6560 1 6 . 1 1 3 3 GLU N N 3 121.668 121.668 121.834 -0.166 25485 6561 1 6 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.130 -0.341 25485 6562 1 6 . 1 1 3 3 GLU C C 3 176.278 176.278 177.934 -1.656 25485 6563 1 6 . 1 1 3 3 GLU CA C 3 57.059 57.059 58.609 -1.550 25485 6564 1 6 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.635 0.056 25485 6565 1 6 . 1 1 3 3 GLU H H 3 8.331 8.331 8.489 -0.158 25485 6566 1 6 . 1 1 4 4 ALA N N 4 124.493 124.493 121.918 2.575 25485 6567 1 6 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.118 0.392 25485 6568 1 6 . 1 1 4 4 ALA C C 4 178.428 178.428 179.660 -1.232 25485 6569 1 6 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.804 -0.127 25485 6570 1 6 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.045 0.664 25485 6571 1 6 . 1 1 4 4 ALA H H 4 8.131 8.131 8.536 -0.405 25485 6572 1 6 . 1 1 5 5 GLY N N 5 108.204 108.204 106.284 1.920 25485 6573 1 6 . 1 1 5 5 GLY C C 5 174.858 174.858 175.697 -0.839 25485 6574 1 6 . 1 1 5 5 GLY CA C 5 47.661 47.661 45.791 1.870 25485 6575 1 6 . 1 1 5 5 GLY H H 5 8.279 8.279 8.500 -0.221 25485 6576 1 6 . 1 1 6 6 GLY N N 6 108.820 108.820 108.694 0.126 25485 6577 1 6 . 1 1 6 6 GLY C C 6 174.189 174.189 174.449 -0.260 25485 6578 1 6 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.142 0.271 25485 6579 1 6 . 1 1 6 6 GLY H H 6 8.246 8.246 7.724 0.522 25485 6580 1 6 . 1 1 7 7 MET N N 7 119.938 119.938 119.312 0.626 25485 6581 1 6 . 1 1 7 7 MET HA H 7 4.659 4.659 4.640 0.019 25485 6582 1 6 . 1 1 7 7 MET C C 7 176.191 176.191 175.132 1.059 25485 6583 1 6 . 1 1 7 7 MET CA C 7 54.799 54.799 55.337 -0.538 25485 6584 1 6 . 1 1 7 7 MET CB C 7 33.046 33.046 34.582 -1.536 25485 6585 1 6 . 1 1 7 7 MET H H 7 8.005 8.005 7.680 0.325 25485 6586 1 6 . 1 1 8 8 SER N N 8 118.919 118.919 116.314 2.605 25485 6587 1 6 . 1 1 8 8 SER HA H 8 4.239 4.239 4.748 -0.509 25485 6588 1 6 . 1 1 8 8 SER C C 8 174.949 174.949 175.149 -0.200 25485 6589 1 6 . 1 1 8 8 SER CA C 8 58.160 58.160 57.032 1.128 25485 6590 1 6 . 1 1 8 8 SER CB C 8 65.440 65.440 64.680 0.760 25485 6591 1 6 . 1 1 8 8 SER H H 8 8.731 8.731 8.246 0.485 25485 6592 1 6 . 1 1 9 9 GLU N N 9 122.442 122.442 121.611 0.831 25485 6593 1 6 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.064 0.257 25485 6594 1 6 . 1 1 9 9 GLU C C 9 178.604 178.604 178.989 -0.385 25485 6595 1 6 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.551 -0.084 25485 6596 1 6 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.109 0.067 25485 6597 1 6 . 1 1 9 9 GLU H H 9 8.901 8.901 8.950 -0.049 25485 6598 1 6 . 1 1 10 10 LEU N N 10 120.568 120.568 118.191 2.377 25485 6599 1 6 . 1 1 10 10 LEU C C 10 179.307 179.307 179.319 -0.012 25485 6600 1 6 . 1 1 10 10 LEU CA C 10 57.480 57.480 57.740 -0.260 25485 6601 1 6 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.469 0.105 25485 6602 1 6 . 1 1 10 10 LEU H H 10 8.020 8.020 8.097 -0.077 25485 6603 1 6 . 1 1 11 11 GLN N N 11 119.930 119.930 118.817 1.113 25485 6604 1 6 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.079 0.055 25485 6605 1 6 . 1 1 11 11 GLN C C 11 178.330 178.330 178.444 -0.114 25485 6606 1 6 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.615 0.202 25485 6607 1 6 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.389 -0.525 25485 6608 1 6 . 1 1 11 11 GLN H H 11 7.811 7.811 7.742 0.069 25485 6609 1 6 . 1 1 12 12 TRP N N 12 121.031 121.031 120.609 0.422 25485 6610 1 6 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.374 0.040 25485 6611 1 6 . 1 1 12 12 TRP C C 12 178.874 178.874 177.754 1.120 25485 6612 1 6 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.295 0.212 25485 6613 1 6 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.844 -0.457 25485 6614 1 6 . 1 1 12 12 TRP H H 12 8.205 8.205 8.487 -0.282 25485 6615 1 6 . 1 1 13 13 GLU N N 13 121.877 121.877 119.629 2.248 25485 6616 1 6 . 1 1 13 13 GLU C C 13 179.425 179.425 179.219 0.206 25485 6617 1 6 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.921 0.116 25485 6618 1 6 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.459 -0.537 25485 6619 1 6 . 1 1 13 13 GLU H H 13 8.434 8.434 8.054 0.380 25485 6620 1 6 . 1 1 14 14 GLN N N 14 120.449 120.449 119.179 1.270 25485 6621 1 6 . 1 1 14 14 GLN HA H 14 4.238 4.238 4.044 0.194 25485 6622 1 6 . 1 1 14 14 GLN C C 14 179.210 179.210 178.088 1.122 25485 6623 1 6 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.826 0.056 25485 6624 1 6 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.437 -0.687 25485 6625 1 6 . 1 1 14 14 GLN H H 14 8.124 8.124 7.892 0.232 25485 6626 1 6 . 1 1 15 15 ALA N N 15 123.114 123.114 120.999 2.115 25485 6627 1 6 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.682 0.708 25485 6628 1 6 . 1 1 15 15 ALA C C 15 179.352 179.352 179.404 -0.052 25485 6629 1 6 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.026 -0.061 25485 6630 1 6 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.139 0.524 25485 6631 1 6 . 1 1 15 15 ALA H H 15 8.344 8.344 7.383 0.961 25485 6632 1 6 . 1 1 16 16 GLN N N 16 117.718 117.718 116.619 1.099 25485 6633 1 6 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.924 -0.142 25485 6634 1 6 . 1 1 16 16 GLN C C 16 177.719 177.719 178.320 -0.601 25485 6635 1 6 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.674 1.607 25485 6636 1 6 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.592 -0.056 25485 6637 1 6 . 1 1 16 16 GLN H H 16 8.500 8.500 7.441 1.059 25485 6638 1 6 . 1 1 17 17 ASP N N 17 120.040 120.040 120.251 -0.211 25485 6639 1 6 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.402 0.134 25485 6640 1 6 . 1 1 17 17 ASP C C 17 177.630 177.630 178.315 -0.685 25485 6641 1 6 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.684 0.121 25485 6642 1 6 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.993 0.871 25485 6643 1 6 . 1 1 17 17 ASP H H 17 7.871 7.871 7.619 0.252 25485 6644 1 6 . 1 1 18 18 TYR N N 18 122.465 122.465 119.614 2.851 25485 6645 1 6 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.206 -0.016 25485 6646 1 6 . 1 1 18 18 TYR C C 18 178.439 178.439 177.983 0.456 25485 6647 1 6 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.819 1.027 25485 6648 1 6 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.130 1.810 25485 6649 1 6 . 1 1 18 18 TYR H H 18 8.244 8.244 8.282 -0.038 25485 6650 1 6 . 1 1 19 19 LEU N N 19 117.635 117.635 117.069 0.566 25485 6651 1 6 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.807 0.325 25485 6652 1 6 . 1 1 19 19 LEU C C 19 180.940 180.940 177.601 3.339 25485 6653 1 6 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.410 1.095 25485 6654 1 6 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.646 -1.048 25485 6655 1 6 . 1 1 19 19 LEU H H 19 8.713 8.713 7.534 1.179 25485 6656 1 6 . 1 1 20 20 LYS N N 20 124.594 124.594 118.009 6.585 25485 6657 1 6 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.176 -0.092 25485 6658 1 6 . 1 1 20 20 LYS C C 20 178.387 178.387 178.337 0.050 25485 6659 1 6 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.683 1.122 25485 6660 1 6 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.581 -0.125 25485 6661 1 6 . 1 1 20 20 LYS H H 20 8.815 8.815 7.639 1.176 25485 6662 1 6 . 1 1 21 21 ARG N N 21 117.535 117.535 118.102 -0.567 25485 6663 1 6 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.619 -0.900 25485 6664 1 6 . 1 1 21 21 ARG C C 21 178.498 178.498 178.637 -0.139 25485 6665 1 6 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.175 1.069 25485 6666 1 6 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.419 0.022 25485 6667 1 6 . 1 1 21 21 ARG H H 21 7.810 7.810 7.330 0.480 25485 6668 1 6 . 1 1 22 22 PHE N N 22 112.113 112.113 119.458 -7.345 25485 6669 1 6 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.073 0.838 25485 6670 1 6 . 1 1 22 22 PHE C C 22 174.875 174.875 174.746 0.129 25485 6671 1 6 . 1 1 22 22 PHE CA C 22 57.475 57.475 60.706 -3.231 25485 6672 1 6 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.157 0.012 25485 6673 1 6 . 1 1 22 22 PHE H H 22 8.010 8.010 7.422 0.588 25485 6674 1 6 . 1 1 23 23 TYR N N 23 116.187 116.187 115.475 0.712 25485 6675 1 6 . 1 1 23 23 TYR C C 23 173.455 173.455 175.299 -1.844 25485 6676 1 6 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.127 3.300 25485 6677 1 6 . 1 1 23 23 TYR CB C 23 39.529 39.529 37.136 2.393 25485 6678 1 6 . 1 1 23 23 TYR H H 23 7.680 7.680 7.159 0.521 25485 6679 1 6 . 1 1 24 24 LEU N N 24 115.570 115.570 115.935 -0.365 25485 6680 1 6 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.577 0.573 25485 6681 1 6 . 1 1 24 24 LEU C C 24 176.661 176.661 176.030 0.631 25485 6682 1 6 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.070 1.082 25485 6683 1 6 . 1 1 24 24 LEU CB C 24 36.863 36.863 41.073 -4.210 25485 6684 1 6 . 1 1 24 24 LEU H H 24 7.238 7.238 7.410 -0.172 25485 6685 1 6 . 1 1 25 25 TYR N N 25 119.901 119.901 123.391 -3.490 25485 6686 1 6 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.635 -0.276 25485 6687 1 6 . 1 1 25 25 TYR C C 25 173.784 173.784 174.950 -1.166 25485 6688 1 6 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.994 0.253 25485 6689 1 6 . 1 1 25 25 TYR CB C 25 39.079 39.079 37.708 1.371 25485 6690 1 6 . 1 1 25 25 TYR H H 25 7.845 7.845 8.384 -0.539 25485 6691 1 6 . 1 1 26 26 ASP N N 26 129.338 129.338 125.794 3.544 25485 6692 1 6 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.061 -0.610 25485 6693 1 6 . 1 1 26 26 ASP C C 26 175.282 175.282 176.001 -0.719 25485 6694 1 6 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.759 -1.326 25485 6695 1 6 . 1 1 26 26 ASP CB C 26 41.249 41.249 43.248 -1.999 25485 6696 1 6 . 1 1 26 26 ASP H H 26 8.108 8.108 7.989 0.119 25485 6697 1 6 . 1 1 27 27 SER C C 27 175.204 175.204 176.204 -1.000 25485 6698 1 6 . 1 1 27 27 SER CA C 27 59.424 59.424 59.017 0.407 25485 6699 1 6 . 1 1 27 27 SER CB C 27 63.535 63.535 62.922 0.613 25485 6700 1 6 . 1 1 28 28 GLU N N 28 122.058 122.058 121.088 0.970 25485 6701 1 6 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.073 0.252 25485 6702 1 6 . 1 1 28 28 GLU C C 28 177.073 177.073 177.577 -0.504 25485 6703 1 6 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.904 -1.692 25485 6704 1 6 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.493 0.077 25485 6705 1 6 . 1 1 28 28 GLU H H 28 8.255 8.255 8.673 -0.418 25485 6706 1 6 . 1 1 29 29 THR N N 29 114.161 114.161 114.007 0.154 25485 6707 1 6 . 1 1 29 29 THR HA H 29 4.260 4.260 4.205 0.055 25485 6708 1 6 . 1 1 29 29 THR C C 29 174.591 174.591 175.166 -0.575 25485 6709 1 6 . 1 1 29 29 THR CA C 29 61.976 61.976 63.546 -1.570 25485 6710 1 6 . 1 1 29 29 THR CB C 29 69.385 69.385 68.871 0.514 25485 6711 1 6 . 1 1 29 29 THR H H 29 7.498 7.498 7.525 -0.027 25485 6712 1 6 . 1 1 30 30 LYS HA H 30 4.218 4.218 3.976 0.242 25485 6713 1 6 . 1 1 30 30 LYS H H 30 8.218 8.218 8.000 0.218 25485 6714 1 6 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.452 -0.028 25485 6715 1 6 . 1 1 31 31 ASN CB C 31 39.133 39.133 39.028 0.105 25485 6716 1 6 . 1 1 32 32 ALA N N 32 126.484 126.484 124.445 2.039 25485 6717 1 6 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.130 0.166 25485 6718 1 6 . 1 1 32 32 ALA C C 32 178.012 178.012 178.357 -0.345 25485 6719 1 6 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.516 -0.756 25485 6720 1 6 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.148 -0.378 25485 6721 1 6 . 1 1 32 32 ALA H H 32 8.411 8.411 8.584 -0.173 25485 6722 1 6 . 1 1 33 33 ASN N N 33 116.885 116.885 115.242 1.643 25485 6723 1 6 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.565 0.133 25485 6724 1 6 . 1 1 33 33 ASN C C 33 176.240 176.240 176.418 -0.178 25485 6725 1 6 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.595 -1.408 25485 6726 1 6 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.816 -0.231 25485 6727 1 6 . 1 1 33 33 ASN H H 33 8.309 8.309 8.036 0.273 25485 6728 1 6 . 1 1 34 34 SER N N 34 116.836 116.836 115.442 1.394 25485 6729 1 6 . 1 1 34 34 SER HA H 34 4.544 4.544 4.423 0.121 25485 6730 1 6 . 1 1 34 34 SER C C 34 175.253 175.253 175.772 -0.519 25485 6731 1 6 . 1 1 34 34 SER CA C 34 59.583 59.583 60.040 -0.457 25485 6732 1 6 . 1 1 34 34 SER CB C 34 63.919 63.919 63.363 0.556 25485 6733 1 6 . 1 1 34 34 SER H H 34 8.115 8.115 7.463 0.652 25485 6734 1 6 . 1 1 35 35 LEU N N 35 125.355 125.355 124.264 1.091 25485 6735 1 6 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.050 -0.474 25485 6736 1 6 . 1 1 35 35 LEU C C 35 177.973 177.973 177.434 0.539 25485 6737 1 6 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.252 0.245 25485 6738 1 6 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.743 -1.051 25485 6739 1 6 . 1 1 35 35 LEU H H 35 8.312 8.312 7.288 1.024 25485 6740 1 6 . 1 1 36 36 GLU N N 36 119.201 119.201 119.483 -0.282 25485 6741 1 6 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.921 -0.007 25485 6742 1 6 . 1 1 36 36 GLU C C 36 178.141 178.141 178.758 -0.617 25485 6743 1 6 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.389 0.270 25485 6744 1 6 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.558 0.755 25485 6745 1 6 . 1 1 36 36 GLU H H 36 8.225 8.225 8.162 0.063 25485 6746 1 6 . 1 1 37 37 ALA N N 37 120.746 120.746 122.363 -1.617 25485 6747 1 6 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.116 -0.037 25485 6748 1 6 . 1 1 37 37 ALA C C 37 181.485 181.485 179.850 1.635 25485 6749 1 6 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.752 0.707 25485 6750 1 6 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.212 -0.045 25485 6751 1 6 . 1 1 37 37 ALA H H 37 7.917 7.917 7.985 -0.068 25485 6752 1 6 . 1 1 38 38 LYS N N 38 119.326 119.326 119.626 -0.300 25485 6753 1 6 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.196 0.135 25485 6754 1 6 . 1 1 38 38 LYS C C 38 177.946 177.946 179.186 -1.240 25485 6755 1 6 . 1 1 38 38 LYS CA C 38 57.704 57.704 59.089 -1.385 25485 6756 1 6 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.672 -0.873 25485 6757 1 6 . 1 1 38 38 LYS H H 38 8.216 8.216 7.892 0.324 25485 6758 1 6 . 1 1 39 39 LEU N N 39 122.736 122.736 119.379 3.357 25485 6759 1 6 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.976 -0.035 25485 6760 1 6 . 1 1 39 39 LEU C C 39 178.819 178.819 178.813 0.006 25485 6761 1 6 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.274 -0.193 25485 6762 1 6 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.324 -0.696 25485 6763 1 6 . 1 1 39 39 LEU H H 39 8.666 8.666 8.749 -0.083 25485 6764 1 6 . 1 1 40 40 LYS N N 40 118.411 118.411 119.212 -0.801 25485 6765 1 6 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.947 0.691 25485 6766 1 6 . 1 1 40 40 LYS C C 40 179.329 179.329 178.441 0.888 25485 6767 1 6 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.801 0.332 25485 6768 1 6 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.193 -0.408 25485 6769 1 6 . 1 1 40 40 LYS H H 40 8.227 8.227 7.918 0.309 25485 6770 1 6 . 1 1 41 41 GLU N N 41 121.329 121.329 118.291 3.038 25485 6771 1 6 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.122 -0.029 25485 6772 1 6 . 1 1 41 41 GLU C C 41 178.989 178.989 179.056 -0.067 25485 6773 1 6 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.993 0.767 25485 6774 1 6 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.787 1.049 25485 6775 1 6 . 1 1 41 41 GLU H H 41 7.718 7.718 7.640 0.078 25485 6776 1 6 . 1 1 42 42 MET N N 42 123.817 123.817 120.529 3.288 25485 6777 1 6 . 1 1 42 42 MET HA H 42 4.107 4.107 4.389 -0.282 25485 6778 1 6 . 1 1 42 42 MET C C 42 177.719 177.719 178.286 -0.567 25485 6779 1 6 . 1 1 42 42 MET CA C 42 59.912 59.912 58.819 1.093 25485 6780 1 6 . 1 1 42 42 MET CB C 42 30.506 30.506 32.739 -2.233 25485 6781 1 6 . 1 1 42 42 MET H H 42 7.657 7.657 7.588 0.069 25485 6782 1 6 . 1 1 43 43 GLN N N 43 119.998 119.998 118.325 1.673 25485 6783 1 6 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.067 -0.262 25485 6784 1 6 . 1 1 43 43 GLN C C 43 177.604 177.604 178.925 -1.321 25485 6785 1 6 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.729 1.236 25485 6786 1 6 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.662 -1.107 25485 6787 1 6 . 1 1 43 43 GLN H H 43 8.910 8.910 7.954 0.956 25485 6788 1 6 . 1 1 44 44 LYS N N 44 119.165 119.165 119.212 -0.047 25485 6789 1 6 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.242 -0.187 25485 6790 1 6 . 1 1 44 44 LYS C C 44 179.991 179.991 179.123 0.868 25485 6791 1 6 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.270 1.291 25485 6792 1 6 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.088 0.210 25485 6793 1 6 . 1 1 44 44 LYS H H 44 8.507 8.507 7.536 0.971 25485 6794 1 6 . 1 1 45 45 PHE N N 45 123.602 123.602 120.304 3.298 25485 6795 1 6 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.329 -0.427 25485 6796 1 6 . 1 1 45 45 PHE C C 45 177.606 177.606 176.728 0.878 25485 6797 1 6 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.800 2.235 25485 6798 1 6 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.474 0.392 25485 6799 1 6 . 1 1 45 45 PHE H H 45 8.445 8.445 7.749 0.696 25485 6800 1 6 . 1 1 46 46 PHE N N 46 112.715 112.715 116.458 -3.743 25485 6801 1 6 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.398 0.199 25485 6802 1 6 . 1 1 46 46 PHE C C 46 175.285 175.285 177.266 -1.981 25485 6803 1 6 . 1 1 46 46 PHE CA C 46 60.675 60.675 60.757 -0.082 25485 6804 1 6 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.751 -1.292 25485 6805 1 6 . 1 1 46 46 PHE H H 46 8.272 8.272 8.599 -0.327 25485 6806 1 6 . 1 1 47 47 GLY N N 47 110.438 110.438 107.405 3.033 25485 6807 1 6 . 1 1 47 47 GLY C C 47 174.935 174.935 174.176 0.759 25485 6808 1 6 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.351 1.660 25485 6809 1 6 . 1 1 47 47 GLY H H 47 7.926 7.926 8.400 -0.474 25485 6810 1 6 . 1 1 48 48 LEU N N 48 121.830 121.830 119.141 2.689 25485 6811 1 6 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.644 0.280 25485 6812 1 6 . 1 1 48 48 LEU C C 48 174.009 174.009 175.915 -1.906 25485 6813 1 6 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.416 -1.581 25485 6814 1 6 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.987 0.476 25485 6815 1 6 . 1 1 48 48 LEU H H 48 8.762 8.762 7.629 1.133 25485 6816 1 6 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.399 -0.161 25485 6817 1 6 . 1 1 49 49 PRO C C 49 176.874 176.874 176.787 0.087 25485 6818 1 6 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.730 -0.212 25485 6819 1 6 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.895 -0.816 25485 6820 1 6 . 1 1 50 50 ILE N N 50 126.859 126.859 118.289 8.570 25485 6821 1 6 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.045 0.056 25485 6822 1 6 . 1 1 50 50 ILE C C 50 176.540 176.540 175.590 0.950 25485 6823 1 6 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.116 -1.160 25485 6824 1 6 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.111 -0.718 25485 6825 1 6 . 1 1 50 50 ILE H H 50 8.548 8.548 7.849 0.699 25485 6826 1 6 . 1 1 51 51 THR N N 51 116.443 116.443 118.318 -1.875 25485 6827 1 6 . 1 1 51 51 THR HA H 51 4.584 4.584 4.511 0.073 25485 6828 1 6 . 1 1 51 51 THR C C 51 176.672 176.672 175.317 1.355 25485 6829 1 6 . 1 1 51 51 THR CA C 51 60.979 60.979 60.774 0.205 25485 6830 1 6 . 1 1 51 51 THR CB C 51 71.505 71.505 70.588 0.917 25485 6831 1 6 . 1 1 51 51 THR H H 51 8.001 8.001 7.764 0.237 25485 6832 1 6 . 1 1 52 52 GLY N N 52 112.719 112.719 111.130 1.589 25485 6833 1 6 . 1 1 52 52 GLY C C 52 170.609 170.609 174.676 -4.067 25485 6834 1 6 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.922 0.824 25485 6835 1 6 . 1 1 52 52 GLY H H 52 9.499 9.499 8.604 0.895 25485 6836 1 6 . 1 1 53 53 MET N N 53 116.621 116.621 118.377 -1.756 25485 6837 1 6 . 1 1 53 53 MET HA H 53 4.023 4.023 4.546 -0.523 25485 6838 1 6 . 1 1 53 53 MET C C 53 174.695 174.695 174.719 -0.024 25485 6839 1 6 . 1 1 53 53 MET CA C 53 53.460 53.460 54.908 -1.448 25485 6840 1 6 . 1 1 53 53 MET CB C 53 35.408 35.408 34.414 0.994 25485 6841 1 6 . 1 1 53 53 MET H H 53 7.993 7.993 7.446 0.547 25485 6842 1 6 . 1 1 54 54 LEU N N 54 122.679 122.679 121.967 0.712 25485 6843 1 6 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.245 -0.494 25485 6844 1 6 . 1 1 54 54 LEU C C 54 174.784 174.784 174.490 0.294 25485 6845 1 6 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.245 0.056 25485 6846 1 6 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.424 -0.414 25485 6847 1 6 . 1 1 54 54 LEU H H 54 7.940 7.940 8.331 -0.391 25485 6848 1 6 . 1 1 55 55 ASN N N 55 115.797 115.797 118.440 -2.643 25485 6849 1 6 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.699 0.050 25485 6850 1 6 . 1 1 55 55 ASN C C 55 175.459 175.459 175.126 0.333 25485 6851 1 6 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.812 -1.969 25485 6852 1 6 . 1 1 55 55 ASN CB C 55 40.357 40.357 39.386 0.971 25485 6853 1 6 . 1 1 55 55 ASN H H 55 6.543 6.543 8.279 -1.736 25485 6854 1 6 . 1 1 56 56 SER N N 56 121.507 121.507 115.635 5.872 25485 6855 1 6 . 1 1 56 56 SER HA H 56 4.638 4.638 4.408 0.230 25485 6856 1 6 . 1 1 56 56 SER C C 56 175.727 175.727 175.698 0.029 25485 6857 1 6 . 1 1 56 56 SER CA C 56 57.932 57.932 60.239 -2.307 25485 6858 1 6 . 1 1 56 56 SER CB C 56 63.786 63.786 63.524 0.262 25485 6859 1 6 . 1 1 56 56 SER H H 56 8.213 8.213 8.049 0.164 25485 6860 1 6 . 1 1 57 57 ARG N N 57 122.951 122.951 120.961 1.990 25485 6861 1 6 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.311 -0.110 25485 6862 1 6 . 1 1 57 57 ARG C C 57 178.560 178.560 178.293 0.267 25485 6863 1 6 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.543 -0.111 25485 6864 1 6 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.794 -0.689 25485 6865 1 6 . 1 1 57 57 ARG H H 57 7.895 7.895 8.591 -0.696 25485 6866 1 6 . 1 1 58 58 VAL N N 58 118.778 118.778 120.374 -1.596 25485 6867 1 6 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.528 -0.197 25485 6868 1 6 . 1 1 58 58 VAL C C 58 177.370 177.370 177.514 -0.144 25485 6869 1 6 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.107 0.275 25485 6870 1 6 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.092 1.117 25485 6871 1 6 . 1 1 58 58 VAL H H 58 7.583 7.583 8.071 -0.488 25485 6872 1 6 . 1 1 59 59 ILE N N 59 119.159 119.159 117.302 1.857 25485 6873 1 6 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.619 -0.206 25485 6874 1 6 . 1 1 59 59 ILE C C 59 177.067 177.067 177.991 -0.924 25485 6875 1 6 . 1 1 59 59 ILE CA C 59 63.633 63.633 62.773 0.860 25485 6876 1 6 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.740 -0.045 25485 6877 1 6 . 1 1 59 59 ILE H H 59 7.323 7.323 7.989 -0.666 25485 6878 1 6 . 1 1 60 60 GLU N N 60 119.367 119.367 120.072 -0.705 25485 6879 1 6 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.948 -0.210 25485 6880 1 6 . 1 1 60 60 GLU C C 60 179.978 179.978 179.142 0.836 25485 6881 1 6 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.845 -0.587 25485 6882 1 6 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.327 0.061 25485 6883 1 6 . 1 1 60 60 GLU H H 60 7.879 7.879 7.484 0.395 25485 6884 1 6 . 1 1 61 61 ILE N N 61 118.816 118.816 115.367 3.449 25485 6885 1 6 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.979 -0.540 25485 6886 1 6 . 1 1 61 61 ILE C C 61 179.033 179.033 176.741 2.292 25485 6887 1 6 . 1 1 61 61 ILE CA C 61 64.838 64.838 63.616 1.222 25485 6888 1 6 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.711 -0.812 25485 6889 1 6 . 1 1 61 61 ILE H H 61 7.246 7.246 7.477 -0.231 25485 6890 1 6 . 1 1 62 62 MET N N 62 119.986 119.986 117.091 2.895 25485 6891 1 6 . 1 1 62 62 MET HA H 62 3.444 3.444 3.997 -0.553 25485 6892 1 6 . 1 1 62 62 MET C C 62 176.185 176.185 177.904 -1.719 25485 6893 1 6 . 1 1 62 62 MET CA C 62 59.014 59.014 58.055 0.959 25485 6894 1 6 . 1 1 62 62 MET CB C 62 31.250 31.250 32.553 -1.304 25485 6895 1 6 . 1 1 62 62 MET H H 62 7.835 7.835 7.230 0.605 25485 6896 1 6 . 1 1 63 63 GLN N N 63 116.163 116.163 114.265 1.898 25485 6897 1 6 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.306 -0.028 25485 6898 1 6 . 1 1 63 63 GLN C C 63 176.727 176.727 176.636 0.091 25485 6899 1 6 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.299 -0.161 25485 6900 1 6 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.596 -0.530 25485 6901 1 6 . 1 1 63 63 GLN H H 63 7.454 7.454 7.491 -0.037 25485 6902 1 6 . 1 1 64 64 LYS N N 64 121.430 121.430 122.153 -0.723 25485 6903 1 6 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.479 0.064 25485 6904 1 6 . 1 1 64 64 LYS C C 64 174.724 174.724 174.795 -0.071 25485 6905 1 6 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.264 1.253 25485 6906 1 6 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.491 -0.894 25485 6907 1 6 . 1 1 64 64 LYS H H 64 7.483 7.483 7.539 -0.056 25485 6908 1 6 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.643 -2.207 25485 6909 1 6 . 1 1 65 65 PRO C C 65 176.158 176.158 176.529 -0.371 25485 6910 1 6 . 1 1 65 65 PRO CA C 65 62.888 62.888 62.889 -0.001 25485 6911 1 6 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.497 -0.664 25485 6912 1 6 . 1 1 66 66 ARG N N 66 112.697 112.697 120.158 -7.461 25485 6913 1 6 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.486 -0.078 25485 6914 1 6 . 1 1 66 66 ARG C C 66 174.478 174.478 174.486 -0.008 25485 6915 1 6 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.909 -2.273 25485 6916 1 6 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.686 2.987 25485 6917 1 6 . 1 1 66 66 ARG H H 66 8.146 8.146 8.796 -0.650 25485 6918 1 6 . 1 1 67 67 CYS N N 67 121.740 121.740 117.175 4.565 25485 6919 1 6 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.813 -0.373 25485 6920 1 6 . 1 1 67 67 CYS C C 67 175.659 175.659 175.702 -0.043 25485 6921 1 6 . 1 1 67 67 CYS CA C 67 59.195 59.195 56.514 2.681 25485 6922 1 6 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.146 -0.940 25485 6923 1 6 . 1 1 67 67 CYS H H 67 7.757 7.757 7.901 -0.144 25485 6924 1 6 . 1 1 68 68 GLY N N 68 116.217 116.217 112.409 3.808 25485 6925 1 6 . 1 1 68 68 GLY C C 68 172.210 172.210 173.931 -1.721 25485 6926 1 6 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.889 1.670 25485 6927 1 6 . 1 1 68 68 GLY H H 68 9.704 9.704 9.196 0.508 25485 6928 1 6 . 1 1 69 69 VAL N N 69 126.372 126.372 120.774 5.598 25485 6929 1 6 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.412 -0.581 25485 6930 1 6 . 1 1 69 69 VAL C C 69 173.538 173.538 173.932 -0.394 25485 6931 1 6 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.336 3.032 25485 6932 1 6 . 1 1 69 69 VAL CB C 69 32.523 32.523 34.788 -2.265 25485 6933 1 6 . 1 1 69 69 VAL H H 69 9.113 9.113 7.294 1.819 25485 6934 1 6 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.578 0.372 25485 6935 1 6 . 1 1 70 70 PRO C C 70 175.019 175.019 176.094 -1.075 25485 6936 1 6 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.714 0.634 25485 6937 1 6 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.560 -0.202 25485 6938 1 6 . 1 1 71 71 ASP N N 71 118.986 118.986 118.566 0.420 25485 6939 1 6 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.923 -0.490 25485 6940 1 6 . 1 1 71 71 ASP C C 71 175.166 175.166 175.222 -0.056 25485 6941 1 6 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.617 1.751 25485 6942 1 6 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.635 -1.771 25485 6943 1 6 . 1 1 71 71 ASP H H 71 8.054 8.054 8.258 -0.204 25485 6944 1 6 . 1 1 72 72 VAL N N 72 112.953 112.953 114.741 -1.788 25485 6945 1 6 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.425 -0.129 25485 6946 1 6 . 1 1 72 72 VAL C C 72 174.330 174.330 174.416 -0.086 25485 6947 1 6 . 1 1 72 72 VAL CA C 72 59.645 59.645 61.055 -1.410 25485 6948 1 6 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.067 0.805 25485 6949 1 6 . 1 1 72 72 VAL H H 72 6.430 6.430 7.677 -1.247 25485 6950 1 6 . 1 1 73 73 ALA N N 73 125.869 125.869 130.204 -4.335 25485 6951 1 6 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.573 -0.268 25485 6952 1 6 . 1 1 73 73 ALA C C 73 177.382 177.382 175.634 1.748 25485 6953 1 6 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.584 0.465 25485 6954 1 6 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.827 -0.876 25485 6955 1 6 . 1 1 73 73 ALA H H 73 8.177 8.177 8.482 -0.305 25485 6956 1 6 . 1 1 74 74 GLU N N 74 120.724 120.724 119.615 1.109 25485 6957 1 6 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.392 -0.289 25485 6958 1 6 . 1 1 74 74 GLU C C 74 176.246 176.246 174.122 2.124 25485 6959 1 6 . 1 1 74 74 GLU CA C 74 56.792 56.792 55.364 1.429 25485 6960 1 6 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.563 -1.778 25485 6961 1 6 . 1 1 74 74 GLU H H 74 8.381 8.381 8.575 -0.194 25485 6962 1 6 . 1 1 75 75 TYR N N 75 121.473 121.473 122.737 -1.264 25485 6963 1 6 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.177 0.268 25485 6964 1 6 . 1 1 75 75 TYR C C 75 175.633 175.633 174.602 1.031 25485 6965 1 6 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.164 0.163 25485 6966 1 6 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.900 -0.487 25485 6967 1 6 . 1 1 75 75 TYR H H 75 8.065 8.065 8.473 -0.408 25485 6968 1 6 . 1 1 76 76 SER N N 76 117.860 117.860 120.702 -2.842 25485 6969 1 6 . 1 1 76 76 SER HA H 76 3.886 3.886 4.418 -0.532 25485 6970 1 6 . 1 1 76 76 SER C C 76 173.859 173.859 173.188 0.671 25485 6971 1 6 . 1 1 76 76 SER CA C 76 58.250 58.250 58.272 -0.022 25485 6972 1 6 . 1 1 76 76 SER CB C 76 64.117 64.117 63.975 0.142 25485 6973 1 6 . 1 1 76 76 SER H H 76 7.748 7.748 8.512 -0.764 25485 6974 1 6 . 1 1 77 77 LEU N N 77 123.789 123.789 121.547 2.242 25485 6975 1 6 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.060 0.086 25485 6976 1 6 . 1 1 77 77 LEU C C 77 176.451 176.451 175.382 1.069 25485 6977 1 6 . 1 1 77 77 LEU CA C 77 55.464 55.464 55.788 -0.324 25485 6978 1 6 . 1 1 77 77 LEU CB C 77 41.957 41.957 41.320 0.637 25485 6979 1 6 . 1 1 77 77 LEU H H 77 7.979 7.979 8.617 -0.638 25485 6980 1 6 . 1 1 78 78 PHE N N 78 119.275 119.275 119.346 -0.071 25485 6981 1 6 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.726 0.150 25485 6982 1 6 . 1 1 78 78 PHE C C 78 173.844 173.844 175.230 -1.386 25485 6983 1 6 . 1 1 78 78 PHE CA C 78 55.372 55.372 55.210 0.162 25485 6984 1 6 . 1 1 78 78 PHE CB C 78 39.164 39.164 39.136 0.028 25485 6985 1 6 . 1 1 78 78 PHE H H 78 7.827 7.827 7.843 -0.016 25485 6986 1 6 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.565 -0.209 25485 6987 1 6 . 1 1 79 79 PRO C C 79 176.433 176.433 175.384 1.049 25485 6988 1 6 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.578 1.272 25485 6989 1 6 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.749 -1.057 25485 6990 1 6 . 1 1 80 80 ASN N N 80 118.057 118.057 119.432 -1.375 25485 6991 1 6 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.871 -0.224 25485 6992 1 6 . 1 1 80 80 ASN C C 80 174.305 174.305 175.363 -1.058 25485 6993 1 6 . 1 1 80 80 ASN CA C 80 52.860 52.860 52.818 0.042 25485 6994 1 6 . 1 1 80 80 ASN CB C 80 39.583 39.583 39.504 0.079 25485 6995 1 6 . 1 1 80 80 ASN H H 80 8.068 8.068 8.361 -0.293 25485 6996 1 6 . 1 1 81 81 SER HA H 81 4.565 4.565 4.393 0.172 25485 6997 1 6 . 1 1 81 81 SER CA C 81 56.800 56.800 58.179 -1.379 25485 6998 1 6 . 1 1 81 81 SER CB C 81 63.128 63.128 63.048 0.080 25485 6999 1 6 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.431 0.030 25485 7000 1 6 . 1 1 82 82 PRO C C 82 174.589 174.589 176.379 -1.790 25485 7001 1 6 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.504 -0.858 25485 7002 1 6 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.085 -0.831 25485 7003 1 6 . 1 1 83 83 LYS N N 83 114.578 114.578 119.034 -4.456 25485 7004 1 6 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.640 -0.487 25485 7005 1 6 . 1 1 83 83 LYS C C 83 175.308 175.308 177.755 -2.447 25485 7006 1 6 . 1 1 83 83 LYS CA C 83 54.407 54.407 56.003 -1.596 25485 7007 1 6 . 1 1 83 83 LYS CB C 83 34.418 34.418 32.608 1.810 25485 7008 1 6 . 1 1 83 83 LYS H H 83 7.356 7.356 7.656 -0.300 25485 7009 1 6 . 1 1 84 84 TRP N N 84 122.455 122.455 124.930 -2.475 25485 7010 1 6 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.606 -0.586 25485 7011 1 6 . 1 1 84 84 TRP C C 84 177.636 177.636 177.349 0.287 25485 7012 1 6 . 1 1 84 84 TRP CA C 84 57.471 57.471 57.724 -0.253 25485 7013 1 6 . 1 1 84 84 TRP CB C 84 30.318 30.318 28.115 2.203 25485 7014 1 6 . 1 1 84 84 TRP H H 84 8.050 8.050 8.405 -0.355 25485 7015 1 6 . 1 1 85 85 THR N N 85 113.501 113.501 116.138 -2.637 25485 7016 1 6 . 1 1 85 85 THR HA H 85 4.573 4.573 4.500 0.073 25485 7017 1 6 . 1 1 85 85 THR C C 85 174.757 174.757 174.866 -0.109 25485 7018 1 6 . 1 1 85 85 THR CA C 85 62.130 62.130 61.507 0.623 25485 7019 1 6 . 1 1 85 85 THR CB C 85 69.107 69.107 69.299 -0.192 25485 7020 1 6 . 1 1 85 85 THR H H 85 8.861 8.861 8.495 0.366 25485 7021 1 6 . 1 1 86 86 SER N N 86 117.270 117.270 118.075 -0.805 25485 7022 1 6 . 1 1 86 86 SER HA H 86 4.741 4.741 4.487 0.254 25485 7023 1 6 . 1 1 86 86 SER C C 86 173.457 173.457 174.631 -1.174 25485 7024 1 6 . 1 1 86 86 SER CA C 86 56.739 56.739 58.669 -1.930 25485 7025 1 6 . 1 1 86 86 SER CB C 86 64.717 64.717 63.986 0.731 25485 7026 1 6 . 1 1 86 86 SER H H 86 7.743 7.743 7.902 -0.159 25485 7027 1 6 . 1 1 87 87 LYS N N 87 120.329 120.329 119.850 0.479 25485 7028 1 6 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.205 0.024 25485 7029 1 6 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.761 -0.169 25485 7030 1 6 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.612 -0.489 25485 7031 1 6 . 1 1 87 87 LYS H H 87 8.285 8.285 8.414 -0.129 25485 7032 1 6 . 1 1 88 88 VAL N N 88 117.531 117.531 116.503 1.028 25485 7033 1 6 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.865 -0.210 25485 7034 1 6 . 1 1 88 88 VAL C C 88 174.868 174.868 173.880 0.988 25485 7035 1 6 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.248 -0.153 25485 7036 1 6 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.048 -1.353 25485 7037 1 6 . 1 1 88 88 VAL H H 88 7.428 7.428 7.333 0.095 25485 7038 1 6 . 1 1 89 89 VAL N N 89 131.452 131.452 124.528 6.924 25485 7039 1 6 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.359 -0.200 25485 7040 1 6 . 1 1 89 89 VAL C C 89 175.758 175.758 175.051 0.707 25485 7041 1 6 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.410 0.311 25485 7042 1 6 . 1 1 89 89 VAL CB C 89 34.173 34.173 33.962 0.211 25485 7043 1 6 . 1 1 89 89 VAL H H 89 8.603 8.603 8.392 0.211 25485 7044 1 6 . 1 1 90 90 THR N N 90 118.206 118.206 116.301 1.905 25485 7045 1 6 . 1 1 90 90 THR HA H 90 5.649 5.649 5.642 0.007 25485 7046 1 6 . 1 1 90 90 THR C C 90 174.579 174.579 173.772 0.807 25485 7047 1 6 . 1 1 90 90 THR CA C 90 58.959 58.959 59.264 -0.305 25485 7048 1 6 . 1 1 90 90 THR CB C 90 72.288 72.288 72.522 -0.234 25485 7049 1 6 . 1 1 90 90 THR H H 90 9.021 9.021 8.130 0.891 25485 7050 1 6 . 1 1 91 91 TYR N N 91 118.117 118.117 115.731 2.386 25485 7051 1 6 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.564 0.134 25485 7052 1 6 . 1 1 91 91 TYR C C 91 171.233 171.233 172.772 -1.539 25485 7053 1 6 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.884 -0.452 25485 7054 1 6 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.082 1.178 25485 7055 1 6 . 1 1 91 91 TYR H H 91 8.555 8.555 8.039 0.516 25485 7056 1 6 . 1 1 92 92 ARG N N 92 120.252 120.252 120.031 0.221 25485 7057 1 6 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.624 0.073 25485 7058 1 6 . 1 1 92 92 ARG C C 92 173.932 173.932 174.169 -0.237 25485 7059 1 6 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.536 0.305 25485 7060 1 6 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.772 -0.086 25485 7061 1 6 . 1 1 92 92 ARG H H 92 8.520 8.520 8.638 -0.118 25485 7062 1 6 . 1 1 93 93 ILE N N 93 128.305 128.305 126.188 2.117 25485 7063 1 6 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.334 0.298 25485 7064 1 6 . 1 1 93 93 ILE C C 93 175.468 175.468 176.625 -1.157 25485 7065 1 6 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.102 1.126 25485 7066 1 6 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.081 1.144 25485 7067 1 6 . 1 1 93 93 ILE H H 93 8.886 8.886 8.738 0.148 25485 7068 1 6 . 1 1 94 94 VAL N N 94 126.647 126.647 128.104 -1.457 25485 7069 1 6 . 1 1 94 94 VAL HA H 94 3.996 3.996 3.980 0.016 25485 7070 1 6 . 1 1 94 94 VAL C C 94 175.670 175.670 176.500 -0.830 25485 7071 1 6 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.401 -0.987 25485 7072 1 6 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.565 0.454 25485 7073 1 6 . 1 1 94 94 VAL H H 94 9.517 9.517 8.741 0.776 25485 7074 1 6 . 1 1 95 95 SER N N 95 113.398 113.398 111.637 1.761 25485 7075 1 6 . 1 1 95 95 SER HA H 95 4.701 4.701 4.644 0.057 25485 7076 1 6 . 1 1 95 95 SER C C 95 170.684 170.684 172.544 -1.860 25485 7077 1 6 . 1 1 95 95 SER CA C 95 56.945 56.945 57.215 -0.270 25485 7078 1 6 . 1 1 95 95 SER CB C 95 65.276 65.276 64.968 0.308 25485 7079 1 6 . 1 1 95 95 SER H H 95 7.463 7.463 7.714 -0.251 25485 7080 1 6 . 1 1 96 96 TYR N N 96 116.512 116.512 117.073 -0.561 25485 7081 1 6 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.888 -0.624 25485 7082 1 6 . 1 1 96 96 TYR C C 96 174.856 174.856 173.899 0.957 25485 7083 1 6 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.562 2.075 25485 7084 1 6 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.454 0.709 25485 7085 1 6 . 1 1 96 96 TYR H H 96 8.240 8.240 8.062 0.178 25485 7086 1 6 . 1 1 97 97 THR CA C 97 57.798 57.798 60.294 -2.496 25485 7087 1 6 . 1 1 97 97 THR CB C 97 67.420 67.420 69.912 -2.492 25485 7088 1 6 . 1 1 98 98 ARG N N 98 128.156 128.156 127.517 0.639 25485 7089 1 6 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.028 0.297 25485 7090 1 6 . 1 1 98 98 ARG C C 98 177.625 177.625 177.188 0.437 25485 7091 1 6 . 1 1 98 98 ARG CA C 98 57.214 57.214 57.997 -0.783 25485 7092 1 6 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.479 0.001 25485 7093 1 6 . 1 1 98 98 ARG H H 98 8.914 8.914 8.814 0.100 25485 7094 1 6 . 1 1 99 99 ASP N N 99 120.592 120.592 119.748 0.844 25485 7095 1 6 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.456 -0.075 25485 7096 1 6 . 1 1 99 99 ASP C C 99 175.679 175.679 176.370 -0.691 25485 7097 1 6 . 1 1 99 99 ASP CA C 99 56.436 56.436 56.402 0.034 25485 7098 1 6 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.927 0.443 25485 7099 1 6 . 1 1 99 99 ASP H H 99 8.708 8.708 7.598 1.110 25485 7100 1 6 . 1 1 100 100 LEU N N 100 116.829 116.829 117.419 -0.590 25485 7101 1 6 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.658 0.298 25485 7102 1 6 . 1 1 100 100 LEU C C 100 173.335 173.335 173.872 -0.537 25485 7103 1 6 . 1 1 100 100 LEU CA C 100 51.037 51.037 52.135 -1.098 25485 7104 1 6 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.767 1.500 25485 7105 1 6 . 1 1 100 100 LEU H H 100 6.916 6.916 7.638 -0.722 25485 7106 1 6 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.148 0.027 25485 7107 1 6 . 1 1 102 102 HIS C C 102 177.649 177.649 177.559 0.090 25485 7108 1 6 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.267 -0.593 25485 7109 1 6 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.003 -1.569 25485 7110 1 6 . 1 1 103 103 ILE N N 103 115.170 115.170 118.381 -3.211 25485 7111 1 6 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.841 0.332 25485 7112 1 6 . 1 1 103 103 ILE C C 103 177.214 177.214 177.182 0.032 25485 7113 1 6 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.240 -1.075 25485 7114 1 6 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.998 -0.233 25485 7115 1 6 . 1 1 103 103 ILE H H 103 8.234 8.234 8.130 0.104 25485 7116 1 6 . 1 1 104 104 THR N N 104 119.374 119.374 117.301 2.073 25485 7117 1 6 . 1 1 104 104 THR HA H 104 4.045 4.045 4.040 0.005 25485 7118 1 6 . 1 1 104 104 THR C C 104 175.612 175.612 176.699 -1.087 25485 7119 1 6 . 1 1 104 104 THR CA C 104 66.568 66.568 66.774 -0.206 25485 7120 1 6 . 1 1 104 104 THR CB C 104 68.077 68.077 68.561 -0.484 25485 7121 1 6 . 1 1 104 104 THR H H 104 6.947 6.947 7.597 -0.650 25485 7122 1 6 . 1 1 105 105 VAL N N 105 123.263 123.263 121.311 1.952 25485 7123 1 6 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.176 0.262 25485 7124 1 6 . 1 1 105 105 VAL C C 105 177.322 177.322 177.555 -0.233 25485 7125 1 6 . 1 1 105 105 VAL CA C 105 67.947 67.947 65.768 2.179 25485 7126 1 6 . 1 1 105 105 VAL CB C 105 31.269 31.269 30.837 0.432 25485 7127 1 6 . 1 1 105 105 VAL H H 105 7.407 7.407 8.235 -0.828 25485 7128 1 6 . 1 1 106 106 ASP N N 106 119.972 119.972 119.605 0.367 25485 7129 1 6 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.436 -0.114 25485 7130 1 6 . 1 1 106 106 ASP C C 106 179.747 179.747 178.635 1.112 25485 7131 1 6 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.603 0.632 25485 7132 1 6 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.923 -0.561 25485 7133 1 6 . 1 1 106 106 ASP H H 106 8.627 8.627 8.058 0.569 25485 7134 1 6 . 1 1 107 107 ARG N N 107 121.033 121.033 118.374 2.659 25485 7135 1 6 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.123 0.055 25485 7136 1 6 . 1 1 107 107 ARG C C 107 179.485 179.485 178.626 0.859 25485 7137 1 6 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.980 0.600 25485 7138 1 6 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.737 0.471 25485 7139 1 6 . 1 1 107 107 ARG H H 107 8.356 8.356 7.807 0.549 25485 7140 1 6 . 1 1 108 108 LEU N N 108 121.463 121.463 121.164 0.299 25485 7141 1 6 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.159 0.146 25485 7142 1 6 . 1 1 108 108 LEU C C 108 178.852 178.852 178.956 -0.104 25485 7143 1 6 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.561 0.321 25485 7144 1 6 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.425 -0.111 25485 7145 1 6 . 1 1 108 108 LEU H H 108 8.790 8.790 7.800 0.990 25485 7146 1 6 . 1 1 109 109 VAL N N 109 120.233 120.233 116.283 3.950 25485 7147 1 6 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.663 -0.263 25485 7148 1 6 . 1 1 109 109 VAL C C 109 177.019 177.019 177.688 -0.669 25485 7149 1 6 . 1 1 109 109 VAL CA C 109 68.046 68.046 67.010 1.036 25485 7150 1 6 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.202 -0.013 25485 7151 1 6 . 1 1 109 109 VAL H H 109 8.787 8.787 8.221 0.566 25485 7152 1 6 . 1 1 110 110 SER N N 110 112.862 112.862 116.203 -3.341 25485 7153 1 6 . 1 1 110 110 SER HA H 110 4.300 4.300 4.164 0.136 25485 7154 1 6 . 1 1 110 110 SER C C 110 176.770 176.770 176.877 -0.107 25485 7155 1 6 . 1 1 110 110 SER CA C 110 61.744 61.744 61.525 0.219 25485 7156 1 6 . 1 1 110 110 SER CB C 110 62.742 62.742 62.861 -0.119 25485 7157 1 6 . 1 1 110 110 SER H H 110 7.605 7.605 7.925 -0.320 25485 7158 1 6 . 1 1 111 111 LYS N N 111 122.319 122.319 121.872 0.447 25485 7159 1 6 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.127 -0.066 25485 7160 1 6 . 1 1 111 111 LYS C C 111 178.309 178.309 178.209 0.100 25485 7161 1 6 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.289 0.525 25485 7162 1 6 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.523 -0.014 25485 7163 1 6 . 1 1 111 111 LYS H H 111 8.156 8.156 7.930 0.226 25485 7164 1 6 . 1 1 112 112 ALA N N 112 124.147 124.147 120.732 3.415 25485 7165 1 6 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.435 -0.336 25485 7166 1 6 . 1 1 112 112 ALA C C 112 179.445 179.445 178.842 0.603 25485 7167 1 6 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.112 1.114 25485 7168 1 6 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.511 0.463 25485 7169 1 6 . 1 1 112 112 ALA H H 112 8.278 8.278 7.475 0.803 25485 7170 1 6 . 1 1 113 113 LEU N N 113 116.195 116.195 120.641 -4.446 25485 7171 1 6 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.095 -0.344 25485 7172 1 6 . 1 1 113 113 LEU C C 113 179.537 179.537 177.983 1.554 25485 7173 1 6 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.107 -0.363 25485 7174 1 6 . 1 1 113 113 LEU CB C 113 40.555 40.555 42.044 -1.489 25485 7175 1 6 . 1 1 113 113 LEU H H 113 8.021 8.021 8.607 -0.586 25485 7176 1 6 . 1 1 114 114 ASN N N 114 116.570 116.570 117.604 -1.034 25485 7177 1 6 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.571 -0.025 25485 7178 1 6 . 1 1 114 114 ASN C C 114 177.136 177.136 177.597 -0.461 25485 7179 1 6 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.300 -0.536 25485 7180 1 6 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.577 0.046 25485 7181 1 6 . 1 1 114 114 ASN H H 114 8.212 8.212 8.361 -0.149 25485 7182 1 6 . 1 1 115 115 MET N N 115 122.055 122.055 119.000 3.055 25485 7183 1 6 . 1 1 115 115 MET HA H 115 4.010 4.010 3.991 0.019 25485 7184 1 6 . 1 1 115 115 MET C C 115 177.681 177.681 177.709 -0.028 25485 7185 1 6 . 1 1 115 115 MET CA C 115 59.445 59.445 58.747 0.698 25485 7186 1 6 . 1 1 115 115 MET CB C 115 31.616 31.616 32.240 -0.624 25485 7187 1 6 . 1 1 115 115 MET H H 115 7.937 7.937 7.726 0.211 25485 7188 1 6 . 1 1 116 116 TRP N N 116 117.115 117.115 118.797 -1.682 25485 7189 1 6 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.262 0.256 25485 7190 1 6 . 1 1 116 116 TRP C C 116 179.054 179.054 179.408 -0.354 25485 7191 1 6 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.038 0.473 25485 7192 1 6 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.276 1.597 25485 7193 1 6 . 1 1 116 116 TRP H H 116 6.783 6.783 7.496 -0.713 25485 7194 1 6 . 1 1 117 117 GLY N N 117 104.511 104.511 106.287 -1.776 25485 7195 1 6 . 1 1 117 117 GLY C C 117 175.035 175.035 175.855 -0.820 25485 7196 1 6 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.303 0.694 25485 7197 1 6 . 1 1 117 117 GLY H H 117 9.302 9.302 7.909 1.393 25485 7198 1 6 . 1 1 118 118 LYS N N 118 118.580 118.580 119.846 -1.266 25485 7199 1 6 . 1 1 118 118 LYS HA H 118 4.207 4.207 3.999 0.208 25485 7200 1 6 . 1 1 118 118 LYS C C 118 177.235 177.235 177.327 -0.092 25485 7201 1 6 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.932 -0.041 25485 7202 1 6 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.419 -0.514 25485 7203 1 6 . 1 1 118 118 LYS H H 118 7.940 7.940 7.678 0.262 25485 7204 1 6 . 1 1 119 119 GLU N N 119 113.749 113.749 116.475 -2.726 25485 7205 1 6 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.370 0.468 25485 7206 1 6 . 1 1 119 119 GLU C C 119 178.024 178.024 175.314 2.710 25485 7207 1 6 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.923 -0.648 25485 7208 1 6 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.860 0.826 25485 7209 1 6 . 1 1 119 119 GLU H H 119 7.763 7.763 7.543 0.220 25485 7210 1 6 . 1 1 120 120 ILE N N 120 111.144 111.144 113.286 -2.142 25485 7211 1 6 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.624 0.747 25485 7212 1 6 . 1 1 120 120 ILE C C 120 174.033 174.033 174.224 -0.191 25485 7213 1 6 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.610 0.844 25485 7214 1 6 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.877 2.052 25485 7215 1 6 . 1 1 120 120 ILE H H 120 7.518 7.518 7.496 0.022 25485 7216 1 6 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.424 0.238 25485 7217 1 6 . 1 1 121 121 PRO C C 121 174.784 174.784 176.372 -1.588 25485 7218 1 6 . 1 1 121 121 PRO CA C 121 62.015 62.015 62.956 -0.941 25485 7219 1 6 . 1 1 121 121 PRO CB C 121 29.385 29.385 30.057 -0.672 25485 7220 1 6 . 1 1 122 122 LEU N N 122 121.531 121.531 119.200 2.331 25485 7221 1 6 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.480 -0.141 25485 7222 1 6 . 1 1 122 122 LEU C C 122 173.977 173.977 176.744 -2.767 25485 7223 1 6 . 1 1 122 122 LEU CA C 122 54.558 54.558 54.495 0.063 25485 7224 1 6 . 1 1 122 122 LEU CB C 122 45.399 45.399 43.103 2.296 25485 7225 1 6 . 1 1 122 122 LEU H H 122 6.847 6.847 7.413 -0.566 25485 7226 1 6 . 1 1 123 123 HIS N N 123 121.054 121.054 118.327 2.727 25485 7227 1 6 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.797 -0.190 25485 7228 1 6 . 1 1 123 123 HIS C C 123 172.820 172.820 173.850 -1.030 25485 7229 1 6 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.182 -0.673 25485 7230 1 6 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.545 0.565 25485 7231 1 6 . 1 1 123 123 HIS H H 123 7.760 7.760 8.739 -0.979 25485 7232 1 6 . 1 1 124 124 PHE N N 124 120.465 120.465 124.692 -4.227 25485 7233 1 6 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.355 0.479 25485 7234 1 6 . 1 1 124 124 PHE C C 124 175.677 175.677 175.576 0.101 25485 7235 1 6 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.667 0.625 25485 7236 1 6 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.395 0.427 25485 7237 1 6 . 1 1 124 124 PHE H H 124 8.306 8.306 8.796 -0.490 25485 7238 1 6 . 1 1 125 125 ARG N N 125 124.008 124.008 123.907 0.101 25485 7239 1 6 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.849 -0.138 25485 7240 1 6 . 1 1 125 125 ARG C C 125 172.901 172.901 175.285 -2.384 25485 7241 1 6 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.813 -0.539 25485 7242 1 6 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.336 -0.514 25485 7243 1 6 . 1 1 125 125 ARG H H 125 8.426 8.426 9.180 -0.754 25485 7244 1 6 . 1 1 126 126 LYS N N 126 130.004 130.004 123.976 6.028 25485 7245 1 6 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.175 -0.792 25485 7246 1 6 . 1 1 126 126 LYS C C 126 176.126 176.126 175.830 0.296 25485 7247 1 6 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.646 0.535 25485 7248 1 6 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.959 -0.932 25485 7249 1 6 . 1 1 126 126 LYS H H 126 8.481 8.481 8.609 -0.128 25485 7250 1 6 . 1 1 127 127 VAL N N 127 125.288 125.288 118.617 6.671 25485 7251 1 6 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.188 0.317 25485 7252 1 6 . 1 1 127 127 VAL C C 127 175.565 175.565 174.994 0.571 25485 7253 1 6 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.845 -1.896 25485 7254 1 6 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.028 2.334 25485 7255 1 6 . 1 1 127 127 VAL H H 127 8.721 8.721 8.150 0.571 25485 7256 1 6 . 1 1 128 128 VAL N N 128 117.467 117.467 119.334 -1.867 25485 7257 1 6 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.008 0.321 25485 7258 1 6 . 1 1 128 128 VAL C C 128 174.622 174.622 175.094 -0.472 25485 7259 1 6 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.360 0.758 25485 7260 1 6 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.238 0.272 25485 7261 1 6 . 1 1 128 128 VAL H H 128 8.406 8.406 8.004 0.402 25485 7262 1 6 . 1 1 129 129 TRP N N 129 119.986 119.986 120.642 -0.656 25485 7263 1 6 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.800 -0.084 25485 7264 1 6 . 1 1 129 129 TRP C C 129 174.536 174.536 176.235 -1.699 25485 7265 1 6 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.714 -0.797 25485 7266 1 6 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.548 2.466 25485 7267 1 6 . 1 1 129 129 TRP H H 129 7.435 7.435 7.299 0.136 25485 7268 1 6 . 1 1 130 130 GLY N N 130 109.900 109.900 113.717 -3.817 25485 7269 1 6 . 1 1 130 130 GLY C C 130 173.187 173.187 173.350 -0.163 25485 7270 1 6 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.353 0.126 25485 7271 1 6 . 1 1 130 130 GLY H H 130 8.006 8.006 8.187 -0.181 25485 7272 1 6 . 1 1 131 131 THR N N 131 116.142 116.142 115.058 1.084 25485 7273 1 6 . 1 1 131 131 THR HA H 131 4.162 4.162 4.519 -0.357 25485 7274 1 6 . 1 1 131 131 THR C C 131 172.766 172.766 173.665 -0.899 25485 7275 1 6 . 1 1 131 131 THR CA C 131 63.212 63.212 61.724 1.488 25485 7276 1 6 . 1 1 131 131 THR CB C 131 69.308 69.308 70.219 -0.910 25485 7277 1 6 . 1 1 131 131 THR H H 131 8.233 8.233 8.257 -0.024 25485 7278 1 6 . 1 1 132 132 ALA N N 132 129.807 129.807 124.106 5.701 25485 7279 1 6 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.534 -0.018 25485 7280 1 6 . 1 1 132 132 ALA C C 132 175.358 175.358 176.772 -1.414 25485 7281 1 6 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.070 -0.704 25485 7282 1 6 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.475 1.323 25485 7283 1 6 . 1 1 132 132 ALA H H 132 7.962 7.962 8.418 -0.456 25485 7284 1 6 . 1 1 133 133 ASP N N 133 122.896 122.896 119.592 3.304 25485 7285 1 6 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.473 -0.052 25485 7286 1 6 . 1 1 133 133 ASP C C 133 177.314 177.314 176.706 0.608 25485 7287 1 6 . 1 1 133 133 ASP CA C 133 57.919 57.919 57.175 0.744 25485 7288 1 6 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.492 -1.021 25485 7289 1 6 . 1 1 133 133 ASP H H 133 8.251 8.251 8.282 -0.031 25485 7290 1 6 . 1 1 134 134 ILE N N 134 125.472 125.472 121.110 4.362 25485 7291 1 6 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.440 -0.297 25485 7292 1 6 . 1 1 134 134 ILE C C 134 174.201 174.201 174.807 -0.606 25485 7293 1 6 . 1 1 134 134 ILE CA C 134 61.271 61.271 60.462 0.809 25485 7294 1 6 . 1 1 134 134 ILE CB C 134 38.710 38.710 38.437 0.273 25485 7295 1 6 . 1 1 134 134 ILE H H 134 8.802 8.802 7.967 0.835 25485 7296 1 6 . 1 1 135 135 MET N N 135 127.265 127.265 127.385 -0.120 25485 7297 1 6 . 1 1 135 135 MET HA H 135 5.192 5.192 5.182 0.010 25485 7298 1 6 . 1 1 135 135 MET C C 135 176.206 176.206 175.390 0.816 25485 7299 1 6 . 1 1 135 135 MET CA C 135 53.626 53.626 53.211 0.416 25485 7300 1 6 . 1 1 135 135 MET CB C 135 32.639 32.639 34.261 -1.622 25485 7301 1 6 . 1 1 135 135 MET H H 135 7.418 7.418 8.320 -0.902 25485 7302 1 6 . 1 1 136 136 ILE N N 136 125.440 125.440 123.988 1.452 25485 7303 1 6 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.889 0.700 25485 7304 1 6 . 1 1 136 136 ILE C C 136 175.190 175.190 175.682 -0.492 25485 7305 1 6 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.816 1.292 25485 7306 1 6 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.604 4.336 25485 7307 1 6 . 1 1 136 136 ILE H H 136 9.124 9.124 8.911 0.213 25485 7308 1 6 . 1 1 137 137 GLY N N 137 112.211 112.211 114.458 -2.247 25485 7309 1 6 . 1 1 137 137 GLY C C 137 170.855 170.855 171.957 -1.102 25485 7310 1 6 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.328 1.077 25485 7311 1 6 . 1 1 137 137 GLY H H 137 8.594 8.594 8.273 0.321 25485 7312 1 6 . 1 1 138 138 PHE N N 138 119.463 119.463 119.269 0.194 25485 7313 1 6 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.392 0.104 25485 7314 1 6 . 1 1 138 138 PHE C C 138 175.186 175.186 175.256 -0.070 25485 7315 1 6 . 1 1 138 138 PHE CA C 138 55.995 55.995 56.827 -0.832 25485 7316 1 6 . 1 1 138 138 PHE CB C 138 41.442 41.442 42.102 -0.660 25485 7317 1 6 . 1 1 138 138 PHE H H 138 7.857 7.857 8.144 -0.287 25485 7318 1 6 . 1 1 139 139 ALA N N 139 123.914 123.914 124.755 -0.841 25485 7319 1 6 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.608 0.123 25485 7320 1 6 . 1 1 139 139 ALA C C 139 174.613 174.613 175.242 -0.629 25485 7321 1 6 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.359 -1.324 25485 7322 1 6 . 1 1 139 139 ALA CB C 139 22.472 22.472 21.020 1.452 25485 7323 1 6 . 1 1 139 139 ALA H H 139 8.955 8.955 8.445 0.510 25485 7324 1 6 . 1 1 140 140 ARG N N 140 118.339 118.339 120.326 -1.987 25485 7325 1 6 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.976 0.130 25485 7326 1 6 . 1 1 140 140 ARG C C 140 176.201 176.201 178.295 -2.094 25485 7327 1 6 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.975 -0.809 25485 7328 1 6 . 1 1 140 140 ARG CB C 140 33.469 33.469 33.118 0.351 25485 7329 1 6 . 1 1 140 140 ARG H H 140 8.546 8.546 8.472 0.074 25485 7330 1 6 . 1 1 141 141 GLY N N 141 108.916 108.916 108.871 0.045 25485 7331 1 6 . 1 1 141 141 GLY C C 141 175.595 175.595 175.277 0.318 25485 7332 1 6 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.351 -1.061 25485 7333 1 6 . 1 1 141 141 GLY H H 141 8.989 8.989 9.085 -0.096 25485 7334 1 6 . 1 1 142 142 ALA N N 142 121.448 121.448 122.807 -1.359 25485 7335 1 6 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.392 0.016 25485 7336 1 6 . 1 1 142 142 ALA C C 142 177.027 177.027 177.733 -0.706 25485 7337 1 6 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.651 0.626 25485 7338 1 6 . 1 1 142 142 ALA CB C 142 17.964 17.964 17.899 0.065 25485 7339 1 6 . 1 1 142 142 ALA H H 142 8.642 8.642 8.544 0.098 25485 7340 1 6 . 1 1 143 143 HIS N N 143 120.356 120.356 115.243 5.113 25485 7341 1 6 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.597 0.560 25485 7342 1 6 . 1 1 143 143 HIS C C 143 174.303 174.303 176.068 -1.765 25485 7343 1 6 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.977 -0.524 25485 7344 1 6 . 1 1 143 143 HIS CB C 143 27.791 27.791 30.165 -2.374 25485 7345 1 6 . 1 1 143 143 HIS H H 143 8.990 8.990 8.552 0.438 25485 7346 1 6 . 1 1 144 144 GLY N N 144 112.517 112.517 106.967 5.550 25485 7347 1 6 . 1 1 144 144 GLY C C 144 173.758 173.758 173.061 0.697 25485 7348 1 6 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.565 1.530 25485 7349 1 6 . 1 1 144 144 GLY H H 144 5.175 5.175 7.525 -2.350 25485 7350 1 6 . 1 1 145 145 ASP N N 145 117.762 117.762 119.322 -1.560 25485 7351 1 6 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.827 -0.129 25485 7352 1 6 . 1 1 145 145 ASP C C 145 175.851 175.851 175.047 0.804 25485 7353 1 6 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.987 -1.028 25485 7354 1 6 . 1 1 145 145 ASP CB C 145 41.799 41.799 43.761 -1.962 25485 7355 1 6 . 1 1 145 145 ASP H H 145 7.096 7.096 7.619 -0.523 25485 7356 1 6 . 1 1 146 146 SER N N 146 125.540 125.540 115.961 9.579 25485 7357 1 6 . 1 1 146 146 SER HA H 146 4.204 4.204 4.487 -0.283 25485 7358 1 6 . 1 1 146 146 SER C C 146 172.319 172.319 174.256 -1.937 25485 7359 1 6 . 1 1 146 146 SER CA C 146 58.862 58.862 58.532 0.330 25485 7360 1 6 . 1 1 146 146 SER CB C 146 62.933 62.933 63.898 -0.966 25485 7361 1 6 . 1 1 146 146 SER H H 146 8.261 8.261 8.316 -0.055 25485 7362 1 6 . 1 1 147 147 TYR N N 147 120.757 120.757 119.204 1.553 25485 7363 1 6 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.295 0.527 25485 7364 1 6 . 1 1 147 147 TYR C C 147 170.372 170.372 173.790 -3.418 25485 7365 1 6 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.077 -3.809 25485 7366 1 6 . 1 1 147 147 TYR CB C 147 38.296 38.296 38.039 0.257 25485 7367 1 6 . 1 1 147 147 TYR H H 147 7.450 7.450 8.496 -1.046 25485 7368 1 6 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.452 0.420 25485 7369 1 6 . 1 1 148 148 PRO C C 148 179.009 179.009 175.460 3.549 25485 7370 1 6 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.573 0.802 25485 7371 1 6 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.321 -1.411 25485 7372 1 6 . 1 1 149 149 PHE N N 149 120.514 120.514 120.311 0.203 25485 7373 1 6 . 1 1 149 149 PHE C C 149 176.813 176.813 175.910 0.903 25485 7374 1 6 . 1 1 149 149 PHE CA C 149 58.453 58.453 58.700 -0.247 25485 7375 1 6 . 1 1 149 149 PHE CB C 149 38.573 38.573 39.985 -1.412 25485 7376 1 6 . 1 1 149 149 PHE H H 149 8.024 8.024 8.402 -0.378 25485 7377 1 6 . 1 1 150 150 ASP N N 150 115.555 115.555 116.968 -1.413 25485 7378 1 6 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.356 0.483 25485 7379 1 6 . 1 1 150 150 ASP C C 150 177.007 177.007 176.538 0.469 25485 7380 1 6 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.821 -0.950 25485 7381 1 6 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.272 2.664 25485 7382 1 6 . 1 1 150 150 ASP H H 150 7.511 7.511 8.527 -1.016 25485 7383 1 6 . 1 1 151 151 GLY N N 151 110.650 110.650 109.559 1.091 25485 7384 1 6 . 1 1 151 151 GLY C C 151 170.281 170.281 171.988 -1.707 25485 7385 1 6 . 1 1 151 151 GLY CA C 151 44.398 44.398 45.111 -0.714 25485 7386 1 6 . 1 1 151 151 GLY H H 151 9.080 9.080 8.094 0.986 25485 7387 1 6 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.074 -0.018 25485 7388 1 6 . 1 1 152 152 PRO C C 152 178.300 178.300 176.601 1.699 25485 7389 1 6 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.172 0.678 25485 7390 1 6 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.756 -0.496 25485 7391 1 6 . 1 1 153 153 GLY N N 153 118.783 118.783 113.591 5.192 25485 7392 1 6 . 1 1 153 153 GLY C C 153 174.098 174.098 173.316 0.782 25485 7393 1 6 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.486 -0.880 25485 7394 1 6 . 1 1 153 153 GLY H H 153 11.431 11.431 7.958 3.473 25485 7395 1 6 . 1 1 154 154 ASN N N 154 120.679 120.679 122.272 -1.593 25485 7396 1 6 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.524 -0.280 25485 7397 1 6 . 1 1 154 154 ASN C C 154 174.636 174.636 175.237 -0.601 25485 7398 1 6 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.790 1.878 25485 7399 1 6 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.807 -1.836 25485 7400 1 6 . 1 1 154 154 ASN H H 154 9.247 9.247 8.538 0.709 25485 7401 1 6 . 1 1 155 155 THR N N 155 118.252 118.252 110.949 7.303 25485 7402 1 6 . 1 1 155 155 THR HA H 155 5.577 5.577 4.153 1.424 25485 7403 1 6 . 1 1 155 155 THR C C 155 176.596 176.596 173.229 3.367 25485 7404 1 6 . 1 1 155 155 THR CA C 155 61.731 61.731 63.192 -1.461 25485 7405 1 6 . 1 1 155 155 THR CB C 155 71.325 71.325 68.656 2.668 25485 7406 1 6 . 1 1 155 155 THR H H 155 9.501 9.501 8.562 0.939 25485 7407 1 6 . 1 1 156 156 LEU N N 156 122.598 122.598 124.723 -2.125 25485 7408 1 6 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.546 0.325 25485 7409 1 6 . 1 1 156 156 LEU C C 156 175.655 175.655 176.078 -0.423 25485 7410 1 6 . 1 1 156 156 LEU CA C 156 55.538 55.538 55.834 -0.296 25485 7411 1 6 . 1 1 156 156 LEU CB C 156 44.511 44.511 43.183 1.328 25485 7412 1 6 . 1 1 156 156 LEU H H 156 8.492 8.492 8.445 0.047 25485 7413 1 6 . 1 1 157 157 ALA N N 157 115.389 115.389 115.826 -0.437 25485 7414 1 6 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.781 0.254 25485 7415 1 6 . 1 1 157 157 ALA C C 157 175.739 175.739 175.145 0.594 25485 7416 1 6 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.611 -0.672 25485 7417 1 6 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.970 1.484 25485 7418 1 6 . 1 1 157 157 ALA H H 157 7.567 7.567 7.889 -0.322 25485 7419 1 6 . 1 1 158 158 HIS N N 158 111.900 111.900 118.310 -6.410 25485 7420 1 6 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.734 -0.129 25485 7421 1 6 . 1 1 158 158 HIS C C 158 170.186 170.186 172.192 -2.006 25485 7422 1 6 . 1 1 158 158 HIS CA C 158 56.075 56.075 53.864 2.211 25485 7423 1 6 . 1 1 158 158 HIS CB C 158 30.186 30.186 30.756 -0.570 25485 7424 1 6 . 1 1 158 158 HIS H H 158 8.757 8.757 7.804 0.953 25485 7425 1 6 . 1 1 159 159 ALA N N 159 118.286 118.286 125.710 -7.424 25485 7426 1 6 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.120 0.534 25485 7427 1 6 . 1 1 159 159 ALA C C 159 174.036 174.036 174.806 -0.770 25485 7428 1 6 . 1 1 159 159 ALA CA C 159 51.133 51.133 49.846 1.287 25485 7429 1 6 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.890 2.147 25485 7430 1 6 . 1 1 159 159 ALA H H 159 6.110 6.110 8.026 -1.916 25485 7431 1 6 . 1 1 160 160 PHE N N 160 117.937 117.937 116.700 1.237 25485 7432 1 6 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.739 -0.236 25485 7433 1 6 . 1 1 160 160 PHE C C 160 174.455 174.455 174.436 0.019 25485 7434 1 6 . 1 1 160 160 PHE CA C 160 56.813 56.813 56.521 0.292 25485 7435 1 6 . 1 1 160 160 PHE CB C 160 42.194 42.194 42.855 -0.661 25485 7436 1 6 . 1 1 160 160 PHE H H 160 7.912 7.912 7.837 0.075 25485 7437 1 6 . 1 1 161 161 ALA N N 161 123.531 123.531 122.288 1.243 25485 7438 1 6 . 1 1 161 161 ALA HA H 161 4.491 4.491 5.050 -0.559 25485 7439 1 6 . 1 1 161 161 ALA C C 161 175.503 175.503 176.369 -0.866 25485 7440 1 6 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.301 1.332 25485 7441 1 6 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.587 -3.031 25485 7442 1 6 . 1 1 161 161 ALA H H 161 8.107 8.107 8.603 -0.496 25485 7443 1 6 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.421 -1.511 25485 7444 1 6 . 1 1 162 162 PRO C C 162 173.465 173.465 176.023 -2.558 25485 7445 1 6 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.986 1.271 25485 7446 1 6 . 1 1 162 162 PRO CB C 162 31.242 31.242 30.414 0.828 25485 7447 1 6 . 1 1 163 163 GLY N N 163 107.206 107.206 109.664 -2.458 25485 7448 1 6 . 1 1 163 163 GLY C C 163 172.092 172.092 173.783 -1.691 25485 7449 1 6 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.575 -0.582 25485 7450 1 6 . 1 1 163 163 GLY H H 163 5.997 5.997 7.879 -1.882 25485 7451 1 6 . 1 1 165 165 GLY N N 165 103.110 103.110 108.606 -5.496 25485 7452 1 6 . 1 1 165 165 GLY C C 165 177.158 177.158 174.852 2.306 25485 7453 1 6 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.426 -1.183 25485 7454 1 6 . 1 1 165 165 GLY H H 165 9.145 9.145 7.922 1.223 25485 7455 1 6 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.152 0.027 25485 7456 1 6 . 1 1 166 166 LEU C C 166 176.437 176.437 177.415 -0.978 25485 7457 1 6 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.773 0.427 25485 7458 1 6 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.434 -0.600 25485 7459 1 6 . 1 1 167 167 GLY N N 167 103.318 103.318 103.459 -0.141 25485 7460 1 6 . 1 1 167 167 GLY C C 167 174.803 174.803 174.537 0.266 25485 7461 1 6 . 1 1 167 167 GLY CA C 167 47.233 47.233 45.116 2.117 25485 7462 1 6 . 1 1 167 167 GLY H H 167 7.768 7.768 7.377 0.391 25485 7463 1 6 . 1 1 168 168 GLY N N 168 121.051 121.051 107.887 13.164 25485 7464 1 6 . 1 1 168 168 GLY C C 168 172.122 172.122 174.273 -2.151 25485 7465 1 6 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.276 1.326 25485 7466 1 6 . 1 1 168 168 GLY H H 168 7.698 7.698 8.060 -0.362 25485 7467 1 6 . 1 1 169 169 ASP N N 169 123.641 123.641 121.739 1.902 25485 7468 1 6 . 1 1 169 169 ASP C C 169 173.942 173.942 173.903 0.039 25485 7469 1 6 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.633 2.208 25485 7470 1 6 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.193 -2.323 25485 7471 1 6 . 1 1 169 169 ASP H H 169 8.595 8.595 7.675 0.920 25485 7472 1 6 . 1 1 170 170 ALA N N 170 119.366 119.366 122.917 -3.551 25485 7473 1 6 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.388 0.342 25485 7474 1 6 . 1 1 170 170 ALA C C 170 174.593 174.593 175.117 -0.524 25485 7475 1 6 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.764 0.360 25485 7476 1 6 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.150 1.185 25485 7477 1 6 . 1 1 170 170 ALA H H 170 8.324 8.324 8.674 -0.350 25485 7478 1 6 . 1 1 171 171 HIS N N 171 120.239 120.239 121.127 -0.888 25485 7479 1 6 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.530 0.218 25485 7480 1 6 . 1 1 171 171 HIS C C 171 172.949 172.949 173.987 -1.038 25485 7481 1 6 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.007 -2.283 25485 7482 1 6 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.090 1.451 25485 7483 1 6 . 1 1 171 171 HIS H H 171 8.499 8.499 7.766 0.733 25485 7484 1 6 . 1 1 172 172 PHE N N 172 121.125 121.125 120.992 0.133 25485 7485 1 6 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.623 -0.095 25485 7486 1 6 . 1 1 172 172 PHE C C 172 173.875 173.875 174.618 -0.743 25485 7487 1 6 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.499 0.421 25485 7488 1 6 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.006 0.897 25485 7489 1 6 . 1 1 172 172 PHE H H 172 8.445 8.445 8.320 0.125 25485 7490 1 6 . 1 1 173 173 ASP N N 173 124.014 124.014 123.322 0.692 25485 7491 1 6 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.292 -0.378 25485 7492 1 6 . 1 1 173 173 ASP C C 173 178.613 178.613 177.711 0.902 25485 7493 1 6 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.714 1.084 25485 7494 1 6 . 1 1 173 173 ASP CB C 173 40.743 40.743 40.803 -0.060 25485 7495 1 6 . 1 1 173 173 ASP H H 173 7.927 7.927 8.694 -0.767 25485 7496 1 6 . 1 1 174 174 GLU N N 174 132.469 132.469 126.270 6.199 25485 7497 1 6 . 1 1 174 174 GLU C C 174 176.442 176.442 177.203 -0.761 25485 7498 1 6 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.779 -1.595 25485 7499 1 6 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.721 0.563 25485 7500 1 6 . 1 1 174 174 GLU H H 174 9.528 9.528 8.669 0.859 25485 7501 1 6 . 1 1 175 175 ASP N N 175 117.394 117.394 118.410 -1.016 25485 7502 1 6 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.628 0.165 25485 7503 1 6 . 1 1 175 175 ASP C C 175 176.645 176.645 176.568 0.077 25485 7504 1 6 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.142 0.789 25485 7505 1 6 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.623 -1.482 25485 7506 1 6 . 1 1 175 175 ASP H H 175 8.768 8.768 8.433 0.335 25485 7507 1 6 . 1 1 176 176 GLU N N 176 116.493 116.493 118.776 -2.283 25485 7508 1 6 . 1 1 176 176 GLU C C 176 175.038 175.038 175.947 -0.909 25485 7509 1 6 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.359 -1.694 25485 7510 1 6 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.410 -4.187 25485 7511 1 6 . 1 1 176 176 GLU H H 176 7.159 7.159 7.986 -0.827 25485 7512 1 6 . 1 1 177 177 ARG N N 177 122.186 122.186 119.281 2.905 25485 7513 1 6 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.292 0.397 25485 7514 1 6 . 1 1 177 177 ARG C C 177 174.482 174.482 174.773 -0.291 25485 7515 1 6 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.152 -1.465 25485 7516 1 6 . 1 1 177 177 ARG CB C 177 29.084 29.084 31.148 -2.064 25485 7517 1 6 . 1 1 177 177 ARG H H 177 7.560 7.560 8.162 -0.602 25485 7518 1 6 . 1 1 178 178 TRP N N 178 129.179 129.179 125.878 3.301 25485 7519 1 6 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.308 -0.208 25485 7520 1 6 . 1 1 178 178 TRP C C 178 176.298 176.298 176.718 -0.420 25485 7521 1 6 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.055 0.758 25485 7522 1 6 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.727 -0.530 25485 7523 1 6 . 1 1 178 178 TRP H H 178 8.807 8.807 8.281 0.526 25485 7524 1 6 . 1 1 179 179 THR N N 179 112.792 112.792 113.640 -0.848 25485 7525 1 6 . 1 1 179 179 THR HA H 179 4.985 4.985 4.597 0.388 25485 7526 1 6 . 1 1 179 179 THR C C 179 172.765 172.765 172.037 0.728 25485 7527 1 6 . 1 1 179 179 THR CA C 179 59.106 59.106 61.780 -2.674 25485 7528 1 6 . 1 1 179 179 THR CB C 179 71.786 71.786 70.039 1.747 25485 7529 1 6 . 1 1 179 179 THR H H 179 8.974 8.974 8.744 0.230 25485 7530 1 6 . 1 1 180 180 ASP N N 180 122.074 122.074 124.568 -2.494 25485 7531 1 6 . 1 1 180 180 ASP HA H 180 4.463 4.463 4.830 -0.367 25485 7532 1 6 . 1 1 180 180 ASP C C 180 176.366 176.366 178.239 -1.873 25485 7533 1 6 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.653 -2.610 25485 7534 1 6 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.318 -0.590 25485 7535 1 6 . 1 1 180 180 ASP H H 180 8.485 8.485 8.806 -0.321 25485 7536 1 6 . 1 1 181 181 GLY N N 181 110.123 110.123 108.628 1.495 25485 7537 1 6 . 1 1 181 181 GLY C C 181 174.325 174.325 175.343 -1.018 25485 7538 1 6 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.513 1.148 25485 7539 1 6 . 1 1 181 181 GLY H H 181 8.569 8.569 8.593 -0.024 25485 7540 1 6 . 1 1 182 182 SER N N 182 115.562 115.562 115.045 0.517 25485 7541 1 6 . 1 1 182 182 SER HA H 182 4.519 4.519 4.519 -0.000 25485 7542 1 6 . 1 1 182 182 SER C C 182 173.783 173.783 174.460 -0.677 25485 7543 1 6 . 1 1 182 182 SER CA C 182 57.965 57.965 57.874 0.090 25485 7544 1 6 . 1 1 182 182 SER CB C 182 64.166 64.166 64.085 0.080 25485 7545 1 6 . 1 1 182 182 SER H H 182 8.160 8.160 7.680 0.480 25485 7546 1 6 . 1 1 183 183 SER N N 183 117.153 117.153 116.059 1.094 25485 7547 1 6 . 1 1 183 183 SER HA H 183 4.275 4.275 4.409 -0.134 25485 7548 1 6 . 1 1 183 183 SER C C 183 173.333 173.333 173.956 -0.623 25485 7549 1 6 . 1 1 183 183 SER CA C 183 59.902 59.902 59.064 0.838 25485 7550 1 6 . 1 1 183 183 SER CB C 183 64.941 64.941 62.995 1.946 25485 7551 1 6 . 1 1 183 183 SER H H 183 7.796 7.796 7.812 -0.016 25485 7552 1 6 . 1 1 184 184 LEU N N 184 122.351 122.351 119.268 3.083 25485 7553 1 6 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.568 -0.176 25485 7554 1 6 . 1 1 184 184 LEU C C 184 176.250 176.250 176.379 -0.129 25485 7555 1 6 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.117 0.458 25485 7556 1 6 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.372 -1.291 25485 7557 1 6 . 1 1 184 184 LEU H H 184 8.092 8.092 8.159 -0.067 25485 7558 1 6 . 1 1 185 185 GLY N N 185 108.871 108.871 107.151 1.720 25485 7559 1 6 . 1 1 185 185 GLY C C 185 172.375 172.375 174.087 -1.712 25485 7560 1 6 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.004 0.376 25485 7561 1 6 . 1 1 185 185 GLY H H 185 7.960 7.960 7.665 0.295 25485 7562 1 6 . 1 1 186 186 ILE N N 186 123.096 123.096 122.102 0.994 25485 7563 1 6 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.127 -0.286 25485 7564 1 6 . 1 1 186 186 ILE C C 186 175.350 175.350 175.884 -0.534 25485 7565 1 6 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.128 -0.727 25485 7566 1 6 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.110 0.346 25485 7567 1 6 . 1 1 186 186 ILE H H 186 8.893 8.893 7.985 0.908 25485 7568 1 6 . 1 1 187 187 ASN N N 187 127.167 127.167 126.811 0.356 25485 7569 1 6 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.989 -0.636 25485 7570 1 6 . 1 1 187 187 ASN C C 187 175.849 175.849 176.957 -1.108 25485 7571 1 6 . 1 1 187 187 ASN CA C 187 55.714 55.714 53.448 2.266 25485 7572 1 6 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.361 0.769 25485 7573 1 6 . 1 1 187 187 ASN H H 187 8.580 8.580 8.343 0.237 25485 7574 1 6 . 1 1 188 188 PHE N N 188 129.985 129.985 126.853 3.132 25485 7575 1 6 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.322 0.251 25485 7576 1 6 . 1 1 188 188 PHE C C 188 175.578 175.578 177.391 -1.813 25485 7577 1 6 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.161 -0.433 25485 7578 1 6 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.570 -0.138 25485 7579 1 6 . 1 1 188 188 PHE H H 188 9.361 9.361 8.399 0.962 25485 7580 1 6 . 1 1 189 189 LEU N N 189 119.113 119.113 119.481 -0.368 25485 7581 1 6 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.075 -0.274 25485 7582 1 6 . 1 1 189 189 LEU C C 189 179.601 179.601 178.327 1.274 25485 7583 1 6 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.312 0.197 25485 7584 1 6 . 1 1 189 189 LEU CB C 189 39.877 39.877 40.994 -1.117 25485 7585 1 6 . 1 1 189 189 LEU H H 189 8.562 8.562 8.042 0.520 25485 7586 1 6 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.400 0.517 25485 7587 1 6 . 1 1 190 190 TYR C C 190 177.621 177.621 177.086 0.535 25485 7588 1 6 . 1 1 190 190 TYR CA C 190 60.808 60.808 59.873 0.935 25485 7589 1 6 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.318 2.451 25485 7590 1 6 . 1 1 191 191 ALA N N 191 120.352 120.352 121.235 -0.883 25485 7591 1 6 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.009 0.306 25485 7592 1 6 . 1 1 191 191 ALA C C 191 180.252 180.252 178.900 1.352 25485 7593 1 6 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.696 0.486 25485 7594 1 6 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.434 0.708 25485 7595 1 6 . 1 1 191 191 ALA H H 191 7.993 7.993 8.893 -0.900 25485 7596 1 6 . 1 1 192 192 ALA N N 192 121.409 121.409 121.652 -0.243 25485 7597 1 6 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.103 -0.046 25485 7598 1 6 . 1 1 192 192 ALA C C 192 178.575 178.575 179.756 -1.181 25485 7599 1 6 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.488 -0.303 25485 7600 1 6 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.151 -1.953 25485 7601 1 6 . 1 1 192 192 ALA H H 192 9.297 9.297 8.444 0.853 25485 7602 1 6 . 1 1 193 193 THR N N 193 116.996 116.996 115.587 1.409 25485 7603 1 6 . 1 1 193 193 THR HA H 193 3.833 3.833 4.148 -0.315 25485 7604 1 6 . 1 1 193 193 THR CA C 193 69.138 69.138 68.138 1.000 25485 7605 1 6 . 1 1 193 193 THR CB C 193 67.365 67.365 68.774 -1.409 25485 7606 1 6 . 1 1 193 193 THR H H 193 8.226 8.226 7.759 0.467 25485 7607 1 6 . 1 1 194 194 HIS N N 194 120.296 120.296 121.213 -0.917 25485 7608 1 6 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.138 0.098 25485 7609 1 6 . 1 1 194 194 HIS C C 194 175.962 175.962 176.788 -0.826 25485 7610 1 6 . 1 1 194 194 HIS CA C 194 59.747 59.747 59.269 0.478 25485 7611 1 6 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.853 -1.934 25485 7612 1 6 . 1 1 194 194 HIS H H 194 7.782 7.782 7.760 0.022 25485 7613 1 6 . 1 1 195 195 ALA N N 195 121.290 121.290 122.322 -1.032 25485 7614 1 6 . 1 1 195 195 ALA HA H 195 4.156 4.156 4.021 0.135 25485 7615 1 6 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.948 1.016 25485 7616 1 6 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.634 0.076 25485 7617 1 6 . 1 1 195 195 ALA H H 195 8.690 8.690 8.458 0.232 25485 7618 1 6 . 1 1 196 196 LEU N N 196 114.899 114.899 118.092 -3.193 25485 7619 1 6 . 1 1 196 196 LEU HA H 196 4.170 4.170 3.975 0.195 25485 7620 1 6 . 1 1 196 196 LEU C C 196 177.946 177.946 179.249 -1.303 25485 7621 1 6 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.389 -1.161 25485 7622 1 6 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.035 -1.259 25485 7623 1 6 . 1 1 196 196 LEU H H 196 8.715 8.715 8.821 -0.106 25485 7624 1 6 . 1 1 197 197 GLY N N 197 107.901 107.901 104.619 3.282 25485 7625 1 6 . 1 1 197 197 GLY C C 197 178.641 178.641 175.286 3.355 25485 7626 1 6 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.597 0.970 25485 7627 1 6 . 1 1 197 197 GLY H H 197 7.546 7.546 8.097 -0.551 25485 7628 1 6 . 1 1 198 198 HIS N N 198 122.017 122.017 119.479 2.538 25485 7629 1 6 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.388 0.469 25485 7630 1 6 . 1 1 198 198 HIS C C 198 179.874 179.874 178.427 1.447 25485 7631 1 6 . 1 1 198 198 HIS CA C 198 58.522 58.522 58.238 0.284 25485 7632 1 6 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.284 -1.738 25485 7633 1 6 . 1 1 198 198 HIS H H 198 7.196 7.196 7.227 -0.031 25485 7634 1 6 . 1 1 199 199 SER N N 199 118.486 118.486 114.932 3.554 25485 7635 1 6 . 1 1 199 199 SER HA H 199 4.490 4.490 4.452 0.038 25485 7636 1 6 . 1 1 199 199 SER C C 199 174.493 174.493 175.949 -1.456 25485 7637 1 6 . 1 1 199 199 SER CA C 199 58.173 58.173 61.584 -3.411 25485 7638 1 6 . 1 1 199 199 SER CB C 199 63.589 63.589 63.050 0.539 25485 7639 1 6 . 1 1 199 199 SER H H 199 7.884 7.884 7.871 0.013 25485 7640 1 6 . 1 1 200 200 LEU N N 200 114.686 114.686 117.890 -3.204 25485 7641 1 6 . 1 1 200 200 LEU C C 200 177.720 177.720 177.303 0.417 25485 7642 1 6 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.385 0.452 25485 7643 1 6 . 1 1 200 200 LEU CB C 200 42.357 42.357 40.509 1.848 25485 7644 1 6 . 1 1 200 200 LEU H H 200 7.108 7.108 6.824 0.284 25485 7645 1 6 . 1 1 201 201 GLY N N 201 108.363 108.363 106.532 1.831 25485 7646 1 6 . 1 1 201 201 GLY C C 201 174.008 174.008 174.551 -0.543 25485 7647 1 6 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.648 -1.234 25485 7648 1 6 . 1 1 201 201 GLY H H 201 8.195 8.195 8.036 0.159 25485 7649 1 6 . 1 1 202 202 MET N N 202 119.635 119.635 121.682 -2.047 25485 7650 1 6 . 1 1 202 202 MET HA H 202 4.473 4.473 4.299 0.174 25485 7651 1 6 . 1 1 202 202 MET C C 202 176.593 176.593 175.108 1.485 25485 7652 1 6 . 1 1 202 202 MET CA C 202 54.500 54.500 55.579 -1.079 25485 7653 1 6 . 1 1 202 202 MET CB C 202 32.161 32.161 33.255 -1.094 25485 7654 1 6 . 1 1 202 202 MET H H 202 8.182 8.182 7.255 0.927 25485 7655 1 6 . 1 1 203 203 GLY N N 203 109.749 109.749 110.591 -0.842 25485 7656 1 6 . 1 1 203 203 GLY C C 203 174.042 174.042 173.825 0.217 25485 7657 1 6 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.827 -0.822 25485 7658 1 6 . 1 1 203 203 GLY H H 203 8.405 8.405 8.196 0.209 25485 7659 1 6 . 1 1 204 204 HIS N N 204 115.732 115.732 117.889 -2.157 25485 7660 1 6 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.453 0.947 25485 7661 1 6 . 1 1 204 204 HIS C C 204 174.430 174.430 174.874 -0.444 25485 7662 1 6 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.952 -2.138 25485 7663 1 6 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.588 -0.762 25485 7664 1 6 . 1 1 204 204 HIS H H 204 8.364 8.364 8.705 -0.341 25485 7665 1 6 . 1 1 205 205 SER N N 205 115.484 115.484 116.606 -1.122 25485 7666 1 6 . 1 1 205 205 SER HA H 205 4.766 4.766 4.749 0.017 25485 7667 1 6 . 1 1 205 205 SER C C 205 173.611 173.611 174.866 -1.255 25485 7668 1 6 . 1 1 205 205 SER CA C 205 54.729 54.729 57.213 -2.484 25485 7669 1 6 . 1 1 205 205 SER CB C 205 65.855 65.855 66.586 -0.731 25485 7670 1 6 . 1 1 205 205 SER H H 205 7.231 7.231 8.367 -1.136 25485 7671 1 6 . 1 1 206 206 SER N N 206 119.263 119.263 116.899 2.364 25485 7672 1 6 . 1 1 206 206 SER HA H 206 3.701 3.701 4.821 -1.120 25485 7673 1 6 . 1 1 206 206 SER C C 206 173.635 173.635 174.453 -0.818 25485 7674 1 6 . 1 1 206 206 SER CA C 206 63.846 63.846 59.220 4.626 25485 7675 1 6 . 1 1 206 206 SER CB C 206 63.764 63.764 63.532 0.232 25485 7676 1 6 . 1 1 206 206 SER H H 206 8.289 8.289 8.768 -0.479 25485 7677 1 6 . 1 1 207 207 ASP N N 207 126.646 126.646 122.295 4.351 25485 7678 1 6 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.666 0.263 25485 7679 1 6 . 1 1 207 207 ASP C C 207 174.614 174.614 175.678 -1.064 25485 7680 1 6 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.310 -1.038 25485 7681 1 6 . 1 1 207 207 ASP CB C 207 41.288 41.288 41.973 -0.685 25485 7682 1 6 . 1 1 207 207 ASP H H 207 8.541 8.541 8.025 0.516 25485 7683 1 6 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.582 0.205 25485 7684 1 6 . 1 1 208 208 PRO C C 208 177.467 177.467 175.685 1.782 25485 7685 1 6 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.765 -0.929 25485 7686 1 6 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.040 -0.443 25485 7687 1 6 . 1 1 209 209 ASN N N 209 116.020 116.020 112.594 3.426 25485 7688 1 6 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.661 -0.020 25485 7689 1 6 . 1 1 209 209 ASN C C 209 174.695 174.695 173.316 1.379 25485 7690 1 6 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.318 1.902 25485 7691 1 6 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.328 0.782 25485 7692 1 6 . 1 1 209 209 ASN H H 209 8.350 8.350 7.771 0.579 25485 7693 1 6 . 1 1 210 210 ALA N N 210 124.892 124.892 121.341 3.551 25485 7694 1 6 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.515 -0.420 25485 7695 1 6 . 1 1 210 210 ALA C C 210 179.495 179.495 178.654 0.841 25485 7696 1 6 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.641 1.413 25485 7697 1 6 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.683 -1.484 25485 7698 1 6 . 1 1 210 210 ALA H H 210 8.193 8.193 7.145 1.048 25485 7699 1 6 . 1 1 211 211 VAL N N 211 130.402 130.402 123.104 7.298 25485 7700 1 6 . 1 1 211 211 VAL HA H 211 4.263 4.263 4.054 0.209 25485 7701 1 6 . 1 1 211 211 VAL C C 211 179.408 179.408 176.671 2.737 25485 7702 1 6 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.984 -0.932 25485 7703 1 6 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.383 -1.400 25485 7704 1 6 . 1 1 211 211 VAL H H 211 11.592 11.592 8.895 2.697 25485 7705 1 6 . 1 1 212 212 MET N N 212 113.285 113.285 116.068 -2.783 25485 7706 1 6 . 1 1 212 212 MET C C 212 176.996 176.996 174.499 2.497 25485 7707 1 6 . 1 1 212 212 MET CA C 212 53.614 53.614 53.946 -0.332 25485 7708 1 6 . 1 1 212 212 MET CB C 212 26.975 26.975 32.021 -5.046 25485 7709 1 6 . 1 1 212 212 MET H H 212 7.724 7.724 7.711 0.013 25485 7710 1 6 . 1 1 213 213 TYR N N 213 129.919 129.919 123.567 6.352 25485 7711 1 6 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.529 1.167 25485 7712 1 6 . 1 1 213 213 TYR C C 213 178.411 178.411 175.129 3.282 25485 7713 1 6 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.152 -0.021 25485 7714 1 6 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.205 0.962 25485 7715 1 6 . 1 1 213 213 TYR H H 213 7.902 7.902 7.560 0.342 25485 7716 1 6 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.470 -0.995 25485 7717 1 6 . 1 1 214 214 PRO C C 214 177.694 177.694 176.980 0.714 25485 7718 1 6 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.211 1.817 25485 7719 1 6 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.393 1.429 25485 7720 1 6 . 1 1 215 215 THR N N 215 104.450 104.450 114.508 -10.058 25485 7721 1 6 . 1 1 215 215 THR HA H 215 4.444 4.444 4.479 -0.035 25485 7722 1 6 . 1 1 215 215 THR C C 215 173.429 173.429 173.264 0.165 25485 7723 1 6 . 1 1 215 215 THR CA C 215 60.528 60.528 61.705 -1.177 25485 7724 1 6 . 1 1 215 215 THR CB C 215 69.614 69.614 67.345 2.269 25485 7725 1 6 . 1 1 215 215 THR H H 215 6.407 6.407 7.326 -0.919 25485 7726 1 6 . 1 1 216 216 TYR N N 216 124.618 124.618 125.774 -1.156 25485 7727 1 6 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.311 -0.079 25485 7728 1 6 . 1 1 216 216 TYR C C 216 175.669 175.669 174.400 1.269 25485 7729 1 6 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.489 0.098 25485 7730 1 6 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.605 2.286 25485 7731 1 6 . 1 1 216 216 TYR H H 216 8.331 8.331 7.952 0.379 25485 7732 1 6 . 1 1 217 217 GLY N N 217 116.089 116.089 113.572 2.517 25485 7733 1 6 . 1 1 217 217 GLY C C 217 173.560 173.560 172.416 1.144 25485 7734 1 6 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.833 0.485 25485 7735 1 6 . 1 1 217 217 GLY H H 217 7.695 7.695 8.111 -0.416 25485 7736 1 6 . 1 1 218 218 ASN N N 218 120.167 120.167 115.951 4.216 25485 7737 1 6 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.528 0.138 25485 7738 1 6 . 1 1 218 218 ASN C C 218 175.343 175.343 176.080 -0.737 25485 7739 1 6 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.521 0.094 25485 7740 1 6 . 1 1 218 218 ASN CB C 218 38.546 38.546 39.303 -0.757 25485 7741 1 6 . 1 1 218 218 ASN H H 218 8.237 8.237 8.307 -0.070 25485 7742 1 6 . 1 1 219 219 GLY N N 219 109.322 109.322 107.382 1.940 25485 7743 1 6 . 1 1 219 219 GLY C C 219 172.842 172.842 173.587 -0.745 25485 7744 1 6 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.875 -0.157 25485 7745 1 6 . 1 1 219 219 GLY H H 219 8.027 8.027 8.491 -0.464 25485 7746 1 6 . 1 1 220 220 ASP N N 220 123.006 123.006 120.756 2.250 25485 7747 1 6 . 1 1 220 220 ASP H H 220 8.273 8.273 8.431 -0.158 25485 7748 1 6 . 1 1 221 221 PRO C C 221 177.138 177.138 176.402 0.736 25485 7749 1 6 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.672 -5.609 25485 7750 1 6 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.671 -0.975 25485 7751 1 6 . 1 1 222 222 GLN N N 222 116.718 116.718 118.932 -2.214 25485 7752 1 6 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.236 0.100 25485 7753 1 6 . 1 1 222 222 GLN C C 222 176.321 176.321 177.236 -0.915 25485 7754 1 6 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.642 -0.499 25485 7755 1 6 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.152 0.344 25485 7756 1 6 . 1 1 222 222 GLN H H 222 8.240 8.240 8.437 -0.197 25485 7757 1 6 . 1 1 223 223 ASN N N 223 118.368 118.368 115.521 2.847 25485 7758 1 6 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.775 0.141 25485 7759 1 6 . 1 1 223 223 ASN C C 223 173.271 173.271 174.491 -1.220 25485 7760 1 6 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.102 -0.506 25485 7761 1 6 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.922 -0.708 25485 7762 1 6 . 1 1 223 223 ASN H H 223 7.946 7.946 8.217 -0.271 25485 7763 1 6 . 1 1 224 224 PHE N N 224 118.429 118.429 118.868 -0.439 25485 7764 1 6 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.196 0.255 25485 7765 1 6 . 1 1 224 224 PHE C C 224 172.897 172.897 173.483 -0.586 25485 7766 1 6 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.945 0.464 25485 7767 1 6 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.530 1.171 25485 7768 1 6 . 1 1 224 224 PHE H H 224 6.992 6.992 7.984 -0.992 25485 7769 1 6 . 1 1 225 225 LYS N N 225 121.714 121.714 122.737 -1.023 25485 7770 1 6 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.735 0.695 25485 7771 1 6 . 1 1 225 225 LYS C C 225 174.664 174.664 174.156 0.508 25485 7772 1 6 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.544 0.768 25485 7773 1 6 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.748 -0.021 25485 7774 1 6 . 1 1 225 225 LYS H H 225 7.709 7.709 7.240 0.469 25485 7775 1 6 . 1 1 226 226 LEU N N 226 119.026 119.026 120.497 -1.471 25485 7776 1 6 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.936 0.204 25485 7777 1 6 . 1 1 226 226 LEU C C 226 177.495 177.495 177.205 0.290 25485 7778 1 6 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.247 0.352 25485 7779 1 6 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.552 -1.271 25485 7780 1 6 . 1 1 226 226 LEU H H 226 8.015 8.015 8.031 -0.016 25485 7781 1 6 . 1 1 227 227 SER N N 227 120.320 120.320 115.916 4.404 25485 7782 1 6 . 1 1 227 227 SER HA H 227 4.600 4.600 4.427 0.173 25485 7783 1 6 . 1 1 227 227 SER C C 227 175.492 175.492 174.568 0.924 25485 7784 1 6 . 1 1 227 227 SER CA C 227 57.239 57.239 57.576 -0.337 25485 7785 1 6 . 1 1 227 227 SER CB C 227 66.278 66.278 65.149 1.129 25485 7786 1 6 . 1 1 227 227 SER H H 227 9.654 9.654 8.129 1.525 25485 7787 1 6 . 1 1 228 228 GLN N N 228 127.511 127.511 123.304 4.207 25485 7788 1 6 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.947 0.747 25485 7789 1 6 . 1 1 228 228 GLN H H 228 8.248 8.248 8.926 -0.678 25485 7790 1 6 . 1 1 229 229 ASP N N 229 124.358 124.358 118.313 6.045 25485 7791 1 6 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.352 0.022 25485 7792 1 6 . 1 1 229 229 ASP C C 229 178.793 178.793 178.276 0.517 25485 7793 1 6 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.409 0.733 25485 7794 1 6 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.300 2.942 25485 7795 1 6 . 1 1 229 229 ASP H H 229 8.138 8.138 8.522 -0.384 25485 7796 1 6 . 1 1 230 230 ASP N N 230 119.694 119.694 120.014 -0.320 25485 7797 1 6 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.492 -0.070 25485 7798 1 6 . 1 1 230 230 ASP C C 230 177.736 177.736 178.039 -0.303 25485 7799 1 6 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.072 0.850 25485 7800 1 6 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.907 2.329 25485 7801 1 6 . 1 1 230 230 ASP H H 230 7.393 7.393 7.489 -0.096 25485 7802 1 6 . 1 1 231 231 ILE N N 231 120.364 120.364 119.736 0.628 25485 7803 1 6 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.597 0.068 25485 7804 1 6 . 1 1 231 231 ILE C C 231 177.631 177.631 177.770 -0.139 25485 7805 1 6 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.380 0.119 25485 7806 1 6 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.004 0.509 25485 7807 1 6 . 1 1 231 231 ILE H H 231 8.115 8.115 7.710 0.405 25485 7808 1 6 . 1 1 232 232 LYS N N 232 119.156 119.156 120.429 -1.273 25485 7809 1 6 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.116 -0.002 25485 7810 1 6 . 1 1 232 232 LYS C C 232 180.574 180.574 179.104 1.470 25485 7811 1 6 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.411 0.149 25485 7812 1 6 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.743 0.054 25485 7813 1 6 . 1 1 232 232 LYS H H 232 8.607 8.607 8.418 0.189 25485 7814 1 6 . 1 1 233 233 GLY N N 233 106.425 106.425 108.263 -1.838 25485 7815 1 6 . 1 1 233 233 GLY C C 233 176.098 176.098 175.941 0.157 25485 7816 1 6 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.826 0.811 25485 7817 1 6 . 1 1 233 233 GLY H H 233 8.075 8.075 7.763 0.312 25485 7818 1 6 . 1 1 234 234 ILE N N 234 125.119 125.119 122.066 3.053 25485 7819 1 6 . 1 1 234 234 ILE C C 234 178.231 178.231 177.585 0.646 25485 7820 1 6 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.667 -2.074 25485 7821 1 6 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.502 -0.956 25485 7822 1 6 . 1 1 234 234 ILE H H 234 8.539 8.539 7.515 1.024 25485 7823 1 6 . 1 1 235 235 GLN N N 235 122.877 122.877 118.940 3.937 25485 7824 1 6 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.112 0.245 25485 7825 1 6 . 1 1 235 235 GLN C C 235 180.105 180.105 178.386 1.719 25485 7826 1 6 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.136 -1.249 25485 7827 1 6 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.813 -1.276 25485 7828 1 6 . 1 1 235 235 GLN H H 235 8.296 8.296 8.322 -0.026 25485 7829 1 6 . 1 1 236 236 LYS N N 236 123.678 123.678 119.274 4.404 25485 7830 1 6 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.273 -0.191 25485 7831 1 6 . 1 1 236 236 LYS C C 236 178.169 178.169 177.974 0.195 25485 7832 1 6 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.825 0.550 25485 7833 1 6 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.888 0.090 25485 7834 1 6 . 1 1 236 236 LYS H H 236 8.024 8.024 7.824 0.200 25485 7835 1 6 . 1 1 237 237 LEU N N 237 116.873 116.873 118.817 -1.944 25485 7836 1 6 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.337 -0.350 25485 7837 1 6 . 1 1 237 237 LEU C C 237 177.893 177.893 177.713 0.180 25485 7838 1 6 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.511 0.928 25485 7839 1 6 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.649 0.964 25485 7840 1 6 . 1 1 237 237 LEU H H 237 6.888 6.888 7.337 -0.449 25485 7841 1 6 . 1 1 238 238 TYR N N 238 112.237 112.237 117.206 -4.969 25485 7842 1 6 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.603 0.048 25485 7843 1 6 . 1 1 238 238 TYR C C 238 176.082 176.082 176.127 -0.045 25485 7844 1 6 . 1 1 238 238 TYR CA C 238 59.636 59.636 59.655 -0.019 25485 7845 1 6 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.779 1.619 25485 7846 1 6 . 1 1 238 238 TYR H H 238 7.445 7.445 8.528 -1.083 25485 7847 1 6 . 1 1 239 239 GLY N N 239 110.906 110.906 106.279 4.627 25485 7848 1 6 . 1 1 239 239 GLY C C 239 171.269 171.269 172.543 -1.274 25485 7849 1 6 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.231 -1.345 25485 7850 1 6 . 1 1 239 239 GLY H H 239 8.443 8.443 7.851 0.592 25485 7851 1 6 . 1 1 240 240 LYS N N 240 114.281 114.281 121.889 -7.608 25485 7852 1 6 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.519 0.219 25485 7853 1 6 . 1 1 240 240 LYS C C 240 177.527 177.527 175.458 2.069 25485 7854 1 6 . 1 1 240 240 LYS CA C 240 54.958 54.958 56.115 -1.157 25485 7855 1 6 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.023 1.252 25485 7856 1 6 . 1 1 240 240 LYS H H 240 7.873 7.873 8.380 -0.507 25485 7857 1 6 . 1 1 241 241 ARG N N 241 123.758 123.758 123.945 -0.187 25485 7858 1 6 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.489 -0.492 25485 7859 1 6 . 1 1 241 241 ARG C C 241 176.026 176.026 174.159 1.867 25485 7860 1 6 . 1 1 241 241 ARG CA C 241 57.492 57.492 55.680 1.812 25485 7861 1 6 . 1 1 241 241 ARG CB C 241 30.371 30.371 32.471 -2.100 25485 7862 1 6 . 1 1 241 241 ARG H H 241 7.742 7.742 8.550 -0.808 25485 7863 1 6 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.592 -0.252 25485 7864 1 6 . 1 1 246 246 LYS C C 246 175.403 175.403 176.035 -0.632 25485 7865 1 6 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.805 0.704 25485 7866 1 6 . 1 1 246 246 LYS CB C 246 32.858 32.858 34.764 -1.905 25485 7867 1 7 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.540 -0.233 25485 7868 1 7 . 1 1 2 2 GLN C C 2 176.492 176.492 175.669 0.823 25485 7869 1 7 . 1 1 2 2 GLN CA C 2 56.749 56.749 55.635 1.114 25485 7870 1 7 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.974 -0.320 25485 7871 1 7 . 1 1 3 3 GLU N N 3 121.668 121.668 123.261 -1.593 25485 7872 1 7 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.440 -0.651 25485 7873 1 7 . 1 1 3 3 GLU C C 3 176.278 176.278 177.676 -1.398 25485 7874 1 7 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.408 -0.349 25485 7875 1 7 . 1 1 3 3 GLU CB C 3 29.691 29.691 30.097 -0.406 25485 7876 1 7 . 1 1 3 3 GLU H H 3 8.331 8.331 8.916 -0.585 25485 7877 1 7 . 1 1 4 4 ALA N N 4 124.493 124.493 123.461 1.032 25485 7878 1 7 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.380 0.130 25485 7879 1 7 . 1 1 4 4 ALA C C 4 178.428 178.428 179.765 -1.337 25485 7880 1 7 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.875 -0.198 25485 7881 1 7 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.500 0.209 25485 7882 1 7 . 1 1 4 4 ALA H H 4 8.131 8.131 8.001 0.130 25485 7883 1 7 . 1 1 5 5 GLY N N 5 108.204 108.204 108.124 0.080 25485 7884 1 7 . 1 1 5 5 GLY C C 5 174.858 174.858 175.455 -0.597 25485 7885 1 7 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.239 1.422 25485 7886 1 7 . 1 1 5 5 GLY H H 5 8.279 8.279 8.783 -0.504 25485 7887 1 7 . 1 1 6 6 GLY N N 6 108.820 108.820 107.956 0.864 25485 7888 1 7 . 1 1 6 6 GLY C C 6 174.189 174.189 173.930 0.259 25485 7889 1 7 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.354 0.059 25485 7890 1 7 . 1 1 6 6 GLY H H 6 8.246 8.246 7.812 0.433 25485 7891 1 7 . 1 1 7 7 MET N N 7 119.938 119.938 119.721 0.217 25485 7892 1 7 . 1 1 7 7 MET HA H 7 4.659 4.659 4.621 0.038 25485 7893 1 7 . 1 1 7 7 MET C C 7 176.191 176.191 176.046 0.145 25485 7894 1 7 . 1 1 7 7 MET CA C 7 54.799 54.799 54.812 -0.013 25485 7895 1 7 . 1 1 7 7 MET CB C 7 33.046 33.046 33.523 -0.477 25485 7896 1 7 . 1 1 7 7 MET H H 7 8.005 8.005 7.744 0.261 25485 7897 1 7 . 1 1 8 8 SER N N 8 118.919 118.919 116.450 2.469 25485 7898 1 7 . 1 1 8 8 SER HA H 8 4.239 4.239 4.363 -0.124 25485 7899 1 7 . 1 1 8 8 SER C C 8 174.949 174.949 175.832 -0.883 25485 7900 1 7 . 1 1 8 8 SER CA C 8 58.160 58.160 58.693 -0.533 25485 7901 1 7 . 1 1 8 8 SER CB C 8 65.440 65.440 64.200 1.240 25485 7902 1 7 . 1 1 8 8 SER H H 8 8.731 8.731 8.437 0.294 25485 7903 1 7 . 1 1 9 9 GLU N N 9 122.442 122.442 123.071 -0.629 25485 7904 1 7 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.117 0.204 25485 7905 1 7 . 1 1 9 9 GLU C C 9 178.604 178.604 179.026 -0.422 25485 7906 1 7 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.657 -0.190 25485 7907 1 7 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.742 -0.566 25485 7908 1 7 . 1 1 9 9 GLU H H 9 8.901 8.901 8.896 0.005 25485 7909 1 7 . 1 1 10 10 LEU N N 10 120.568 120.568 120.437 0.131 25485 7910 1 7 . 1 1 10 10 LEU C C 10 179.307 179.307 178.738 0.569 25485 7911 1 7 . 1 1 10 10 LEU CA C 10 57.480 57.480 57.947 -0.467 25485 7912 1 7 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.726 -0.151 25485 7913 1 7 . 1 1 10 10 LEU H H 10 8.020 8.020 8.189 -0.169 25485 7914 1 7 . 1 1 11 11 GLN N N 11 119.930 119.930 118.830 1.100 25485 7915 1 7 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.057 0.077 25485 7916 1 7 . 1 1 11 11 GLN C C 11 178.330 178.330 178.255 0.075 25485 7917 1 7 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.156 -0.338 25485 7918 1 7 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.514 -0.650 25485 7919 1 7 . 1 1 11 11 GLN H H 11 7.811 7.811 7.622 0.189 25485 7920 1 7 . 1 1 12 12 TRP N N 12 121.031 121.031 121.314 -0.283 25485 7921 1 7 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.415 -0.001 25485 7922 1 7 . 1 1 12 12 TRP C C 12 178.874 178.874 178.274 0.600 25485 7923 1 7 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.600 -0.093 25485 7924 1 7 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.538 -0.151 25485 7925 1 7 . 1 1 12 12 TRP H H 12 8.205 8.205 7.665 0.540 25485 7926 1 7 . 1 1 13 13 GLU N N 13 121.877 121.877 119.996 1.881 25485 7927 1 7 . 1 1 13 13 GLU C C 13 179.425 179.425 178.877 0.548 25485 7928 1 7 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.578 0.459 25485 7929 1 7 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.791 -0.869 25485 7930 1 7 . 1 1 13 13 GLU H H 13 8.434 8.434 8.634 -0.200 25485 7931 1 7 . 1 1 14 14 GLN N N 14 120.449 120.449 118.654 1.795 25485 7932 1 7 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.713 0.525 25485 7933 1 7 . 1 1 14 14 GLN C C 14 179.210 179.210 178.075 1.135 25485 7934 1 7 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.257 0.625 25485 7935 1 7 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.134 -0.384 25485 7936 1 7 . 1 1 14 14 GLN H H 14 8.124 8.124 8.236 -0.113 25485 7937 1 7 . 1 1 15 15 ALA N N 15 123.114 123.114 121.476 1.638 25485 7938 1 7 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.054 0.336 25485 7939 1 7 . 1 1 15 15 ALA C C 15 179.352 179.352 179.190 0.162 25485 7940 1 7 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.432 -0.467 25485 7941 1 7 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.025 0.638 25485 7942 1 7 . 1 1 15 15 ALA H H 15 8.344 8.344 7.600 0.744 25485 7943 1 7 . 1 1 16 16 GLN N N 16 117.718 117.718 117.253 0.465 25485 7944 1 7 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.904 -0.122 25485 7945 1 7 . 1 1 16 16 GLN C C 16 177.719 177.719 177.674 0.045 25485 7946 1 7 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.336 1.945 25485 7947 1 7 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.713 -0.177 25485 7948 1 7 . 1 1 16 16 GLN H H 16 8.500 8.500 7.485 1.015 25485 7949 1 7 . 1 1 17 17 ASP N N 17 120.040 120.040 120.235 -0.195 25485 7950 1 7 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.303 0.233 25485 7951 1 7 . 1 1 17 17 ASP C C 17 177.630 177.630 178.512 -0.882 25485 7952 1 7 . 1 1 17 17 ASP CA C 17 57.805 57.805 56.988 0.817 25485 7953 1 7 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.355 1.509 25485 7954 1 7 . 1 1 17 17 ASP H H 17 7.871 7.871 7.988 -0.117 25485 7955 1 7 . 1 1 18 18 TYR N N 18 122.465 122.465 118.266 4.199 25485 7956 1 7 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.181 0.009 25485 7957 1 7 . 1 1 18 18 TYR C C 18 178.439 178.439 177.560 0.879 25485 7958 1 7 . 1 1 18 18 TYR CA C 18 61.846 61.846 61.372 0.474 25485 7959 1 7 . 1 1 18 18 TYR CB C 18 39.940 39.940 37.728 2.212 25485 7960 1 7 . 1 1 18 18 TYR H H 18 8.244 8.244 8.216 0.028 25485 7961 1 7 . 1 1 19 19 LEU N N 19 117.635 117.635 117.171 0.464 25485 7962 1 7 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.869 0.263 25485 7963 1 7 . 1 1 19 19 LEU C C 19 180.940 180.940 178.035 2.905 25485 7964 1 7 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.591 0.914 25485 7965 1 7 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.042 -0.444 25485 7966 1 7 . 1 1 19 19 LEU H H 19 8.713 8.713 8.012 0.701 25485 7967 1 7 . 1 1 20 20 LYS N N 20 124.594 124.594 116.359 8.235 25485 7968 1 7 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.088 -0.004 25485 7969 1 7 . 1 1 20 20 LYS C C 20 178.387 178.387 177.693 0.694 25485 7970 1 7 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.735 1.070 25485 7971 1 7 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.519 -0.063 25485 7972 1 7 . 1 1 20 20 LYS H H 20 8.815 8.815 7.193 1.622 25485 7973 1 7 . 1 1 21 21 ARG N N 21 117.535 117.535 117.774 -0.239 25485 7974 1 7 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.390 -0.671 25485 7975 1 7 . 1 1 21 21 ARG C C 21 178.498 178.498 178.353 0.145 25485 7976 1 7 . 1 1 21 21 ARG CA C 21 59.244 59.244 57.883 1.361 25485 7977 1 7 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.580 -0.139 25485 7978 1 7 . 1 1 21 21 ARG H H 21 7.810 7.810 7.135 0.675 25485 7979 1 7 . 1 1 22 22 PHE N N 22 112.113 112.113 121.595 -9.482 25485 7980 1 7 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.027 0.884 25485 7981 1 7 . 1 1 22 22 PHE C C 22 174.875 174.875 174.690 0.185 25485 7982 1 7 . 1 1 22 22 PHE CA C 22 57.475 57.475 61.209 -3.734 25485 7983 1 7 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.397 -0.228 25485 7984 1 7 . 1 1 22 22 PHE H H 22 8.010 8.010 7.627 0.383 25485 7985 1 7 . 1 1 23 23 TYR N N 23 116.187 116.187 115.662 0.525 25485 7986 1 7 . 1 1 23 23 TYR C C 23 173.455 173.455 175.456 -2.001 25485 7987 1 7 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.394 3.033 25485 7988 1 7 . 1 1 23 23 TYR CB C 23 39.529 39.529 37.339 2.190 25485 7989 1 7 . 1 1 23 23 TYR H H 23 7.680 7.680 7.224 0.456 25485 7990 1 7 . 1 1 24 24 LEU N N 24 115.570 115.570 116.677 -1.107 25485 7991 1 7 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.974 0.176 25485 7992 1 7 . 1 1 24 24 LEU C C 24 176.661 176.661 176.396 0.265 25485 7993 1 7 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.193 0.959 25485 7994 1 7 . 1 1 24 24 LEU CB C 24 36.863 36.863 41.175 -4.312 25485 7995 1 7 . 1 1 24 24 LEU H H 24 7.238 7.238 7.558 -0.320 25485 7996 1 7 . 1 1 25 25 TYR N N 25 119.901 119.901 123.233 -3.332 25485 7997 1 7 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.430 -0.071 25485 7998 1 7 . 1 1 25 25 TYR C C 25 173.784 173.784 174.594 -0.810 25485 7999 1 7 . 1 1 25 25 TYR CA C 25 58.247 58.247 58.342 -0.095 25485 8000 1 7 . 1 1 25 25 TYR CB C 25 39.079 39.079 37.591 1.488 25485 8001 1 7 . 1 1 25 25 TYR H H 25 7.845 7.845 8.375 -0.530 25485 8002 1 7 . 1 1 26 26 ASP N N 26 129.338 129.338 127.348 1.990 25485 8003 1 7 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.039 -0.588 25485 8004 1 7 . 1 1 26 26 ASP C C 26 175.282 175.282 176.429 -1.147 25485 8005 1 7 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.312 -0.879 25485 8006 1 7 . 1 1 26 26 ASP CB C 26 41.249 41.249 42.744 -1.495 25485 8007 1 7 . 1 1 26 26 ASP H H 26 8.108 8.108 7.871 0.237 25485 8008 1 7 . 1 1 27 27 SER C C 27 175.204 175.204 176.123 -0.919 25485 8009 1 7 . 1 1 27 27 SER CA C 27 59.424 59.424 60.312 -0.888 25485 8010 1 7 . 1 1 27 27 SER CB C 27 63.535 63.535 63.714 -0.179 25485 8011 1 7 . 1 1 28 28 GLU N N 28 122.058 122.058 123.363 -1.305 25485 8012 1 7 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.135 0.190 25485 8013 1 7 . 1 1 28 28 GLU C C 28 177.073 177.073 177.356 -0.283 25485 8014 1 7 . 1 1 28 28 GLU CA C 28 57.212 57.212 59.604 -2.392 25485 8015 1 7 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.157 0.413 25485 8016 1 7 . 1 1 28 28 GLU H H 28 8.255 8.255 8.806 -0.551 25485 8017 1 7 . 1 1 29 29 THR N N 29 114.161 114.161 113.656 0.505 25485 8018 1 7 . 1 1 29 29 THR HA H 29 4.260 4.260 4.208 0.052 25485 8019 1 7 . 1 1 29 29 THR C C 29 174.591 174.591 175.222 -0.631 25485 8020 1 7 . 1 1 29 29 THR CA C 29 61.976 61.976 63.645 -1.669 25485 8021 1 7 . 1 1 29 29 THR CB C 29 69.385 69.385 68.707 0.678 25485 8022 1 7 . 1 1 29 29 THR H H 29 7.498 7.498 7.479 0.019 25485 8023 1 7 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.002 0.216 25485 8024 1 7 . 1 1 30 30 LYS H H 30 8.218 8.218 7.924 0.294 25485 8025 1 7 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.487 -0.063 25485 8026 1 7 . 1 1 31 31 ASN CB C 31 39.133 39.133 38.945 0.188 25485 8027 1 7 . 1 1 32 32 ALA N N 32 126.484 126.484 125.289 1.195 25485 8028 1 7 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.163 0.133 25485 8029 1 7 . 1 1 32 32 ALA C C 32 178.012 178.012 178.309 -0.297 25485 8030 1 7 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.674 -0.914 25485 8031 1 7 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.172 -0.402 25485 8032 1 7 . 1 1 32 32 ALA H H 32 8.411 8.411 8.645 -0.234 25485 8033 1 7 . 1 1 33 33 ASN N N 33 116.885 116.885 115.531 1.354 25485 8034 1 7 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.482 0.216 25485 8035 1 7 . 1 1 33 33 ASN C C 33 176.240 176.240 177.269 -1.029 25485 8036 1 7 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.771 -1.584 25485 8037 1 7 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.444 0.141 25485 8038 1 7 . 1 1 33 33 ASN H H 33 8.309 8.309 8.132 0.177 25485 8039 1 7 . 1 1 34 34 SER N N 34 116.836 116.836 115.410 1.426 25485 8040 1 7 . 1 1 34 34 SER HA H 34 4.544 4.544 4.415 0.129 25485 8041 1 7 . 1 1 34 34 SER C C 34 175.253 175.253 175.778 -0.525 25485 8042 1 7 . 1 1 34 34 SER CA C 34 59.583 59.583 59.809 -0.226 25485 8043 1 7 . 1 1 34 34 SER CB C 34 63.919 63.919 63.396 0.523 25485 8044 1 7 . 1 1 34 34 SER H H 34 8.115 8.115 7.542 0.573 25485 8045 1 7 . 1 1 35 35 LEU N N 35 125.355 125.355 124.141 1.214 25485 8046 1 7 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.044 -0.468 25485 8047 1 7 . 1 1 35 35 LEU C C 35 177.973 177.973 177.967 0.006 25485 8048 1 7 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.391 0.107 25485 8049 1 7 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.585 -0.893 25485 8050 1 7 . 1 1 35 35 LEU H H 35 8.312 8.312 8.031 0.281 25485 8051 1 7 . 1 1 36 36 GLU N N 36 119.201 119.201 118.872 0.329 25485 8052 1 7 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.986 -0.072 25485 8053 1 7 . 1 1 36 36 GLU C C 36 178.141 178.141 178.591 -0.450 25485 8054 1 7 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.347 0.312 25485 8055 1 7 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.335 0.978 25485 8056 1 7 . 1 1 36 36 GLU H H 36 8.225 8.225 7.902 0.323 25485 8057 1 7 . 1 1 37 37 ALA N N 37 120.746 120.746 122.416 -1.670 25485 8058 1 7 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.063 0.016 25485 8059 1 7 . 1 1 37 37 ALA C C 37 181.485 181.485 179.672 1.813 25485 8060 1 7 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.807 0.652 25485 8061 1 7 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.177 -0.010 25485 8062 1 7 . 1 1 37 37 ALA H H 37 7.917 7.917 7.799 0.118 25485 8063 1 7 . 1 1 38 38 LYS N N 38 119.326 119.326 119.816 -0.490 25485 8064 1 7 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.256 0.075 25485 8065 1 7 . 1 1 38 38 LYS C C 38 177.946 177.946 178.838 -0.892 25485 8066 1 7 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.726 -1.022 25485 8067 1 7 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.387 -0.587 25485 8068 1 7 . 1 1 38 38 LYS H H 38 8.216 8.216 8.215 0.001 25485 8069 1 7 . 1 1 39 39 LEU N N 39 122.736 122.736 119.993 2.743 25485 8070 1 7 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.956 -0.015 25485 8071 1 7 . 1 1 39 39 LEU C C 39 178.819 178.819 178.615 0.204 25485 8072 1 7 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.448 -0.367 25485 8073 1 7 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.218 -0.590 25485 8074 1 7 . 1 1 39 39 LEU H H 39 8.666 8.666 8.450 0.216 25485 8075 1 7 . 1 1 40 40 LYS N N 40 118.411 118.411 119.424 -1.013 25485 8076 1 7 . 1 1 40 40 LYS HA H 40 4.638 4.638 4.211 0.427 25485 8077 1 7 . 1 1 40 40 LYS C C 40 179.329 179.329 179.221 0.108 25485 8078 1 7 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.577 0.556 25485 8079 1 7 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.125 -0.340 25485 8080 1 7 . 1 1 40 40 LYS H H 40 8.227 8.227 7.560 0.667 25485 8081 1 7 . 1 1 41 41 GLU N N 41 121.329 121.329 118.714 2.615 25485 8082 1 7 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.145 -0.052 25485 8083 1 7 . 1 1 41 41 GLU C C 41 178.989 178.989 179.124 -0.135 25485 8084 1 7 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.025 0.735 25485 8085 1 7 . 1 1 41 41 GLU CB C 41 29.836 29.836 29.284 0.552 25485 8086 1 7 . 1 1 41 41 GLU H H 41 7.718 7.718 7.603 0.115 25485 8087 1 7 . 1 1 42 42 MET N N 42 123.817 123.817 121.631 2.186 25485 8088 1 7 . 1 1 42 42 MET HA H 42 4.107 4.107 4.267 -0.160 25485 8089 1 7 . 1 1 42 42 MET C C 42 177.719 177.719 178.214 -0.495 25485 8090 1 7 . 1 1 42 42 MET CA C 42 59.912 59.912 58.932 0.980 25485 8091 1 7 . 1 1 42 42 MET CB C 42 30.506 30.506 32.649 -2.143 25485 8092 1 7 . 1 1 42 42 MET H H 42 7.657 7.657 8.406 -0.749 25485 8093 1 7 . 1 1 43 43 GLN N N 43 119.998 119.998 118.777 1.221 25485 8094 1 7 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.814 -0.009 25485 8095 1 7 . 1 1 43 43 GLN C C 43 177.604 177.604 178.802 -1.198 25485 8096 1 7 . 1 1 43 43 GLN CA C 43 59.965 59.965 59.672 0.293 25485 8097 1 7 . 1 1 43 43 GLN CB C 43 26.555 26.555 28.529 -1.974 25485 8098 1 7 . 1 1 43 43 GLN H H 43 8.910 8.910 8.552 0.358 25485 8099 1 7 . 1 1 44 44 LYS N N 44 119.165 119.165 118.927 0.238 25485 8100 1 7 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.187 -0.132 25485 8101 1 7 . 1 1 44 44 LYS C C 44 179.991 179.991 178.892 1.099 25485 8102 1 7 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.338 1.223 25485 8103 1 7 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.139 0.159 25485 8104 1 7 . 1 1 44 44 LYS H H 44 8.507 8.507 7.691 0.816 25485 8105 1 7 . 1 1 45 45 PHE N N 45 123.602 123.602 120.306 3.296 25485 8106 1 7 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.349 -0.448 25485 8107 1 7 . 1 1 45 45 PHE C C 45 177.606 177.606 176.763 0.843 25485 8108 1 7 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.601 2.433 25485 8109 1 7 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.278 0.588 25485 8110 1 7 . 1 1 45 45 PHE H H 45 8.445 8.445 7.796 0.649 25485 8111 1 7 . 1 1 46 46 PHE N N 46 112.715 112.715 115.840 -3.125 25485 8112 1 7 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.478 0.119 25485 8113 1 7 . 1 1 46 46 PHE C C 46 175.285 175.285 176.523 -1.238 25485 8114 1 7 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.384 1.291 25485 8115 1 7 . 1 1 46 46 PHE CB C 46 39.459 39.459 39.916 -0.457 25485 8116 1 7 . 1 1 46 46 PHE H H 46 8.272 8.272 8.199 0.073 25485 8117 1 7 . 1 1 47 47 GLY N N 47 110.438 110.438 106.443 3.995 25485 8118 1 7 . 1 1 47 47 GLY C C 47 174.935 174.935 174.868 0.067 25485 8119 1 7 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.053 1.958 25485 8120 1 7 . 1 1 47 47 GLY H H 47 7.926 7.926 7.874 0.052 25485 8121 1 7 . 1 1 48 48 LEU N N 48 121.830 121.830 119.655 2.175 25485 8122 1 7 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.822 0.102 25485 8123 1 7 . 1 1 48 48 LEU C C 48 174.009 174.009 175.848 -1.839 25485 8124 1 7 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.262 -1.427 25485 8125 1 7 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.889 0.574 25485 8126 1 7 . 1 1 48 48 LEU H H 48 8.762 8.762 7.555 1.207 25485 8127 1 7 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.403 -0.165 25485 8128 1 7 . 1 1 49 49 PRO C C 49 176.874 176.874 176.791 0.083 25485 8129 1 7 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.894 -0.376 25485 8130 1 7 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.726 -0.646 25485 8131 1 7 . 1 1 50 50 ILE N N 50 126.859 126.859 118.358 8.501 25485 8132 1 7 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.012 0.089 25485 8133 1 7 . 1 1 50 50 ILE C C 50 176.540 176.540 175.622 0.918 25485 8134 1 7 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.821 -0.865 25485 8135 1 7 . 1 1 50 50 ILE CB C 50 36.393 36.393 36.703 -0.310 25485 8136 1 7 . 1 1 50 50 ILE H H 50 8.548 8.548 7.864 0.684 25485 8137 1 7 . 1 1 51 51 THR N N 51 116.443 116.443 121.781 -5.338 25485 8138 1 7 . 1 1 51 51 THR HA H 51 4.584 4.584 4.544 0.040 25485 8139 1 7 . 1 1 51 51 THR C C 51 176.672 176.672 175.313 1.359 25485 8140 1 7 . 1 1 51 51 THR CA C 51 60.979 60.979 60.702 0.277 25485 8141 1 7 . 1 1 51 51 THR CB C 51 71.505 71.505 70.741 0.764 25485 8142 1 7 . 1 1 51 51 THR H H 51 8.001 8.001 7.732 0.269 25485 8143 1 7 . 1 1 52 52 GLY N N 52 112.719 112.719 113.738 -1.019 25485 8144 1 7 . 1 1 52 52 GLY C C 52 170.609 170.609 173.647 -3.038 25485 8145 1 7 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.809 0.937 25485 8146 1 7 . 1 1 52 52 GLY H H 52 9.499 9.499 9.079 0.420 25485 8147 1 7 . 1 1 53 53 MET N N 53 116.621 116.621 118.001 -1.380 25485 8148 1 7 . 1 1 53 53 MET HA H 53 4.023 4.023 4.701 -0.678 25485 8149 1 7 . 1 1 53 53 MET C C 53 174.695 174.695 174.701 -0.006 25485 8150 1 7 . 1 1 53 53 MET CA C 53 53.460 53.460 54.293 -0.833 25485 8151 1 7 . 1 1 53 53 MET CB C 53 35.408 35.408 34.866 0.542 25485 8152 1 7 . 1 1 53 53 MET H H 53 7.993 7.993 7.571 0.422 25485 8153 1 7 . 1 1 54 54 LEU N N 54 122.679 122.679 125.578 -2.899 25485 8154 1 7 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.442 -0.691 25485 8155 1 7 . 1 1 54 54 LEU C C 54 174.784 174.784 174.532 0.252 25485 8156 1 7 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.089 0.212 25485 8157 1 7 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.251 -0.241 25485 8158 1 7 . 1 1 54 54 LEU H H 54 7.940 7.940 8.554 -0.614 25485 8159 1 7 . 1 1 55 55 ASN N N 55 115.797 115.797 116.570 -0.773 25485 8160 1 7 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.601 0.148 25485 8161 1 7 . 1 1 55 55 ASN C C 55 175.459 175.459 175.016 0.443 25485 8162 1 7 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.684 -1.841 25485 8163 1 7 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.772 1.585 25485 8164 1 7 . 1 1 55 55 ASN H H 55 6.543 6.543 8.375 -1.832 25485 8165 1 7 . 1 1 56 56 SER N N 56 121.507 121.507 117.316 4.191 25485 8166 1 7 . 1 1 56 56 SER HA H 56 4.638 4.638 4.415 0.223 25485 8167 1 7 . 1 1 56 56 SER C C 56 175.727 175.727 175.943 -0.216 25485 8168 1 7 . 1 1 56 56 SER CA C 56 57.932 57.932 59.360 -1.428 25485 8169 1 7 . 1 1 56 56 SER CB C 56 63.786 63.786 63.781 0.005 25485 8170 1 7 . 1 1 56 56 SER H H 56 8.213 8.213 8.289 -0.076 25485 8171 1 7 . 1 1 57 57 ARG N N 57 122.951 122.951 120.735 2.216 25485 8172 1 7 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.486 -0.285 25485 8173 1 7 . 1 1 57 57 ARG C C 57 178.560 178.560 178.318 0.242 25485 8174 1 7 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.557 -0.125 25485 8175 1 7 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.375 -0.270 25485 8176 1 7 . 1 1 57 57 ARG H H 57 7.895 7.895 8.636 -0.741 25485 8177 1 7 . 1 1 58 58 VAL N N 58 118.778 118.778 121.070 -2.292 25485 8178 1 7 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.576 -0.245 25485 8179 1 7 . 1 1 58 58 VAL C C 58 177.370 177.370 178.181 -0.811 25485 8180 1 7 . 1 1 58 58 VAL CA C 58 66.382 66.382 65.657 0.725 25485 8181 1 7 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.229 0.980 25485 8182 1 7 . 1 1 58 58 VAL H H 58 7.583 7.583 7.912 -0.329 25485 8183 1 7 . 1 1 59 59 ILE N N 59 119.159 119.159 117.813 1.346 25485 8184 1 7 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.679 -0.266 25485 8185 1 7 . 1 1 59 59 ILE C C 59 177.067 177.067 177.887 -0.820 25485 8186 1 7 . 1 1 59 59 ILE CA C 59 63.633 63.633 62.924 0.709 25485 8187 1 7 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.763 -0.067 25485 8188 1 7 . 1 1 59 59 ILE H H 59 7.323 7.323 7.945 -0.622 25485 8189 1 7 . 1 1 60 60 GLU N N 60 119.367 119.367 120.227 -0.860 25485 8190 1 7 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.970 -0.232 25485 8191 1 7 . 1 1 60 60 GLU C C 60 179.978 179.978 179.256 0.722 25485 8192 1 7 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.725 -0.467 25485 8193 1 7 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.465 -0.077 25485 8194 1 7 . 1 1 60 60 GLU H H 60 7.879 7.879 7.498 0.381 25485 8195 1 7 . 1 1 61 61 ILE N N 61 118.816 118.816 118.074 0.742 25485 8196 1 7 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.855 -0.416 25485 8197 1 7 . 1 1 61 61 ILE C C 61 179.033 179.033 177.336 1.697 25485 8198 1 7 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.497 0.341 25485 8199 1 7 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.133 -1.234 25485 8200 1 7 . 1 1 61 61 ILE H H 61 7.246 7.246 7.453 -0.207 25485 8201 1 7 . 1 1 62 62 MET N N 62 119.986 119.986 115.986 4.000 25485 8202 1 7 . 1 1 62 62 MET HA H 62 3.444 3.444 4.233 -0.789 25485 8203 1 7 . 1 1 62 62 MET C C 62 176.185 176.185 177.874 -1.689 25485 8204 1 7 . 1 1 62 62 MET CA C 62 59.014 59.014 56.602 2.412 25485 8205 1 7 . 1 1 62 62 MET CB C 62 31.250 31.250 31.809 -0.559 25485 8206 1 7 . 1 1 62 62 MET H H 62 7.835 7.835 7.352 0.483 25485 8207 1 7 . 1 1 63 63 GLN N N 63 116.163 116.163 116.517 -0.354 25485 8208 1 7 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.215 0.063 25485 8209 1 7 . 1 1 63 63 GLN C C 63 176.727 176.727 176.713 0.014 25485 8210 1 7 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.692 -0.554 25485 8211 1 7 . 1 1 63 63 GLN CB C 63 29.066 29.066 28.971 0.095 25485 8212 1 7 . 1 1 63 63 GLN H H 63 7.454 7.454 7.738 -0.284 25485 8213 1 7 . 1 1 64 64 LYS N N 64 121.430 121.430 121.174 0.256 25485 8214 1 7 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.460 0.083 25485 8215 1 7 . 1 1 64 64 LYS C C 64 174.724 174.724 174.404 0.320 25485 8216 1 7 . 1 1 64 64 LYS CA C 64 55.517 55.517 53.594 1.923 25485 8217 1 7 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.811 -1.214 25485 8218 1 7 . 1 1 64 64 LYS H H 64 7.483 7.483 7.492 -0.009 25485 8219 1 7 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.366 -1.930 25485 8220 1 7 . 1 1 65 65 PRO C C 65 176.158 176.158 176.225 -0.067 25485 8221 1 7 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.182 -0.294 25485 8222 1 7 . 1 1 65 65 PRO CB C 65 31.833 31.833 31.843 -0.010 25485 8223 1 7 . 1 1 66 66 ARG N N 66 112.697 112.697 124.378 -11.681 25485 8224 1 7 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.450 -0.042 25485 8225 1 7 . 1 1 66 66 ARG C C 66 174.478 174.478 174.949 -0.471 25485 8226 1 7 . 1 1 66 66 ARG CA C 66 54.636 54.636 57.403 -2.767 25485 8227 1 7 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.821 2.852 25485 8228 1 7 . 1 1 66 66 ARG H H 66 8.146 8.146 7.842 0.304 25485 8229 1 7 . 1 1 67 67 CYS N N 67 121.740 121.740 114.350 7.390 25485 8230 1 7 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.601 -0.161 25485 8231 1 7 . 1 1 67 67 CYS C C 67 175.659 175.659 175.490 0.169 25485 8232 1 7 . 1 1 67 67 CYS CA C 67 59.195 59.195 57.709 1.486 25485 8233 1 7 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.606 -1.400 25485 8234 1 7 . 1 1 67 67 CYS H H 67 7.757 7.757 8.155 -0.398 25485 8235 1 7 . 1 1 68 68 GLY N N 68 116.217 116.217 112.619 3.598 25485 8236 1 7 . 1 1 68 68 GLY C C 68 172.210 172.210 172.717 -0.507 25485 8237 1 7 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.266 1.293 25485 8238 1 7 . 1 1 68 68 GLY H H 68 9.704 9.704 9.138 0.566 25485 8239 1 7 . 1 1 69 69 VAL N N 69 126.372 126.372 117.657 8.715 25485 8240 1 7 . 1 1 69 69 VAL HA H 69 3.831 3.831 3.994 -0.163 25485 8241 1 7 . 1 1 69 69 VAL C C 69 173.538 173.538 173.322 0.216 25485 8242 1 7 . 1 1 69 69 VAL CA C 69 61.368 61.368 56.910 4.458 25485 8243 1 7 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.797 -0.274 25485 8244 1 7 . 1 1 69 69 VAL H H 69 9.113 9.113 7.185 1.928 25485 8245 1 7 . 1 1 70 70 PRO HA H 70 4.950 4.950 3.637 1.313 25485 8246 1 7 . 1 1 70 70 PRO C C 70 175.019 175.019 175.909 -0.890 25485 8247 1 7 . 1 1 70 70 PRO CA C 70 63.348 63.348 61.960 1.388 25485 8248 1 7 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.819 -0.461 25485 8249 1 7 . 1 1 71 71 ASP N N 71 118.986 118.986 119.170 -0.184 25485 8250 1 7 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.846 -0.413 25485 8251 1 7 . 1 1 71 71 ASP C C 71 175.166 175.166 176.578 -1.412 25485 8252 1 7 . 1 1 71 71 ASP CA C 71 55.368 55.368 55.206 0.162 25485 8253 1 7 . 1 1 71 71 ASP CB C 71 39.864 39.864 42.656 -2.792 25485 8254 1 7 . 1 1 71 71 ASP H H 71 8.054 8.054 8.709 -0.655 25485 8255 1 7 . 1 1 72 72 VAL N N 72 112.953 112.953 117.526 -4.573 25485 8256 1 7 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.450 -0.154 25485 8257 1 7 . 1 1 72 72 VAL C C 72 174.330 174.330 174.109 0.221 25485 8258 1 7 . 1 1 72 72 VAL CA C 72 59.645 59.645 59.921 -0.276 25485 8259 1 7 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.865 0.007 25485 8260 1 7 . 1 1 72 72 VAL H H 72 6.430 6.430 7.397 -0.967 25485 8261 1 7 . 1 1 73 73 ALA N N 73 125.869 125.869 129.687 -3.818 25485 8262 1 7 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.699 -0.394 25485 8263 1 7 . 1 1 73 73 ALA C C 73 177.382 177.382 176.730 0.652 25485 8264 1 7 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.876 0.173 25485 8265 1 7 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.736 -0.785 25485 8266 1 7 . 1 1 73 73 ALA H H 73 8.177 8.177 8.132 0.045 25485 8267 1 7 . 1 1 74 74 GLU N N 74 120.724 120.724 120.206 0.518 25485 8268 1 7 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.510 -0.407 25485 8269 1 7 . 1 1 74 74 GLU C C 74 176.246 176.246 174.519 1.727 25485 8270 1 7 . 1 1 74 74 GLU CA C 74 56.792 56.792 57.204 -0.412 25485 8271 1 7 . 1 1 74 74 GLU CB C 74 29.785 29.785 30.694 -0.909 25485 8272 1 7 . 1 1 74 74 GLU H H 74 8.381 8.381 8.525 -0.144 25485 8273 1 7 . 1 1 75 75 TYR N N 75 121.473 121.473 122.518 -1.045 25485 8274 1 7 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.908 -0.463 25485 8275 1 7 . 1 1 75 75 TYR C C 75 175.633 175.633 174.364 1.269 25485 8276 1 7 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.092 0.235 25485 8277 1 7 . 1 1 75 75 TYR CB C 75 38.413 38.413 40.135 -1.722 25485 8278 1 7 . 1 1 75 75 TYR H H 75 8.065 8.065 8.570 -0.505 25485 8279 1 7 . 1 1 76 76 SER N N 76 117.860 117.860 118.599 -0.739 25485 8280 1 7 . 1 1 76 76 SER HA H 76 3.886 3.886 3.710 0.176 25485 8281 1 7 . 1 1 76 76 SER C C 76 173.859 173.859 174.823 -0.964 25485 8282 1 7 . 1 1 76 76 SER CA C 76 58.250 58.250 58.780 -0.530 25485 8283 1 7 . 1 1 76 76 SER CB C 76 64.117 64.117 63.201 0.916 25485 8284 1 7 . 1 1 76 76 SER H H 76 7.748 7.748 8.450 -0.702 25485 8285 1 7 . 1 1 77 77 LEU N N 77 123.789 123.789 123.217 0.572 25485 8286 1 7 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.592 0.554 25485 8287 1 7 . 1 1 77 77 LEU C C 77 176.451 176.451 175.470 0.981 25485 8288 1 7 . 1 1 77 77 LEU CA C 77 55.464 55.464 56.282 -0.818 25485 8289 1 7 . 1 1 77 77 LEU CB C 77 41.957 41.957 41.590 0.367 25485 8290 1 7 . 1 1 77 77 LEU H H 77 7.979 7.979 7.940 0.039 25485 8291 1 7 . 1 1 78 78 PHE N N 78 119.275 119.275 115.550 3.725 25485 8292 1 7 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.372 0.504 25485 8293 1 7 . 1 1 78 78 PHE C C 78 173.844 173.844 174.308 -0.464 25485 8294 1 7 . 1 1 78 78 PHE CA C 78 55.372 55.372 57.221 -1.849 25485 8295 1 7 . 1 1 78 78 PHE CB C 78 39.164 39.164 36.385 2.780 25485 8296 1 7 . 1 1 78 78 PHE H H 78 7.827 7.827 7.604 0.223 25485 8297 1 7 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.490 -0.134 25485 8298 1 7 . 1 1 79 79 PRO C C 79 176.433 176.433 176.143 0.290 25485 8299 1 7 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.904 0.946 25485 8300 1 7 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.708 -1.016 25485 8301 1 7 . 1 1 80 80 ASN N N 80 118.057 118.057 116.999 1.058 25485 8302 1 7 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.793 -0.146 25485 8303 1 7 . 1 1 80 80 ASN C C 80 174.305 174.305 174.138 0.167 25485 8304 1 7 . 1 1 80 80 ASN CA C 80 52.860 52.860 52.652 0.208 25485 8305 1 7 . 1 1 80 80 ASN CB C 80 39.583 39.583 40.376 -0.793 25485 8306 1 7 . 1 1 80 80 ASN H H 80 8.068 8.068 8.293 -0.225 25485 8307 1 7 . 1 1 81 81 SER HA H 81 4.565 4.565 4.394 0.171 25485 8308 1 7 . 1 1 81 81 SER CA C 81 56.800 56.800 58.047 -1.247 25485 8309 1 7 . 1 1 81 81 SER CB C 81 63.128 63.128 63.582 -0.454 25485 8310 1 7 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.407 0.054 25485 8311 1 7 . 1 1 82 82 PRO C C 82 174.589 174.589 176.529 -1.940 25485 8312 1 7 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.046 -0.400 25485 8313 1 7 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.294 -1.040 25485 8314 1 7 . 1 1 83 83 LYS N N 83 114.578 114.578 119.543 -4.965 25485 8315 1 7 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.783 -0.630 25485 8316 1 7 . 1 1 83 83 LYS C C 83 175.308 175.308 176.319 -1.011 25485 8317 1 7 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.358 -0.952 25485 8318 1 7 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.205 1.213 25485 8319 1 7 . 1 1 83 83 LYS H H 83 7.356 7.356 7.587 -0.231 25485 8320 1 7 . 1 1 84 84 TRP N N 84 122.455 122.455 124.251 -1.796 25485 8321 1 7 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.627 -0.607 25485 8322 1 7 . 1 1 84 84 TRP C C 84 177.636 177.636 178.270 -0.634 25485 8323 1 7 . 1 1 84 84 TRP CA C 84 57.471 57.471 56.715 0.756 25485 8324 1 7 . 1 1 84 84 TRP CB C 84 30.318 30.318 28.137 2.181 25485 8325 1 7 . 1 1 84 84 TRP H H 84 8.050 8.050 8.359 -0.309 25485 8326 1 7 . 1 1 85 85 THR N N 85 113.501 113.501 115.250 -1.749 25485 8327 1 7 . 1 1 85 85 THR HA H 85 4.573 4.573 4.584 -0.011 25485 8328 1 7 . 1 1 85 85 THR C C 85 174.757 174.757 174.382 0.375 25485 8329 1 7 . 1 1 85 85 THR CA C 85 62.130 62.130 61.521 0.609 25485 8330 1 7 . 1 1 85 85 THR CB C 85 69.107 69.107 69.534 -0.427 25485 8331 1 7 . 1 1 85 85 THR H H 85 8.861 8.861 8.535 0.326 25485 8332 1 7 . 1 1 86 86 SER N N 86 117.270 117.270 118.286 -1.016 25485 8333 1 7 . 1 1 86 86 SER HA H 86 4.741 4.741 4.484 0.257 25485 8334 1 7 . 1 1 86 86 SER C C 86 173.457 173.457 175.154 -1.697 25485 8335 1 7 . 1 1 86 86 SER CA C 86 56.739 56.739 58.172 -1.433 25485 8336 1 7 . 1 1 86 86 SER CB C 86 64.717 64.717 64.519 0.198 25485 8337 1 7 . 1 1 86 86 SER H H 86 7.743 7.743 7.755 -0.012 25485 8338 1 7 . 1 1 87 87 LYS N N 87 120.329 120.329 120.120 0.209 25485 8339 1 7 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.238 -0.009 25485 8340 1 7 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.741 -0.149 25485 8341 1 7 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.450 -0.327 25485 8342 1 7 . 1 1 87 87 LYS H H 87 8.285 8.285 8.528 -0.243 25485 8343 1 7 . 1 1 88 88 VAL N N 88 117.531 117.531 117.978 -0.447 25485 8344 1 7 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.959 -0.304 25485 8345 1 7 . 1 1 88 88 VAL C C 88 174.868 174.868 173.871 0.997 25485 8346 1 7 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.827 -0.732 25485 8347 1 7 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.132 -1.437 25485 8348 1 7 . 1 1 88 88 VAL H H 88 7.428 7.428 7.352 0.076 25485 8349 1 7 . 1 1 89 89 VAL N N 89 131.452 131.452 126.128 5.324 25485 8350 1 7 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.400 -0.241 25485 8351 1 7 . 1 1 89 89 VAL C C 89 175.758 175.758 174.373 1.385 25485 8352 1 7 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.941 -0.219 25485 8353 1 7 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.635 -0.462 25485 8354 1 7 . 1 1 89 89 VAL H H 89 8.603 8.603 8.495 0.108 25485 8355 1 7 . 1 1 90 90 THR N N 90 118.206 118.206 116.720 1.486 25485 8356 1 7 . 1 1 90 90 THR HA H 90 5.649 5.649 5.551 0.098 25485 8357 1 7 . 1 1 90 90 THR C C 90 174.579 174.579 173.366 1.213 25485 8358 1 7 . 1 1 90 90 THR CA C 90 58.959 58.959 59.195 -0.236 25485 8359 1 7 . 1 1 90 90 THR CB C 90 72.288 72.288 72.477 -0.188 25485 8360 1 7 . 1 1 90 90 THR H H 90 9.021 9.021 8.244 0.777 25485 8361 1 7 . 1 1 91 91 TYR N N 91 118.117 118.117 115.553 2.564 25485 8362 1 7 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.466 0.232 25485 8363 1 7 . 1 1 91 91 TYR C C 91 171.233 171.233 172.771 -1.538 25485 8364 1 7 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.979 -0.547 25485 8365 1 7 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.026 1.234 25485 8366 1 7 . 1 1 91 91 TYR H H 91 8.555 8.555 7.991 0.564 25485 8367 1 7 . 1 1 92 92 ARG N N 92 120.252 120.252 119.999 0.253 25485 8368 1 7 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.603 0.094 25485 8369 1 7 . 1 1 92 92 ARG C C 92 173.932 173.932 174.490 -0.558 25485 8370 1 7 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.342 0.499 25485 8371 1 7 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.702 -0.016 25485 8372 1 7 . 1 1 92 92 ARG H H 92 8.520 8.520 8.590 -0.070 25485 8373 1 7 . 1 1 93 93 ILE N N 93 128.305 128.305 126.642 1.663 25485 8374 1 7 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.353 0.279 25485 8375 1 7 . 1 1 93 93 ILE C C 93 175.468 175.468 176.629 -1.161 25485 8376 1 7 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.093 1.135 25485 8377 1 7 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.695 0.530 25485 8378 1 7 . 1 1 93 93 ILE H H 93 8.886 8.886 8.801 0.085 25485 8379 1 7 . 1 1 94 94 VAL N N 94 126.647 126.647 128.127 -1.480 25485 8380 1 7 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.026 -0.030 25485 8381 1 7 . 1 1 94 94 VAL C C 94 175.670 175.670 176.408 -0.738 25485 8382 1 7 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.359 -0.945 25485 8383 1 7 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.506 0.513 25485 8384 1 7 . 1 1 94 94 VAL H H 94 9.517 9.517 8.805 0.712 25485 8385 1 7 . 1 1 95 95 SER N N 95 113.398 113.398 112.617 0.781 25485 8386 1 7 . 1 1 95 95 SER HA H 95 4.701 4.701 4.807 -0.106 25485 8387 1 7 . 1 1 95 95 SER C C 95 170.684 170.684 172.755 -2.071 25485 8388 1 7 . 1 1 95 95 SER CA C 95 56.945 56.945 57.181 -0.236 25485 8389 1 7 . 1 1 95 95 SER CB C 95 65.276 65.276 65.114 0.162 25485 8390 1 7 . 1 1 95 95 SER H H 95 7.463 7.463 7.673 -0.210 25485 8391 1 7 . 1 1 96 96 TYR N N 96 116.512 116.512 119.839 -3.327 25485 8392 1 7 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.668 -0.404 25485 8393 1 7 . 1 1 96 96 TYR C C 96 174.856 174.856 174.512 0.344 25485 8394 1 7 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.456 2.181 25485 8395 1 7 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.884 1.279 25485 8396 1 7 . 1 1 96 96 TYR H H 96 8.240 8.240 8.263 -0.023 25485 8397 1 7 . 1 1 97 97 THR CA C 97 57.798 57.798 60.557 -2.759 25485 8398 1 7 . 1 1 97 97 THR CB C 97 67.420 67.420 69.114 -1.694 25485 8399 1 7 . 1 1 98 98 ARG N N 98 128.156 128.156 123.067 5.089 25485 8400 1 7 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.080 0.245 25485 8401 1 7 . 1 1 98 98 ARG C C 98 177.625 177.625 176.022 1.603 25485 8402 1 7 . 1 1 98 98 ARG CA C 98 57.214 57.214 57.876 -0.661 25485 8403 1 7 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.860 -0.380 25485 8404 1 7 . 1 1 98 98 ARG H H 98 8.914 8.914 8.425 0.489 25485 8405 1 7 . 1 1 99 99 ASP N N 99 120.592 120.592 116.990 3.602 25485 8406 1 7 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.650 -0.269 25485 8407 1 7 . 1 1 99 99 ASP C C 99 175.679 175.679 175.196 0.483 25485 8408 1 7 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.634 1.802 25485 8409 1 7 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.617 0.753 25485 8410 1 7 . 1 1 99 99 ASP H H 99 8.708 8.708 7.993 0.715 25485 8411 1 7 . 1 1 100 100 LEU N N 100 116.829 116.829 118.790 -1.961 25485 8412 1 7 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.710 0.246 25485 8413 1 7 . 1 1 100 100 LEU C C 100 173.335 173.335 173.992 -0.657 25485 8414 1 7 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.933 -0.896 25485 8415 1 7 . 1 1 100 100 LEU CB C 100 46.267 46.267 43.916 2.351 25485 8416 1 7 . 1 1 100 100 LEU H H 100 6.916 6.916 7.019 -0.103 25485 8417 1 7 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.216 -0.041 25485 8418 1 7 . 1 1 102 102 HIS C C 102 177.649 177.649 177.672 -0.023 25485 8419 1 7 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.367 -0.694 25485 8420 1 7 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.166 -1.732 25485 8421 1 7 . 1 1 103 103 ILE N N 103 115.170 115.170 118.278 -3.108 25485 8422 1 7 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.897 0.276 25485 8423 1 7 . 1 1 103 103 ILE C C 103 177.214 177.214 177.303 -0.089 25485 8424 1 7 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.549 -1.384 25485 8425 1 7 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.966 -0.201 25485 8426 1 7 . 1 1 103 103 ILE H H 103 8.234 8.234 8.248 -0.014 25485 8427 1 7 . 1 1 104 104 THR N N 104 119.374 119.374 117.102 2.272 25485 8428 1 7 . 1 1 104 104 THR HA H 104 4.045 4.045 4.116 -0.071 25485 8429 1 7 . 1 1 104 104 THR C C 104 175.612 175.612 176.746 -1.134 25485 8430 1 7 . 1 1 104 104 THR CA C 104 66.568 66.568 67.023 -0.455 25485 8431 1 7 . 1 1 104 104 THR CB C 104 68.077 68.077 68.540 -0.463 25485 8432 1 7 . 1 1 104 104 THR H H 104 6.947 6.947 7.806 -0.859 25485 8433 1 7 . 1 1 105 105 VAL N N 105 123.263 123.263 121.175 2.088 25485 8434 1 7 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.706 -0.268 25485 8435 1 7 . 1 1 105 105 VAL C C 105 177.322 177.322 177.707 -0.385 25485 8436 1 7 . 1 1 105 105 VAL CA C 105 67.947 67.947 65.887 2.060 25485 8437 1 7 . 1 1 105 105 VAL CB C 105 31.269 31.269 30.856 0.413 25485 8438 1 7 . 1 1 105 105 VAL H H 105 7.407 7.407 8.350 -0.943 25485 8439 1 7 . 1 1 106 106 ASP N N 106 119.972 119.972 119.803 0.169 25485 8440 1 7 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.536 -0.214 25485 8441 1 7 . 1 1 106 106 ASP C C 106 179.747 179.747 178.611 1.136 25485 8442 1 7 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.541 0.694 25485 8443 1 7 . 1 1 106 106 ASP CB C 106 40.362 40.362 41.034 -0.672 25485 8444 1 7 . 1 1 106 106 ASP H H 106 8.627 8.627 8.131 0.496 25485 8445 1 7 . 1 1 107 107 ARG N N 107 121.033 121.033 118.653 2.380 25485 8446 1 7 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.147 0.031 25485 8447 1 7 . 1 1 107 107 ARG C C 107 179.485 179.485 178.616 0.869 25485 8448 1 7 . 1 1 107 107 ARG CA C 107 59.580 59.580 59.045 0.535 25485 8449 1 7 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.776 0.432 25485 8450 1 7 . 1 1 107 107 ARG H H 107 8.356 8.356 8.070 0.286 25485 8451 1 7 . 1 1 108 108 LEU N N 108 121.463 121.463 121.157 0.306 25485 8452 1 7 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.191 0.114 25485 8453 1 7 . 1 1 108 108 LEU C C 108 178.852 178.852 178.864 -0.012 25485 8454 1 7 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.638 0.244 25485 8455 1 7 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.592 -0.277 25485 8456 1 7 . 1 1 108 108 LEU H H 108 8.790 8.790 7.967 0.823 25485 8457 1 7 . 1 1 109 109 VAL N N 109 120.233 120.233 116.037 4.196 25485 8458 1 7 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.525 -0.125 25485 8459 1 7 . 1 1 109 109 VAL C C 109 177.019 177.019 177.677 -0.658 25485 8460 1 7 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.857 1.189 25485 8461 1 7 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.289 -0.100 25485 8462 1 7 . 1 1 109 109 VAL H H 109 8.787 8.787 7.881 0.906 25485 8463 1 7 . 1 1 110 110 SER N N 110 112.862 112.862 115.948 -3.086 25485 8464 1 7 . 1 1 110 110 SER HA H 110 4.300 4.300 4.127 0.173 25485 8465 1 7 . 1 1 110 110 SER C C 110 176.770 176.770 176.770 0.000 25485 8466 1 7 . 1 1 110 110 SER CA C 110 61.744 61.744 61.728 0.016 25485 8467 1 7 . 1 1 110 110 SER CB C 110 62.742 62.742 63.023 -0.281 25485 8468 1 7 . 1 1 110 110 SER H H 110 7.605 7.605 7.894 -0.289 25485 8469 1 7 . 1 1 111 111 LYS N N 111 122.319 122.319 122.156 0.163 25485 8470 1 7 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.060 0.001 25485 8471 1 7 . 1 1 111 111 LYS C C 111 178.309 178.309 178.057 0.252 25485 8472 1 7 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.195 0.619 25485 8473 1 7 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.575 -0.066 25485 8474 1 7 . 1 1 111 111 LYS H H 111 8.156 8.156 7.937 0.219 25485 8475 1 7 . 1 1 112 112 ALA N N 112 124.147 124.147 120.047 4.100 25485 8476 1 7 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.328 -0.229 25485 8477 1 7 . 1 1 112 112 ALA C C 112 179.445 179.445 178.817 0.628 25485 8478 1 7 . 1 1 112 112 ALA CA C 112 55.226 55.226 53.976 1.250 25485 8479 1 7 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.422 0.552 25485 8480 1 7 . 1 1 112 112 ALA H H 112 8.278 8.278 7.371 0.907 25485 8481 1 7 . 1 1 113 113 LEU N N 113 116.195 116.195 120.616 -4.421 25485 8482 1 7 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.065 -0.314 25485 8483 1 7 . 1 1 113 113 LEU C C 113 179.537 179.537 177.960 1.577 25485 8484 1 7 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.006 -0.262 25485 8485 1 7 . 1 1 113 113 LEU CB C 113 40.555 40.555 42.023 -1.468 25485 8486 1 7 . 1 1 113 113 LEU H H 113 8.021 8.021 8.474 -0.453 25485 8487 1 7 . 1 1 114 114 ASN N N 114 116.570 116.570 117.636 -1.066 25485 8488 1 7 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.547 -0.001 25485 8489 1 7 . 1 1 114 114 ASN C C 114 177.136 177.136 177.516 -0.380 25485 8490 1 7 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.523 -0.759 25485 8491 1 7 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.542 0.081 25485 8492 1 7 . 1 1 114 114 ASN H H 114 8.212 8.212 8.371 -0.159 25485 8493 1 7 . 1 1 115 115 MET N N 115 122.055 122.055 119.345 2.710 25485 8494 1 7 . 1 1 115 115 MET HA H 115 4.010 4.010 3.996 0.014 25485 8495 1 7 . 1 1 115 115 MET C C 115 177.681 177.681 177.722 -0.041 25485 8496 1 7 . 1 1 115 115 MET CA C 115 59.445 59.445 58.715 0.730 25485 8497 1 7 . 1 1 115 115 MET CB C 115 31.616 31.616 32.260 -0.644 25485 8498 1 7 . 1 1 115 115 MET H H 115 7.937 7.937 7.687 0.250 25485 8499 1 7 . 1 1 116 116 TRP N N 116 117.115 117.115 118.907 -1.792 25485 8500 1 7 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.203 0.315 25485 8501 1 7 . 1 1 116 116 TRP C C 116 179.054 179.054 179.286 -0.232 25485 8502 1 7 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.208 0.303 25485 8503 1 7 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.288 1.585 25485 8504 1 7 . 1 1 116 116 TRP H H 116 6.783 6.783 7.510 -0.727 25485 8505 1 7 . 1 1 117 117 GLY N N 117 104.511 104.511 106.389 -1.878 25485 8506 1 7 . 1 1 117 117 GLY C C 117 175.035 175.035 175.776 -0.741 25485 8507 1 7 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.272 0.725 25485 8508 1 7 . 1 1 117 117 GLY H H 117 9.302 9.302 7.943 1.359 25485 8509 1 7 . 1 1 118 118 LYS N N 118 118.580 118.580 119.947 -1.367 25485 8510 1 7 . 1 1 118 118 LYS HA H 118 4.207 4.207 3.984 0.223 25485 8511 1 7 . 1 1 118 118 LYS C C 118 177.235 177.235 177.412 -0.177 25485 8512 1 7 . 1 1 118 118 LYS CA C 118 57.891 57.891 58.062 -0.171 25485 8513 1 7 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.401 -0.496 25485 8514 1 7 . 1 1 118 118 LYS H H 118 7.940 7.940 7.691 0.249 25485 8515 1 7 . 1 1 119 119 GLU N N 119 113.749 113.749 116.602 -2.853 25485 8516 1 7 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.351 0.487 25485 8517 1 7 . 1 1 119 119 GLU C C 119 178.024 178.024 175.493 2.531 25485 8518 1 7 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.969 -0.695 25485 8519 1 7 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.809 0.877 25485 8520 1 7 . 1 1 119 119 GLU H H 119 7.763 7.763 7.467 0.296 25485 8521 1 7 . 1 1 120 120 ILE N N 120 111.144 111.144 113.221 -2.077 25485 8522 1 7 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.656 0.715 25485 8523 1 7 . 1 1 120 120 ILE C C 120 174.033 174.033 174.015 0.018 25485 8524 1 7 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.422 1.032 25485 8525 1 7 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.647 2.282 25485 8526 1 7 . 1 1 120 120 ILE H H 120 7.518 7.518 7.558 -0.040 25485 8527 1 7 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.449 0.213 25485 8528 1 7 . 1 1 121 121 PRO C C 121 174.784 174.784 176.469 -1.685 25485 8529 1 7 . 1 1 121 121 PRO CA C 121 62.015 62.015 62.914 -0.899 25485 8530 1 7 . 1 1 121 121 PRO CB C 121 29.385 29.385 30.015 -0.630 25485 8531 1 7 . 1 1 122 122 LEU N N 122 121.531 121.531 119.094 2.437 25485 8532 1 7 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.435 -0.096 25485 8533 1 7 . 1 1 122 122 LEU C C 122 173.977 173.977 176.996 -3.019 25485 8534 1 7 . 1 1 122 122 LEU CA C 122 54.558 54.558 54.598 -0.040 25485 8535 1 7 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.960 2.439 25485 8536 1 7 . 1 1 122 122 LEU H H 122 6.847 6.847 7.530 -0.683 25485 8537 1 7 . 1 1 123 123 HIS N N 123 121.054 121.054 116.225 4.829 25485 8538 1 7 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.713 -0.106 25485 8539 1 7 . 1 1 123 123 HIS C C 123 172.820 172.820 173.750 -0.930 25485 8540 1 7 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.602 -1.093 25485 8541 1 7 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.557 0.553 25485 8542 1 7 . 1 1 123 123 HIS H H 123 7.760 7.760 8.568 -0.808 25485 8543 1 7 . 1 1 124 124 PHE N N 124 120.465 120.465 124.381 -3.916 25485 8544 1 7 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.224 0.610 25485 8545 1 7 . 1 1 124 124 PHE C C 124 175.677 175.677 175.359 0.318 25485 8546 1 7 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.353 0.939 25485 8547 1 7 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.423 0.399 25485 8548 1 7 . 1 1 124 124 PHE H H 124 8.306 8.306 8.373 -0.067 25485 8549 1 7 . 1 1 125 125 ARG N N 125 124.008 124.008 123.019 0.989 25485 8550 1 7 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.743 -0.032 25485 8551 1 7 . 1 1 125 125 ARG C C 125 172.901 172.901 174.974 -2.073 25485 8552 1 7 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.868 -0.595 25485 8553 1 7 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.037 -0.215 25485 8554 1 7 . 1 1 125 125 ARG H H 125 8.426 8.426 9.132 -0.706 25485 8555 1 7 . 1 1 126 126 LYS N N 126 130.004 130.004 123.753 6.251 25485 8556 1 7 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.132 -0.749 25485 8557 1 7 . 1 1 126 126 LYS C C 126 176.126 176.126 175.603 0.523 25485 8558 1 7 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.769 0.412 25485 8559 1 7 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.772 -0.745 25485 8560 1 7 . 1 1 126 126 LYS H H 126 8.481 8.481 8.555 -0.074 25485 8561 1 7 . 1 1 127 127 VAL N N 127 125.288 125.288 119.400 5.888 25485 8562 1 7 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.153 0.352 25485 8563 1 7 . 1 1 127 127 VAL C C 127 175.565 175.565 175.045 0.520 25485 8564 1 7 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.771 -1.822 25485 8565 1 7 . 1 1 127 127 VAL CB C 127 34.362 34.362 31.899 2.463 25485 8566 1 7 . 1 1 127 127 VAL H H 127 8.721 8.721 8.151 0.570 25485 8567 1 7 . 1 1 128 128 VAL N N 128 117.467 117.467 121.104 -3.637 25485 8568 1 7 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.030 0.299 25485 8569 1 7 . 1 1 128 128 VAL C C 128 174.622 174.622 174.925 -0.303 25485 8570 1 7 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.903 0.215 25485 8571 1 7 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.952 0.558 25485 8572 1 7 . 1 1 128 128 VAL H H 128 8.406 8.406 8.120 0.286 25485 8573 1 7 . 1 1 129 129 TRP N N 129 119.986 119.986 121.276 -1.290 25485 8574 1 7 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.810 -0.094 25485 8575 1 7 . 1 1 129 129 TRP C C 129 174.536 174.536 176.105 -1.569 25485 8576 1 7 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.751 -0.834 25485 8577 1 7 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.940 2.074 25485 8578 1 7 . 1 1 129 129 TRP H H 129 7.435 7.435 7.393 0.042 25485 8579 1 7 . 1 1 130 130 GLY N N 130 109.900 109.900 113.569 -3.669 25485 8580 1 7 . 1 1 130 130 GLY C C 130 173.187 173.187 173.785 -0.598 25485 8581 1 7 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.501 -0.021 25485 8582 1 7 . 1 1 130 130 GLY H H 130 8.006 8.006 8.365 -0.359 25485 8583 1 7 . 1 1 131 131 THR N N 131 116.142 116.142 116.219 -0.077 25485 8584 1 7 . 1 1 131 131 THR HA H 131 4.162 4.162 4.462 -0.300 25485 8585 1 7 . 1 1 131 131 THR C C 131 172.766 172.766 173.498 -0.732 25485 8586 1 7 . 1 1 131 131 THR CA C 131 63.212 63.212 61.766 1.446 25485 8587 1 7 . 1 1 131 131 THR CB C 131 69.308 69.308 70.147 -0.840 25485 8588 1 7 . 1 1 131 131 THR H H 131 8.233 8.233 8.185 0.048 25485 8589 1 7 . 1 1 132 132 ALA N N 132 129.807 129.807 125.175 4.632 25485 8590 1 7 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.624 -0.108 25485 8591 1 7 . 1 1 132 132 ALA C C 132 175.358 175.358 176.103 -0.745 25485 8592 1 7 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.516 -1.150 25485 8593 1 7 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.578 1.220 25485 8594 1 7 . 1 1 132 132 ALA H H 132 7.962 7.962 8.454 -0.492 25485 8595 1 7 . 1 1 133 133 ASP N N 133 122.896 122.896 120.481 2.415 25485 8596 1 7 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.488 -0.067 25485 8597 1 7 . 1 1 133 133 ASP C C 133 177.314 177.314 176.698 0.616 25485 8598 1 7 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.389 1.530 25485 8599 1 7 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.824 -1.353 25485 8600 1 7 . 1 1 133 133 ASP H H 133 8.251 8.251 8.195 0.056 25485 8601 1 7 . 1 1 134 134 ILE N N 134 125.472 125.472 121.956 3.516 25485 8602 1 7 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.369 -0.226 25485 8603 1 7 . 1 1 134 134 ILE C C 134 174.201 174.201 174.857 -0.656 25485 8604 1 7 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.094 0.177 25485 8605 1 7 . 1 1 134 134 ILE CB C 134 38.710 38.710 38.106 0.604 25485 8606 1 7 . 1 1 134 134 ILE H H 134 8.802 8.802 8.031 0.771 25485 8607 1 7 . 1 1 135 135 MET N N 135 127.265 127.265 127.593 -0.328 25485 8608 1 7 . 1 1 135 135 MET HA H 135 5.192 5.192 5.258 -0.066 25485 8609 1 7 . 1 1 135 135 MET C C 135 176.206 176.206 175.746 0.460 25485 8610 1 7 . 1 1 135 135 MET CA C 135 53.626 53.626 52.563 1.063 25485 8611 1 7 . 1 1 135 135 MET CB C 135 32.639 32.639 33.555 -0.916 25485 8612 1 7 . 1 1 135 135 MET H H 135 7.418 7.418 8.814 -1.396 25485 8613 1 7 . 1 1 136 136 ILE N N 136 125.440 125.440 124.085 1.355 25485 8614 1 7 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.904 0.685 25485 8615 1 7 . 1 1 136 136 ILE C C 136 175.190 175.190 175.916 -0.726 25485 8616 1 7 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.755 1.353 25485 8617 1 7 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.642 4.298 25485 8618 1 7 . 1 1 136 136 ILE H H 136 9.124 9.124 8.825 0.299 25485 8619 1 7 . 1 1 137 137 GLY N N 137 112.211 112.211 114.635 -2.424 25485 8620 1 7 . 1 1 137 137 GLY C C 137 170.855 170.855 171.758 -0.903 25485 8621 1 7 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.844 1.561 25485 8622 1 7 . 1 1 137 137 GLY H H 137 8.594 8.594 8.055 0.539 25485 8623 1 7 . 1 1 138 138 PHE N N 138 119.463 119.463 119.740 -0.277 25485 8624 1 7 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.309 0.187 25485 8625 1 7 . 1 1 138 138 PHE C C 138 175.186 175.186 175.865 -0.679 25485 8626 1 7 . 1 1 138 138 PHE CA C 138 55.995 55.995 57.290 -1.295 25485 8627 1 7 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.631 -0.189 25485 8628 1 7 . 1 1 138 138 PHE H H 138 7.857 7.857 8.504 -0.647 25485 8629 1 7 . 1 1 139 139 ALA N N 139 123.914 123.914 125.419 -1.505 25485 8630 1 7 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.597 0.134 25485 8631 1 7 . 1 1 139 139 ALA C C 139 174.613 174.613 174.983 -0.370 25485 8632 1 7 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.436 -1.401 25485 8633 1 7 . 1 1 139 139 ALA CB C 139 22.472 22.472 21.037 1.435 25485 8634 1 7 . 1 1 139 139 ALA H H 139 8.955 8.955 9.153 -0.198 25485 8635 1 7 . 1 1 140 140 ARG N N 140 118.339 118.339 120.220 -1.881 25485 8636 1 7 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.882 0.224 25485 8637 1 7 . 1 1 140 140 ARG C C 140 176.201 176.201 177.621 -1.420 25485 8638 1 7 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.651 -0.485 25485 8639 1 7 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.066 1.403 25485 8640 1 7 . 1 1 140 140 ARG H H 140 8.546 8.546 8.494 0.052 25485 8641 1 7 . 1 1 141 141 GLY N N 141 108.916 108.916 107.571 1.345 25485 8642 1 7 . 1 1 141 141 GLY C C 141 175.595 175.595 174.811 0.784 25485 8643 1 7 . 1 1 141 141 GLY CA C 141 46.290 46.290 46.907 -0.617 25485 8644 1 7 . 1 1 141 141 GLY H H 141 8.989 8.989 9.224 -0.235 25485 8645 1 7 . 1 1 142 142 ALA N N 142 121.448 121.448 121.239 0.209 25485 8646 1 7 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.403 0.005 25485 8647 1 7 . 1 1 142 142 ALA C C 142 177.027 177.027 177.444 -0.417 25485 8648 1 7 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.415 0.862 25485 8649 1 7 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.128 -0.164 25485 8650 1 7 . 1 1 142 142 ALA H H 142 8.642 8.642 8.224 0.418 25485 8651 1 7 . 1 1 143 143 HIS N N 143 120.356 120.356 115.887 4.469 25485 8652 1 7 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.624 0.533 25485 8653 1 7 . 1 1 143 143 HIS C C 143 174.303 174.303 175.803 -1.500 25485 8654 1 7 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.760 -0.307 25485 8655 1 7 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.571 -1.780 25485 8656 1 7 . 1 1 143 143 HIS H H 143 8.990 8.990 8.374 0.616 25485 8657 1 7 . 1 1 144 144 GLY N N 144 112.517 112.517 108.101 4.416 25485 8658 1 7 . 1 1 144 144 GLY C C 144 173.758 173.758 173.221 0.537 25485 8659 1 7 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.691 1.404 25485 8660 1 7 . 1 1 144 144 GLY H H 144 5.175 5.175 7.737 -2.562 25485 8661 1 7 . 1 1 145 145 ASP N N 145 117.762 117.762 118.592 -0.830 25485 8662 1 7 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.573 0.125 25485 8663 1 7 . 1 1 145 145 ASP C C 145 175.851 175.851 174.544 1.307 25485 8664 1 7 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.781 -0.822 25485 8665 1 7 . 1 1 145 145 ASP CB C 145 41.799 41.799 41.983 -0.184 25485 8666 1 7 . 1 1 145 145 ASP H H 145 7.096 7.096 7.520 -0.424 25485 8667 1 7 . 1 1 146 146 SER N N 146 125.540 125.540 114.455 11.085 25485 8668 1 7 . 1 1 146 146 SER HA H 146 4.204 4.204 4.208 -0.004 25485 8669 1 7 . 1 1 146 146 SER C C 146 172.319 172.319 173.310 -0.991 25485 8670 1 7 . 1 1 146 146 SER CA C 146 58.862 58.862 58.589 0.273 25485 8671 1 7 . 1 1 146 146 SER CB C 146 62.933 62.933 63.306 -0.373 25485 8672 1 7 . 1 1 146 146 SER H H 146 8.261 8.261 8.140 0.121 25485 8673 1 7 . 1 1 147 147 TYR N N 147 120.757 120.757 115.044 5.713 25485 8674 1 7 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.224 0.598 25485 8675 1 7 . 1 1 147 147 TYR C C 147 170.372 170.372 173.830 -3.458 25485 8676 1 7 . 1 1 147 147 TYR CA C 147 53.268 53.268 56.183 -2.915 25485 8677 1 7 . 1 1 147 147 TYR CB C 147 38.296 38.296 36.562 1.734 25485 8678 1 7 . 1 1 147 147 TYR H H 147 7.450 7.450 8.178 -0.728 25485 8679 1 7 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.257 0.615 25485 8680 1 7 . 1 1 148 148 PRO C C 148 179.009 179.009 176.288 2.721 25485 8681 1 7 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.194 1.181 25485 8682 1 7 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.248 -1.339 25485 8683 1 7 . 1 1 149 149 PHE N N 149 120.514 120.514 117.825 2.689 25485 8684 1 7 . 1 1 149 149 PHE C C 149 176.813 176.813 175.479 1.334 25485 8685 1 7 . 1 1 149 149 PHE CA C 149 58.453 58.453 58.928 -0.475 25485 8686 1 7 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.410 0.163 25485 8687 1 7 . 1 1 149 149 PHE H H 149 8.024 8.024 7.489 0.535 25485 8688 1 7 . 1 1 150 150 ASP N N 150 115.555 115.555 115.250 0.305 25485 8689 1 7 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.314 0.525 25485 8690 1 7 . 1 1 150 150 ASP C C 150 177.007 177.007 176.354 0.653 25485 8691 1 7 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.635 -0.764 25485 8692 1 7 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.036 2.900 25485 8693 1 7 . 1 1 150 150 ASP H H 150 7.511 7.511 7.913 -0.402 25485 8694 1 7 . 1 1 151 151 GLY N N 151 110.650 110.650 108.605 2.045 25485 8695 1 7 . 1 1 151 151 GLY C C 151 170.281 170.281 172.867 -2.586 25485 8696 1 7 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.696 -0.298 25485 8697 1 7 . 1 1 151 151 GLY H H 151 9.080 9.080 8.553 0.527 25485 8698 1 7 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.251 -0.195 25485 8699 1 7 . 1 1 152 152 PRO C C 152 178.300 178.300 176.544 1.756 25485 8700 1 7 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.210 0.640 25485 8701 1 7 . 1 1 152 152 PRO CB C 152 31.260 31.260 32.028 -0.768 25485 8702 1 7 . 1 1 153 153 GLY N N 153 118.783 118.783 112.773 6.010 25485 8703 1 7 . 1 1 153 153 GLY C C 153 174.098 174.098 173.774 0.324 25485 8704 1 7 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.481 -0.875 25485 8705 1 7 . 1 1 153 153 GLY H H 153 11.431 11.431 8.000 3.431 25485 8706 1 7 . 1 1 154 154 ASN N N 154 120.679 120.679 122.454 -1.775 25485 8707 1 7 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.196 0.048 25485 8708 1 7 . 1 1 154 154 ASN C C 154 174.636 174.636 175.127 -0.491 25485 8709 1 7 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.424 2.244 25485 8710 1 7 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.464 -1.493 25485 8711 1 7 . 1 1 154 154 ASN H H 154 9.247 9.247 8.469 0.778 25485 8712 1 7 . 1 1 155 155 THR N N 155 118.252 118.252 112.271 5.981 25485 8713 1 7 . 1 1 155 155 THR HA H 155 5.577 5.577 3.983 1.594 25485 8714 1 7 . 1 1 155 155 THR C C 155 176.596 176.596 173.306 3.290 25485 8715 1 7 . 1 1 155 155 THR CA C 155 61.731 61.731 63.088 -1.357 25485 8716 1 7 . 1 1 155 155 THR CB C 155 71.325 71.325 68.490 2.835 25485 8717 1 7 . 1 1 155 155 THR H H 155 9.501 9.501 8.432 1.069 25485 8718 1 7 . 1 1 156 156 LEU N N 156 122.598 122.598 124.589 -1.991 25485 8719 1 7 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.550 0.321 25485 8720 1 7 . 1 1 156 156 LEU C C 156 175.655 175.655 176.180 -0.525 25485 8721 1 7 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.085 -0.547 25485 8722 1 7 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.821 1.690 25485 8723 1 7 . 1 1 156 156 LEU H H 156 8.492 8.492 8.208 0.284 25485 8724 1 7 . 1 1 157 157 ALA N N 157 115.389 115.389 114.867 0.522 25485 8725 1 7 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.479 0.556 25485 8726 1 7 . 1 1 157 157 ALA C C 157 175.739 175.739 175.013 0.726 25485 8727 1 7 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.306 -0.367 25485 8728 1 7 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.649 1.805 25485 8729 1 7 . 1 1 157 157 ALA H H 157 7.567 7.567 7.673 -0.106 25485 8730 1 7 . 1 1 158 158 HIS N N 158 111.900 111.900 118.010 -6.110 25485 8731 1 7 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.778 -0.173 25485 8732 1 7 . 1 1 158 158 HIS C C 158 170.186 170.186 172.525 -2.339 25485 8733 1 7 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.240 1.835 25485 8734 1 7 . 1 1 158 158 HIS CB C 158 30.186 30.186 32.172 -1.986 25485 8735 1 7 . 1 1 158 158 HIS H H 158 8.757 8.757 7.913 0.844 25485 8736 1 7 . 1 1 159 159 ALA N N 159 118.286 118.286 125.453 -7.167 25485 8737 1 7 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.037 0.617 25485 8738 1 7 . 1 1 159 159 ALA C C 159 174.036 174.036 175.657 -1.621 25485 8739 1 7 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.458 0.675 25485 8740 1 7 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.561 2.476 25485 8741 1 7 . 1 1 159 159 ALA H H 159 6.110 6.110 8.258 -2.148 25485 8742 1 7 . 1 1 160 160 PHE N N 160 117.937 117.937 118.488 -0.551 25485 8743 1 7 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.895 -0.392 25485 8744 1 7 . 1 1 160 160 PHE C C 160 174.455 174.455 175.102 -0.647 25485 8745 1 7 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.363 1.450 25485 8746 1 7 . 1 1 160 160 PHE CB C 160 42.194 42.194 42.279 -0.085 25485 8747 1 7 . 1 1 160 160 PHE H H 160 7.912 7.912 7.929 -0.017 25485 8748 1 7 . 1 1 161 161 ALA N N 161 123.531 123.531 123.880 -0.349 25485 8749 1 7 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.741 -0.250 25485 8750 1 7 . 1 1 161 161 ALA C C 161 175.503 175.503 175.777 -0.274 25485 8751 1 7 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.264 1.369 25485 8752 1 7 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.116 -2.560 25485 8753 1 7 . 1 1 161 161 ALA H H 161 8.107 8.107 8.524 -0.417 25485 8754 1 7 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.405 -1.495 25485 8755 1 7 . 1 1 162 162 PRO C C 162 173.465 173.465 176.161 -2.696 25485 8756 1 7 . 1 1 162 162 PRO CA C 162 64.257 64.257 63.027 1.230 25485 8757 1 7 . 1 1 162 162 PRO CB C 162 31.242 31.242 30.690 0.552 25485 8758 1 7 . 1 1 163 163 GLY N N 163 107.206 107.206 110.194 -2.988 25485 8759 1 7 . 1 1 163 163 GLY C C 163 172.092 172.092 173.686 -1.594 25485 8760 1 7 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.461 -0.468 25485 8761 1 7 . 1 1 163 163 GLY H H 163 5.997 5.997 8.087 -2.090 25485 8762 1 7 . 1 1 165 165 GLY N N 165 103.110 103.110 106.975 -3.865 25485 8763 1 7 . 1 1 165 165 GLY C C 165 177.158 177.158 174.005 3.153 25485 8764 1 7 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.466 -1.223 25485 8765 1 7 . 1 1 165 165 GLY H H 165 9.145 9.145 8.115 1.030 25485 8766 1 7 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.268 -0.089 25485 8767 1 7 . 1 1 166 166 LEU C C 166 176.437 176.437 177.117 -0.680 25485 8768 1 7 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.989 0.211 25485 8769 1 7 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.434 -0.600 25485 8770 1 7 . 1 1 167 167 GLY N N 167 103.318 103.318 103.859 -0.541 25485 8771 1 7 . 1 1 167 167 GLY C C 167 174.803 174.803 174.392 0.411 25485 8772 1 7 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.549 2.684 25485 8773 1 7 . 1 1 167 167 GLY H H 167 7.768 7.768 7.407 0.361 25485 8774 1 7 . 1 1 168 168 GLY N N 168 121.051 121.051 107.199 13.852 25485 8775 1 7 . 1 1 168 168 GLY C C 168 172.122 172.122 174.534 -2.412 25485 8776 1 7 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.243 1.359 25485 8777 1 7 . 1 1 168 168 GLY H H 168 7.698 7.698 8.088 -0.390 25485 8778 1 7 . 1 1 169 169 ASP N N 169 123.641 123.641 121.283 2.358 25485 8779 1 7 . 1 1 169 169 ASP C C 169 173.942 173.942 174.169 -0.227 25485 8780 1 7 . 1 1 169 169 ASP CA C 169 55.842 55.842 54.251 1.591 25485 8781 1 7 . 1 1 169 169 ASP CB C 169 39.870 39.870 41.535 -1.665 25485 8782 1 7 . 1 1 169 169 ASP H H 169 8.595 8.595 7.821 0.774 25485 8783 1 7 . 1 1 170 170 ALA N N 170 119.366 119.366 120.037 -0.671 25485 8784 1 7 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.376 0.354 25485 8785 1 7 . 1 1 170 170 ALA C C 170 174.593 174.593 175.060 -0.467 25485 8786 1 7 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.754 0.370 25485 8787 1 7 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.575 0.760 25485 8788 1 7 . 1 1 170 170 ALA H H 170 8.324 8.324 8.032 0.292 25485 8789 1 7 . 1 1 171 171 HIS N N 171 120.239 120.239 121.085 -0.846 25485 8790 1 7 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.134 0.614 25485 8791 1 7 . 1 1 171 171 HIS C C 171 172.949 172.949 173.737 -0.788 25485 8792 1 7 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.530 -2.806 25485 8793 1 7 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.109 1.432 25485 8794 1 7 . 1 1 171 171 HIS H H 171 8.499 8.499 7.762 0.737 25485 8795 1 7 . 1 1 172 172 PHE N N 172 121.125 121.125 121.825 -0.700 25485 8796 1 7 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.501 0.027 25485 8797 1 7 . 1 1 172 172 PHE C C 172 173.875 173.875 174.072 -0.197 25485 8798 1 7 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.616 0.304 25485 8799 1 7 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.484 0.419 25485 8800 1 7 . 1 1 172 172 PHE H H 172 8.445 8.445 8.391 0.054 25485 8801 1 7 . 1 1 173 173 ASP N N 173 124.014 124.014 122.727 1.287 25485 8802 1 7 . 1 1 173 173 ASP HA H 173 3.914 3.914 5.196 -1.282 25485 8803 1 7 . 1 1 173 173 ASP C C 173 178.613 178.613 178.005 0.608 25485 8804 1 7 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.236 1.562 25485 8805 1 7 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.383 -0.640 25485 8806 1 7 . 1 1 173 173 ASP H H 173 7.927 7.927 8.744 -0.817 25485 8807 1 7 . 1 1 174 174 GLU N N 174 132.469 132.469 127.232 5.237 25485 8808 1 7 . 1 1 174 174 GLU C C 174 176.442 176.442 177.152 -0.710 25485 8809 1 7 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.721 -1.537 25485 8810 1 7 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.094 1.191 25485 8811 1 7 . 1 1 174 174 GLU H H 174 9.528 9.528 8.662 0.866 25485 8812 1 7 . 1 1 175 175 ASP N N 175 117.394 117.394 118.737 -1.343 25485 8813 1 7 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.683 0.110 25485 8814 1 7 . 1 1 175 175 ASP C C 175 176.645 176.645 176.723 -0.078 25485 8815 1 7 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.388 0.543 25485 8816 1 7 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.668 -1.527 25485 8817 1 7 . 1 1 175 175 ASP H H 175 8.768 8.768 8.750 0.018 25485 8818 1 7 . 1 1 176 176 GLU N N 176 116.493 116.493 118.918 -2.425 25485 8819 1 7 . 1 1 176 176 GLU C C 176 175.038 175.038 175.962 -0.924 25485 8820 1 7 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.425 -1.760 25485 8821 1 7 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.472 -4.249 25485 8822 1 7 . 1 1 176 176 GLU H H 176 7.159 7.159 8.207 -1.048 25485 8823 1 7 . 1 1 177 177 ARG N N 177 122.186 122.186 119.373 2.813 25485 8824 1 7 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.325 0.364 25485 8825 1 7 . 1 1 177 177 ARG C C 177 174.482 174.482 174.582 -0.100 25485 8826 1 7 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.230 -1.543 25485 8827 1 7 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.826 -1.742 25485 8828 1 7 . 1 1 177 177 ARG H H 177 7.560 7.560 8.240 -0.680 25485 8829 1 7 . 1 1 178 178 TRP N N 178 129.179 129.179 124.925 4.254 25485 8830 1 7 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.366 -0.266 25485 8831 1 7 . 1 1 178 178 TRP C C 178 176.298 176.298 176.573 -0.275 25485 8832 1 7 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.087 0.726 25485 8833 1 7 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.786 -0.589 25485 8834 1 7 . 1 1 178 178 TRP H H 178 8.807 8.807 8.527 0.280 25485 8835 1 7 . 1 1 179 179 THR N N 179 112.792 112.792 115.808 -3.016 25485 8836 1 7 . 1 1 179 179 THR HA H 179 4.985 4.985 4.531 0.454 25485 8837 1 7 . 1 1 179 179 THR C C 179 172.765 172.765 172.434 0.331 25485 8838 1 7 . 1 1 179 179 THR CA C 179 59.106 59.106 60.957 -1.851 25485 8839 1 7 . 1 1 179 179 THR CB C 179 71.786 71.786 70.013 1.773 25485 8840 1 7 . 1 1 179 179 THR H H 179 8.974 8.974 8.679 0.295 25485 8841 1 7 . 1 1 180 180 ASP N N 180 122.074 122.074 124.682 -2.608 25485 8842 1 7 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.023 -0.560 25485 8843 1 7 . 1 1 180 180 ASP C C 180 176.366 176.366 178.472 -2.106 25485 8844 1 7 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.747 -2.704 25485 8845 1 7 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.157 -0.429 25485 8846 1 7 . 1 1 180 180 ASP H H 180 8.485 8.485 8.749 -0.264 25485 8847 1 7 . 1 1 181 181 GLY N N 181 110.123 110.123 107.835 2.288 25485 8848 1 7 . 1 1 181 181 GLY C C 181 174.325 174.325 175.617 -1.292 25485 8849 1 7 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.896 0.765 25485 8850 1 7 . 1 1 181 181 GLY H H 181 8.569 8.569 8.679 -0.110 25485 8851 1 7 . 1 1 182 182 SER N N 182 115.562 115.562 114.110 1.452 25485 8852 1 7 . 1 1 182 182 SER HA H 182 4.519 4.519 4.498 0.021 25485 8853 1 7 . 1 1 182 182 SER C C 182 173.783 173.783 174.043 -0.260 25485 8854 1 7 . 1 1 182 182 SER CA C 182 57.965 57.965 58.055 -0.090 25485 8855 1 7 . 1 1 182 182 SER CB C 182 64.166 64.166 64.215 -0.049 25485 8856 1 7 . 1 1 182 182 SER H H 182 8.160 8.160 7.649 0.511 25485 8857 1 7 . 1 1 183 183 SER N N 183 117.153 117.153 116.191 0.962 25485 8858 1 7 . 1 1 183 183 SER HA H 183 4.275 4.275 4.340 -0.065 25485 8859 1 7 . 1 1 183 183 SER C C 183 173.333 173.333 174.435 -1.102 25485 8860 1 7 . 1 1 183 183 SER CA C 183 59.902 59.902 59.233 0.669 25485 8861 1 7 . 1 1 183 183 SER CB C 183 64.941 64.941 62.357 2.584 25485 8862 1 7 . 1 1 183 183 SER H H 183 7.796 7.796 7.755 0.041 25485 8863 1 7 . 1 1 184 184 LEU N N 184 122.351 122.351 121.196 1.155 25485 8864 1 7 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.507 -0.115 25485 8865 1 7 . 1 1 184 184 LEU C C 184 176.250 176.250 177.167 -0.917 25485 8866 1 7 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.727 -0.152 25485 8867 1 7 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.413 -1.332 25485 8868 1 7 . 1 1 184 184 LEU H H 184 8.092 8.092 8.046 0.046 25485 8869 1 7 . 1 1 185 185 GLY N N 185 108.871 108.871 106.474 2.397 25485 8870 1 7 . 1 1 185 185 GLY C C 185 172.375 172.375 173.595 -1.220 25485 8871 1 7 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.214 0.166 25485 8872 1 7 . 1 1 185 185 GLY H H 185 7.960 7.960 7.661 0.299 25485 8873 1 7 . 1 1 186 186 ILE N N 186 123.096 123.096 122.048 1.048 25485 8874 1 7 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.283 -0.442 25485 8875 1 7 . 1 1 186 186 ILE C C 186 175.350 175.350 176.229 -0.879 25485 8876 1 7 . 1 1 186 186 ILE CA C 186 58.401 58.401 58.914 -0.513 25485 8877 1 7 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.147 0.309 25485 8878 1 7 . 1 1 186 186 ILE H H 186 8.893 8.893 8.079 0.814 25485 8879 1 7 . 1 1 187 187 ASN N N 187 127.167 127.167 126.772 0.395 25485 8880 1 7 . 1 1 187 187 ASN HA H 187 4.353 4.353 5.018 -0.665 25485 8881 1 7 . 1 1 187 187 ASN C C 187 175.849 175.849 176.913 -1.064 25485 8882 1 7 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.219 1.494 25485 8883 1 7 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.821 0.309 25485 8884 1 7 . 1 1 187 187 ASN H H 187 8.580 8.580 8.417 0.163 25485 8885 1 7 . 1 1 188 188 PHE N N 188 129.985 129.985 127.414 2.571 25485 8886 1 7 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.459 0.114 25485 8887 1 7 . 1 1 188 188 PHE C C 188 175.578 175.578 177.472 -1.894 25485 8888 1 7 . 1 1 188 188 PHE CA C 188 61.728 61.728 61.563 0.165 25485 8889 1 7 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.472 -0.041 25485 8890 1 7 . 1 1 188 188 PHE H H 188 9.361 9.361 8.543 0.818 25485 8891 1 7 . 1 1 189 189 LEU N N 189 119.113 119.113 119.974 -0.861 25485 8892 1 7 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.102 -0.301 25485 8893 1 7 . 1 1 189 189 LEU C C 189 179.601 179.601 178.581 1.020 25485 8894 1 7 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.384 0.125 25485 8895 1 7 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.185 -1.308 25485 8896 1 7 . 1 1 189 189 LEU H H 189 8.562 8.562 7.860 0.702 25485 8897 1 7 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.882 0.035 25485 8898 1 7 . 1 1 190 190 TYR C C 190 177.621 177.621 177.671 -0.050 25485 8899 1 7 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.951 -0.143 25485 8900 1 7 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.987 1.782 25485 8901 1 7 . 1 1 191 191 ALA N N 191 120.352 120.352 121.393 -1.041 25485 8902 1 7 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.132 0.183 25485 8903 1 7 . 1 1 191 191 ALA C C 191 180.252 180.252 178.827 1.425 25485 8904 1 7 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.594 0.588 25485 8905 1 7 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.648 0.494 25485 8906 1 7 . 1 1 191 191 ALA H H 191 7.993 7.993 9.058 -1.065 25485 8907 1 7 . 1 1 192 192 ALA N N 192 121.409 121.409 121.384 0.025 25485 8908 1 7 . 1 1 192 192 ALA HA H 192 4.057 4.057 3.937 0.120 25485 8909 1 7 . 1 1 192 192 ALA C C 192 178.575 178.575 179.532 -0.957 25485 8910 1 7 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.434 -0.249 25485 8911 1 7 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.043 -1.845 25485 8912 1 7 . 1 1 192 192 ALA H H 192 9.297 9.297 8.458 0.839 25485 8913 1 7 . 1 1 193 193 THR N N 193 116.996 116.996 114.241 2.755 25485 8914 1 7 . 1 1 193 193 THR HA H 193 3.833 3.833 4.040 -0.207 25485 8915 1 7 . 1 1 193 193 THR CA C 193 69.138 69.138 67.236 1.902 25485 8916 1 7 . 1 1 193 193 THR CB C 193 67.365 67.365 68.535 -1.170 25485 8917 1 7 . 1 1 193 193 THR H H 193 8.226 8.226 7.669 0.557 25485 8918 1 7 . 1 1 194 194 HIS N N 194 120.296 120.296 121.461 -1.165 25485 8919 1 7 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.034 0.202 25485 8920 1 7 . 1 1 194 194 HIS C C 194 175.962 175.962 176.691 -0.729 25485 8921 1 7 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.370 1.377 25485 8922 1 7 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.946 -2.027 25485 8923 1 7 . 1 1 194 194 HIS H H 194 7.782 7.782 7.561 0.221 25485 8924 1 7 . 1 1 195 195 ALA N N 195 121.290 121.290 122.304 -1.014 25485 8925 1 7 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.894 0.262 25485 8926 1 7 . 1 1 195 195 ALA CA C 195 55.964 55.964 55.048 0.916 25485 8927 1 7 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.452 0.258 25485 8928 1 7 . 1 1 195 195 ALA H H 195 8.690 8.690 8.494 0.196 25485 8929 1 7 . 1 1 196 196 LEU N N 196 114.899 114.899 118.441 -3.542 25485 8930 1 7 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.170 -0.000 25485 8931 1 7 . 1 1 196 196 LEU C C 196 177.946 177.946 180.039 -2.093 25485 8932 1 7 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.219 -0.991 25485 8933 1 7 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.847 -1.071 25485 8934 1 7 . 1 1 196 196 LEU H H 196 8.715 8.715 8.797 -0.082 25485 8935 1 7 . 1 1 197 197 GLY N N 197 107.901 107.901 106.014 1.887 25485 8936 1 7 . 1 1 197 197 GLY C C 197 178.641 178.641 175.548 3.093 25485 8937 1 7 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.693 0.875 25485 8938 1 7 . 1 1 197 197 GLY H H 197 7.546 7.546 8.214 -0.668 25485 8939 1 7 . 1 1 198 198 HIS N N 198 122.017 122.017 120.161 1.856 25485 8940 1 7 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.482 0.375 25485 8941 1 7 . 1 1 198 198 HIS C C 198 179.874 179.874 178.430 1.444 25485 8942 1 7 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.984 0.538 25485 8943 1 7 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.530 -1.984 25485 8944 1 7 . 1 1 198 198 HIS H H 198 7.196 7.196 7.517 -0.321 25485 8945 1 7 . 1 1 199 199 SER N N 199 118.486 118.486 115.577 2.909 25485 8946 1 7 . 1 1 199 199 SER HA H 199 4.490 4.490 4.620 -0.130 25485 8947 1 7 . 1 1 199 199 SER C C 199 174.493 174.493 175.679 -1.186 25485 8948 1 7 . 1 1 199 199 SER CA C 199 58.173 58.173 61.428 -3.255 25485 8949 1 7 . 1 1 199 199 SER CB C 199 63.589 63.589 63.042 0.547 25485 8950 1 7 . 1 1 199 199 SER H H 199 7.884 7.884 7.944 -0.060 25485 8951 1 7 . 1 1 200 200 LEU N N 200 114.686 114.686 118.430 -3.744 25485 8952 1 7 . 1 1 200 200 LEU C C 200 177.720 177.720 177.536 0.184 25485 8953 1 7 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.215 0.622 25485 8954 1 7 . 1 1 200 200 LEU CB C 200 42.357 42.357 40.426 1.931 25485 8955 1 7 . 1 1 200 200 LEU H H 200 7.108 7.108 6.767 0.341 25485 8956 1 7 . 1 1 201 201 GLY N N 201 108.363 108.363 106.541 1.822 25485 8957 1 7 . 1 1 201 201 GLY C C 201 174.008 174.008 174.828 -0.820 25485 8958 1 7 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.591 -1.177 25485 8959 1 7 . 1 1 201 201 GLY H H 201 8.195 8.195 8.054 0.141 25485 8960 1 7 . 1 1 202 202 MET N N 202 119.635 119.635 121.915 -2.280 25485 8961 1 7 . 1 1 202 202 MET HA H 202 4.473 4.473 4.240 0.233 25485 8962 1 7 . 1 1 202 202 MET C C 202 176.593 176.593 175.211 1.382 25485 8963 1 7 . 1 1 202 202 MET CA C 202 54.500 54.500 54.737 -0.237 25485 8964 1 7 . 1 1 202 202 MET CB C 202 32.161 32.161 33.170 -1.009 25485 8965 1 7 . 1 1 202 202 MET H H 202 8.182 8.182 7.285 0.897 25485 8966 1 7 . 1 1 203 203 GLY N N 203 109.749 109.749 111.747 -1.998 25485 8967 1 7 . 1 1 203 203 GLY C C 203 174.042 174.042 173.751 0.291 25485 8968 1 7 . 1 1 203 203 GLY CA C 203 43.004 43.004 44.117 -1.113 25485 8969 1 7 . 1 1 203 203 GLY H H 203 8.405 8.405 8.204 0.201 25485 8970 1 7 . 1 1 204 204 HIS N N 204 115.732 115.732 118.368 -2.636 25485 8971 1 7 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.320 1.080 25485 8972 1 7 . 1 1 204 204 HIS C C 204 174.430 174.430 174.651 -0.221 25485 8973 1 7 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.540 -1.726 25485 8974 1 7 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.595 -0.769 25485 8975 1 7 . 1 1 204 204 HIS H H 204 8.364 8.364 8.651 -0.287 25485 8976 1 7 . 1 1 205 205 SER N N 205 115.484 115.484 114.507 0.977 25485 8977 1 7 . 1 1 205 205 SER HA H 205 4.766 4.766 4.779 -0.013 25485 8978 1 7 . 1 1 205 205 SER C C 205 173.611 173.611 174.837 -1.226 25485 8979 1 7 . 1 1 205 205 SER CA C 205 54.729 54.729 57.288 -2.559 25485 8980 1 7 . 1 1 205 205 SER CB C 205 65.855 65.855 65.611 0.244 25485 8981 1 7 . 1 1 205 205 SER H H 205 7.231 7.231 7.898 -0.667 25485 8982 1 7 . 1 1 206 206 SER N N 206 119.263 119.263 116.081 3.182 25485 8983 1 7 . 1 1 206 206 SER HA H 206 3.701 3.701 4.533 -0.832 25485 8984 1 7 . 1 1 206 206 SER C C 206 173.635 173.635 174.510 -0.875 25485 8985 1 7 . 1 1 206 206 SER CA C 206 63.846 63.846 58.983 4.863 25485 8986 1 7 . 1 1 206 206 SER CB C 206 63.764 63.764 63.525 0.239 25485 8987 1 7 . 1 1 206 206 SER H H 206 8.289 8.289 8.865 -0.576 25485 8988 1 7 . 1 1 207 207 ASP N N 207 126.646 126.646 120.827 5.819 25485 8989 1 7 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.577 0.352 25485 8990 1 7 . 1 1 207 207 ASP C C 207 174.614 174.614 175.796 -1.182 25485 8991 1 7 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.629 -1.357 25485 8992 1 7 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.171 -0.883 25485 8993 1 7 . 1 1 207 207 ASP H H 207 8.541 8.541 7.856 0.685 25485 8994 1 7 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.574 0.213 25485 8995 1 7 . 1 1 208 208 PRO C C 208 177.467 177.467 175.808 1.659 25485 8996 1 7 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.817 -0.981 25485 8997 1 7 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.011 -0.414 25485 8998 1 7 . 1 1 209 209 ASN N N 209 116.020 116.020 114.161 1.859 25485 8999 1 7 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.646 -0.005 25485 9000 1 7 . 1 1 209 209 ASN C C 209 174.695 174.695 173.769 0.926 25485 9001 1 7 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.387 1.833 25485 9002 1 7 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.864 0.246 25485 9003 1 7 . 1 1 209 209 ASN H H 209 8.350 8.350 7.615 0.735 25485 9004 1 7 . 1 1 210 210 ALA N N 210 124.892 124.892 123.297 1.595 25485 9005 1 7 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.410 -0.315 25485 9006 1 7 . 1 1 210 210 ALA C C 210 179.495 179.495 178.614 0.881 25485 9007 1 7 . 1 1 210 210 ALA CA C 210 52.054 52.054 51.090 0.964 25485 9008 1 7 . 1 1 210 210 ALA CB C 210 19.199 19.199 21.034 -1.835 25485 9009 1 7 . 1 1 210 210 ALA H H 210 8.193 8.193 7.100 1.093 25485 9010 1 7 . 1 1 211 211 VAL N N 211 130.402 130.402 123.568 6.834 25485 9011 1 7 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.814 0.449 25485 9012 1 7 . 1 1 211 211 VAL C C 211 179.408 179.408 176.447 2.961 25485 9013 1 7 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.729 0.323 25485 9014 1 7 . 1 1 211 211 VAL CB C 211 30.983 30.983 31.787 -0.804 25485 9015 1 7 . 1 1 211 211 VAL H H 211 11.592 11.592 8.746 2.846 25485 9016 1 7 . 1 1 212 212 MET N N 212 113.285 113.285 114.944 -1.659 25485 9017 1 7 . 1 1 212 212 MET C C 212 176.996 176.996 175.430 1.566 25485 9018 1 7 . 1 1 212 212 MET CA C 212 53.614 53.614 54.289 -0.675 25485 9019 1 7 . 1 1 212 212 MET CB C 212 26.975 26.975 32.054 -5.079 25485 9020 1 7 . 1 1 212 212 MET H H 212 7.724 7.724 7.527 0.197 25485 9021 1 7 . 1 1 213 213 TYR N N 213 129.919 129.919 124.840 5.079 25485 9022 1 7 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.384 1.312 25485 9023 1 7 . 1 1 213 213 TYR C C 213 178.411 178.411 175.323 3.088 25485 9024 1 7 . 1 1 213 213 TYR CA C 213 57.131 57.131 56.870 0.261 25485 9025 1 7 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.396 0.771 25485 9026 1 7 . 1 1 213 213 TYR H H 213 7.902 7.902 7.314 0.588 25485 9027 1 7 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.225 -0.750 25485 9028 1 7 . 1 1 214 214 PRO C C 214 177.694 177.694 176.567 1.127 25485 9029 1 7 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.227 1.801 25485 9030 1 7 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.734 1.089 25485 9031 1 7 . 1 1 215 215 THR N N 215 104.450 104.450 111.698 -7.248 25485 9032 1 7 . 1 1 215 215 THR HA H 215 4.444 4.444 4.157 0.287 25485 9033 1 7 . 1 1 215 215 THR C C 215 173.429 173.429 174.018 -0.589 25485 9034 1 7 . 1 1 215 215 THR CA C 215 60.528 60.528 61.766 -1.238 25485 9035 1 7 . 1 1 215 215 THR CB C 215 69.614 69.614 67.940 1.674 25485 9036 1 7 . 1 1 215 215 THR H H 215 6.407 6.407 7.332 -0.925 25485 9037 1 7 . 1 1 216 216 TYR N N 216 124.618 124.618 120.301 4.317 25485 9038 1 7 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.165 0.067 25485 9039 1 7 . 1 1 216 216 TYR C C 216 175.669 175.669 176.640 -0.971 25485 9040 1 7 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.236 -0.649 25485 9041 1 7 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.189 2.702 25485 9042 1 7 . 1 1 216 216 TYR H H 216 8.331 8.331 7.427 0.904 25485 9043 1 7 . 1 1 217 217 GLY N N 217 116.089 116.089 110.120 5.969 25485 9044 1 7 . 1 1 217 217 GLY C C 217 173.560 173.560 175.223 -1.663 25485 9045 1 7 . 1 1 217 217 GLY CA C 217 45.318 45.318 46.219 -0.901 25485 9046 1 7 . 1 1 217 217 GLY H H 217 7.695 7.695 8.655 -0.960 25485 9047 1 7 . 1 1 218 218 ASN N N 218 120.167 120.167 117.340 2.827 25485 9048 1 7 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.408 0.258 25485 9049 1 7 . 1 1 218 218 ASN C C 218 175.343 175.343 175.941 -0.598 25485 9050 1 7 . 1 1 218 218 ASN CA C 218 53.615 53.615 54.606 -0.991 25485 9051 1 7 . 1 1 218 218 ASN CB C 218 38.546 38.546 37.237 1.309 25485 9052 1 7 . 1 1 218 218 ASN H H 218 8.237 8.237 8.424 -0.187 25485 9053 1 7 . 1 1 219 219 GLY N N 219 109.322 109.322 108.433 0.889 25485 9054 1 7 . 1 1 219 219 GLY C C 219 172.842 172.842 172.842 0.000 25485 9055 1 7 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.819 -0.101 25485 9056 1 7 . 1 1 219 219 GLY H H 219 8.027 8.027 8.133 -0.106 25485 9057 1 7 . 1 1 220 220 ASP N N 220 123.006 123.006 120.869 2.137 25485 9058 1 7 . 1 1 220 220 ASP H H 220 8.273 8.273 8.286 -0.013 25485 9059 1 7 . 1 1 221 221 PRO C C 221 177.138 177.138 176.791 0.347 25485 9060 1 7 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.722 -5.659 25485 9061 1 7 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.903 -1.207 25485 9062 1 7 . 1 1 222 222 GLN N N 222 116.718 116.718 118.744 -2.026 25485 9063 1 7 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.200 0.136 25485 9064 1 7 . 1 1 222 222 GLN C C 222 176.321 176.321 176.670 -0.349 25485 9065 1 7 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.160 -1.018 25485 9066 1 7 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.828 0.668 25485 9067 1 7 . 1 1 222 222 GLN H H 222 8.240 8.240 8.479 -0.239 25485 9068 1 7 . 1 1 223 223 ASN N N 223 118.368 118.368 115.148 3.220 25485 9069 1 7 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.791 0.125 25485 9070 1 7 . 1 1 223 223 ASN C C 223 173.271 173.271 174.342 -1.071 25485 9071 1 7 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.264 -0.668 25485 9072 1 7 . 1 1 223 223 ASN CB C 223 39.215 39.215 40.017 -0.802 25485 9073 1 7 . 1 1 223 223 ASN H H 223 7.946 7.946 8.279 -0.333 25485 9074 1 7 . 1 1 224 224 PHE N N 224 118.429 118.429 119.467 -1.038 25485 9075 1 7 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.280 0.171 25485 9076 1 7 . 1 1 224 224 PHE C C 224 172.897 172.897 173.706 -0.809 25485 9077 1 7 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.849 0.560 25485 9078 1 7 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.341 1.360 25485 9079 1 7 . 1 1 224 224 PHE H H 224 6.992 6.992 7.977 -0.985 25485 9080 1 7 . 1 1 225 225 LYS N N 225 121.714 121.714 126.545 -4.831 25485 9081 1 7 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.746 0.684 25485 9082 1 7 . 1 1 225 225 LYS C C 225 174.664 174.664 174.603 0.061 25485 9083 1 7 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.231 0.081 25485 9084 1 7 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.645 0.082 25485 9085 1 7 . 1 1 225 225 LYS H H 225 7.709 7.709 8.043 -0.334 25485 9086 1 7 . 1 1 226 226 LEU N N 226 119.026 119.026 120.848 -1.822 25485 9087 1 7 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.988 0.152 25485 9088 1 7 . 1 1 226 226 LEU C C 226 177.495 177.495 176.933 0.562 25485 9089 1 7 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.293 0.306 25485 9090 1 7 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.818 -0.537 25485 9091 1 7 . 1 1 226 226 LEU H H 226 8.015 8.015 8.147 -0.132 25485 9092 1 7 . 1 1 227 227 SER N N 227 120.320 120.320 116.441 3.879 25485 9093 1 7 . 1 1 227 227 SER HA H 227 4.600 4.600 4.506 0.094 25485 9094 1 7 . 1 1 227 227 SER C C 227 175.492 175.492 175.332 0.160 25485 9095 1 7 . 1 1 227 227 SER CA C 227 57.239 57.239 57.180 0.059 25485 9096 1 7 . 1 1 227 227 SER CB C 227 66.278 66.278 65.740 0.538 25485 9097 1 7 . 1 1 227 227 SER H H 227 9.654 9.654 8.197 1.457 25485 9098 1 7 . 1 1 228 228 GLN N N 228 127.511 127.511 125.039 2.472 25485 9099 1 7 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.921 0.773 25485 9100 1 7 . 1 1 228 228 GLN H H 228 8.248 8.248 8.837 -0.589 25485 9101 1 7 . 1 1 229 229 ASP N N 229 124.358 124.358 118.474 5.884 25485 9102 1 7 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.319 0.055 25485 9103 1 7 . 1 1 229 229 ASP C C 229 178.793 178.793 178.417 0.376 25485 9104 1 7 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.759 0.383 25485 9105 1 7 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.407 2.834 25485 9106 1 7 . 1 1 229 229 ASP H H 229 8.138 8.138 8.615 -0.477 25485 9107 1 7 . 1 1 230 230 ASP N N 230 119.694 119.694 120.012 -0.318 25485 9108 1 7 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.487 -0.065 25485 9109 1 7 . 1 1 230 230 ASP C C 230 177.736 177.736 178.172 -0.436 25485 9110 1 7 . 1 1 230 230 ASP CA C 230 57.922 57.922 56.976 0.946 25485 9111 1 7 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.846 2.390 25485 9112 1 7 . 1 1 230 230 ASP H H 230 7.393 7.393 7.530 -0.137 25485 9113 1 7 . 1 1 231 231 ILE N N 231 120.364 120.364 119.805 0.559 25485 9114 1 7 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.634 0.031 25485 9115 1 7 . 1 1 231 231 ILE C C 231 177.631 177.631 177.735 -0.104 25485 9116 1 7 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.493 0.007 25485 9117 1 7 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.962 0.551 25485 9118 1 7 . 1 1 231 231 ILE H H 231 8.115 8.115 8.011 0.104 25485 9119 1 7 . 1 1 232 232 LYS N N 232 119.156 119.156 120.593 -1.437 25485 9120 1 7 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.335 -0.221 25485 9121 1 7 . 1 1 232 232 LYS C C 232 180.574 180.574 179.219 1.355 25485 9122 1 7 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.278 0.282 25485 9123 1 7 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.721 0.076 25485 9124 1 7 . 1 1 232 232 LYS H H 232 8.607 8.607 8.181 0.426 25485 9125 1 7 . 1 1 233 233 GLY N N 233 106.425 106.425 108.119 -1.694 25485 9126 1 7 . 1 1 233 233 GLY C C 233 176.098 176.098 175.896 0.202 25485 9127 1 7 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.711 0.926 25485 9128 1 7 . 1 1 233 233 GLY H H 233 8.075 8.075 7.686 0.389 25485 9129 1 7 . 1 1 234 234 ILE N N 234 125.119 125.119 122.337 2.782 25485 9130 1 7 . 1 1 234 234 ILE C C 234 178.231 178.231 177.149 1.082 25485 9131 1 7 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.873 -2.280 25485 9132 1 7 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.551 -1.005 25485 9133 1 7 . 1 1 234 234 ILE H H 234 8.539 8.539 7.566 0.973 25485 9134 1 7 . 1 1 235 235 GLN N N 235 122.877 122.877 119.934 2.943 25485 9135 1 7 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.127 0.230 25485 9136 1 7 . 1 1 235 235 GLN C C 235 180.105 180.105 178.029 2.076 25485 9137 1 7 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.064 -1.177 25485 9138 1 7 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.595 -1.058 25485 9139 1 7 . 1 1 235 235 GLN H H 235 8.296 8.296 8.797 -0.501 25485 9140 1 7 . 1 1 236 236 LYS N N 236 123.678 123.678 119.841 3.837 25485 9141 1 7 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.379 -0.297 25485 9142 1 7 . 1 1 236 236 LYS C C 236 178.169 178.169 177.848 0.321 25485 9143 1 7 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.440 0.936 25485 9144 1 7 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.814 0.164 25485 9145 1 7 . 1 1 236 236 LYS H H 236 8.024 8.024 7.831 0.193 25485 9146 1 7 . 1 1 237 237 LEU N N 237 116.873 116.873 119.007 -2.134 25485 9147 1 7 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.342 -0.355 25485 9148 1 7 . 1 1 237 237 LEU C C 237 177.893 177.893 177.787 0.106 25485 9149 1 7 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.633 0.806 25485 9150 1 7 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.649 0.964 25485 9151 1 7 . 1 1 237 237 LEU H H 237 6.888 6.888 7.381 -0.493 25485 9152 1 7 . 1 1 238 238 TYR N N 238 112.237 112.237 117.419 -5.182 25485 9153 1 7 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.610 0.041 25485 9154 1 7 . 1 1 238 238 TYR C C 238 176.082 176.082 176.268 -0.186 25485 9155 1 7 . 1 1 238 238 TYR CA C 238 59.636 59.636 59.688 -0.052 25485 9156 1 7 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.674 1.724 25485 9157 1 7 . 1 1 238 238 TYR H H 238 7.445 7.445 8.328 -0.883 25485 9158 1 7 . 1 1 239 239 GLY N N 239 110.906 110.906 106.730 4.176 25485 9159 1 7 . 1 1 239 239 GLY C C 239 171.269 171.269 172.598 -1.329 25485 9160 1 7 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.020 -1.134 25485 9161 1 7 . 1 1 239 239 GLY H H 239 8.443 8.443 7.883 0.560 25485 9162 1 7 . 1 1 240 240 LYS N N 240 114.281 114.281 123.656 -9.375 25485 9163 1 7 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.407 0.331 25485 9164 1 7 . 1 1 240 240 LYS C C 240 177.527 177.527 177.001 0.526 25485 9165 1 7 . 1 1 240 240 LYS CA C 240 54.958 54.958 56.007 -1.049 25485 9166 1 7 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.213 1.062 25485 9167 1 7 . 1 1 240 240 LYS H H 240 7.873 7.873 8.325 -0.452 25485 9168 1 7 . 1 1 241 241 ARG N N 241 123.758 123.758 124.005 -0.247 25485 9169 1 7 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.267 -0.270 25485 9170 1 7 . 1 1 241 241 ARG C C 241 176.026 176.026 175.172 0.854 25485 9171 1 7 . 1 1 241 241 ARG CA C 241 57.492 57.492 57.214 0.278 25485 9172 1 7 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.774 -0.403 25485 9173 1 7 . 1 1 241 241 ARG H H 241 7.742 7.742 8.719 -0.977 25485 9174 1 7 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.595 -0.255 25485 9175 1 7 . 1 1 246 246 LYS C C 246 175.403 175.403 175.797 -0.394 25485 9176 1 7 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.299 0.210 25485 9177 1 7 . 1 1 246 246 LYS CB C 246 32.858 32.858 32.091 0.767 25485 9178 1 8 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.074 0.233 25485 9179 1 8 . 1 1 2 2 GLN C C 2 176.492 176.492 177.713 -1.221 25485 9180 1 8 . 1 1 2 2 GLN CA C 2 56.749 56.749 58.396 -1.647 25485 9181 1 8 . 1 1 2 2 GLN CB C 2 28.654 28.654 27.833 0.821 25485 9182 1 8 . 1 1 3 3 GLU N N 3 121.668 121.668 119.972 1.696 25485 9183 1 8 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.115 -0.326 25485 9184 1 8 . 1 1 3 3 GLU C C 3 176.278 176.278 178.588 -2.310 25485 9185 1 8 . 1 1 3 3 GLU CA C 3 57.059 57.059 58.352 -1.294 25485 9186 1 8 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.320 0.371 25485 9187 1 8 . 1 1 3 3 GLU H H 3 8.331 8.331 8.644 -0.313 25485 9188 1 8 . 1 1 4 4 ALA N N 4 124.493 124.493 121.644 2.849 25485 9189 1 8 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.148 0.362 25485 9190 1 8 . 1 1 4 4 ALA C C 4 178.428 178.428 179.303 -0.875 25485 9191 1 8 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.757 -0.080 25485 9192 1 8 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.340 0.369 25485 9193 1 8 . 1 1 4 4 ALA H H 4 8.131 8.131 8.078 0.053 25485 9194 1 8 . 1 1 5 5 GLY N N 5 108.204 108.204 106.206 1.998 25485 9195 1 8 . 1 1 5 5 GLY C C 5 174.858 174.858 175.704 -0.846 25485 9196 1 8 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.071 1.590 25485 9197 1 8 . 1 1 5 5 GLY H H 5 8.279 8.279 7.729 0.550 25485 9198 1 8 . 1 1 6 6 GLY N N 6 108.820 108.820 108.208 0.612 25485 9199 1 8 . 1 1 6 6 GLY C C 6 174.189 174.189 174.564 -0.375 25485 9200 1 8 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.242 0.171 25485 9201 1 8 . 1 1 6 6 GLY H H 6 8.246 8.246 7.533 0.713 25485 9202 1 8 . 1 1 7 7 MET N N 7 119.938 119.938 120.016 -0.078 25485 9203 1 8 . 1 1 7 7 MET HA H 7 4.659 4.659 4.813 -0.154 25485 9204 1 8 . 1 1 7 7 MET C C 7 176.191 176.191 176.103 0.088 25485 9205 1 8 . 1 1 7 7 MET CA C 7 54.799 54.799 54.608 0.191 25485 9206 1 8 . 1 1 7 7 MET CB C 7 33.046 33.046 33.948 -0.902 25485 9207 1 8 . 1 1 7 7 MET H H 7 8.005 8.005 7.946 0.059 25485 9208 1 8 . 1 1 8 8 SER N N 8 118.919 118.919 116.932 1.987 25485 9209 1 8 . 1 1 8 8 SER HA H 8 4.239 4.239 4.683 -0.444 25485 9210 1 8 . 1 1 8 8 SER C C 8 174.949 174.949 175.464 -0.515 25485 9211 1 8 . 1 1 8 8 SER CA C 8 58.160 58.160 57.047 1.113 25485 9212 1 8 . 1 1 8 8 SER CB C 8 65.440 65.440 64.922 0.518 25485 9213 1 8 . 1 1 8 8 SER H H 8 8.731 8.731 8.348 0.383 25485 9214 1 8 . 1 1 9 9 GLU N N 9 122.442 122.442 122.297 0.145 25485 9215 1 8 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.144 0.177 25485 9216 1 8 . 1 1 9 9 GLU C C 9 178.604 178.604 179.022 -0.418 25485 9217 1 8 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.355 0.112 25485 9218 1 8 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.603 -0.427 25485 9219 1 8 . 1 1 9 9 GLU H H 9 8.901 8.901 8.979 -0.078 25485 9220 1 8 . 1 1 10 10 LEU N N 10 120.568 120.568 119.545 1.023 25485 9221 1 8 . 1 1 10 10 LEU C C 10 179.307 179.307 179.116 0.191 25485 9222 1 8 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.154 -0.674 25485 9223 1 8 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.889 -0.314 25485 9224 1 8 . 1 1 10 10 LEU H H 10 8.020 8.020 8.280 -0.260 25485 9225 1 8 . 1 1 11 11 GLN N N 11 119.930 119.930 117.986 1.944 25485 9226 1 8 . 1 1 11 11 GLN HA H 11 4.134 4.134 3.967 0.167 25485 9227 1 8 . 1 1 11 11 GLN C C 11 178.330 178.330 178.639 -0.309 25485 9228 1 8 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.713 0.105 25485 9229 1 8 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.325 -0.461 25485 9230 1 8 . 1 1 11 11 GLN H H 11 7.811 7.811 7.713 0.098 25485 9231 1 8 . 1 1 12 12 TRP N N 12 121.031 121.031 121.288 -0.257 25485 9232 1 8 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.394 0.020 25485 9233 1 8 . 1 1 12 12 TRP C C 12 178.874 178.874 178.053 0.821 25485 9234 1 8 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.237 0.270 25485 9235 1 8 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.662 -0.275 25485 9236 1 8 . 1 1 12 12 TRP H H 12 8.205 8.205 7.752 0.453 25485 9237 1 8 . 1 1 13 13 GLU N N 13 121.877 121.877 120.268 1.609 25485 9238 1 8 . 1 1 13 13 GLU C C 13 179.425 179.425 178.923 0.502 25485 9239 1 8 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.767 0.270 25485 9240 1 8 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.672 -0.750 25485 9241 1 8 . 1 1 13 13 GLU H H 13 8.434 8.434 8.262 0.172 25485 9242 1 8 . 1 1 14 14 GLN N N 14 120.449 120.449 118.561 1.888 25485 9243 1 8 . 1 1 14 14 GLN HA H 14 4.238 4.238 4.079 0.159 25485 9244 1 8 . 1 1 14 14 GLN C C 14 179.210 179.210 178.210 1.000 25485 9245 1 8 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.507 0.375 25485 9246 1 8 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.358 -0.608 25485 9247 1 8 . 1 1 14 14 GLN H H 14 8.124 8.124 8.026 0.098 25485 9248 1 8 . 1 1 15 15 ALA N N 15 123.114 123.114 120.647 2.467 25485 9249 1 8 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.800 0.590 25485 9250 1 8 . 1 1 15 15 ALA C C 15 179.352 179.352 179.360 -0.008 25485 9251 1 8 . 1 1 15 15 ALA CA C 15 54.965 54.965 54.955 0.010 25485 9252 1 8 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.815 0.848 25485 9253 1 8 . 1 1 15 15 ALA H H 15 8.344 8.344 7.713 0.631 25485 9254 1 8 . 1 1 16 16 GLN N N 16 117.718 117.718 118.499 -0.781 25485 9255 1 8 . 1 1 16 16 GLN HA H 16 3.782 3.782 4.077 -0.295 25485 9256 1 8 . 1 1 16 16 GLN C C 16 177.719 177.719 178.340 -0.621 25485 9257 1 8 . 1 1 16 16 GLN CA C 16 60.281 60.281 59.037 1.244 25485 9258 1 8 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.802 -0.266 25485 9259 1 8 . 1 1 16 16 GLN H H 16 8.500 8.500 7.719 0.781 25485 9260 1 8 . 1 1 17 17 ASP N N 17 120.040 120.040 120.895 -0.855 25485 9261 1 8 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.441 0.095 25485 9262 1 8 . 1 1 17 17 ASP C C 17 177.630 177.630 178.871 -1.241 25485 9263 1 8 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.999 -0.194 25485 9264 1 8 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.690 1.174 25485 9265 1 8 . 1 1 17 17 ASP H H 17 7.871 7.871 7.643 0.228 25485 9266 1 8 . 1 1 18 18 TYR N N 18 122.465 122.465 120.028 2.437 25485 9267 1 8 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.131 0.059 25485 9268 1 8 . 1 1 18 18 TYR C C 18 178.439 178.439 177.855 0.584 25485 9269 1 8 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.902 0.944 25485 9270 1 8 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.317 1.623 25485 9271 1 8 . 1 1 18 18 TYR H H 18 8.244 8.244 8.646 -0.402 25485 9272 1 8 . 1 1 19 19 LEU N N 19 117.635 117.635 118.745 -1.110 25485 9273 1 8 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.016 0.116 25485 9274 1 8 . 1 1 19 19 LEU C C 19 180.940 180.940 178.697 2.243 25485 9275 1 8 . 1 1 19 19 LEU CA C 19 57.505 57.505 57.094 0.411 25485 9276 1 8 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.810 -1.212 25485 9277 1 8 . 1 1 19 19 LEU H H 19 8.713 8.713 7.926 0.787 25485 9278 1 8 . 1 1 20 20 LYS N N 20 124.594 124.594 119.513 5.081 25485 9279 1 8 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.011 0.073 25485 9280 1 8 . 1 1 20 20 LYS C C 20 178.387 178.387 179.275 -0.888 25485 9281 1 8 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.453 0.352 25485 9282 1 8 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.276 0.180 25485 9283 1 8 . 1 1 20 20 LYS H H 20 8.815 8.815 7.648 1.167 25485 9284 1 8 . 1 1 21 21 ARG N N 21 117.535 117.535 117.539 -0.004 25485 9285 1 8 . 1 1 21 21 ARG HA H 21 3.719 3.719 3.929 -0.210 25485 9286 1 8 . 1 1 21 21 ARG C C 21 178.498 178.498 178.270 0.228 25485 9287 1 8 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.318 0.926 25485 9288 1 8 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.083 0.358 25485 9289 1 8 . 1 1 21 21 ARG H H 21 7.810 7.810 7.404 0.406 25485 9290 1 8 . 1 1 22 22 PHE N N 22 112.113 112.113 118.379 -6.266 25485 9291 1 8 . 1 1 22 22 PHE HA H 22 4.911 4.911 3.926 0.985 25485 9292 1 8 . 1 1 22 22 PHE C C 22 174.875 174.875 174.703 0.172 25485 9293 1 8 . 1 1 22 22 PHE CA C 22 57.475 57.475 60.544 -3.069 25485 9294 1 8 . 1 1 22 22 PHE CB C 22 39.169 39.169 38.803 0.366 25485 9295 1 8 . 1 1 22 22 PHE H H 22 8.010 8.010 7.152 0.858 25485 9296 1 8 . 1 1 23 23 TYR N N 23 116.187 116.187 115.341 0.846 25485 9297 1 8 . 1 1 23 23 TYR C C 23 173.455 173.455 175.329 -1.874 25485 9298 1 8 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.612 2.815 25485 9299 1 8 . 1 1 23 23 TYR CB C 23 39.529 39.529 37.194 2.334 25485 9300 1 8 . 1 1 23 23 TYR H H 23 7.680 7.680 7.087 0.593 25485 9301 1 8 . 1 1 24 24 LEU N N 24 115.570 115.570 116.929 -1.359 25485 9302 1 8 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.031 0.119 25485 9303 1 8 . 1 1 24 24 LEU C C 24 176.661 176.661 176.523 0.138 25485 9304 1 8 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.096 1.056 25485 9305 1 8 . 1 1 24 24 LEU CB C 24 36.863 36.863 41.150 -4.287 25485 9306 1 8 . 1 1 24 24 LEU H H 24 7.238 7.238 7.352 -0.114 25485 9307 1 8 . 1 1 25 25 TYR N N 25 119.901 119.901 123.680 -3.779 25485 9308 1 8 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.599 -0.240 25485 9309 1 8 . 1 1 25 25 TYR C C 25 173.784 173.784 174.966 -1.182 25485 9310 1 8 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.851 0.396 25485 9311 1 8 . 1 1 25 25 TYR CB C 25 39.079 39.079 38.165 0.914 25485 9312 1 8 . 1 1 25 25 TYR H H 25 7.845 7.845 8.690 -0.845 25485 9313 1 8 . 1 1 26 26 ASP N N 26 129.338 129.338 127.311 2.027 25485 9314 1 8 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.090 -0.639 25485 9315 1 8 . 1 1 26 26 ASP C C 26 175.282 175.282 175.949 -0.667 25485 9316 1 8 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.526 -1.093 25485 9317 1 8 . 1 1 26 26 ASP CB C 26 41.249 41.249 42.320 -1.071 25485 9318 1 8 . 1 1 26 26 ASP H H 26 8.108 8.108 7.993 0.115 25485 9319 1 8 . 1 1 27 27 SER C C 27 175.204 175.204 176.552 -1.348 25485 9320 1 8 . 1 1 27 27 SER CA C 27 59.424 59.424 59.747 -0.323 25485 9321 1 8 . 1 1 27 27 SER CB C 27 63.535 63.535 63.706 -0.171 25485 9322 1 8 . 1 1 28 28 GLU N N 28 122.058 122.058 121.991 0.067 25485 9323 1 8 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.166 0.159 25485 9324 1 8 . 1 1 28 28 GLU C C 28 177.073 177.073 177.372 -0.299 25485 9325 1 8 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.474 -1.262 25485 9326 1 8 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.541 0.029 25485 9327 1 8 . 1 1 28 28 GLU H H 28 8.255 8.255 8.585 -0.330 25485 9328 1 8 . 1 1 29 29 THR N N 29 114.161 114.161 113.036 1.125 25485 9329 1 8 . 1 1 29 29 THR HA H 29 4.260 4.260 4.344 -0.084 25485 9330 1 8 . 1 1 29 29 THR C C 29 174.591 174.591 173.838 0.753 25485 9331 1 8 . 1 1 29 29 THR CA C 29 61.976 61.976 62.189 -0.213 25485 9332 1 8 . 1 1 29 29 THR CB C 29 69.385 69.385 69.029 0.356 25485 9333 1 8 . 1 1 29 29 THR H H 29 7.498 7.498 7.534 -0.036 25485 9334 1 8 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.035 0.183 25485 9335 1 8 . 1 1 30 30 LYS H H 30 8.218 8.218 7.764 0.454 25485 9336 1 8 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.757 -0.333 25485 9337 1 8 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.849 -1.716 25485 9338 1 8 . 1 1 32 32 ALA N N 32 126.484 126.484 122.967 3.517 25485 9339 1 8 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.280 0.016 25485 9340 1 8 . 1 1 32 32 ALA C C 32 178.012 178.012 178.325 -0.313 25485 9341 1 8 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.349 -0.589 25485 9342 1 8 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.419 -0.649 25485 9343 1 8 . 1 1 32 32 ALA H H 32 8.411 8.411 8.556 -0.145 25485 9344 1 8 . 1 1 33 33 ASN N N 33 116.885 116.885 116.643 0.242 25485 9345 1 8 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.605 0.093 25485 9346 1 8 . 1 1 33 33 ASN C C 33 176.240 176.240 177.377 -1.137 25485 9347 1 8 . 1 1 33 33 ASN CA C 33 54.187 54.187 54.770 -0.583 25485 9348 1 8 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.194 0.391 25485 9349 1 8 . 1 1 33 33 ASN H H 33 8.309 8.309 8.762 -0.453 25485 9350 1 8 . 1 1 34 34 SER N N 34 116.836 116.836 116.199 0.637 25485 9351 1 8 . 1 1 34 34 SER HA H 34 4.544 4.544 4.252 0.292 25485 9352 1 8 . 1 1 34 34 SER C C 34 175.253 175.253 175.853 -0.600 25485 9353 1 8 . 1 1 34 34 SER CA C 34 59.583 59.583 60.435 -0.852 25485 9354 1 8 . 1 1 34 34 SER CB C 34 63.919 63.919 62.691 1.228 25485 9355 1 8 . 1 1 34 34 SER H H 34 8.115 8.115 8.427 -0.312 25485 9356 1 8 . 1 1 35 35 LEU N N 35 125.355 125.355 122.770 2.585 25485 9357 1 8 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.027 -0.451 25485 9358 1 8 . 1 1 35 35 LEU C C 35 177.973 177.973 177.736 0.237 25485 9359 1 8 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.398 0.099 25485 9360 1 8 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.693 -1.001 25485 9361 1 8 . 1 1 35 35 LEU H H 35 8.312 8.312 7.370 0.942 25485 9362 1 8 . 1 1 36 36 GLU N N 36 119.201 119.201 118.758 0.443 25485 9363 1 8 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.894 0.020 25485 9364 1 8 . 1 1 36 36 GLU C C 36 178.141 178.141 178.842 -0.701 25485 9365 1 8 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.655 0.004 25485 9366 1 8 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.946 0.367 25485 9367 1 8 . 1 1 36 36 GLU H H 36 8.225 8.225 7.912 0.313 25485 9368 1 8 . 1 1 37 37 ALA N N 37 120.746 120.746 121.948 -1.202 25485 9369 1 8 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.085 -0.006 25485 9370 1 8 . 1 1 37 37 ALA C C 37 181.485 181.485 179.746 1.739 25485 9371 1 8 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.907 0.552 25485 9372 1 8 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.172 -0.005 25485 9373 1 8 . 1 1 37 37 ALA H H 37 7.917 7.917 7.757 0.160 25485 9374 1 8 . 1 1 38 38 LYS N N 38 119.326 119.326 119.476 -0.150 25485 9375 1 8 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.019 0.312 25485 9376 1 8 . 1 1 38 38 LYS C C 38 177.946 177.946 179.116 -1.170 25485 9377 1 8 . 1 1 38 38 LYS CA C 38 57.704 57.704 59.623 -1.919 25485 9378 1 8 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.529 -0.729 25485 9379 1 8 . 1 1 38 38 LYS H H 38 8.216 8.216 7.990 0.226 25485 9380 1 8 . 1 1 39 39 LEU N N 39 122.736 122.736 118.590 4.146 25485 9381 1 8 . 1 1 39 39 LEU HA H 39 3.941 3.941 4.004 -0.063 25485 9382 1 8 . 1 1 39 39 LEU C C 39 178.819 178.819 179.020 -0.201 25485 9383 1 8 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.027 0.054 25485 9384 1 8 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.489 -0.861 25485 9385 1 8 . 1 1 39 39 LEU H H 39 8.666 8.666 8.543 0.123 25485 9386 1 8 . 1 1 40 40 LYS N N 40 118.411 118.411 119.245 -0.834 25485 9387 1 8 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.898 0.740 25485 9388 1 8 . 1 1 40 40 LYS C C 40 179.329 179.329 178.828 0.501 25485 9389 1 8 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.116 0.017 25485 9390 1 8 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.256 -0.471 25485 9391 1 8 . 1 1 40 40 LYS H H 40 8.227 8.227 8.036 0.191 25485 9392 1 8 . 1 1 41 41 GLU N N 41 121.329 121.329 118.768 2.561 25485 9393 1 8 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.022 0.071 25485 9394 1 8 . 1 1 41 41 GLU C C 41 178.989 178.989 178.795 0.194 25485 9395 1 8 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.957 0.803 25485 9396 1 8 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.869 0.967 25485 9397 1 8 . 1 1 41 41 GLU H H 41 7.718 7.718 7.889 -0.171 25485 9398 1 8 . 1 1 42 42 MET N N 42 123.817 123.817 119.204 4.613 25485 9399 1 8 . 1 1 42 42 MET HA H 42 4.107 4.107 4.221 -0.114 25485 9400 1 8 . 1 1 42 42 MET C C 42 177.719 177.719 177.327 0.392 25485 9401 1 8 . 1 1 42 42 MET CA C 42 59.912 59.912 58.742 1.170 25485 9402 1 8 . 1 1 42 42 MET CB C 42 30.506 30.506 32.516 -2.010 25485 9403 1 8 . 1 1 42 42 MET H H 42 7.657 7.657 7.443 0.214 25485 9404 1 8 . 1 1 43 43 GLN N N 43 119.998 119.998 118.289 1.709 25485 9405 1 8 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.987 -0.182 25485 9406 1 8 . 1 1 43 43 GLN C C 43 177.604 177.604 178.856 -1.252 25485 9407 1 8 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.736 1.229 25485 9408 1 8 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.658 -1.103 25485 9409 1 8 . 1 1 43 43 GLN H H 43 8.910 8.910 7.642 1.268 25485 9410 1 8 . 1 1 44 44 LYS N N 44 119.165 119.165 119.341 -0.176 25485 9411 1 8 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.214 -0.159 25485 9412 1 8 . 1 1 44 44 LYS C C 44 179.991 179.991 179.188 0.803 25485 9413 1 8 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.340 1.221 25485 9414 1 8 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.038 0.260 25485 9415 1 8 . 1 1 44 44 LYS H H 44 8.507 8.507 7.497 1.010 25485 9416 1 8 . 1 1 45 45 PHE N N 45 123.602 123.602 119.977 3.625 25485 9417 1 8 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.387 -0.486 25485 9418 1 8 . 1 1 45 45 PHE C C 45 177.606 177.606 176.101 1.505 25485 9419 1 8 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.659 2.375 25485 9420 1 8 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.464 0.402 25485 9421 1 8 . 1 1 45 45 PHE H H 45 8.445 8.445 7.721 0.724 25485 9422 1 8 . 1 1 46 46 PHE N N 46 112.715 112.715 115.176 -2.461 25485 9423 1 8 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.468 0.129 25485 9424 1 8 . 1 1 46 46 PHE C C 46 175.285 175.285 177.240 -1.955 25485 9425 1 8 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.589 1.086 25485 9426 1 8 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.291 -0.832 25485 9427 1 8 . 1 1 46 46 PHE H H 46 8.272 8.272 8.512 -0.240 25485 9428 1 8 . 1 1 47 47 GLY N N 47 110.438 110.438 107.622 2.816 25485 9429 1 8 . 1 1 47 47 GLY C C 47 174.935 174.935 174.620 0.315 25485 9430 1 8 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.198 1.813 25485 9431 1 8 . 1 1 47 47 GLY H H 47 7.926 7.926 8.462 -0.536 25485 9432 1 8 . 1 1 48 48 LEU N N 48 121.830 121.830 119.533 2.297 25485 9433 1 8 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.713 0.211 25485 9434 1 8 . 1 1 48 48 LEU C C 48 174.009 174.009 176.108 -2.099 25485 9435 1 8 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.534 -1.699 25485 9436 1 8 . 1 1 48 48 LEU CB C 48 41.463 41.463 41.003 0.460 25485 9437 1 8 . 1 1 48 48 LEU H H 48 8.762 8.762 7.606 1.156 25485 9438 1 8 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.388 -0.150 25485 9439 1 8 . 1 1 49 49 PRO C C 49 176.874 176.874 176.933 -0.059 25485 9440 1 8 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.785 -0.266 25485 9441 1 8 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.970 -0.891 25485 9442 1 8 . 1 1 50 50 ILE N N 50 126.859 126.859 117.029 9.830 25485 9443 1 8 . 1 1 50 50 ILE HA H 50 4.101 4.101 3.996 0.105 25485 9444 1 8 . 1 1 50 50 ILE C C 50 176.540 176.540 175.319 1.221 25485 9445 1 8 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.843 -0.887 25485 9446 1 8 . 1 1 50 50 ILE CB C 50 36.393 36.393 36.951 -0.558 25485 9447 1 8 . 1 1 50 50 ILE H H 50 8.548 8.548 7.889 0.659 25485 9448 1 8 . 1 1 51 51 THR N N 51 116.443 116.443 117.718 -1.275 25485 9449 1 8 . 1 1 51 51 THR HA H 51 4.584 4.584 4.503 0.081 25485 9450 1 8 . 1 1 51 51 THR C C 51 176.672 176.672 175.462 1.210 25485 9451 1 8 . 1 1 51 51 THR CA C 51 60.979 60.979 60.524 0.455 25485 9452 1 8 . 1 1 51 51 THR CB C 51 71.505 71.505 70.416 1.089 25485 9453 1 8 . 1 1 51 51 THR H H 51 8.001 8.001 7.757 0.244 25485 9454 1 8 . 1 1 52 52 GLY N N 52 112.719 112.719 110.460 2.259 25485 9455 1 8 . 1 1 52 52 GLY C C 52 170.609 170.609 174.724 -4.115 25485 9456 1 8 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.954 0.792 25485 9457 1 8 . 1 1 52 52 GLY H H 52 9.499 9.499 8.505 0.994 25485 9458 1 8 . 1 1 53 53 MET N N 53 116.621 116.621 118.376 -1.755 25485 9459 1 8 . 1 1 53 53 MET HA H 53 4.023 4.023 4.519 -0.496 25485 9460 1 8 . 1 1 53 53 MET C C 53 174.695 174.695 174.685 0.010 25485 9461 1 8 . 1 1 53 53 MET CA C 53 53.460 53.460 55.044 -1.584 25485 9462 1 8 . 1 1 53 53 MET CB C 53 35.408 35.408 34.127 1.280 25485 9463 1 8 . 1 1 53 53 MET H H 53 7.993 7.993 7.412 0.581 25485 9464 1 8 . 1 1 54 54 LEU N N 54 122.679 122.679 121.911 0.768 25485 9465 1 8 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.282 -0.531 25485 9466 1 8 . 1 1 54 54 LEU C C 54 174.784 174.784 173.978 0.806 25485 9467 1 8 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.176 0.125 25485 9468 1 8 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.206 -0.196 25485 9469 1 8 . 1 1 54 54 LEU H H 54 7.940 7.940 8.340 -0.400 25485 9470 1 8 . 1 1 55 55 ASN N N 55 115.797 115.797 117.880 -2.083 25485 9471 1 8 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.554 0.195 25485 9472 1 8 . 1 1 55 55 ASN C C 55 175.459 175.459 175.128 0.331 25485 9473 1 8 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.146 -1.303 25485 9474 1 8 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.182 2.175 25485 9475 1 8 . 1 1 55 55 ASN H H 55 6.543 6.543 7.991 -1.448 25485 9476 1 8 . 1 1 56 56 SER N N 56 121.507 121.507 117.183 4.324 25485 9477 1 8 . 1 1 56 56 SER HA H 56 4.638 4.638 4.291 0.347 25485 9478 1 8 . 1 1 56 56 SER C C 56 175.727 175.727 175.763 -0.036 25485 9479 1 8 . 1 1 56 56 SER CA C 56 57.932 57.932 60.120 -2.188 25485 9480 1 8 . 1 1 56 56 SER CB C 56 63.786 63.786 63.578 0.208 25485 9481 1 8 . 1 1 56 56 SER H H 56 8.213 8.213 7.996 0.217 25485 9482 1 8 . 1 1 57 57 ARG N N 57 122.951 122.951 120.955 1.996 25485 9483 1 8 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.309 -0.108 25485 9484 1 8 . 1 1 57 57 ARG C C 57 178.560 178.560 178.055 0.505 25485 9485 1 8 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.508 -0.076 25485 9486 1 8 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.592 -0.487 25485 9487 1 8 . 1 1 57 57 ARG H H 57 7.895 7.895 8.565 -0.670 25485 9488 1 8 . 1 1 58 58 VAL N N 58 118.778 118.778 120.986 -2.208 25485 9489 1 8 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.615 -0.284 25485 9490 1 8 . 1 1 58 58 VAL C C 58 177.370 177.370 177.845 -0.475 25485 9491 1 8 . 1 1 58 58 VAL CA C 58 66.382 66.382 65.375 1.007 25485 9492 1 8 . 1 1 58 58 VAL CB C 58 32.209 32.209 30.792 1.417 25485 9493 1 8 . 1 1 58 58 VAL H H 58 7.583 7.583 8.054 -0.471 25485 9494 1 8 . 1 1 59 59 ILE N N 59 119.159 119.159 118.384 0.775 25485 9495 1 8 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.705 -0.292 25485 9496 1 8 . 1 1 59 59 ILE C C 59 177.067 177.067 177.641 -0.574 25485 9497 1 8 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.482 0.151 25485 9498 1 8 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.874 -0.178 25485 9499 1 8 . 1 1 59 59 ILE H H 59 7.323 7.323 7.984 -0.661 25485 9500 1 8 . 1 1 60 60 GLU N N 60 119.367 119.367 121.607 -2.240 25485 9501 1 8 . 1 1 60 60 GLU HA H 60 3.738 3.738 4.015 -0.277 25485 9502 1 8 . 1 1 60 60 GLU C C 60 179.978 179.978 178.966 1.012 25485 9503 1 8 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.722 -0.464 25485 9504 1 8 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.260 0.128 25485 9505 1 8 . 1 1 60 60 GLU H H 60 7.879 7.879 7.547 0.332 25485 9506 1 8 . 1 1 61 61 ILE N N 61 118.816 118.816 119.398 -0.582 25485 9507 1 8 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.998 -0.559 25485 9508 1 8 . 1 1 61 61 ILE C C 61 179.033 179.033 177.184 1.849 25485 9509 1 8 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.109 0.729 25485 9510 1 8 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.369 -1.470 25485 9511 1 8 . 1 1 61 61 ILE H H 61 7.246 7.246 7.672 -0.426 25485 9512 1 8 . 1 1 62 62 MET N N 62 119.986 119.986 116.223 3.763 25485 9513 1 8 . 1 1 62 62 MET HA H 62 3.444 3.444 4.485 -1.041 25485 9514 1 8 . 1 1 62 62 MET C C 62 176.185 176.185 177.979 -1.794 25485 9515 1 8 . 1 1 62 62 MET CA C 62 59.014 59.014 57.921 1.093 25485 9516 1 8 . 1 1 62 62 MET CB C 62 31.250 31.250 32.884 -1.634 25485 9517 1 8 . 1 1 62 62 MET H H 62 7.835 7.835 7.336 0.499 25485 9518 1 8 . 1 1 63 63 GLN N N 63 116.163 116.163 116.630 -0.467 25485 9519 1 8 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.354 -0.076 25485 9520 1 8 . 1 1 63 63 GLN C C 63 176.727 176.727 176.720 0.007 25485 9521 1 8 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.826 -0.688 25485 9522 1 8 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.456 -0.390 25485 9523 1 8 . 1 1 63 63 GLN H H 63 7.454 7.454 7.961 -0.507 25485 9524 1 8 . 1 1 64 64 LYS N N 64 121.430 121.430 121.522 -0.092 25485 9525 1 8 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.536 0.007 25485 9526 1 8 . 1 1 64 64 LYS C C 64 174.724 174.724 174.729 -0.005 25485 9527 1 8 . 1 1 64 64 LYS CA C 64 55.517 55.517 53.944 1.573 25485 9528 1 8 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.538 -0.942 25485 9529 1 8 . 1 1 64 64 LYS H H 64 7.483 7.483 7.660 -0.177 25485 9530 1 8 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.480 -2.044 25485 9531 1 8 . 1 1 65 65 PRO C C 65 176.158 176.158 175.962 0.196 25485 9532 1 8 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.156 -0.268 25485 9533 1 8 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.274 -0.441 25485 9534 1 8 . 1 1 66 66 ARG N N 66 112.697 112.697 123.541 -10.844 25485 9535 1 8 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.713 -0.305 25485 9536 1 8 . 1 1 66 66 ARG C C 66 174.478 174.478 174.181 0.297 25485 9537 1 8 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.222 -1.586 25485 9538 1 8 . 1 1 66 66 ARG CB C 66 34.673 34.673 32.157 2.516 25485 9539 1 8 . 1 1 66 66 ARG H H 66 8.146 8.146 8.690 -0.544 25485 9540 1 8 . 1 1 67 67 CYS N N 67 121.740 121.740 116.234 5.506 25485 9541 1 8 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.740 -0.300 25485 9542 1 8 . 1 1 67 67 CYS C C 67 175.659 175.659 175.891 -0.232 25485 9543 1 8 . 1 1 67 67 CYS CA C 67 59.195 59.195 57.584 1.611 25485 9544 1 8 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.798 -1.592 25485 9545 1 8 . 1 1 67 67 CYS H H 67 7.757 7.757 8.232 -0.475 25485 9546 1 8 . 1 1 68 68 GLY N N 68 116.217 116.217 111.179 5.038 25485 9547 1 8 . 1 1 68 68 GLY C C 68 172.210 172.210 174.121 -1.911 25485 9548 1 8 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.816 1.743 25485 9549 1 8 . 1 1 68 68 GLY H H 68 9.704 9.704 9.012 0.692 25485 9550 1 8 . 1 1 69 69 VAL N N 69 126.372 126.372 122.191 4.181 25485 9551 1 8 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.303 -0.472 25485 9552 1 8 . 1 1 69 69 VAL C C 69 173.538 173.538 174.600 -1.062 25485 9553 1 8 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.647 2.721 25485 9554 1 8 . 1 1 69 69 VAL CB C 69 32.523 32.523 30.635 1.888 25485 9555 1 8 . 1 1 69 69 VAL H H 69 9.113 9.113 7.454 1.659 25485 9556 1 8 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.811 0.139 25485 9557 1 8 . 1 1 70 70 PRO C C 70 175.019 175.019 176.389 -1.370 25485 9558 1 8 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.650 0.698 25485 9559 1 8 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.907 -0.549 25485 9560 1 8 . 1 1 71 71 ASP N N 71 118.986 118.986 117.639 1.347 25485 9561 1 8 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.983 -0.550 25485 9562 1 8 . 1 1 71 71 ASP C C 71 175.166 175.166 175.278 -0.112 25485 9563 1 8 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.544 1.824 25485 9564 1 8 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.389 -1.525 25485 9565 1 8 . 1 1 71 71 ASP H H 71 8.054 8.054 8.287 -0.233 25485 9566 1 8 . 1 1 72 72 VAL N N 72 112.953 112.953 114.251 -1.298 25485 9567 1 8 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.623 -0.327 25485 9568 1 8 . 1 1 72 72 VAL C C 72 174.330 174.330 174.564 -0.234 25485 9569 1 8 . 1 1 72 72 VAL CA C 72 59.645 59.645 61.185 -1.540 25485 9570 1 8 . 1 1 72 72 VAL CB C 72 33.872 33.872 34.380 -0.508 25485 9571 1 8 . 1 1 72 72 VAL H H 72 6.430 6.430 7.607 -1.177 25485 9572 1 8 . 1 1 73 73 ALA N N 73 125.869 125.869 130.024 -4.155 25485 9573 1 8 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.669 -0.364 25485 9574 1 8 . 1 1 73 73 ALA C C 73 177.382 177.382 175.986 1.396 25485 9575 1 8 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.615 0.434 25485 9576 1 8 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.738 -0.787 25485 9577 1 8 . 1 1 73 73 ALA H H 73 8.177 8.177 8.399 -0.222 25485 9578 1 8 . 1 1 74 74 GLU N N 74 120.724 120.724 120.205 0.519 25485 9579 1 8 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.533 -0.430 25485 9580 1 8 . 1 1 74 74 GLU C C 74 176.246 176.246 174.591 1.655 25485 9581 1 8 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.156 0.636 25485 9582 1 8 . 1 1 74 74 GLU CB C 74 29.785 29.785 32.051 -2.266 25485 9583 1 8 . 1 1 74 74 GLU H H 74 8.381 8.381 8.523 -0.142 25485 9584 1 8 . 1 1 75 75 TYR N N 75 121.473 121.473 118.940 2.533 25485 9585 1 8 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.077 0.368 25485 9586 1 8 . 1 1 75 75 TYR C C 75 175.633 175.633 175.088 0.545 25485 9587 1 8 . 1 1 75 75 TYR CA C 75 58.327 58.327 57.076 1.251 25485 9588 1 8 . 1 1 75 75 TYR CB C 75 38.413 38.413 39.331 -0.918 25485 9589 1 8 . 1 1 75 75 TYR H H 75 8.065 8.065 8.130 -0.065 25485 9590 1 8 . 1 1 76 76 SER N N 76 117.860 117.860 117.988 -0.128 25485 9591 1 8 . 1 1 76 76 SER HA H 76 3.886 3.886 4.593 -0.707 25485 9592 1 8 . 1 1 76 76 SER C C 76 173.859 173.859 173.401 0.458 25485 9593 1 8 . 1 1 76 76 SER CA C 76 58.250 58.250 58.577 -0.327 25485 9594 1 8 . 1 1 76 76 SER CB C 76 64.117 64.117 63.884 0.233 25485 9595 1 8 . 1 1 76 76 SER H H 76 7.748 7.748 8.500 -0.752 25485 9596 1 8 . 1 1 77 77 LEU N N 77 123.789 123.789 121.170 2.619 25485 9597 1 8 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.036 0.110 25485 9598 1 8 . 1 1 77 77 LEU C C 77 176.451 176.451 175.677 0.774 25485 9599 1 8 . 1 1 77 77 LEU CA C 77 55.464 55.464 55.468 -0.004 25485 9600 1 8 . 1 1 77 77 LEU CB C 77 41.957 41.957 40.986 0.971 25485 9601 1 8 . 1 1 77 77 LEU H H 77 7.979 7.979 8.640 -0.661 25485 9602 1 8 . 1 1 78 78 PHE N N 78 119.275 119.275 118.809 0.466 25485 9603 1 8 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.420 0.456 25485 9604 1 8 . 1 1 78 78 PHE C C 78 173.844 173.844 175.176 -1.332 25485 9605 1 8 . 1 1 78 78 PHE CA C 78 55.372 55.372 56.090 -0.718 25485 9606 1 8 . 1 1 78 78 PHE CB C 78 39.164 39.164 38.850 0.314 25485 9607 1 8 . 1 1 78 78 PHE H H 78 7.827 7.827 7.990 -0.163 25485 9608 1 8 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.382 -0.026 25485 9609 1 8 . 1 1 79 79 PRO C C 79 176.433 176.433 175.967 0.466 25485 9610 1 8 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.297 1.553 25485 9611 1 8 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.532 -0.840 25485 9612 1 8 . 1 1 80 80 ASN N N 80 118.057 118.057 120.092 -2.035 25485 9613 1 8 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.420 0.227 25485 9614 1 8 . 1 1 80 80 ASN C C 80 174.305 174.305 174.950 -0.645 25485 9615 1 8 . 1 1 80 80 ASN CA C 80 52.860 52.860 54.219 -1.359 25485 9616 1 8 . 1 1 80 80 ASN CB C 80 39.583 39.583 36.980 2.603 25485 9617 1 8 . 1 1 80 80 ASN H H 80 8.068 8.068 8.501 -0.433 25485 9618 1 8 . 1 1 81 81 SER HA H 81 4.565 4.565 4.288 0.277 25485 9619 1 8 . 1 1 81 81 SER CA C 81 56.800 56.800 58.816 -2.016 25485 9620 1 8 . 1 1 81 81 SER CB C 81 63.128 63.128 63.949 -0.821 25485 9621 1 8 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.542 -0.081 25485 9622 1 8 . 1 1 82 82 PRO C C 82 174.589 174.589 176.751 -2.162 25485 9623 1 8 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.490 -0.844 25485 9624 1 8 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.452 -1.198 25485 9625 1 8 . 1 1 83 83 LYS N N 83 114.578 114.578 118.867 -4.289 25485 9626 1 8 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.380 -0.227 25485 9627 1 8 . 1 1 83 83 LYS C C 83 175.308 175.308 176.956 -1.648 25485 9628 1 8 . 1 1 83 83 LYS CA C 83 54.407 54.407 56.112 -1.705 25485 9629 1 8 . 1 1 83 83 LYS CB C 83 34.418 34.418 32.934 1.484 25485 9630 1 8 . 1 1 83 83 LYS H H 83 7.356 7.356 7.788 -0.432 25485 9631 1 8 . 1 1 84 84 TRP N N 84 122.455 122.455 120.396 2.059 25485 9632 1 8 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.689 -0.669 25485 9633 1 8 . 1 1 84 84 TRP C C 84 177.636 177.636 177.282 0.354 25485 9634 1 8 . 1 1 84 84 TRP CA C 84 57.471 57.471 56.605 0.866 25485 9635 1 8 . 1 1 84 84 TRP CB C 84 30.318 30.318 27.625 2.693 25485 9636 1 8 . 1 1 84 84 TRP H H 84 8.050 8.050 8.403 -0.353 25485 9637 1 8 . 1 1 85 85 THR N N 85 113.501 113.501 115.510 -2.009 25485 9638 1 8 . 1 1 85 85 THR HA H 85 4.573 4.573 4.514 0.059 25485 9639 1 8 . 1 1 85 85 THR C C 85 174.757 174.757 174.579 0.178 25485 9640 1 8 . 1 1 85 85 THR CA C 85 62.130 62.130 61.192 0.938 25485 9641 1 8 . 1 1 85 85 THR CB C 85 69.107 69.107 69.138 -0.031 25485 9642 1 8 . 1 1 85 85 THR H H 85 8.861 8.861 8.283 0.578 25485 9643 1 8 . 1 1 86 86 SER N N 86 117.270 117.270 118.004 -0.734 25485 9644 1 8 . 1 1 86 86 SER HA H 86 4.741 4.741 4.421 0.320 25485 9645 1 8 . 1 1 86 86 SER C C 86 173.457 173.457 174.751 -1.294 25485 9646 1 8 . 1 1 86 86 SER CA C 86 56.739 56.739 58.833 -2.094 25485 9647 1 8 . 1 1 86 86 SER CB C 86 64.717 64.717 64.122 0.595 25485 9648 1 8 . 1 1 86 86 SER H H 86 7.743 7.743 7.986 -0.243 25485 9649 1 8 . 1 1 87 87 LYS N N 87 120.329 120.329 119.580 0.749 25485 9650 1 8 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.220 0.009 25485 9651 1 8 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.800 -0.208 25485 9652 1 8 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.459 -0.336 25485 9653 1 8 . 1 1 87 87 LYS H H 87 8.285 8.285 8.397 -0.112 25485 9654 1 8 . 1 1 88 88 VAL N N 88 117.531 117.531 117.343 0.188 25485 9655 1 8 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.908 -0.253 25485 9656 1 8 . 1 1 88 88 VAL C C 88 174.868 174.868 174.452 0.416 25485 9657 1 8 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.734 -0.639 25485 9658 1 8 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.326 -1.631 25485 9659 1 8 . 1 1 88 88 VAL H H 88 7.428 7.428 7.357 0.071 25485 9660 1 8 . 1 1 89 89 VAL N N 89 131.452 131.452 126.894 4.558 25485 9661 1 8 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.262 -0.103 25485 9662 1 8 . 1 1 89 89 VAL C C 89 175.758 175.758 174.943 0.815 25485 9663 1 8 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.920 -0.199 25485 9664 1 8 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.339 -0.166 25485 9665 1 8 . 1 1 89 89 VAL H H 89 8.603 8.603 8.775 -0.172 25485 9666 1 8 . 1 1 90 90 THR N N 90 118.206 118.206 118.410 -0.204 25485 9667 1 8 . 1 1 90 90 THR HA H 90 5.649 5.649 5.432 0.217 25485 9668 1 8 . 1 1 90 90 THR C C 90 174.579 174.579 173.593 0.986 25485 9669 1 8 . 1 1 90 90 THR CA C 90 58.959 58.959 59.469 -0.510 25485 9670 1 8 . 1 1 90 90 THR CB C 90 72.288 72.288 72.146 0.142 25485 9671 1 8 . 1 1 90 90 THR H H 90 9.021 9.021 8.199 0.822 25485 9672 1 8 . 1 1 91 91 TYR N N 91 118.117 118.117 116.098 2.019 25485 9673 1 8 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.351 0.347 25485 9674 1 8 . 1 1 91 91 TYR C C 91 171.233 171.233 172.879 -1.646 25485 9675 1 8 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.924 -0.492 25485 9676 1 8 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.199 1.062 25485 9677 1 8 . 1 1 91 91 TYR H H 91 8.555 8.555 8.271 0.284 25485 9678 1 8 . 1 1 92 92 ARG N N 92 120.252 120.252 119.798 0.454 25485 9679 1 8 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.577 0.120 25485 9680 1 8 . 1 1 92 92 ARG C C 92 173.932 173.932 174.486 -0.554 25485 9681 1 8 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.704 0.137 25485 9682 1 8 . 1 1 92 92 ARG CB C 92 34.686 34.686 35.119 -0.433 25485 9683 1 8 . 1 1 92 92 ARG H H 92 8.520 8.520 8.445 0.075 25485 9684 1 8 . 1 1 93 93 ILE N N 93 128.305 128.305 127.206 1.099 25485 9685 1 8 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.399 0.233 25485 9686 1 8 . 1 1 93 93 ILE C C 93 175.468 175.468 176.430 -0.962 25485 9687 1 8 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.565 0.663 25485 9688 1 8 . 1 1 93 93 ILE CB C 93 37.225 37.225 37.083 0.142 25485 9689 1 8 . 1 1 93 93 ILE H H 93 8.886 8.886 8.732 0.154 25485 9690 1 8 . 1 1 94 94 VAL N N 94 126.647 126.647 125.396 1.251 25485 9691 1 8 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.211 -0.215 25485 9692 1 8 . 1 1 94 94 VAL C C 94 175.670 175.670 176.446 -0.776 25485 9693 1 8 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.228 0.186 25485 9694 1 8 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.699 0.320 25485 9695 1 8 . 1 1 94 94 VAL H H 94 9.517 9.517 8.752 0.765 25485 9696 1 8 . 1 1 95 95 SER N N 95 113.398 113.398 113.654 -0.256 25485 9697 1 8 . 1 1 95 95 SER HA H 95 4.701 4.701 4.740 -0.039 25485 9698 1 8 . 1 1 95 95 SER C C 95 170.684 170.684 172.446 -1.762 25485 9699 1 8 . 1 1 95 95 SER CA C 95 56.945 56.945 57.050 -0.104 25485 9700 1 8 . 1 1 95 95 SER CB C 95 65.276 65.276 65.662 -0.386 25485 9701 1 8 . 1 1 95 95 SER H H 95 7.463 7.463 7.625 -0.162 25485 9702 1 8 . 1 1 96 96 TYR N N 96 116.512 116.512 120.137 -3.625 25485 9703 1 8 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.621 -0.357 25485 9704 1 8 . 1 1 96 96 TYR C C 96 174.856 174.856 174.586 0.270 25485 9705 1 8 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.300 2.337 25485 9706 1 8 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.946 1.217 25485 9707 1 8 . 1 1 96 96 TYR H H 96 8.240 8.240 8.116 0.124 25485 9708 1 8 . 1 1 97 97 THR CA C 97 57.798 57.798 60.806 -3.008 25485 9709 1 8 . 1 1 97 97 THR CB C 97 67.420 67.420 69.350 -1.930 25485 9710 1 8 . 1 1 98 98 ARG N N 98 128.156 128.156 124.928 3.228 25485 9711 1 8 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.153 0.172 25485 9712 1 8 . 1 1 98 98 ARG C C 98 177.625 177.625 176.226 1.399 25485 9713 1 8 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.175 -0.961 25485 9714 1 8 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.663 -0.183 25485 9715 1 8 . 1 1 98 98 ARG H H 98 8.914 8.914 8.788 0.126 25485 9716 1 8 . 1 1 99 99 ASP N N 99 120.592 120.592 118.054 2.538 25485 9717 1 8 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.638 -0.257 25485 9718 1 8 . 1 1 99 99 ASP C C 99 175.679 175.679 175.371 0.308 25485 9719 1 8 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.894 1.542 25485 9720 1 8 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.656 0.714 25485 9721 1 8 . 1 1 99 99 ASP H H 99 8.708 8.708 8.426 0.282 25485 9722 1 8 . 1 1 100 100 LEU N N 100 116.829 116.829 119.369 -2.540 25485 9723 1 8 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.698 0.258 25485 9724 1 8 . 1 1 100 100 LEU C C 100 173.335 173.335 174.147 -0.812 25485 9725 1 8 . 1 1 100 100 LEU CA C 100 51.037 51.037 52.001 -0.964 25485 9726 1 8 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.203 2.064 25485 9727 1 8 . 1 1 100 100 LEU H H 100 6.916 6.916 7.199 -0.283 25485 9728 1 8 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.182 -0.007 25485 9729 1 8 . 1 1 102 102 HIS C C 102 177.649 177.649 177.589 0.060 25485 9730 1 8 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.189 -0.516 25485 9731 1 8 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.123 -1.690 25485 9732 1 8 . 1 1 103 103 ILE N N 103 115.170 115.170 118.137 -2.967 25485 9733 1 8 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.871 0.302 25485 9734 1 8 . 1 1 103 103 ILE C C 103 177.214 177.214 177.155 0.059 25485 9735 1 8 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.269 -1.104 25485 9736 1 8 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.919 -0.154 25485 9737 1 8 . 1 1 103 103 ILE H H 103 8.234 8.234 8.197 0.037 25485 9738 1 8 . 1 1 104 104 THR N N 104 119.374 119.374 117.242 2.132 25485 9739 1 8 . 1 1 104 104 THR HA H 104 4.045 4.045 4.036 0.009 25485 9740 1 8 . 1 1 104 104 THR C C 104 175.612 175.612 176.502 -0.890 25485 9741 1 8 . 1 1 104 104 THR CA C 104 66.568 66.568 67.094 -0.526 25485 9742 1 8 . 1 1 104 104 THR CB C 104 68.077 68.077 68.487 -0.410 25485 9743 1 8 . 1 1 104 104 THR H H 104 6.947 6.947 7.771 -0.824 25485 9744 1 8 . 1 1 105 105 VAL N N 105 123.263 123.263 120.671 2.592 25485 9745 1 8 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.106 0.332 25485 9746 1 8 . 1 1 105 105 VAL C C 105 177.322 177.322 177.288 0.034 25485 9747 1 8 . 1 1 105 105 VAL CA C 105 67.947 67.947 65.411 2.536 25485 9748 1 8 . 1 1 105 105 VAL CB C 105 31.269 31.269 30.674 0.595 25485 9749 1 8 . 1 1 105 105 VAL H H 105 7.407 7.407 7.979 -0.572 25485 9750 1 8 . 1 1 106 106 ASP N N 106 119.972 119.972 119.611 0.361 25485 9751 1 8 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.464 -0.142 25485 9752 1 8 . 1 1 106 106 ASP C C 106 179.747 179.747 178.551 1.196 25485 9753 1 8 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.471 0.764 25485 9754 1 8 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.943 -0.581 25485 9755 1 8 . 1 1 106 106 ASP H H 106 8.627 8.627 8.013 0.614 25485 9756 1 8 . 1 1 107 107 ARG N N 107 121.033 121.033 118.555 2.478 25485 9757 1 8 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.125 0.053 25485 9758 1 8 . 1 1 107 107 ARG C C 107 179.485 179.485 178.554 0.931 25485 9759 1 8 . 1 1 107 107 ARG CA C 107 59.580 59.580 59.020 0.560 25485 9760 1 8 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.747 0.461 25485 9761 1 8 . 1 1 107 107 ARG H H 107 8.356 8.356 7.906 0.450 25485 9762 1 8 . 1 1 108 108 LEU N N 108 121.463 121.463 120.724 0.739 25485 9763 1 8 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.136 0.169 25485 9764 1 8 . 1 1 108 108 LEU C C 108 178.852 178.852 179.085 -0.233 25485 9765 1 8 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.318 0.564 25485 9766 1 8 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.208 0.107 25485 9767 1 8 . 1 1 108 108 LEU H H 108 8.790 8.790 7.797 0.993 25485 9768 1 8 . 1 1 109 109 VAL N N 109 120.233 120.233 116.580 3.653 25485 9769 1 8 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.683 -0.283 25485 9770 1 8 . 1 1 109 109 VAL C C 109 177.019 177.019 177.647 -0.628 25485 9771 1 8 . 1 1 109 109 VAL CA C 109 68.046 68.046 67.129 0.917 25485 9772 1 8 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.496 -0.307 25485 9773 1 8 . 1 1 109 109 VAL H H 109 8.787 8.787 7.992 0.795 25485 9774 1 8 . 1 1 110 110 SER N N 110 112.862 112.862 115.698 -2.836 25485 9775 1 8 . 1 1 110 110 SER HA H 110 4.300 4.300 4.139 0.161 25485 9776 1 8 . 1 1 110 110 SER C C 110 176.770 176.770 176.905 -0.135 25485 9777 1 8 . 1 1 110 110 SER CA C 110 61.744 61.744 61.976 -0.232 25485 9778 1 8 . 1 1 110 110 SER CB C 110 62.742 62.742 62.963 -0.221 25485 9779 1 8 . 1 1 110 110 SER H H 110 7.605 7.605 7.848 -0.243 25485 9780 1 8 . 1 1 111 111 LYS N N 111 122.319 122.319 122.188 0.131 25485 9781 1 8 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.153 -0.092 25485 9782 1 8 . 1 1 111 111 LYS C C 111 178.309 178.309 178.358 -0.049 25485 9783 1 8 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.289 0.525 25485 9784 1 8 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.616 -0.107 25485 9785 1 8 . 1 1 111 111 LYS H H 111 8.156 8.156 8.088 0.068 25485 9786 1 8 . 1 1 112 112 ALA N N 112 124.147 124.147 120.585 3.562 25485 9787 1 8 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.508 -0.409 25485 9788 1 8 . 1 1 112 112 ALA C C 112 179.445 179.445 179.073 0.372 25485 9789 1 8 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.361 0.865 25485 9790 1 8 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.313 0.661 25485 9791 1 8 . 1 1 112 112 ALA H H 112 8.278 8.278 7.534 0.744 25485 9792 1 8 . 1 1 113 113 LEU N N 113 116.195 116.195 120.672 -4.477 25485 9793 1 8 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.120 -0.369 25485 9794 1 8 . 1 1 113 113 LEU C C 113 179.537 179.537 177.981 1.556 25485 9795 1 8 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.009 -0.265 25485 9796 1 8 . 1 1 113 113 LEU CB C 113 40.555 40.555 42.050 -1.495 25485 9797 1 8 . 1 1 113 113 LEU H H 113 8.021 8.021 8.595 -0.574 25485 9798 1 8 . 1 1 114 114 ASN N N 114 116.570 116.570 117.814 -1.244 25485 9799 1 8 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.601 -0.055 25485 9800 1 8 . 1 1 114 114 ASN C C 114 177.136 177.136 177.609 -0.473 25485 9801 1 8 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.607 -0.843 25485 9802 1 8 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.533 0.090 25485 9803 1 8 . 1 1 114 114 ASN H H 114 8.212 8.212 8.384 -0.172 25485 9804 1 8 . 1 1 115 115 MET N N 115 122.055 122.055 119.600 2.455 25485 9805 1 8 . 1 1 115 115 MET HA H 115 4.010 4.010 4.114 -0.104 25485 9806 1 8 . 1 1 115 115 MET C C 115 177.681 177.681 178.367 -0.686 25485 9807 1 8 . 1 1 115 115 MET CA C 115 59.445 59.445 59.136 0.309 25485 9808 1 8 . 1 1 115 115 MET CB C 115 31.616 31.616 32.359 -0.743 25485 9809 1 8 . 1 1 115 115 MET H H 115 7.937 7.937 7.775 0.162 25485 9810 1 8 . 1 1 116 116 TRP N N 116 117.115 117.115 119.473 -2.358 25485 9811 1 8 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.278 0.240 25485 9812 1 8 . 1 1 116 116 TRP C C 116 179.054 179.054 179.537 -0.483 25485 9813 1 8 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.136 0.375 25485 9814 1 8 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.266 1.607 25485 9815 1 8 . 1 1 116 116 TRP H H 116 6.783 6.783 7.567 -0.784 25485 9816 1 8 . 1 1 117 117 GLY N N 117 104.511 104.511 106.510 -1.999 25485 9817 1 8 . 1 1 117 117 GLY C C 117 175.035 175.035 175.931 -0.896 25485 9818 1 8 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.367 0.630 25485 9819 1 8 . 1 1 117 117 GLY H H 117 9.302 9.302 8.019 1.283 25485 9820 1 8 . 1 1 118 118 LYS N N 118 118.580 118.580 119.660 -1.080 25485 9821 1 8 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.039 0.168 25485 9822 1 8 . 1 1 118 118 LYS C C 118 177.235 177.235 177.494 -0.259 25485 9823 1 8 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.650 0.241 25485 9824 1 8 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.077 -0.172 25485 9825 1 8 . 1 1 118 118 LYS H H 118 7.940 7.940 7.929 0.011 25485 9826 1 8 . 1 1 119 119 GLU N N 119 113.749 113.749 116.514 -2.765 25485 9827 1 8 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.376 0.462 25485 9828 1 8 . 1 1 119 119 GLU C C 119 178.024 178.024 175.092 2.932 25485 9829 1 8 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.578 -0.302 25485 9830 1 8 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.478 1.208 25485 9831 1 8 . 1 1 119 119 GLU H H 119 7.763 7.763 7.469 0.294 25485 9832 1 8 . 1 1 120 120 ILE N N 120 111.144 111.144 112.421 -1.277 25485 9833 1 8 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.663 0.708 25485 9834 1 8 . 1 1 120 120 ILE C C 120 174.033 174.033 173.333 0.700 25485 9835 1 8 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.489 0.965 25485 9836 1 8 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.886 2.043 25485 9837 1 8 . 1 1 120 120 ILE H H 120 7.518 7.518 7.458 0.060 25485 9838 1 8 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.362 0.300 25485 9839 1 8 . 1 1 121 121 PRO C C 121 174.784 174.784 176.884 -2.100 25485 9840 1 8 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.433 -1.418 25485 9841 1 8 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.536 -2.151 25485 9842 1 8 . 1 1 122 122 LEU N N 122 121.531 121.531 118.894 2.637 25485 9843 1 8 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.380 -0.041 25485 9844 1 8 . 1 1 122 122 LEU C C 122 173.977 173.977 176.725 -2.748 25485 9845 1 8 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.544 -0.986 25485 9846 1 8 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.709 2.690 25485 9847 1 8 . 1 1 122 122 LEU H H 122 6.847 6.847 7.491 -0.644 25485 9848 1 8 . 1 1 123 123 HIS N N 123 121.054 121.054 117.843 3.211 25485 9849 1 8 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.744 -0.137 25485 9850 1 8 . 1 1 123 123 HIS C C 123 172.820 172.820 173.680 -0.860 25485 9851 1 8 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.106 -0.597 25485 9852 1 8 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.487 0.623 25485 9853 1 8 . 1 1 123 123 HIS H H 123 7.760 7.760 8.673 -0.913 25485 9854 1 8 . 1 1 124 124 PHE N N 124 120.465 120.465 124.270 -3.805 25485 9855 1 8 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.408 0.426 25485 9856 1 8 . 1 1 124 124 PHE C C 124 175.677 175.677 175.656 0.021 25485 9857 1 8 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.530 0.762 25485 9858 1 8 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.418 0.404 25485 9859 1 8 . 1 1 124 124 PHE H H 124 8.306 8.306 8.743 -0.437 25485 9860 1 8 . 1 1 125 125 ARG N N 125 124.008 124.008 123.849 0.159 25485 9861 1 8 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.891 -0.180 25485 9862 1 8 . 1 1 125 125 ARG C C 125 172.901 172.901 175.174 -2.273 25485 9863 1 8 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.857 -0.583 25485 9864 1 8 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.430 -0.608 25485 9865 1 8 . 1 1 125 125 ARG H H 125 8.426 8.426 8.968 -0.542 25485 9866 1 8 . 1 1 126 126 LYS N N 126 130.004 130.004 125.175 4.829 25485 9867 1 8 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.250 -0.867 25485 9868 1 8 . 1 1 126 126 LYS C C 126 176.126 176.126 175.527 0.599 25485 9869 1 8 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.949 0.232 25485 9870 1 8 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.151 -0.124 25485 9871 1 8 . 1 1 126 126 LYS H H 126 8.481 8.481 8.566 -0.085 25485 9872 1 8 . 1 1 127 127 VAL N N 127 125.288 125.288 120.655 4.633 25485 9873 1 8 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.194 0.311 25485 9874 1 8 . 1 1 127 127 VAL C C 127 175.565 175.565 175.375 0.190 25485 9875 1 8 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.589 -1.640 25485 9876 1 8 . 1 1 127 127 VAL CB C 127 34.362 34.362 33.384 0.978 25485 9877 1 8 . 1 1 127 127 VAL H H 127 8.721 8.721 7.882 0.839 25485 9878 1 8 . 1 1 128 128 VAL N N 128 117.467 117.467 118.678 -1.211 25485 9879 1 8 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.025 0.304 25485 9880 1 8 . 1 1 128 128 VAL C C 128 174.622 174.622 174.543 0.079 25485 9881 1 8 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.445 0.673 25485 9882 1 8 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.793 0.717 25485 9883 1 8 . 1 1 128 128 VAL H H 128 8.406 8.406 7.891 0.515 25485 9884 1 8 . 1 1 129 129 TRP N N 129 119.986 119.986 121.762 -1.776 25485 9885 1 8 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.849 -0.133 25485 9886 1 8 . 1 1 129 129 TRP C C 129 174.536 174.536 176.376 -1.840 25485 9887 1 8 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.955 -1.038 25485 9888 1 8 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.578 2.436 25485 9889 1 8 . 1 1 129 129 TRP H H 129 7.435 7.435 7.299 0.136 25485 9890 1 8 . 1 1 130 130 GLY N N 130 109.900 109.900 113.327 -3.427 25485 9891 1 8 . 1 1 130 130 GLY C C 130 173.187 173.187 173.919 -0.732 25485 9892 1 8 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.462 0.018 25485 9893 1 8 . 1 1 130 130 GLY H H 130 8.006 8.006 8.411 -0.405 25485 9894 1 8 . 1 1 131 131 THR N N 131 116.142 116.142 115.592 0.550 25485 9895 1 8 . 1 1 131 131 THR HA H 131 4.162 4.162 4.475 -0.313 25485 9896 1 8 . 1 1 131 131 THR C C 131 172.766 172.766 173.606 -0.840 25485 9897 1 8 . 1 1 131 131 THR CA C 131 63.212 63.212 61.310 1.902 25485 9898 1 8 . 1 1 131 131 THR CB C 131 69.308 69.308 70.102 -0.794 25485 9899 1 8 . 1 1 131 131 THR H H 131 8.233 8.233 8.150 0.083 25485 9900 1 8 . 1 1 132 132 ALA N N 132 129.807 129.807 125.304 4.503 25485 9901 1 8 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.423 0.093 25485 9902 1 8 . 1 1 132 132 ALA C C 132 175.358 175.358 176.344 -0.986 25485 9903 1 8 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.254 -0.888 25485 9904 1 8 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.169 1.629 25485 9905 1 8 . 1 1 132 132 ALA H H 132 7.962 7.962 8.369 -0.407 25485 9906 1 8 . 1 1 133 133 ASP N N 133 122.896 122.896 120.295 2.601 25485 9907 1 8 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.432 -0.011 25485 9908 1 8 . 1 1 133 133 ASP C C 133 177.314 177.314 177.074 0.240 25485 9909 1 8 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.733 1.186 25485 9910 1 8 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.248 -0.777 25485 9911 1 8 . 1 1 133 133 ASP H H 133 8.251 8.251 8.477 -0.226 25485 9912 1 8 . 1 1 134 134 ILE N N 134 125.472 125.472 119.948 5.524 25485 9913 1 8 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.289 -0.146 25485 9914 1 8 . 1 1 134 134 ILE C C 134 174.201 174.201 175.140 -0.939 25485 9915 1 8 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.589 -0.318 25485 9916 1 8 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.259 -0.549 25485 9917 1 8 . 1 1 134 134 ILE H H 134 8.802 8.802 7.934 0.868 25485 9918 1 8 . 1 1 135 135 MET N N 135 127.265 127.265 125.496 1.769 25485 9919 1 8 . 1 1 135 135 MET HA H 135 5.192 5.192 5.190 0.002 25485 9920 1 8 . 1 1 135 135 MET C C 135 176.206 176.206 175.451 0.755 25485 9921 1 8 . 1 1 135 135 MET CA C 135 53.626 53.626 53.130 0.496 25485 9922 1 8 . 1 1 135 135 MET CB C 135 32.639 32.639 34.329 -1.690 25485 9923 1 8 . 1 1 135 135 MET H H 135 7.418 7.418 8.286 -0.868 25485 9924 1 8 . 1 1 136 136 ILE N N 136 125.440 125.440 124.517 0.923 25485 9925 1 8 . 1 1 136 136 ILE HA H 136 5.589 5.589 5.037 0.552 25485 9926 1 8 . 1 1 136 136 ILE C C 136 175.190 175.190 175.976 -0.786 25485 9927 1 8 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.847 1.261 25485 9928 1 8 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.649 4.291 25485 9929 1 8 . 1 1 136 136 ILE H H 136 9.124 9.124 9.035 0.089 25485 9930 1 8 . 1 1 137 137 GLY N N 137 112.211 112.211 114.484 -2.273 25485 9931 1 8 . 1 1 137 137 GLY C C 137 170.855 170.855 171.846 -0.991 25485 9932 1 8 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.026 1.379 25485 9933 1 8 . 1 1 137 137 GLY H H 137 8.594 8.594 8.149 0.445 25485 9934 1 8 . 1 1 138 138 PHE N N 138 119.463 119.463 119.166 0.297 25485 9935 1 8 . 1 1 138 138 PHE HA H 138 5.496 5.496 4.829 0.667 25485 9936 1 8 . 1 1 138 138 PHE C C 138 175.186 175.186 175.545 -0.359 25485 9937 1 8 . 1 1 138 138 PHE CA C 138 55.995 55.995 57.443 -1.448 25485 9938 1 8 . 1 1 138 138 PHE CB C 138 41.442 41.442 42.001 -0.559 25485 9939 1 8 . 1 1 138 138 PHE H H 138 7.857 7.857 8.473 -0.616 25485 9940 1 8 . 1 1 139 139 ALA N N 139 123.914 123.914 124.644 -0.730 25485 9941 1 8 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.655 0.076 25485 9942 1 8 . 1 1 139 139 ALA C C 139 174.613 174.613 174.844 -0.231 25485 9943 1 8 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.143 -1.108 25485 9944 1 8 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.857 1.615 25485 9945 1 8 . 1 1 139 139 ALA H H 139 8.955 8.955 8.730 0.225 25485 9946 1 8 . 1 1 140 140 ARG N N 140 118.339 118.339 119.794 -1.455 25485 9947 1 8 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.825 0.281 25485 9948 1 8 . 1 1 140 140 ARG C C 140 176.201 176.201 178.393 -2.192 25485 9949 1 8 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.810 -0.645 25485 9950 1 8 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.905 0.564 25485 9951 1 8 . 1 1 140 140 ARG H H 140 8.546 8.546 8.538 0.008 25485 9952 1 8 . 1 1 141 141 GLY N N 141 108.916 108.916 108.842 0.074 25485 9953 1 8 . 1 1 141 141 GLY C C 141 175.595 175.595 174.868 0.727 25485 9954 1 8 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.308 -1.018 25485 9955 1 8 . 1 1 141 141 GLY H H 141 8.989 8.989 9.280 -0.291 25485 9956 1 8 . 1 1 142 142 ALA N N 142 121.448 121.448 121.803 -0.355 25485 9957 1 8 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.540 -0.132 25485 9958 1 8 . 1 1 142 142 ALA C C 142 177.027 177.027 177.672 -0.645 25485 9959 1 8 . 1 1 142 142 ALA CA C 142 53.277 53.277 51.937 1.340 25485 9960 1 8 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.276 -0.312 25485 9961 1 8 . 1 1 142 142 ALA H H 142 8.642 8.642 8.214 0.428 25485 9962 1 8 . 1 1 143 143 HIS N N 143 120.356 120.356 116.422 3.934 25485 9963 1 8 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.430 0.727 25485 9964 1 8 . 1 1 143 143 HIS C C 143 174.303 174.303 176.339 -2.036 25485 9965 1 8 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.995 -1.542 25485 9966 1 8 . 1 1 143 143 HIS CB C 143 27.791 27.791 30.180 -2.389 25485 9967 1 8 . 1 1 143 143 HIS H H 143 8.990 8.990 8.394 0.596 25485 9968 1 8 . 1 1 144 144 GLY N N 144 112.517 112.517 106.200 6.317 25485 9969 1 8 . 1 1 144 144 GLY C C 144 173.758 173.758 172.817 0.941 25485 9970 1 8 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.517 1.578 25485 9971 1 8 . 1 1 144 144 GLY H H 144 5.175 5.175 7.952 -2.777 25485 9972 1 8 . 1 1 145 145 ASP N N 145 117.762 117.762 119.252 -1.490 25485 9973 1 8 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.801 -0.103 25485 9974 1 8 . 1 1 145 145 ASP C C 145 175.851 175.851 175.139 0.712 25485 9975 1 8 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.810 -0.851 25485 9976 1 8 . 1 1 145 145 ASP CB C 145 41.799 41.799 43.535 -1.736 25485 9977 1 8 . 1 1 145 145 ASP H H 145 7.096 7.096 7.740 -0.644 25485 9978 1 8 . 1 1 146 146 SER N N 146 125.540 125.540 115.099 10.441 25485 9979 1 8 . 1 1 146 146 SER HA H 146 4.204 4.204 4.332 -0.128 25485 9980 1 8 . 1 1 146 146 SER C C 146 172.319 172.319 173.718 -1.399 25485 9981 1 8 . 1 1 146 146 SER CA C 146 58.862 58.862 58.233 0.629 25485 9982 1 8 . 1 1 146 146 SER CB C 146 62.933 62.933 63.286 -0.353 25485 9983 1 8 . 1 1 146 146 SER H H 146 8.261 8.261 8.134 0.127 25485 9984 1 8 . 1 1 147 147 TYR N N 147 120.757 120.757 116.275 4.482 25485 9985 1 8 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.218 0.604 25485 9986 1 8 . 1 1 147 147 TYR C C 147 170.372 170.372 173.763 -3.391 25485 9987 1 8 . 1 1 147 147 TYR CA C 147 53.268 53.268 56.655 -3.387 25485 9988 1 8 . 1 1 147 147 TYR CB C 147 38.296 38.296 36.575 1.721 25485 9989 1 8 . 1 1 147 147 TYR H H 147 7.450 7.450 8.237 -0.787 25485 9990 1 8 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.185 0.687 25485 9991 1 8 . 1 1 148 148 PRO C C 148 179.009 179.009 176.457 2.552 25485 9992 1 8 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.036 1.339 25485 9993 1 8 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.290 -1.381 25485 9994 1 8 . 1 1 149 149 PHE N N 149 120.514 120.514 116.996 3.518 25485 9995 1 8 . 1 1 149 149 PHE C C 149 176.813 176.813 175.553 1.260 25485 9996 1 8 . 1 1 149 149 PHE CA C 149 58.453 58.453 58.273 0.180 25485 9997 1 8 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.347 0.226 25485 9998 1 8 . 1 1 149 149 PHE H H 149 8.024 8.024 7.229 0.795 25485 9999 1 8 . 1 1 150 150 ASP N N 150 115.555 115.555 114.611 0.944 25485 10000 1 8 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.379 0.460 25485 10001 1 8 . 1 1 150 150 ASP C C 150 177.007 177.007 176.275 0.732 25485 10002 1 8 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.376 -0.505 25485 10003 1 8 . 1 1 150 150 ASP CB C 150 41.936 41.936 38.659 3.277 25485 10004 1 8 . 1 1 150 150 ASP H H 150 7.511 7.511 8.347 -0.836 25485 10005 1 8 . 1 1 151 151 GLY N N 151 110.650 110.650 108.640 2.010 25485 10006 1 8 . 1 1 151 151 GLY C C 151 170.281 170.281 172.887 -2.606 25485 10007 1 8 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.697 -0.299 25485 10008 1 8 . 1 1 151 151 GLY H H 151 9.080 9.080 8.572 0.508 25485 10009 1 8 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.168 -0.112 25485 10010 1 8 . 1 1 152 152 PRO C C 152 178.300 178.300 176.438 1.862 25485 10011 1 8 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.142 0.708 25485 10012 1 8 . 1 1 152 152 PRO CB C 152 31.260 31.260 32.047 -0.787 25485 10013 1 8 . 1 1 153 153 GLY N N 153 118.783 118.783 112.462 6.321 25485 10014 1 8 . 1 1 153 153 GLY C C 153 174.098 174.098 173.549 0.549 25485 10015 1 8 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.441 -0.835 25485 10016 1 8 . 1 1 153 153 GLY H H 153 11.431 11.431 8.099 3.332 25485 10017 1 8 . 1 1 154 154 ASN N N 154 120.679 120.679 122.675 -1.996 25485 10018 1 8 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.381 -0.137 25485 10019 1 8 . 1 1 154 154 ASN C C 154 174.636 174.636 174.727 -0.091 25485 10020 1 8 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.595 2.073 25485 10021 1 8 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.352 -1.381 25485 10022 1 8 . 1 1 154 154 ASN H H 154 9.247 9.247 8.577 0.670 25485 10023 1 8 . 1 1 155 155 THR N N 155 118.252 118.252 112.415 5.837 25485 10024 1 8 . 1 1 155 155 THR HA H 155 5.577 5.577 4.108 1.469 25485 10025 1 8 . 1 1 155 155 THR C C 155 176.596 176.596 172.729 3.867 25485 10026 1 8 . 1 1 155 155 THR CA C 155 61.731 61.731 62.613 -0.882 25485 10027 1 8 . 1 1 155 155 THR CB C 155 71.325 71.325 68.962 2.363 25485 10028 1 8 . 1 1 155 155 THR H H 155 9.501 9.501 8.442 1.059 25485 10029 1 8 . 1 1 156 156 LEU N N 156 122.598 122.598 121.735 0.863 25485 10030 1 8 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.676 0.195 25485 10031 1 8 . 1 1 156 156 LEU C C 156 175.655 175.655 175.544 0.111 25485 10032 1 8 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.338 -0.800 25485 10033 1 8 . 1 1 156 156 LEU CB C 156 44.511 44.511 43.492 1.018 25485 10034 1 8 . 1 1 156 156 LEU H H 156 8.492 8.492 8.224 0.268 25485 10035 1 8 . 1 1 157 157 ALA N N 157 115.389 115.389 116.931 -1.542 25485 10036 1 8 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.449 0.586 25485 10037 1 8 . 1 1 157 157 ALA C C 157 175.739 175.739 174.965 0.774 25485 10038 1 8 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.056 -0.117 25485 10039 1 8 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.760 1.694 25485 10040 1 8 . 1 1 157 157 ALA H H 157 7.567 7.567 7.543 0.024 25485 10041 1 8 . 1 1 158 158 HIS N N 158 111.900 111.900 117.150 -5.250 25485 10042 1 8 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.801 -0.196 25485 10043 1 8 . 1 1 158 158 HIS C C 158 170.186 170.186 172.708 -2.522 25485 10044 1 8 . 1 1 158 158 HIS CA C 158 56.075 56.075 53.700 2.375 25485 10045 1 8 . 1 1 158 158 HIS CB C 158 30.186 30.186 30.564 -0.378 25485 10046 1 8 . 1 1 158 158 HIS H H 158 8.757 8.757 7.969 0.788 25485 10047 1 8 . 1 1 159 159 ALA N N 159 118.286 118.286 126.432 -8.146 25485 10048 1 8 . 1 1 159 159 ALA HA H 159 4.654 4.654 3.989 0.665 25485 10049 1 8 . 1 1 159 159 ALA C C 159 174.036 174.036 174.621 -0.585 25485 10050 1 8 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.183 0.950 25485 10051 1 8 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.875 2.162 25485 10052 1 8 . 1 1 159 159 ALA H H 159 6.110 6.110 7.995 -1.885 25485 10053 1 8 . 1 1 160 160 PHE N N 160 117.937 117.937 116.727 1.210 25485 10054 1 8 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.832 -0.329 25485 10055 1 8 . 1 1 160 160 PHE C C 160 174.455 174.455 174.069 0.386 25485 10056 1 8 . 1 1 160 160 PHE CA C 160 56.813 56.813 56.194 0.619 25485 10057 1 8 . 1 1 160 160 PHE CB C 160 42.194 42.194 42.625 -0.431 25485 10058 1 8 . 1 1 160 160 PHE H H 160 7.912 7.912 7.645 0.267 25485 10059 1 8 . 1 1 161 161 ALA N N 161 123.531 123.531 122.341 1.190 25485 10060 1 8 . 1 1 161 161 ALA HA H 161 4.491 4.491 5.054 -0.563 25485 10061 1 8 . 1 1 161 161 ALA C C 161 175.503 175.503 176.450 -0.947 25485 10062 1 8 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.321 1.312 25485 10063 1 8 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.651 -3.095 25485 10064 1 8 . 1 1 161 161 ALA H H 161 8.107 8.107 8.639 -0.532 25485 10065 1 8 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.286 -1.376 25485 10066 1 8 . 1 1 162 162 PRO C C 162 173.465 173.465 175.989 -2.524 25485 10067 1 8 . 1 1 162 162 PRO CA C 162 64.257 64.257 63.004 1.253 25485 10068 1 8 . 1 1 162 162 PRO CB C 162 31.242 31.242 30.476 0.766 25485 10069 1 8 . 1 1 163 163 GLY N N 163 107.206 107.206 109.746 -2.540 25485 10070 1 8 . 1 1 163 163 GLY C C 163 172.092 172.092 173.851 -1.759 25485 10071 1 8 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.549 -0.556 25485 10072 1 8 . 1 1 163 163 GLY H H 163 5.997 5.997 7.866 -1.869 25485 10073 1 8 . 1 1 165 165 GLY N N 165 103.110 103.110 108.928 -5.818 25485 10074 1 8 . 1 1 165 165 GLY C C 165 177.158 177.158 174.851 2.307 25485 10075 1 8 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.410 -1.167 25485 10076 1 8 . 1 1 165 165 GLY H H 165 9.145 9.145 8.015 1.130 25485 10077 1 8 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.210 -0.031 25485 10078 1 8 . 1 1 166 166 LEU C C 166 176.437 176.437 177.235 -0.798 25485 10079 1 8 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.520 0.680 25485 10080 1 8 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.385 -0.551 25485 10081 1 8 . 1 1 167 167 GLY N N 167 103.318 103.318 103.353 -0.035 25485 10082 1 8 . 1 1 167 167 GLY C C 167 174.803 174.803 174.753 0.050 25485 10083 1 8 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.866 2.367 25485 10084 1 8 . 1 1 167 167 GLY H H 167 7.768 7.768 7.354 0.414 25485 10085 1 8 . 1 1 168 168 GLY N N 168 121.051 121.051 106.944 14.107 25485 10086 1 8 . 1 1 168 168 GLY C C 168 172.122 172.122 174.571 -2.449 25485 10087 1 8 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.455 1.147 25485 10088 1 8 . 1 1 168 168 GLY H H 168 7.698 7.698 8.083 -0.385 25485 10089 1 8 . 1 1 169 169 ASP N N 169 123.641 123.641 122.202 1.439 25485 10090 1 8 . 1 1 169 169 ASP C C 169 173.942 173.942 174.257 -0.315 25485 10091 1 8 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.810 2.032 25485 10092 1 8 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.019 -2.148 25485 10093 1 8 . 1 1 169 169 ASP H H 169 8.595 8.595 7.833 0.762 25485 10094 1 8 . 1 1 170 170 ALA N N 170 119.366 119.366 122.981 -3.615 25485 10095 1 8 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.445 0.285 25485 10096 1 8 . 1 1 170 170 ALA C C 170 174.593 174.593 175.332 -0.739 25485 10097 1 8 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.666 0.458 25485 10098 1 8 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.398 0.937 25485 10099 1 8 . 1 1 170 170 ALA H H 170 8.324 8.324 8.218 0.106 25485 10100 1 8 . 1 1 171 171 HIS N N 171 120.239 120.239 120.113 0.126 25485 10101 1 8 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.404 0.344 25485 10102 1 8 . 1 1 171 171 HIS C C 171 172.949 172.949 173.866 -0.917 25485 10103 1 8 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.306 -2.582 25485 10104 1 8 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.505 1.036 25485 10105 1 8 . 1 1 171 171 HIS H H 171 8.499 8.499 7.976 0.523 25485 10106 1 8 . 1 1 172 172 PHE N N 172 121.125 121.125 118.030 3.095 25485 10107 1 8 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.318 0.210 25485 10108 1 8 . 1 1 172 172 PHE C C 172 173.875 173.875 173.823 0.052 25485 10109 1 8 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.660 0.260 25485 10110 1 8 . 1 1 172 172 PHE CB C 172 41.903 41.903 42.044 -0.141 25485 10111 1 8 . 1 1 172 172 PHE H H 172 8.445 8.445 7.873 0.572 25485 10112 1 8 . 1 1 173 173 ASP N N 173 124.014 124.014 123.313 0.701 25485 10113 1 8 . 1 1 173 173 ASP HA H 173 3.914 3.914 5.032 -1.118 25485 10114 1 8 . 1 1 173 173 ASP C C 173 178.613 178.613 177.877 0.736 25485 10115 1 8 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.650 1.148 25485 10116 1 8 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.160 -0.417 25485 10117 1 8 . 1 1 173 173 ASP H H 173 7.927 7.927 8.666 -0.739 25485 10118 1 8 . 1 1 174 174 GLU N N 174 132.469 132.469 127.258 5.211 25485 10119 1 8 . 1 1 174 174 GLU C C 174 176.442 176.442 177.359 -0.917 25485 10120 1 8 . 1 1 174 174 GLU CA C 174 57.184 57.184 59.124 -1.940 25485 10121 1 8 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.747 0.538 25485 10122 1 8 . 1 1 174 174 GLU H H 174 9.528 9.528 8.442 1.086 25485 10123 1 8 . 1 1 175 175 ASP N N 175 117.394 117.394 117.954 -0.560 25485 10124 1 8 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.660 0.133 25485 10125 1 8 . 1 1 175 175 ASP C C 175 176.645 176.645 176.295 0.350 25485 10126 1 8 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.537 0.394 25485 10127 1 8 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.791 -1.650 25485 10128 1 8 . 1 1 175 175 ASP H H 175 8.768 8.768 8.646 0.122 25485 10129 1 8 . 1 1 176 176 GLU N N 176 116.493 116.493 118.543 -2.050 25485 10130 1 8 . 1 1 176 176 GLU C C 176 175.038 175.038 176.014 -0.976 25485 10131 1 8 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.719 -2.054 25485 10132 1 8 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.622 -4.399 25485 10133 1 8 . 1 1 176 176 GLU H H 176 7.159 7.159 8.225 -1.066 25485 10134 1 8 . 1 1 177 177 ARG N N 177 122.186 122.186 119.662 2.524 25485 10135 1 8 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.510 0.179 25485 10136 1 8 . 1 1 177 177 ARG C C 177 174.482 174.482 174.613 -0.131 25485 10137 1 8 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.177 -1.490 25485 10138 1 8 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.869 -1.785 25485 10139 1 8 . 1 1 177 177 ARG H H 177 7.560 7.560 8.379 -0.819 25485 10140 1 8 . 1 1 178 178 TRP N N 178 129.179 129.179 124.706 4.473 25485 10141 1 8 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.476 -0.376 25485 10142 1 8 . 1 1 178 178 TRP C C 178 176.298 176.298 176.468 -0.170 25485 10143 1 8 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.065 0.748 25485 10144 1 8 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.044 -0.847 25485 10145 1 8 . 1 1 178 178 TRP H H 178 8.807 8.807 8.694 0.113 25485 10146 1 8 . 1 1 179 179 THR N N 179 112.792 112.792 112.860 -0.068 25485 10147 1 8 . 1 1 179 179 THR HA H 179 4.985 4.985 4.651 0.334 25485 10148 1 8 . 1 1 179 179 THR C C 179 172.765 172.765 172.196 0.569 25485 10149 1 8 . 1 1 179 179 THR CA C 179 59.106 59.106 61.500 -2.394 25485 10150 1 8 . 1 1 179 179 THR CB C 179 71.786 71.786 70.270 1.516 25485 10151 1 8 . 1 1 179 179 THR H H 179 8.974 8.974 8.678 0.296 25485 10152 1 8 . 1 1 180 180 ASP N N 180 122.074 122.074 124.742 -2.668 25485 10153 1 8 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.444 -0.981 25485 10154 1 8 . 1 1 180 180 ASP C C 180 176.366 176.366 178.497 -2.131 25485 10155 1 8 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.161 -2.118 25485 10156 1 8 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.424 -0.696 25485 10157 1 8 . 1 1 180 180 ASP H H 180 8.485 8.485 8.843 -0.358 25485 10158 1 8 . 1 1 181 181 GLY N N 181 110.123 110.123 107.772 2.351 25485 10159 1 8 . 1 1 181 181 GLY C C 181 174.325 174.325 175.272 -0.947 25485 10160 1 8 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.730 0.931 25485 10161 1 8 . 1 1 181 181 GLY H H 181 8.569 8.569 8.640 -0.071 25485 10162 1 8 . 1 1 182 182 SER N N 182 115.562 115.562 115.050 0.512 25485 10163 1 8 . 1 1 182 182 SER HA H 182 4.519 4.519 4.555 -0.036 25485 10164 1 8 . 1 1 182 182 SER C C 182 173.783 173.783 174.167 -0.384 25485 10165 1 8 . 1 1 182 182 SER CA C 182 57.965 57.965 57.642 0.323 25485 10166 1 8 . 1 1 182 182 SER CB C 182 64.166 64.166 64.093 0.073 25485 10167 1 8 . 1 1 182 182 SER H H 182 8.160 8.160 7.600 0.560 25485 10168 1 8 . 1 1 183 183 SER N N 183 117.153 117.153 115.133 2.020 25485 10169 1 8 . 1 1 183 183 SER HA H 183 4.275 4.275 4.190 0.085 25485 10170 1 8 . 1 1 183 183 SER C C 183 173.333 173.333 173.880 -0.547 25485 10171 1 8 . 1 1 183 183 SER CA C 183 59.902 59.902 58.721 1.181 25485 10172 1 8 . 1 1 183 183 SER CB C 183 64.941 64.941 62.938 2.003 25485 10173 1 8 . 1 1 183 183 SER H H 183 7.796 7.796 7.576 0.220 25485 10174 1 8 . 1 1 184 184 LEU N N 184 122.351 122.351 119.268 3.083 25485 10175 1 8 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.507 -0.115 25485 10176 1 8 . 1 1 184 184 LEU C C 184 176.250 176.250 176.777 -0.527 25485 10177 1 8 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.557 0.018 25485 10178 1 8 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.367 -1.286 25485 10179 1 8 . 1 1 184 184 LEU H H 184 8.092 8.092 7.998 0.094 25485 10180 1 8 . 1 1 185 185 GLY N N 185 108.871 108.871 106.739 2.132 25485 10181 1 8 . 1 1 185 185 GLY C C 185 172.375 172.375 174.137 -1.762 25485 10182 1 8 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.001 0.380 25485 10183 1 8 . 1 1 185 185 GLY H H 185 7.960 7.960 7.442 0.518 25485 10184 1 8 . 1 1 186 186 ILE N N 186 123.096 123.096 121.860 1.236 25485 10185 1 8 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.091 -0.250 25485 10186 1 8 . 1 1 186 186 ILE C C 186 175.350 175.350 175.952 -0.602 25485 10187 1 8 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.048 -0.647 25485 10188 1 8 . 1 1 186 186 ILE CB C 186 35.456 35.456 34.917 0.539 25485 10189 1 8 . 1 1 186 186 ILE H H 186 8.893 8.893 8.276 0.617 25485 10190 1 8 . 1 1 187 187 ASN N N 187 127.167 127.167 126.811 0.356 25485 10191 1 8 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.940 -0.587 25485 10192 1 8 . 1 1 187 187 ASN C C 187 175.849 175.849 176.800 -0.951 25485 10193 1 8 . 1 1 187 187 ASN CA C 187 55.714 55.714 53.498 2.216 25485 10194 1 8 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.722 0.408 25485 10195 1 8 . 1 1 187 187 ASN H H 187 8.580 8.580 8.313 0.267 25485 10196 1 8 . 1 1 188 188 PHE N N 188 129.985 129.985 127.640 2.345 25485 10197 1 8 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.340 0.233 25485 10198 1 8 . 1 1 188 188 PHE C C 188 175.578 175.578 177.375 -1.797 25485 10199 1 8 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.077 -0.349 25485 10200 1 8 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.551 -0.119 25485 10201 1 8 . 1 1 188 188 PHE H H 188 9.361 9.361 8.449 0.912 25485 10202 1 8 . 1 1 189 189 LEU N N 189 119.113 119.113 119.703 -0.590 25485 10203 1 8 . 1 1 189 189 LEU HA H 189 3.801 3.801 3.973 -0.172 25485 10204 1 8 . 1 1 189 189 LEU C C 189 179.601 179.601 178.090 1.511 25485 10205 1 8 . 1 1 189 189 LEU CA C 189 58.509 58.509 57.878 0.631 25485 10206 1 8 . 1 1 189 189 LEU CB C 189 39.877 39.877 40.685 -0.808 25485 10207 1 8 . 1 1 189 189 LEU H H 189 8.562 8.562 7.897 0.665 25485 10208 1 8 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.641 0.276 25485 10209 1 8 . 1 1 190 190 TYR C C 190 177.621 177.621 177.698 -0.077 25485 10210 1 8 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.541 0.267 25485 10211 1 8 . 1 1 190 190 TYR CB C 190 39.769 39.769 38.075 1.694 25485 10212 1 8 . 1 1 191 191 ALA N N 191 120.352 120.352 122.047 -1.695 25485 10213 1 8 . 1 1 191 191 ALA HA H 191 4.315 4.315 3.981 0.334 25485 10214 1 8 . 1 1 191 191 ALA C C 191 180.252 180.252 178.414 1.838 25485 10215 1 8 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.458 0.724 25485 10216 1 8 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.520 0.622 25485 10217 1 8 . 1 1 191 191 ALA H H 191 7.993 7.993 8.986 -0.993 25485 10218 1 8 . 1 1 192 192 ALA N N 192 121.409 121.409 121.291 0.118 25485 10219 1 8 . 1 1 192 192 ALA HA H 192 4.057 4.057 3.983 0.074 25485 10220 1 8 . 1 1 192 192 ALA C C 192 178.575 178.575 179.439 -0.864 25485 10221 1 8 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.425 -0.240 25485 10222 1 8 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.129 -1.931 25485 10223 1 8 . 1 1 192 192 ALA H H 192 9.297 9.297 8.344 0.953 25485 10224 1 8 . 1 1 193 193 THR N N 193 116.996 116.996 114.765 2.231 25485 10225 1 8 . 1 1 193 193 THR HA H 193 3.833 3.833 4.067 -0.234 25485 10226 1 8 . 1 1 193 193 THR CA C 193 69.138 69.138 68.037 1.101 25485 10227 1 8 . 1 1 193 193 THR CB C 193 67.365 67.365 68.259 -0.894 25485 10228 1 8 . 1 1 193 193 THR H H 193 8.226 8.226 7.480 0.746 25485 10229 1 8 . 1 1 194 194 HIS N N 194 120.296 120.296 121.273 -0.977 25485 10230 1 8 . 1 1 194 194 HIS HA H 194 4.236 4.236 3.971 0.265 25485 10231 1 8 . 1 1 194 194 HIS C C 194 175.962 175.962 176.673 -0.711 25485 10232 1 8 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.108 1.639 25485 10233 1 8 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.770 -1.851 25485 10234 1 8 . 1 1 194 194 HIS H H 194 7.782 7.782 7.356 0.426 25485 10235 1 8 . 1 1 195 195 ALA N N 195 121.290 121.290 122.470 -1.180 25485 10236 1 8 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.895 0.261 25485 10237 1 8 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.901 1.063 25485 10238 1 8 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.528 0.182 25485 10239 1 8 . 1 1 195 195 ALA H H 195 8.690 8.690 8.368 0.322 25485 10240 1 8 . 1 1 196 196 LEU N N 196 114.899 114.899 118.100 -3.201 25485 10241 1 8 . 1 1 196 196 LEU HA H 196 4.170 4.170 3.998 0.172 25485 10242 1 8 . 1 1 196 196 LEU C C 196 177.946 177.946 179.223 -1.277 25485 10243 1 8 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.473 -1.245 25485 10244 1 8 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.075 -1.298 25485 10245 1 8 . 1 1 196 196 LEU H H 196 8.715 8.715 8.768 -0.053 25485 10246 1 8 . 1 1 197 197 GLY N N 197 107.901 107.901 104.820 3.081 25485 10247 1 8 . 1 1 197 197 GLY C C 197 178.641 178.641 175.249 3.392 25485 10248 1 8 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.771 0.796 25485 10249 1 8 . 1 1 197 197 GLY H H 197 7.546 7.546 7.998 -0.452 25485 10250 1 8 . 1 1 198 198 HIS N N 198 122.017 122.017 119.259 2.758 25485 10251 1 8 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.347 0.510 25485 10252 1 8 . 1 1 198 198 HIS C C 198 179.874 179.874 178.303 1.571 25485 10253 1 8 . 1 1 198 198 HIS CA C 198 58.522 58.522 58.653 -0.131 25485 10254 1 8 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.391 -1.845 25485 10255 1 8 . 1 1 198 198 HIS H H 198 7.196 7.196 7.193 0.003 25485 10256 1 8 . 1 1 199 199 SER N N 199 118.486 118.486 115.130 3.356 25485 10257 1 8 . 1 1 199 199 SER HA H 199 4.490 4.490 4.581 -0.091 25485 10258 1 8 . 1 1 199 199 SER C C 199 174.493 174.493 176.110 -1.617 25485 10259 1 8 . 1 1 199 199 SER CA C 199 58.173 58.173 60.703 -2.530 25485 10260 1 8 . 1 1 199 199 SER CB C 199 63.589 63.589 62.950 0.639 25485 10261 1 8 . 1 1 199 199 SER H H 199 7.884 7.884 7.740 0.144 25485 10262 1 8 . 1 1 200 200 LEU N N 200 114.686 114.686 117.678 -2.992 25485 10263 1 8 . 1 1 200 200 LEU C C 200 177.720 177.720 177.368 0.352 25485 10264 1 8 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.408 0.429 25485 10265 1 8 . 1 1 200 200 LEU CB C 200 42.357 42.357 40.493 1.864 25485 10266 1 8 . 1 1 200 200 LEU H H 200 7.108 7.108 6.831 0.277 25485 10267 1 8 . 1 1 201 201 GLY N N 201 108.363 108.363 106.641 1.722 25485 10268 1 8 . 1 1 201 201 GLY C C 201 174.008 174.008 175.117 -1.109 25485 10269 1 8 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.785 -1.371 25485 10270 1 8 . 1 1 201 201 GLY H H 201 8.195 8.195 8.028 0.167 25485 10271 1 8 . 1 1 202 202 MET N N 202 119.635 119.635 120.174 -0.539 25485 10272 1 8 . 1 1 202 202 MET HA H 202 4.473 4.473 4.272 0.201 25485 10273 1 8 . 1 1 202 202 MET C C 202 176.593 176.593 176.160 0.433 25485 10274 1 8 . 1 1 202 202 MET CA C 202 54.500 54.500 56.197 -1.698 25485 10275 1 8 . 1 1 202 202 MET CB C 202 32.161 32.161 32.666 -0.505 25485 10276 1 8 . 1 1 202 202 MET H H 202 8.182 8.182 7.106 1.076 25485 10277 1 8 . 1 1 203 203 GLY N N 203 109.749 109.749 107.636 2.113 25485 10278 1 8 . 1 1 203 203 GLY C C 203 174.042 174.042 173.006 1.036 25485 10279 1 8 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.276 -0.272 25485 10280 1 8 . 1 1 203 203 GLY H H 203 8.405 8.405 8.355 0.050 25485 10281 1 8 . 1 1 204 204 HIS N N 204 115.732 115.732 118.199 -2.467 25485 10282 1 8 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.509 0.891 25485 10283 1 8 . 1 1 204 204 HIS C C 204 174.430 174.430 174.072 0.358 25485 10284 1 8 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.321 -1.507 25485 10285 1 8 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.208 -0.382 25485 10286 1 8 . 1 1 204 204 HIS H H 204 8.364 8.364 8.652 -0.288 25485 10287 1 8 . 1 1 205 205 SER N N 205 115.484 115.484 115.999 -0.515 25485 10288 1 8 . 1 1 205 205 SER HA H 205 4.766 4.766 4.677 0.089 25485 10289 1 8 . 1 1 205 205 SER C C 205 173.611 173.611 174.670 -1.059 25485 10290 1 8 . 1 1 205 205 SER CA C 205 54.729 54.729 57.239 -2.510 25485 10291 1 8 . 1 1 205 205 SER CB C 205 65.855 65.855 65.572 0.283 25485 10292 1 8 . 1 1 205 205 SER H H 205 7.231 7.231 8.244 -1.013 25485 10293 1 8 . 1 1 206 206 SER N N 206 119.263 119.263 116.719 2.544 25485 10294 1 8 . 1 1 206 206 SER HA H 206 3.701 3.701 4.520 -0.819 25485 10295 1 8 . 1 1 206 206 SER C C 206 173.635 173.635 174.157 -0.522 25485 10296 1 8 . 1 1 206 206 SER CA C 206 63.846 63.846 58.685 5.161 25485 10297 1 8 . 1 1 206 206 SER CB C 206 63.764 63.764 63.646 0.118 25485 10298 1 8 . 1 1 206 206 SER H H 206 8.289 8.289 8.668 -0.379 25485 10299 1 8 . 1 1 207 207 ASP N N 207 126.646 126.646 122.936 3.710 25485 10300 1 8 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.632 0.297 25485 10301 1 8 . 1 1 207 207 ASP C C 207 174.614 174.614 175.288 -0.674 25485 10302 1 8 . 1 1 207 207 ASP CA C 207 51.272 51.272 53.475 -2.203 25485 10303 1 8 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.028 -0.740 25485 10304 1 8 . 1 1 207 207 ASP H H 207 8.541 8.541 7.953 0.588 25485 10305 1 8 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.588 0.199 25485 10306 1 8 . 1 1 208 208 PRO C C 208 177.467 177.467 175.640 1.827 25485 10307 1 8 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.558 -0.722 25485 10308 1 8 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.106 -0.509 25485 10309 1 8 . 1 1 209 209 ASN N N 209 116.020 116.020 113.557 2.463 25485 10310 1 8 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.710 -0.069 25485 10311 1 8 . 1 1 209 209 ASN C C 209 174.695 174.695 174.243 0.452 25485 10312 1 8 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.293 1.927 25485 10313 1 8 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.503 0.607 25485 10314 1 8 . 1 1 209 209 ASN H H 209 8.350 8.350 7.701 0.649 25485 10315 1 8 . 1 1 210 210 ALA N N 210 124.892 124.892 122.260 2.632 25485 10316 1 8 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.570 -0.475 25485 10317 1 8 . 1 1 210 210 ALA C C 210 179.495 179.495 178.246 1.249 25485 10318 1 8 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.253 1.801 25485 10319 1 8 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.274 -1.075 25485 10320 1 8 . 1 1 210 210 ALA H H 210 8.193 8.193 7.274 0.919 25485 10321 1 8 . 1 1 211 211 VAL N N 211 130.402 130.402 122.879 7.523 25485 10322 1 8 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.786 0.477 25485 10323 1 8 . 1 1 211 211 VAL C C 211 179.408 179.408 176.246 3.162 25485 10324 1 8 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.778 0.274 25485 10325 1 8 . 1 1 211 211 VAL CB C 211 30.983 30.983 31.967 -0.984 25485 10326 1 8 . 1 1 211 211 VAL H H 211 11.592 11.592 8.816 2.776 25485 10327 1 8 . 1 1 212 212 MET N N 212 113.285 113.285 115.240 -1.955 25485 10328 1 8 . 1 1 212 212 MET C C 212 176.996 176.996 174.534 2.462 25485 10329 1 8 . 1 1 212 212 MET CA C 212 53.614 53.614 54.302 -0.688 25485 10330 1 8 . 1 1 212 212 MET CB C 212 26.975 26.975 33.014 -6.039 25485 10331 1 8 . 1 1 212 212 MET H H 212 7.724 7.724 7.621 0.103 25485 10332 1 8 . 1 1 213 213 TYR N N 213 129.919 129.919 122.845 7.074 25485 10333 1 8 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.349 1.347 25485 10334 1 8 . 1 1 213 213 TYR C C 213 178.411 178.411 175.351 3.060 25485 10335 1 8 . 1 1 213 213 TYR CA C 213 57.131 57.131 56.764 0.367 25485 10336 1 8 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.725 0.442 25485 10337 1 8 . 1 1 213 213 TYR H H 213 7.902 7.902 7.241 0.661 25485 10338 1 8 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.460 -0.985 25485 10339 1 8 . 1 1 214 214 PRO C C 214 177.694 177.694 176.744 0.950 25485 10340 1 8 . 1 1 214 214 PRO CA C 214 66.028 66.028 63.978 2.050 25485 10341 1 8 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.968 0.855 25485 10342 1 8 . 1 1 215 215 THR N N 215 104.450 104.450 114.734 -10.284 25485 10343 1 8 . 1 1 215 215 THR HA H 215 4.444 4.444 4.254 0.190 25485 10344 1 8 . 1 1 215 215 THR C C 215 173.429 173.429 173.225 0.204 25485 10345 1 8 . 1 1 215 215 THR CA C 215 60.528 60.528 61.883 -1.355 25485 10346 1 8 . 1 1 215 215 THR CB C 215 69.614 69.614 67.181 2.433 25485 10347 1 8 . 1 1 215 215 THR H H 215 6.407 6.407 7.357 -0.950 25485 10348 1 8 . 1 1 216 216 TYR N N 216 124.618 124.618 125.375 -0.757 25485 10349 1 8 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.440 -0.208 25485 10350 1 8 . 1 1 216 216 TYR C C 216 175.669 175.669 174.930 0.739 25485 10351 1 8 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.024 0.563 25485 10352 1 8 . 1 1 216 216 TYR CB C 216 40.891 40.891 39.045 1.846 25485 10353 1 8 . 1 1 216 216 TYR H H 216 8.331 8.331 7.860 0.471 25485 10354 1 8 . 1 1 217 217 GLY N N 217 116.089 116.089 115.501 0.588 25485 10355 1 8 . 1 1 217 217 GLY C C 217 173.560 173.560 172.482 1.078 25485 10356 1 8 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.962 0.356 25485 10357 1 8 . 1 1 217 217 GLY H H 217 7.695 7.695 8.482 -0.787 25485 10358 1 8 . 1 1 218 218 ASN N N 218 120.167 120.167 118.543 1.624 25485 10359 1 8 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.879 -0.213 25485 10360 1 8 . 1 1 218 218 ASN C C 218 175.343 175.343 174.862 0.481 25485 10361 1 8 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.211 0.404 25485 10362 1 8 . 1 1 218 218 ASN CB C 218 38.546 38.546 40.028 -1.482 25485 10363 1 8 . 1 1 218 218 ASN H H 218 8.237 8.237 8.527 -0.290 25485 10364 1 8 . 1 1 219 219 GLY N N 219 109.322 109.322 108.381 0.941 25485 10365 1 8 . 1 1 219 219 GLY C C 219 172.842 172.842 172.911 -0.069 25485 10366 1 8 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.454 0.264 25485 10367 1 8 . 1 1 219 219 GLY H H 219 8.027 8.027 7.872 0.155 25485 10368 1 8 . 1 1 220 220 ASP N N 220 123.006 123.006 122.060 0.946 25485 10369 1 8 . 1 1 220 220 ASP H H 220 8.273 8.273 8.446 -0.173 25485 10370 1 8 . 1 1 221 221 PRO C C 221 177.138 177.138 176.830 0.308 25485 10371 1 8 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.538 -5.474 25485 10372 1 8 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.862 -1.166 25485 10373 1 8 . 1 1 222 222 GLN N N 222 116.718 116.718 118.996 -2.278 25485 10374 1 8 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.303 0.033 25485 10375 1 8 . 1 1 222 222 GLN C C 222 176.321 176.321 176.459 -0.138 25485 10376 1 8 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.964 -0.821 25485 10377 1 8 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.319 0.178 25485 10378 1 8 . 1 1 222 222 GLN H H 222 8.240 8.240 8.543 -0.303 25485 10379 1 8 . 1 1 223 223 ASN N N 223 118.368 118.368 115.449 2.919 25485 10380 1 8 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.849 0.067 25485 10381 1 8 . 1 1 223 223 ASN C C 223 173.271 173.271 174.842 -1.571 25485 10382 1 8 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.112 -0.516 25485 10383 1 8 . 1 1 223 223 ASN CB C 223 39.215 39.215 40.001 -0.786 25485 10384 1 8 . 1 1 223 223 ASN H H 223 7.946 7.946 8.164 -0.218 25485 10385 1 8 . 1 1 224 224 PHE N N 224 118.429 118.429 119.128 -0.699 25485 10386 1 8 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.357 0.094 25485 10387 1 8 . 1 1 224 224 PHE C C 224 172.897 172.897 173.228 -0.331 25485 10388 1 8 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.317 0.092 25485 10389 1 8 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.195 0.506 25485 10390 1 8 . 1 1 224 224 PHE H H 224 6.992 6.992 7.776 -0.784 25485 10391 1 8 . 1 1 225 225 LYS N N 225 121.714 121.714 123.552 -1.838 25485 10392 1 8 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.914 0.516 25485 10393 1 8 . 1 1 225 225 LYS C C 225 174.664 174.664 174.129 0.535 25485 10394 1 8 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.050 0.262 25485 10395 1 8 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.446 0.281 25485 10396 1 8 . 1 1 225 225 LYS H H 225 7.709 7.709 7.715 -0.006 25485 10397 1 8 . 1 1 226 226 LEU N N 226 119.026 119.026 120.446 -1.420 25485 10398 1 8 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.079 0.061 25485 10399 1 8 . 1 1 226 226 LEU C C 226 177.495 177.495 176.276 1.219 25485 10400 1 8 . 1 1 226 226 LEU CA C 226 55.599 55.599 54.636 0.962 25485 10401 1 8 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.626 -1.345 25485 10402 1 8 . 1 1 226 226 LEU H H 226 8.015 8.015 7.990 0.025 25485 10403 1 8 . 1 1 227 227 SER N N 227 120.320 120.320 114.595 5.725 25485 10404 1 8 . 1 1 227 227 SER HA H 227 4.600 4.600 4.314 0.286 25485 10405 1 8 . 1 1 227 227 SER C C 227 175.492 175.492 174.712 0.780 25485 10406 1 8 . 1 1 227 227 SER CA C 227 57.239 57.239 57.622 -0.383 25485 10407 1 8 . 1 1 227 227 SER CB C 227 66.278 66.278 65.069 1.209 25485 10408 1 8 . 1 1 227 227 SER H H 227 9.654 9.654 7.765 1.889 25485 10409 1 8 . 1 1 228 228 GLN N N 228 127.511 127.511 124.229 3.282 25485 10410 1 8 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.894 0.800 25485 10411 1 8 . 1 1 228 228 GLN H H 228 8.248 8.248 9.021 -0.773 25485 10412 1 8 . 1 1 229 229 ASP N N 229 124.358 124.358 118.377 5.981 25485 10413 1 8 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.316 0.058 25485 10414 1 8 . 1 1 229 229 ASP C C 229 178.793 178.793 178.224 0.569 25485 10415 1 8 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.639 0.503 25485 10416 1 8 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.603 2.639 25485 10417 1 8 . 1 1 229 229 ASP H H 229 8.138 8.138 8.431 -0.293 25485 10418 1 8 . 1 1 230 230 ASP N N 230 119.694 119.694 119.934 -0.240 25485 10419 1 8 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.459 -0.037 25485 10420 1 8 . 1 1 230 230 ASP C C 230 177.736 177.736 178.088 -0.352 25485 10421 1 8 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.052 0.870 25485 10422 1 8 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.011 2.224 25485 10423 1 8 . 1 1 230 230 ASP H H 230 7.393 7.393 7.375 0.018 25485 10424 1 8 . 1 1 231 231 ILE N N 231 120.364 120.364 120.216 0.148 25485 10425 1 8 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.640 0.025 25485 10426 1 8 . 1 1 231 231 ILE C C 231 177.631 177.631 177.742 -0.111 25485 10427 1 8 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.041 0.458 25485 10428 1 8 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.924 0.589 25485 10429 1 8 . 1 1 231 231 ILE H H 231 8.115 8.115 7.904 0.211 25485 10430 1 8 . 1 1 232 232 LYS N N 232 119.156 119.156 120.080 -0.924 25485 10431 1 8 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.003 0.111 25485 10432 1 8 . 1 1 232 232 LYS C C 232 180.574 180.574 179.027 1.547 25485 10433 1 8 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.752 -0.192 25485 10434 1 8 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.666 0.131 25485 10435 1 8 . 1 1 232 232 LYS H H 232 8.607 8.607 8.476 0.131 25485 10436 1 8 . 1 1 233 233 GLY N N 233 106.425 106.425 108.111 -1.686 25485 10437 1 8 . 1 1 233 233 GLY C C 233 176.098 176.098 175.874 0.224 25485 10438 1 8 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.776 0.861 25485 10439 1 8 . 1 1 233 233 GLY H H 233 8.075 8.075 7.670 0.405 25485 10440 1 8 . 1 1 234 234 ILE N N 234 125.119 125.119 122.317 2.802 25485 10441 1 8 . 1 1 234 234 ILE C C 234 178.231 178.231 177.878 0.353 25485 10442 1 8 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.375 -1.782 25485 10443 1 8 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.386 -0.840 25485 10444 1 8 . 1 1 234 234 ILE H H 234 8.539 8.539 7.503 1.036 25485 10445 1 8 . 1 1 235 235 GLN N N 235 122.877 122.877 118.834 4.043 25485 10446 1 8 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.128 0.229 25485 10447 1 8 . 1 1 235 235 GLN C C 235 180.105 180.105 178.438 1.667 25485 10448 1 8 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.190 -1.303 25485 10449 1 8 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.791 -1.254 25485 10450 1 8 . 1 1 235 235 GLN H H 235 8.296 8.296 8.405 -0.109 25485 10451 1 8 . 1 1 236 236 LYS N N 236 123.678 123.678 119.316 4.362 25485 10452 1 8 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.262 -0.180 25485 10453 1 8 . 1 1 236 236 LYS C C 236 178.169 178.169 178.019 0.150 25485 10454 1 8 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.892 0.485 25485 10455 1 8 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.877 0.101 25485 10456 1 8 . 1 1 236 236 LYS H H 236 8.024 8.024 7.846 0.178 25485 10457 1 8 . 1 1 237 237 LEU N N 237 116.873 116.873 118.029 -1.156 25485 10458 1 8 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.254 -0.267 25485 10459 1 8 . 1 1 237 237 LEU C C 237 177.893 177.893 177.253 0.640 25485 10460 1 8 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.143 1.296 25485 10461 1 8 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.515 1.098 25485 10462 1 8 . 1 1 237 237 LEU H H 237 6.888 6.888 7.235 -0.347 25485 10463 1 8 . 1 1 238 238 TYR N N 238 112.237 112.237 117.468 -5.231 25485 10464 1 8 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.488 0.163 25485 10465 1 8 . 1 1 238 238 TYR C C 238 176.082 176.082 175.946 0.136 25485 10466 1 8 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.138 -0.501 25485 10467 1 8 . 1 1 238 238 TYR CB C 238 41.398 41.398 40.113 1.285 25485 10468 1 8 . 1 1 238 238 TYR H H 238 7.445 7.445 8.500 -1.055 25485 10469 1 8 . 1 1 239 239 GLY N N 239 110.906 110.906 106.382 4.524 25485 10470 1 8 . 1 1 239 239 GLY C C 239 171.269 171.269 172.744 -1.475 25485 10471 1 8 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.149 -1.263 25485 10472 1 8 . 1 1 239 239 GLY H H 239 8.443 8.443 7.832 0.611 25485 10473 1 8 . 1 1 240 240 LYS N N 240 114.281 114.281 121.803 -7.522 25485 10474 1 8 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.544 0.194 25485 10475 1 8 . 1 1 240 240 LYS C C 240 177.527 177.527 175.374 2.153 25485 10476 1 8 . 1 1 240 240 LYS CA C 240 54.958 54.958 56.033 -1.075 25485 10477 1 8 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.267 1.008 25485 10478 1 8 . 1 1 240 240 LYS H H 240 7.873 7.873 8.391 -0.518 25485 10479 1 8 . 1 1 241 241 ARG N N 241 123.758 123.758 122.679 1.079 25485 10480 1 8 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.494 -0.497 25485 10481 1 8 . 1 1 241 241 ARG C C 241 176.026 176.026 174.479 1.547 25485 10482 1 8 . 1 1 241 241 ARG CA C 241 57.492 57.492 55.598 1.894 25485 10483 1 8 . 1 1 241 241 ARG CB C 241 30.371 30.371 32.146 -1.775 25485 10484 1 8 . 1 1 241 241 ARG H H 241 7.742 7.742 8.515 -0.773 25485 10485 1 8 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.614 -0.274 25485 10486 1 8 . 1 1 246 246 LYS C C 246 175.403 175.403 175.314 0.089 25485 10487 1 8 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.939 0.570 25485 10488 1 8 . 1 1 246 246 LYS CB C 246 32.858 32.858 32.679 0.179 25485 10489 1 9 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.058 0.249 25485 10490 1 9 . 1 1 2 2 GLN C C 2 176.492 176.492 175.150 1.342 25485 10491 1 9 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.111 0.638 25485 10492 1 9 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.481 0.173 25485 10493 1 9 . 1 1 3 3 GLU N N 3 121.668 121.668 118.638 3.030 25485 10494 1 9 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.290 -0.501 25485 10495 1 9 . 1 1 3 3 GLU C C 3 176.278 176.278 177.898 -1.620 25485 10496 1 9 . 1 1 3 3 GLU CA C 3 57.059 57.059 56.677 0.382 25485 10497 1 9 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.718 -0.027 25485 10498 1 9 . 1 1 3 3 GLU H H 3 8.331 8.331 8.558 -0.227 25485 10499 1 9 . 1 1 4 4 ALA N N 4 124.493 124.493 123.661 0.832 25485 10500 1 9 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.210 0.300 25485 10501 1 9 . 1 1 4 4 ALA C C 4 178.428 178.428 179.709 -1.281 25485 10502 1 9 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.757 -0.080 25485 10503 1 9 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.261 0.449 25485 10504 1 9 . 1 1 4 4 ALA H H 4 8.131 8.131 8.459 -0.328 25485 10505 1 9 . 1 1 5 5 GLY N N 5 108.204 108.204 107.513 0.691 25485 10506 1 9 . 1 1 5 5 GLY C C 5 174.858 174.858 175.430 -0.572 25485 10507 1 9 . 1 1 5 5 GLY CA C 5 47.661 47.661 45.868 1.793 25485 10508 1 9 . 1 1 5 5 GLY H H 5 8.279 8.279 8.617 -0.338 25485 10509 1 9 . 1 1 6 6 GLY N N 6 108.820 108.820 109.312 -0.492 25485 10510 1 9 . 1 1 6 6 GLY C C 6 174.189 174.189 174.179 0.010 25485 10511 1 9 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.301 0.112 25485 10512 1 9 . 1 1 6 6 GLY H H 6 8.246 8.246 7.942 0.304 25485 10513 1 9 . 1 1 7 7 MET N N 7 119.938 119.938 119.183 0.755 25485 10514 1 9 . 1 1 7 7 MET HA H 7 4.659 4.659 4.780 -0.121 25485 10515 1 9 . 1 1 7 7 MET C C 7 176.191 176.191 175.433 0.758 25485 10516 1 9 . 1 1 7 7 MET CA C 7 54.799 54.799 55.728 -0.929 25485 10517 1 9 . 1 1 7 7 MET CB C 7 33.046 33.046 33.671 -0.625 25485 10518 1 9 . 1 1 7 7 MET H H 7 8.005 8.005 7.833 0.172 25485 10519 1 9 . 1 1 8 8 SER N N 8 118.919 118.919 115.365 3.554 25485 10520 1 9 . 1 1 8 8 SER HA H 8 4.239 4.239 4.717 -0.478 25485 10521 1 9 . 1 1 8 8 SER C C 8 174.949 174.949 175.531 -0.582 25485 10522 1 9 . 1 1 8 8 SER CA C 8 58.160 58.160 57.429 0.731 25485 10523 1 9 . 1 1 8 8 SER CB C 8 65.440 65.440 64.934 0.506 25485 10524 1 9 . 1 1 8 8 SER H H 8 8.731 8.731 8.296 0.435 25485 10525 1 9 . 1 1 9 9 GLU N N 9 122.442 122.442 121.371 1.071 25485 10526 1 9 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.186 0.135 25485 10527 1 9 . 1 1 9 9 GLU C C 9 178.604 178.604 178.458 0.146 25485 10528 1 9 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.348 0.119 25485 10529 1 9 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.320 -0.144 25485 10530 1 9 . 1 1 9 9 GLU H H 9 8.901 8.901 8.985 -0.084 25485 10531 1 9 . 1 1 10 10 LEU N N 10 120.568 120.568 119.589 0.979 25485 10532 1 9 . 1 1 10 10 LEU C C 10 179.307 179.307 179.153 0.154 25485 10533 1 9 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.516 -1.036 25485 10534 1 9 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.963 -0.388 25485 10535 1 9 . 1 1 10 10 LEU H H 10 8.020 8.020 7.946 0.074 25485 10536 1 9 . 1 1 11 11 GLN N N 11 119.930 119.930 118.709 1.221 25485 10537 1 9 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.115 0.019 25485 10538 1 9 . 1 1 11 11 GLN C C 11 178.330 178.330 178.750 -0.420 25485 10539 1 9 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.451 0.367 25485 10540 1 9 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.513 -0.649 25485 10541 1 9 . 1 1 11 11 GLN H H 11 7.811 7.811 7.629 0.182 25485 10542 1 9 . 1 1 12 12 TRP N N 12 121.031 121.031 121.258 -0.227 25485 10543 1 9 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.471 -0.057 25485 10544 1 9 . 1 1 12 12 TRP C C 12 178.874 178.874 178.091 0.783 25485 10545 1 9 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.505 0.002 25485 10546 1 9 . 1 1 12 12 TRP CB C 12 29.387 29.387 30.127 -0.740 25485 10547 1 9 . 1 1 12 12 TRP H H 12 8.205 8.205 8.276 -0.071 25485 10548 1 9 . 1 1 13 13 GLU N N 13 121.877 121.877 118.867 3.010 25485 10549 1 9 . 1 1 13 13 GLU C C 13 179.425 179.425 179.345 0.080 25485 10550 1 9 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.521 0.516 25485 10551 1 9 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.418 -0.496 25485 10552 1 9 . 1 1 13 13 GLU H H 13 8.434 8.434 8.345 0.089 25485 10553 1 9 . 1 1 14 14 GLN N N 14 120.449 120.449 119.229 1.220 25485 10554 1 9 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.954 0.284 25485 10555 1 9 . 1 1 14 14 GLN C C 14 179.210 179.210 178.248 0.962 25485 10556 1 9 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.577 0.305 25485 10557 1 9 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.468 -0.718 25485 10558 1 9 . 1 1 14 14 GLN H H 14 8.124 8.124 8.371 -0.247 25485 10559 1 9 . 1 1 15 15 ALA N N 15 123.114 123.114 121.011 2.103 25485 10560 1 9 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.092 0.298 25485 10561 1 9 . 1 1 15 15 ALA C C 15 179.352 179.352 179.645 -0.293 25485 10562 1 9 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.292 -0.327 25485 10563 1 9 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.008 0.655 25485 10564 1 9 . 1 1 15 15 ALA H H 15 8.344 8.344 7.663 0.681 25485 10565 1 9 . 1 1 16 16 GLN N N 16 117.718 117.718 117.277 0.441 25485 10566 1 9 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.936 -0.154 25485 10567 1 9 . 1 1 16 16 GLN C C 16 177.719 177.719 178.224 -0.505 25485 10568 1 9 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.991 1.290 25485 10569 1 9 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.567 -0.031 25485 10570 1 9 . 1 1 16 16 GLN H H 16 8.500 8.500 7.458 1.042 25485 10571 1 9 . 1 1 17 17 ASP N N 17 120.040 120.040 120.245 -0.205 25485 10572 1 9 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.300 0.236 25485 10573 1 9 . 1 1 17 17 ASP C C 17 177.630 177.630 178.439 -0.809 25485 10574 1 9 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.710 0.095 25485 10575 1 9 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.728 1.136 25485 10576 1 9 . 1 1 17 17 ASP H H 17 7.871 7.871 7.760 0.111 25485 10577 1 9 . 1 1 18 18 TYR N N 18 122.465 122.465 118.527 3.938 25485 10578 1 9 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.100 0.090 25485 10579 1 9 . 1 1 18 18 TYR C C 18 178.439 178.439 178.080 0.359 25485 10580 1 9 . 1 1 18 18 TYR CA C 18 61.846 61.846 61.390 0.456 25485 10581 1 9 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.346 1.593 25485 10582 1 9 . 1 1 18 18 TYR H H 18 8.244 8.244 7.831 0.413 25485 10583 1 9 . 1 1 19 19 LEU N N 19 117.635 117.635 116.050 1.585 25485 10584 1 9 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.571 -0.439 25485 10585 1 9 . 1 1 19 19 LEU C C 19 180.940 180.940 178.514 2.426 25485 10586 1 9 . 1 1 19 19 LEU CA C 19 57.505 57.505 57.688 -0.183 25485 10587 1 9 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.413 -0.815 25485 10588 1 9 . 1 1 19 19 LEU H H 19 8.713 8.713 7.605 1.108 25485 10589 1 9 . 1 1 20 20 LYS N N 20 124.594 124.594 118.826 5.768 25485 10590 1 9 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.342 -0.258 25485 10591 1 9 . 1 1 20 20 LYS C C 20 178.387 178.387 178.966 -0.579 25485 10592 1 9 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.548 1.257 25485 10593 1 9 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.718 -0.262 25485 10594 1 9 . 1 1 20 20 LYS H H 20 8.815 8.815 8.467 0.348 25485 10595 1 9 . 1 1 21 21 ARG N N 21 117.535 117.535 118.759 -1.224 25485 10596 1 9 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.078 -0.359 25485 10597 1 9 . 1 1 21 21 ARG C C 21 178.498 178.498 178.101 0.397 25485 10598 1 9 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.330 0.914 25485 10599 1 9 . 1 1 21 21 ARG CB C 21 29.441 29.441 28.934 0.507 25485 10600 1 9 . 1 1 21 21 ARG H H 21 7.810 7.810 7.799 0.011 25485 10601 1 9 . 1 1 22 22 PHE N N 22 112.113 112.113 119.156 -7.043 25485 10602 1 9 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.040 0.871 25485 10603 1 9 . 1 1 22 22 PHE C C 22 174.875 174.875 176.730 -1.855 25485 10604 1 9 . 1 1 22 22 PHE CA C 22 57.475 57.475 60.781 -3.306 25485 10605 1 9 . 1 1 22 22 PHE CB C 22 39.169 39.169 38.759 0.410 25485 10606 1 9 . 1 1 22 22 PHE H H 22 8.010 8.010 7.561 0.449 25485 10607 1 9 . 1 1 23 23 TYR N N 23 116.187 116.187 117.911 -1.724 25485 10608 1 9 . 1 1 23 23 TYR C C 23 173.455 173.455 176.007 -2.552 25485 10609 1 9 . 1 1 23 23 TYR CA C 23 58.427 58.427 58.173 0.254 25485 10610 1 9 . 1 1 23 23 TYR CB C 23 39.529 39.529 36.420 3.109 25485 10611 1 9 . 1 1 23 23 TYR H H 23 7.680 7.680 7.724 -0.044 25485 10612 1 9 . 1 1 24 24 LEU N N 24 115.570 115.570 117.393 -1.823 25485 10613 1 9 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.867 0.283 25485 10614 1 9 . 1 1 24 24 LEU C C 24 176.661 176.661 176.065 0.596 25485 10615 1 9 . 1 1 24 24 LEU CA C 24 56.152 56.152 57.264 -1.112 25485 10616 1 9 . 1 1 24 24 LEU CB C 24 36.863 36.863 40.798 -3.935 25485 10617 1 9 . 1 1 24 24 LEU H H 24 7.238 7.238 7.723 -0.485 25485 10618 1 9 . 1 1 25 25 TYR N N 25 119.901 119.901 119.808 0.093 25485 10619 1 9 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.643 -0.284 25485 10620 1 9 . 1 1 25 25 TYR C C 25 173.784 173.784 173.516 0.268 25485 10621 1 9 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.353 0.894 25485 10622 1 9 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.977 -0.899 25485 10623 1 9 . 1 1 25 25 TYR H H 25 7.845 7.845 8.266 -0.421 25485 10624 1 9 . 1 1 26 26 ASP N N 26 129.338 129.338 126.776 2.562 25485 10625 1 9 . 1 1 26 26 ASP HA H 26 4.451 4.451 4.961 -0.510 25485 10626 1 9 . 1 1 26 26 ASP C C 26 175.282 175.282 176.022 -0.740 25485 10627 1 9 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.440 -1.007 25485 10628 1 9 . 1 1 26 26 ASP CB C 26 41.249 41.249 41.778 -0.529 25485 10629 1 9 . 1 1 26 26 ASP H H 26 8.108 8.108 8.685 -0.577 25485 10630 1 9 . 1 1 27 27 SER C C 27 175.204 175.204 175.877 -0.673 25485 10631 1 9 . 1 1 27 27 SER CA C 27 59.424 59.424 60.563 -1.139 25485 10632 1 9 . 1 1 27 27 SER CB C 27 63.535 63.535 63.418 0.117 25485 10633 1 9 . 1 1 28 28 GLU N N 28 122.058 122.058 120.061 1.997 25485 10634 1 9 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.171 0.154 25485 10635 1 9 . 1 1 28 28 GLU C C 28 177.073 177.073 177.404 -0.331 25485 10636 1 9 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.270 -1.058 25485 10637 1 9 . 1 1 28 28 GLU CB C 28 29.570 29.570 28.507 1.063 25485 10638 1 9 . 1 1 28 28 GLU H H 28 8.255 8.255 8.611 -0.356 25485 10639 1 9 . 1 1 29 29 THR N N 29 114.161 114.161 115.548 -1.387 25485 10640 1 9 . 1 1 29 29 THR HA H 29 4.260 4.260 4.133 0.127 25485 10641 1 9 . 1 1 29 29 THR C C 29 174.591 174.591 174.833 -0.242 25485 10642 1 9 . 1 1 29 29 THR CA C 29 61.976 61.976 63.409 -1.433 25485 10643 1 9 . 1 1 29 29 THR CB C 29 69.385 69.385 68.800 0.585 25485 10644 1 9 . 1 1 29 29 THR H H 29 7.498 7.498 7.420 0.078 25485 10645 1 9 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.030 0.188 25485 10646 1 9 . 1 1 30 30 LYS H H 30 8.218 8.218 7.458 0.760 25485 10647 1 9 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.444 -0.020 25485 10648 1 9 . 1 1 31 31 ASN CB C 31 39.133 39.133 38.817 0.316 25485 10649 1 9 . 1 1 32 32 ALA N N 32 126.484 126.484 122.662 3.822 25485 10650 1 9 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.132 0.164 25485 10651 1 9 . 1 1 32 32 ALA C C 32 178.012 178.012 178.593 -0.581 25485 10652 1 9 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.436 -0.676 25485 10653 1 9 . 1 1 32 32 ALA CB C 32 18.770 18.770 18.985 -0.215 25485 10654 1 9 . 1 1 32 32 ALA H H 32 8.411 8.411 8.546 -0.135 25485 10655 1 9 . 1 1 33 33 ASN N N 33 116.885 116.885 115.334 1.551 25485 10656 1 9 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.575 0.123 25485 10657 1 9 . 1 1 33 33 ASN C C 33 176.240 176.240 177.410 -1.170 25485 10658 1 9 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.992 -1.805 25485 10659 1 9 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.352 0.233 25485 10660 1 9 . 1 1 33 33 ASN H H 33 8.309 8.309 8.574 -0.265 25485 10661 1 9 . 1 1 34 34 SER N N 34 116.836 116.836 115.165 1.671 25485 10662 1 9 . 1 1 34 34 SER HA H 34 4.544 4.544 4.384 0.160 25485 10663 1 9 . 1 1 34 34 SER C C 34 175.253 175.253 175.971 -0.718 25485 10664 1 9 . 1 1 34 34 SER CA C 34 59.583 59.583 60.384 -0.801 25485 10665 1 9 . 1 1 34 34 SER CB C 34 63.919 63.919 63.390 0.529 25485 10666 1 9 . 1 1 34 34 SER H H 34 8.115 8.115 7.501 0.614 25485 10667 1 9 . 1 1 35 35 LEU N N 35 125.355 125.355 123.932 1.423 25485 10668 1 9 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.063 -0.487 25485 10669 1 9 . 1 1 35 35 LEU C C 35 177.973 177.973 177.822 0.151 25485 10670 1 9 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.291 0.206 25485 10671 1 9 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.580 -0.888 25485 10672 1 9 . 1 1 35 35 LEU H H 35 8.312 8.312 7.351 0.961 25485 10673 1 9 . 1 1 36 36 GLU N N 36 119.201 119.201 118.828 0.373 25485 10674 1 9 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.944 -0.030 25485 10675 1 9 . 1 1 36 36 GLU C C 36 178.141 178.141 178.914 -0.773 25485 10676 1 9 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.491 0.168 25485 10677 1 9 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.051 0.262 25485 10678 1 9 . 1 1 36 36 GLU H H 36 8.225 8.225 7.680 0.545 25485 10679 1 9 . 1 1 37 37 ALA N N 37 120.746 120.746 122.366 -1.620 25485 10680 1 9 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.018 0.061 25485 10681 1 9 . 1 1 37 37 ALA C C 37 181.485 181.485 179.843 1.642 25485 10682 1 9 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.966 0.493 25485 10683 1 9 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.198 -0.031 25485 10684 1 9 . 1 1 37 37 ALA H H 37 7.917 7.917 7.785 0.132 25485 10685 1 9 . 1 1 38 38 LYS N N 38 119.326 119.326 118.148 1.178 25485 10686 1 9 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.190 0.141 25485 10687 1 9 . 1 1 38 38 LYS C C 38 177.946 177.946 178.844 -0.898 25485 10688 1 9 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.965 -1.261 25485 10689 1 9 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.050 -0.250 25485 10690 1 9 . 1 1 38 38 LYS H H 38 8.216 8.216 7.888 0.328 25485 10691 1 9 . 1 1 39 39 LEU N N 39 122.736 122.736 119.702 3.034 25485 10692 1 9 . 1 1 39 39 LEU HA H 39 3.941 3.941 4.021 -0.080 25485 10693 1 9 . 1 1 39 39 LEU C C 39 178.819 178.819 179.162 -0.343 25485 10694 1 9 . 1 1 39 39 LEU CA C 39 58.081 58.081 57.585 0.496 25485 10695 1 9 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.308 -0.680 25485 10696 1 9 . 1 1 39 39 LEU H H 39 8.666 8.666 7.706 0.960 25485 10697 1 9 . 1 1 40 40 LYS N N 40 118.411 118.411 120.434 -2.023 25485 10698 1 9 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.940 0.698 25485 10699 1 9 . 1 1 40 40 LYS C C 40 179.329 179.329 178.970 0.359 25485 10700 1 9 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.271 -0.138 25485 10701 1 9 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.435 -0.650 25485 10702 1 9 . 1 1 40 40 LYS H H 40 8.227 8.227 7.943 0.284 25485 10703 1 9 . 1 1 41 41 GLU N N 41 121.329 121.329 118.395 2.934 25485 10704 1 9 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.115 -0.022 25485 10705 1 9 . 1 1 41 41 GLU C C 41 178.989 178.989 179.121 -0.132 25485 10706 1 9 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.950 0.810 25485 10707 1 9 . 1 1 41 41 GLU CB C 41 29.836 29.836 29.261 0.575 25485 10708 1 9 . 1 1 41 41 GLU H H 41 7.718 7.718 7.912 -0.194 25485 10709 1 9 . 1 1 42 42 MET N N 42 123.817 123.817 121.419 2.398 25485 10710 1 9 . 1 1 42 42 MET HA H 42 4.107 4.107 4.319 -0.212 25485 10711 1 9 . 1 1 42 42 MET C C 42 177.719 177.719 178.196 -0.477 25485 10712 1 9 . 1 1 42 42 MET CA C 42 59.912 59.912 58.889 1.023 25485 10713 1 9 . 1 1 42 42 MET CB C 42 30.506 30.506 32.837 -2.330 25485 10714 1 9 . 1 1 42 42 MET H H 42 7.657 7.657 8.198 -0.541 25485 10715 1 9 . 1 1 43 43 GLN N N 43 119.998 119.998 118.643 1.355 25485 10716 1 9 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.864 -0.059 25485 10717 1 9 . 1 1 43 43 GLN C C 43 177.604 177.604 178.792 -1.188 25485 10718 1 9 . 1 1 43 43 GLN CA C 43 59.965 59.965 59.779 0.186 25485 10719 1 9 . 1 1 43 43 GLN CB C 43 26.555 26.555 28.447 -1.892 25485 10720 1 9 . 1 1 43 43 GLN H H 43 8.910 8.910 8.603 0.307 25485 10721 1 9 . 1 1 44 44 LYS N N 44 119.165 119.165 119.116 0.049 25485 10722 1 9 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.228 -0.173 25485 10723 1 9 . 1 1 44 44 LYS C C 44 179.991 179.991 178.825 1.166 25485 10724 1 9 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.324 1.237 25485 10725 1 9 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.260 0.039 25485 10726 1 9 . 1 1 44 44 LYS H H 44 8.507 8.507 7.782 0.725 25485 10727 1 9 . 1 1 45 45 PHE N N 45 123.602 123.602 120.848 2.754 25485 10728 1 9 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.296 -0.395 25485 10729 1 9 . 1 1 45 45 PHE C C 45 177.606 177.606 176.542 1.064 25485 10730 1 9 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.681 2.353 25485 10731 1 9 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.276 0.590 25485 10732 1 9 . 1 1 45 45 PHE H H 45 8.445 8.445 7.825 0.620 25485 10733 1 9 . 1 1 46 46 PHE N N 46 112.715 112.715 115.491 -2.776 25485 10734 1 9 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.424 0.173 25485 10735 1 9 . 1 1 46 46 PHE C C 46 175.285 175.285 177.251 -1.966 25485 10736 1 9 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.123 1.552 25485 10737 1 9 . 1 1 46 46 PHE CB C 46 39.459 39.459 39.996 -0.537 25485 10738 1 9 . 1 1 46 46 PHE H H 46 8.272 8.272 8.218 0.054 25485 10739 1 9 . 1 1 47 47 GLY N N 47 110.438 110.438 106.654 3.784 25485 10740 1 9 . 1 1 47 47 GLY C C 47 174.935 174.935 174.415 0.520 25485 10741 1 9 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.147 1.865 25485 10742 1 9 . 1 1 47 47 GLY H H 47 7.926 7.926 8.067 -0.141 25485 10743 1 9 . 1 1 48 48 LEU N N 48 121.830 121.830 119.384 2.446 25485 10744 1 9 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.688 0.236 25485 10745 1 9 . 1 1 48 48 LEU C C 48 174.009 174.009 176.054 -2.045 25485 10746 1 9 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.929 -2.094 25485 10747 1 9 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.854 0.609 25485 10748 1 9 . 1 1 48 48 LEU H H 48 8.762 8.762 7.619 1.143 25485 10749 1 9 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.361 -0.123 25485 10750 1 9 . 1 1 49 49 PRO C C 49 176.874 176.874 176.855 0.019 25485 10751 1 9 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.936 -0.418 25485 10752 1 9 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.895 -0.816 25485 10753 1 9 . 1 1 50 50 ILE N N 50 126.859 126.859 116.883 9.976 25485 10754 1 9 . 1 1 50 50 ILE HA H 50 4.101 4.101 3.959 0.142 25485 10755 1 9 . 1 1 50 50 ILE C C 50 176.540 176.540 174.796 1.744 25485 10756 1 9 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.107 -1.151 25485 10757 1 9 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.062 -0.669 25485 10758 1 9 . 1 1 50 50 ILE H H 50 8.548 8.548 7.942 0.606 25485 10759 1 9 . 1 1 51 51 THR N N 51 116.443 116.443 117.614 -1.171 25485 10760 1 9 . 1 1 51 51 THR HA H 51 4.584 4.584 4.512 0.072 25485 10761 1 9 . 1 1 51 51 THR C C 51 176.672 176.672 174.908 1.764 25485 10762 1 9 . 1 1 51 51 THR CA C 51 60.979 60.979 60.187 0.792 25485 10763 1 9 . 1 1 51 51 THR CB C 51 71.505 71.505 70.729 0.776 25485 10764 1 9 . 1 1 51 51 THR H H 51 8.001 8.001 7.954 0.047 25485 10765 1 9 . 1 1 52 52 GLY N N 52 112.719 112.719 109.627 3.092 25485 10766 1 9 . 1 1 52 52 GLY C C 52 170.609 170.609 173.680 -3.071 25485 10767 1 9 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.474 1.272 25485 10768 1 9 . 1 1 52 52 GLY H H 52 9.499 9.499 8.699 0.800 25485 10769 1 9 . 1 1 53 53 MET N N 53 116.621 116.621 116.440 0.181 25485 10770 1 9 . 1 1 53 53 MET HA H 53 4.023 4.023 4.886 -0.863 25485 10771 1 9 . 1 1 53 53 MET C C 53 174.695 174.695 173.836 0.859 25485 10772 1 9 . 1 1 53 53 MET CA C 53 53.460 53.460 54.078 -0.618 25485 10773 1 9 . 1 1 53 53 MET CB C 53 35.408 35.408 35.875 -0.467 25485 10774 1 9 . 1 1 53 53 MET H H 53 7.993 7.993 7.196 0.797 25485 10775 1 9 . 1 1 54 54 LEU N N 54 122.679 122.679 119.437 3.242 25485 10776 1 9 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.658 -0.907 25485 10777 1 9 . 1 1 54 54 LEU C C 54 174.784 174.784 175.220 -0.436 25485 10778 1 9 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.235 0.066 25485 10779 1 9 . 1 1 54 54 LEU CB C 54 42.010 42.010 44.648 -2.638 25485 10780 1 9 . 1 1 54 54 LEU H H 54 7.940 7.940 8.323 -0.383 25485 10781 1 9 . 1 1 55 55 ASN N N 55 115.797 115.797 116.260 -0.463 25485 10782 1 9 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.713 0.036 25485 10783 1 9 . 1 1 55 55 ASN C C 55 175.459 175.459 174.540 0.919 25485 10784 1 9 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.609 -1.766 25485 10785 1 9 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.699 1.658 25485 10786 1 9 . 1 1 55 55 ASN H H 55 6.543 6.543 8.429 -1.886 25485 10787 1 9 . 1 1 56 56 SER N N 56 121.507 121.507 115.923 5.584 25485 10788 1 9 . 1 1 56 56 SER HA H 56 4.638 4.638 4.633 0.005 25485 10789 1 9 . 1 1 56 56 SER C C 56 175.727 175.727 176.048 -0.321 25485 10790 1 9 . 1 1 56 56 SER CA C 56 57.932 57.932 58.968 -1.036 25485 10791 1 9 . 1 1 56 56 SER CB C 56 63.786 63.786 64.025 -0.239 25485 10792 1 9 . 1 1 56 56 SER H H 56 8.213 8.213 8.053 0.160 25485 10793 1 9 . 1 1 57 57 ARG N N 57 122.951 122.951 121.199 1.752 25485 10794 1 9 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.364 -0.163 25485 10795 1 9 . 1 1 57 57 ARG C C 57 178.560 178.560 178.266 0.294 25485 10796 1 9 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.355 0.076 25485 10797 1 9 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.913 -0.808 25485 10798 1 9 . 1 1 57 57 ARG H H 57 7.895 7.895 8.539 -0.644 25485 10799 1 9 . 1 1 58 58 VAL N N 58 118.778 118.778 120.064 -1.286 25485 10800 1 9 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.580 -0.249 25485 10801 1 9 . 1 1 58 58 VAL C C 58 177.370 177.370 177.864 -0.494 25485 10802 1 9 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.016 0.366 25485 10803 1 9 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.359 0.850 25485 10804 1 9 . 1 1 58 58 VAL H H 58 7.583 7.583 7.884 -0.301 25485 10805 1 9 . 1 1 59 59 ILE N N 59 119.159 119.159 117.484 1.675 25485 10806 1 9 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.716 -0.303 25485 10807 1 9 . 1 1 59 59 ILE C C 59 177.067 177.067 177.732 -0.665 25485 10808 1 9 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.099 0.534 25485 10809 1 9 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.637 0.059 25485 10810 1 9 . 1 1 59 59 ILE H H 59 7.323 7.323 7.959 -0.636 25485 10811 1 9 . 1 1 60 60 GLU N N 60 119.367 119.367 119.405 -0.038 25485 10812 1 9 . 1 1 60 60 GLU HA H 60 3.738 3.738 4.017 -0.279 25485 10813 1 9 . 1 1 60 60 GLU C C 60 179.978 179.978 179.303 0.675 25485 10814 1 9 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.606 -0.348 25485 10815 1 9 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.407 -0.019 25485 10816 1 9 . 1 1 60 60 GLU H H 60 7.879 7.879 7.526 0.353 25485 10817 1 9 . 1 1 61 61 ILE N N 61 118.816 118.816 117.705 1.111 25485 10818 1 9 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.809 -0.370 25485 10819 1 9 . 1 1 61 61 ILE C C 61 179.033 179.033 176.982 2.051 25485 10820 1 9 . 1 1 61 61 ILE CA C 61 64.838 64.838 63.918 0.920 25485 10821 1 9 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.862 -0.963 25485 10822 1 9 . 1 1 61 61 ILE H H 61 7.246 7.246 7.347 -0.101 25485 10823 1 9 . 1 1 62 62 MET N N 62 119.986 119.986 116.132 3.854 25485 10824 1 9 . 1 1 62 62 MET HA H 62 3.444 3.444 4.093 -0.649 25485 10825 1 9 . 1 1 62 62 MET C C 62 176.185 176.185 178.855 -2.670 25485 10826 1 9 . 1 1 62 62 MET CA C 62 59.014 59.014 57.274 1.740 25485 10827 1 9 . 1 1 62 62 MET CB C 62 31.250 31.250 31.403 -0.153 25485 10828 1 9 . 1 1 62 62 MET H H 62 7.835 7.835 7.246 0.589 25485 10829 1 9 . 1 1 63 63 GLN N N 63 116.163 116.163 117.089 -0.926 25485 10830 1 9 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.095 0.183 25485 10831 1 9 . 1 1 63 63 GLN C C 63 176.727 176.727 176.331 0.396 25485 10832 1 9 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.936 -0.798 25485 10833 1 9 . 1 1 63 63 GLN CB C 63 29.066 29.066 28.516 0.550 25485 10834 1 9 . 1 1 63 63 GLN H H 63 7.454 7.454 7.668 -0.214 25485 10835 1 9 . 1 1 64 64 LYS N N 64 121.430 121.430 121.032 0.398 25485 10836 1 9 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.561 -0.018 25485 10837 1 9 . 1 1 64 64 LYS C C 64 174.724 174.724 174.174 0.550 25485 10838 1 9 . 1 1 64 64 LYS CA C 64 55.517 55.517 53.605 1.912 25485 10839 1 9 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.586 -0.989 25485 10840 1 9 . 1 1 64 64 LYS H H 64 7.483 7.483 7.205 0.278 25485 10841 1 9 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.360 -1.924 25485 10842 1 9 . 1 1 65 65 PRO C C 65 176.158 176.158 175.782 0.376 25485 10843 1 9 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.138 -0.250 25485 10844 1 9 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.326 -0.493 25485 10845 1 9 . 1 1 66 66 ARG N N 66 112.697 112.697 118.146 -5.449 25485 10846 1 9 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.717 -0.309 25485 10847 1 9 . 1 1 66 66 ARG C C 66 174.478 174.478 175.108 -0.630 25485 10848 1 9 . 1 1 66 66 ARG CA C 66 54.636 54.636 53.486 1.150 25485 10849 1 9 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.911 2.762 25485 10850 1 9 . 1 1 66 66 ARG H H 66 8.146 8.146 8.292 -0.146 25485 10851 1 9 . 1 1 67 67 CYS N N 67 121.740 121.740 119.071 2.669 25485 10852 1 9 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.465 -0.025 25485 10853 1 9 . 1 1 67 67 CYS C C 67 175.659 175.659 176.273 -0.614 25485 10854 1 9 . 1 1 67 67 CYS CA C 67 59.195 59.195 58.714 0.481 25485 10855 1 9 . 1 1 67 67 CYS CB C 67 30.206 30.206 27.974 2.232 25485 10856 1 9 . 1 1 67 67 CYS H H 67 7.757 7.757 8.667 -0.910 25485 10857 1 9 . 1 1 68 68 GLY N N 68 116.217 116.217 112.123 4.094 25485 10858 1 9 . 1 1 68 68 GLY C C 68 172.210 172.210 173.843 -1.633 25485 10859 1 9 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.377 1.182 25485 10860 1 9 . 1 1 68 68 GLY H H 68 9.704 9.704 9.151 0.553 25485 10861 1 9 . 1 1 69 69 VAL N N 69 126.372 126.372 121.494 4.878 25485 10862 1 9 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.372 -0.541 25485 10863 1 9 . 1 1 69 69 VAL C C 69 173.538 173.538 174.433 -0.895 25485 10864 1 9 . 1 1 69 69 VAL CA C 69 61.368 61.368 59.190 2.178 25485 10865 1 9 . 1 1 69 69 VAL CB C 69 32.523 32.523 33.609 -1.086 25485 10866 1 9 . 1 1 69 69 VAL H H 69 9.113 9.113 7.662 1.451 25485 10867 1 9 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.613 0.337 25485 10868 1 9 . 1 1 70 70 PRO C C 70 175.019 175.019 175.729 -0.710 25485 10869 1 9 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.082 1.266 25485 10870 1 9 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.798 -0.440 25485 10871 1 9 . 1 1 71 71 ASP N N 71 118.986 118.986 117.753 1.233 25485 10872 1 9 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.372 0.061 25485 10873 1 9 . 1 1 71 71 ASP C C 71 175.166 175.166 175.584 -0.418 25485 10874 1 9 . 1 1 71 71 ASP CA C 71 55.368 55.368 55.760 -0.392 25485 10875 1 9 . 1 1 71 71 ASP CB C 71 39.864 39.864 40.699 -0.835 25485 10876 1 9 . 1 1 71 71 ASP H H 71 8.054 8.054 8.127 -0.073 25485 10877 1 9 . 1 1 72 72 VAL N N 72 112.953 112.953 113.749 -0.796 25485 10878 1 9 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.567 -0.271 25485 10879 1 9 . 1 1 72 72 VAL C C 72 174.330 174.330 174.268 0.062 25485 10880 1 9 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.882 -1.237 25485 10881 1 9 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.845 0.027 25485 10882 1 9 . 1 1 72 72 VAL H H 72 6.430 6.430 7.093 -0.663 25485 10883 1 9 . 1 1 73 73 ALA N N 73 125.869 125.869 129.946 -4.077 25485 10884 1 9 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.740 -0.435 25485 10885 1 9 . 1 1 73 73 ALA C C 73 177.382 177.382 176.579 0.803 25485 10886 1 9 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.670 0.379 25485 10887 1 9 . 1 1 73 73 ALA CB C 73 19.951 19.951 21.627 -1.676 25485 10888 1 9 . 1 1 73 73 ALA H H 73 8.177 8.177 8.341 -0.164 25485 10889 1 9 . 1 1 74 74 GLU N N 74 120.724 120.724 119.235 1.489 25485 10890 1 9 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.453 -0.350 25485 10891 1 9 . 1 1 74 74 GLU C C 74 176.246 176.246 175.065 1.181 25485 10892 1 9 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.844 -0.052 25485 10893 1 9 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.153 -1.368 25485 10894 1 9 . 1 1 74 74 GLU H H 74 8.381 8.381 8.484 -0.103 25485 10895 1 9 . 1 1 75 75 TYR N N 75 121.473 121.473 122.098 -0.625 25485 10896 1 9 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.359 0.086 25485 10897 1 9 . 1 1 75 75 TYR C C 75 175.633 175.633 175.661 -0.028 25485 10898 1 9 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.572 -0.245 25485 10899 1 9 . 1 1 75 75 TYR CB C 75 38.413 38.413 39.808 -1.395 25485 10900 1 9 . 1 1 75 75 TYR H H 75 8.065 8.065 8.327 -0.262 25485 10901 1 9 . 1 1 76 76 SER N N 76 117.860 117.860 114.640 3.220 25485 10902 1 9 . 1 1 76 76 SER HA H 76 3.886 3.886 4.572 -0.686 25485 10903 1 9 . 1 1 76 76 SER C C 76 173.859 173.859 173.668 0.191 25485 10904 1 9 . 1 1 76 76 SER CA C 76 58.250 58.250 57.547 0.703 25485 10905 1 9 . 1 1 76 76 SER CB C 76 64.117 64.117 64.882 -0.765 25485 10906 1 9 . 1 1 76 76 SER H H 76 7.748 7.748 8.813 -1.065 25485 10907 1 9 . 1 1 77 77 LEU N N 77 123.789 123.789 119.291 4.498 25485 10908 1 9 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.081 0.065 25485 10909 1 9 . 1 1 77 77 LEU C C 77 176.451 176.451 175.338 1.113 25485 10910 1 9 . 1 1 77 77 LEU CA C 77 55.464 55.464 55.547 -0.083 25485 10911 1 9 . 1 1 77 77 LEU CB C 77 41.957 41.957 41.903 0.054 25485 10912 1 9 . 1 1 77 77 LEU H H 77 7.979 7.979 8.656 -0.677 25485 10913 1 9 . 1 1 78 78 PHE N N 78 119.275 119.275 115.950 3.325 25485 10914 1 9 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.290 0.586 25485 10915 1 9 . 1 1 78 78 PHE C C 78 173.844 173.844 173.928 -0.084 25485 10916 1 9 . 1 1 78 78 PHE CA C 78 55.372 55.372 57.670 -2.298 25485 10917 1 9 . 1 1 78 78 PHE CB C 78 39.164 39.164 37.955 1.209 25485 10918 1 9 . 1 1 78 78 PHE H H 78 7.827 7.827 7.957 -0.130 25485 10919 1 9 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.390 -0.034 25485 10920 1 9 . 1 1 79 79 PRO C C 79 176.433 176.433 176.266 0.167 25485 10921 1 9 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.310 1.540 25485 10922 1 9 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.317 -0.625 25485 10923 1 9 . 1 1 80 80 ASN N N 80 118.057 118.057 122.754 -4.697 25485 10924 1 9 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.454 0.193 25485 10925 1 9 . 1 1 80 80 ASN C C 80 174.305 174.305 174.458 -0.153 25485 10926 1 9 . 1 1 80 80 ASN CA C 80 52.860 52.860 54.114 -1.254 25485 10927 1 9 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.223 1.360 25485 10928 1 9 . 1 1 80 80 ASN H H 80 8.068 8.068 8.539 -0.471 25485 10929 1 9 . 1 1 81 81 SER HA H 81 4.565 4.565 4.256 0.309 25485 10930 1 9 . 1 1 81 81 SER CA C 81 56.800 56.800 58.809 -2.009 25485 10931 1 9 . 1 1 81 81 SER CB C 81 63.128 63.128 61.996 1.132 25485 10932 1 9 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.234 0.227 25485 10933 1 9 . 1 1 82 82 PRO C C 82 174.589 174.589 176.347 -1.758 25485 10934 1 9 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.551 -0.905 25485 10935 1 9 . 1 1 82 82 PRO CB C 82 31.254 31.254 31.980 -0.726 25485 10936 1 9 . 1 1 83 83 LYS N N 83 114.578 114.578 119.717 -5.139 25485 10937 1 9 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.183 -0.030 25485 10938 1 9 . 1 1 83 83 LYS C C 83 175.308 175.308 177.109 -1.801 25485 10939 1 9 . 1 1 83 83 LYS CA C 83 54.407 54.407 56.179 -1.772 25485 10940 1 9 . 1 1 83 83 LYS CB C 83 34.418 34.418 32.805 1.613 25485 10941 1 9 . 1 1 83 83 LYS H H 83 7.356 7.356 7.581 -0.225 25485 10942 1 9 . 1 1 84 84 TRP N N 84 122.455 122.455 121.123 1.332 25485 10943 1 9 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.570 -0.550 25485 10944 1 9 . 1 1 84 84 TRP C C 84 177.636 177.636 177.139 0.497 25485 10945 1 9 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.917 -1.446 25485 10946 1 9 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.126 1.192 25485 10947 1 9 . 1 1 84 84 TRP H H 84 8.050 8.050 8.388 -0.338 25485 10948 1 9 . 1 1 85 85 THR N N 85 113.501 113.501 113.984 -0.483 25485 10949 1 9 . 1 1 85 85 THR HA H 85 4.573 4.573 4.478 0.095 25485 10950 1 9 . 1 1 85 85 THR C C 85 174.757 174.757 175.400 -0.643 25485 10951 1 9 . 1 1 85 85 THR CA C 85 62.130 62.130 61.237 0.893 25485 10952 1 9 . 1 1 85 85 THR CB C 85 69.107 69.107 69.795 -0.688 25485 10953 1 9 . 1 1 85 85 THR H H 85 8.861 8.861 8.486 0.375 25485 10954 1 9 . 1 1 86 86 SER N N 86 117.270 117.270 118.960 -1.690 25485 10955 1 9 . 1 1 86 86 SER HA H 86 4.741 4.741 4.583 0.158 25485 10956 1 9 . 1 1 86 86 SER C C 86 173.457 173.457 175.250 -1.793 25485 10957 1 9 . 1 1 86 86 SER CA C 86 56.739 56.739 58.659 -1.920 25485 10958 1 9 . 1 1 86 86 SER CB C 86 64.717 64.717 64.469 0.248 25485 10959 1 9 . 1 1 86 86 SER H H 86 7.743 7.743 8.323 -0.580 25485 10960 1 9 . 1 1 87 87 LYS N N 87 120.329 120.329 119.635 0.694 25485 10961 1 9 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.364 -0.135 25485 10962 1 9 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.354 0.238 25485 10963 1 9 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.898 -0.774 25485 10964 1 9 . 1 1 87 87 LYS H H 87 8.285 8.285 8.459 -0.174 25485 10965 1 9 . 1 1 88 88 VAL N N 88 117.531 117.531 117.611 -0.080 25485 10966 1 9 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.775 -0.120 25485 10967 1 9 . 1 1 88 88 VAL C C 88 174.868 174.868 174.022 0.846 25485 10968 1 9 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.351 -0.256 25485 10969 1 9 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.048 -1.353 25485 10970 1 9 . 1 1 88 88 VAL H H 88 7.428 7.428 7.356 0.072 25485 10971 1 9 . 1 1 89 89 VAL N N 89 131.452 131.452 125.483 5.969 25485 10972 1 9 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.186 -0.027 25485 10973 1 9 . 1 1 89 89 VAL C C 89 175.758 175.758 174.619 1.139 25485 10974 1 9 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.378 0.343 25485 10975 1 9 . 1 1 89 89 VAL CB C 89 34.173 34.173 33.723 0.450 25485 10976 1 9 . 1 1 89 89 VAL H H 89 8.603 8.603 8.747 -0.144 25485 10977 1 9 . 1 1 90 90 THR N N 90 118.206 118.206 116.400 1.806 25485 10978 1 9 . 1 1 90 90 THR HA H 90 5.649 5.649 5.430 0.219 25485 10979 1 9 . 1 1 90 90 THR C C 90 174.579 174.579 173.390 1.189 25485 10980 1 9 . 1 1 90 90 THR CA C 90 58.959 58.959 59.178 -0.219 25485 10981 1 9 . 1 1 90 90 THR CB C 90 72.288 72.288 72.079 0.209 25485 10982 1 9 . 1 1 90 90 THR H H 90 9.021 9.021 8.197 0.824 25485 10983 1 9 . 1 1 91 91 TYR N N 91 118.117 118.117 115.368 2.749 25485 10984 1 9 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.503 0.195 25485 10985 1 9 . 1 1 91 91 TYR C C 91 171.233 171.233 172.665 -1.432 25485 10986 1 9 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.951 -0.519 25485 10987 1 9 . 1 1 91 91 TYR CB C 91 42.260 42.260 40.965 1.295 25485 10988 1 9 . 1 1 91 91 TYR H H 91 8.555 8.555 8.011 0.544 25485 10989 1 9 . 1 1 92 92 ARG N N 92 120.252 120.252 119.904 0.348 25485 10990 1 9 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.559 0.138 25485 10991 1 9 . 1 1 92 92 ARG C C 92 173.932 173.932 174.537 -0.605 25485 10992 1 9 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.736 0.105 25485 10993 1 9 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.750 -0.064 25485 10994 1 9 . 1 1 92 92 ARG H H 92 8.520 8.520 8.879 -0.359 25485 10995 1 9 . 1 1 93 93 ILE N N 93 128.305 128.305 127.311 0.994 25485 10996 1 9 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.350 0.282 25485 10997 1 9 . 1 1 93 93 ILE C C 93 175.468 175.468 176.440 -0.972 25485 10998 1 9 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.631 0.597 25485 10999 1 9 . 1 1 93 93 ILE CB C 93 37.225 37.225 37.221 0.004 25485 11000 1 9 . 1 1 93 93 ILE H H 93 8.886 8.886 8.744 0.142 25485 11001 1 9 . 1 1 94 94 VAL N N 94 126.647 126.647 128.767 -2.120 25485 11002 1 9 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.099 -0.103 25485 11003 1 9 . 1 1 94 94 VAL C C 94 175.670 175.670 176.165 -0.495 25485 11004 1 9 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.664 -1.250 25485 11005 1 9 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.588 0.431 25485 11006 1 9 . 1 1 94 94 VAL H H 94 9.517 9.517 8.438 1.079 25485 11007 1 9 . 1 1 95 95 SER N N 95 113.398 113.398 112.467 0.931 25485 11008 1 9 . 1 1 95 95 SER HA H 95 4.701 4.701 4.699 0.002 25485 11009 1 9 . 1 1 95 95 SER C C 95 170.684 170.684 172.523 -1.839 25485 11010 1 9 . 1 1 95 95 SER CA C 95 56.945 56.945 57.360 -0.415 25485 11011 1 9 . 1 1 95 95 SER CB C 95 65.276 65.276 64.628 0.648 25485 11012 1 9 . 1 1 95 95 SER H H 95 7.463 7.463 7.677 -0.214 25485 11013 1 9 . 1 1 96 96 TYR N N 96 116.512 116.512 118.096 -1.584 25485 11014 1 9 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.887 -0.623 25485 11015 1 9 . 1 1 96 96 TYR C C 96 174.856 174.856 173.649 1.207 25485 11016 1 9 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.250 2.387 25485 11017 1 9 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.115 1.048 25485 11018 1 9 . 1 1 96 96 TYR H H 96 8.240 8.240 8.162 0.078 25485 11019 1 9 . 1 1 97 97 THR CA C 97 57.798 57.798 60.462 -2.664 25485 11020 1 9 . 1 1 97 97 THR CB C 97 67.420 67.420 69.827 -2.407 25485 11021 1 9 . 1 1 98 98 ARG N N 98 128.156 128.156 127.900 0.256 25485 11022 1 9 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.009 0.316 25485 11023 1 9 . 1 1 98 98 ARG C C 98 177.625 177.625 177.145 0.480 25485 11024 1 9 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.164 -0.950 25485 11025 1 9 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.486 -0.006 25485 11026 1 9 . 1 1 98 98 ARG H H 98 8.914 8.914 8.845 0.069 25485 11027 1 9 . 1 1 99 99 ASP N N 99 120.592 120.592 119.434 1.158 25485 11028 1 9 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.451 -0.070 25485 11029 1 9 . 1 1 99 99 ASP C C 99 175.679 175.679 176.428 -0.749 25485 11030 1 9 . 1 1 99 99 ASP CA C 99 56.436 56.436 56.755 -0.319 25485 11031 1 9 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.870 0.500 25485 11032 1 9 . 1 1 99 99 ASP H H 99 8.708 8.708 7.551 1.157 25485 11033 1 9 . 1 1 100 100 LEU N N 100 116.829 116.829 117.120 -0.291 25485 11034 1 9 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.657 0.299 25485 11035 1 9 . 1 1 100 100 LEU C C 100 173.335 173.335 173.822 -0.487 25485 11036 1 9 . 1 1 100 100 LEU CA C 100 51.037 51.037 52.022 -0.985 25485 11037 1 9 . 1 1 100 100 LEU CB C 100 46.267 46.267 43.781 2.486 25485 11038 1 9 . 1 1 100 100 LEU H H 100 6.916 6.916 7.659 -0.743 25485 11039 1 9 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.154 0.021 25485 11040 1 9 . 1 1 102 102 HIS C C 102 177.649 177.649 177.550 0.099 25485 11041 1 9 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.192 -0.519 25485 11042 1 9 . 1 1 102 102 HIS CB C 102 28.434 28.434 29.990 -1.556 25485 11043 1 9 . 1 1 103 103 ILE N N 103 115.170 115.170 118.462 -3.292 25485 11044 1 9 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.824 0.349 25485 11045 1 9 . 1 1 103 103 ILE C C 103 177.214 177.214 177.291 -0.077 25485 11046 1 9 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.104 -0.939 25485 11047 1 9 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.954 -0.189 25485 11048 1 9 . 1 1 103 103 ILE H H 103 8.234 8.234 8.171 0.063 25485 11049 1 9 . 1 1 104 104 THR N N 104 119.374 119.374 117.310 2.064 25485 11050 1 9 . 1 1 104 104 THR HA H 104 4.045 4.045 4.042 0.003 25485 11051 1 9 . 1 1 104 104 THR C C 104 175.612 175.612 176.768 -1.156 25485 11052 1 9 . 1 1 104 104 THR CA C 104 66.568 66.568 66.802 -0.234 25485 11053 1 9 . 1 1 104 104 THR CB C 104 68.077 68.077 68.591 -0.514 25485 11054 1 9 . 1 1 104 104 THR H H 104 6.947 6.947 7.748 -0.801 25485 11055 1 9 . 1 1 105 105 VAL N N 105 123.263 123.263 120.755 2.508 25485 11056 1 9 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.229 0.209 25485 11057 1 9 . 1 1 105 105 VAL C C 105 177.322 177.322 177.463 -0.141 25485 11058 1 9 . 1 1 105 105 VAL CA C 105 67.947 67.947 65.308 2.639 25485 11059 1 9 . 1 1 105 105 VAL CB C 105 31.269 31.269 30.541 0.728 25485 11060 1 9 . 1 1 105 105 VAL H H 105 7.407 7.407 8.206 -0.799 25485 11061 1 9 . 1 1 106 106 ASP N N 106 119.972 119.972 120.134 -0.162 25485 11062 1 9 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.405 -0.083 25485 11063 1 9 . 1 1 106 106 ASP C C 106 179.747 179.747 178.260 1.487 25485 11064 1 9 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.464 0.771 25485 11065 1 9 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.842 -0.480 25485 11066 1 9 . 1 1 106 106 ASP H H 106 8.627 8.627 8.050 0.577 25485 11067 1 9 . 1 1 107 107 ARG N N 107 121.033 121.033 118.416 2.617 25485 11068 1 9 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.112 0.066 25485 11069 1 9 . 1 1 107 107 ARG C C 107 179.485 179.485 178.575 0.910 25485 11070 1 9 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.961 0.619 25485 11071 1 9 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.749 0.459 25485 11072 1 9 . 1 1 107 107 ARG H H 107 8.356 8.356 7.829 0.527 25485 11073 1 9 . 1 1 108 108 LEU N N 108 121.463 121.463 121.235 0.228 25485 11074 1 9 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.170 0.135 25485 11075 1 9 . 1 1 108 108 LEU C C 108 178.852 178.852 178.899 -0.047 25485 11076 1 9 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.503 0.379 25485 11077 1 9 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.460 -0.145 25485 11078 1 9 . 1 1 108 108 LEU H H 108 8.790 8.790 7.861 0.929 25485 11079 1 9 . 1 1 109 109 VAL N N 109 120.233 120.233 116.089 4.144 25485 11080 1 9 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.631 -0.231 25485 11081 1 9 . 1 1 109 109 VAL C C 109 177.019 177.019 177.655 -0.636 25485 11082 1 9 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.908 1.138 25485 11083 1 9 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.156 0.033 25485 11084 1 9 . 1 1 109 109 VAL H H 109 8.787 8.787 8.169 0.618 25485 11085 1 9 . 1 1 110 110 SER N N 110 112.862 112.862 116.282 -3.420 25485 11086 1 9 . 1 1 110 110 SER HA H 110 4.300 4.300 4.094 0.206 25485 11087 1 9 . 1 1 110 110 SER C C 110 176.770 176.770 176.874 -0.104 25485 11088 1 9 . 1 1 110 110 SER CA C 110 61.744 61.744 61.798 -0.054 25485 11089 1 9 . 1 1 110 110 SER CB C 110 62.742 62.742 62.885 -0.143 25485 11090 1 9 . 1 1 110 110 SER H H 110 7.605 7.605 7.880 -0.275 25485 11091 1 9 . 1 1 111 111 LYS N N 111 122.319 122.319 122.225 0.094 25485 11092 1 9 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.124 -0.063 25485 11093 1 9 . 1 1 111 111 LYS C C 111 178.309 178.309 178.065 0.244 25485 11094 1 9 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.205 0.609 25485 11095 1 9 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.590 -0.081 25485 11096 1 9 . 1 1 111 111 LYS H H 111 8.156 8.156 7.939 0.217 25485 11097 1 9 . 1 1 112 112 ALA N N 112 124.147 124.147 120.303 3.844 25485 11098 1 9 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.462 -0.363 25485 11099 1 9 . 1 1 112 112 ALA C C 112 179.445 179.445 179.012 0.433 25485 11100 1 9 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.278 0.948 25485 11101 1 9 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.456 0.518 25485 11102 1 9 . 1 1 112 112 ALA H H 112 8.278 8.278 7.425 0.853 25485 11103 1 9 . 1 1 113 113 LEU N N 113 116.195 116.195 120.542 -4.347 25485 11104 1 9 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.159 -0.408 25485 11105 1 9 . 1 1 113 113 LEU C C 113 179.537 179.537 178.106 1.431 25485 11106 1 9 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.207 -0.463 25485 11107 1 9 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.982 -1.427 25485 11108 1 9 . 1 1 113 113 LEU H H 113 8.021 8.021 8.637 -0.616 25485 11109 1 9 . 1 1 114 114 ASN N N 114 116.570 116.570 117.991 -1.421 25485 11110 1 9 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.535 0.011 25485 11111 1 9 . 1 1 114 114 ASN C C 114 177.136 177.136 177.656 -0.520 25485 11112 1 9 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.506 -0.742 25485 11113 1 9 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.408 0.215 25485 11114 1 9 . 1 1 114 114 ASN H H 114 8.212 8.212 8.326 -0.114 25485 11115 1 9 . 1 1 115 115 MET N N 115 122.055 122.055 119.322 2.733 25485 11116 1 9 . 1 1 115 115 MET HA H 115 4.010 4.010 4.094 -0.084 25485 11117 1 9 . 1 1 115 115 MET C C 115 177.681 177.681 178.170 -0.489 25485 11118 1 9 . 1 1 115 115 MET CA C 115 59.445 59.445 59.011 0.434 25485 11119 1 9 . 1 1 115 115 MET CB C 115 31.616 31.616 32.410 -0.794 25485 11120 1 9 . 1 1 115 115 MET H H 115 7.937 7.937 7.404 0.533 25485 11121 1 9 . 1 1 116 116 TRP N N 116 117.115 117.115 118.960 -1.845 25485 11122 1 9 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.280 0.238 25485 11123 1 9 . 1 1 116 116 TRP C C 116 179.054 179.054 179.166 -0.112 25485 11124 1 9 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.268 0.243 25485 11125 1 9 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.612 1.261 25485 11126 1 9 . 1 1 116 116 TRP H H 116 6.783 6.783 7.567 -0.784 25485 11127 1 9 . 1 1 117 117 GLY N N 117 104.511 104.511 106.230 -1.719 25485 11128 1 9 . 1 1 117 117 GLY C C 117 175.035 175.035 175.178 -0.143 25485 11129 1 9 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.120 0.877 25485 11130 1 9 . 1 1 117 117 GLY H H 117 9.302 9.302 8.163 1.139 25485 11131 1 9 . 1 1 118 118 LYS N N 118 118.580 118.580 120.065 -1.485 25485 11132 1 9 . 1 1 118 118 LYS HA H 118 4.207 4.207 3.956 0.251 25485 11133 1 9 . 1 1 118 118 LYS C C 118 177.235 177.235 177.290 -0.055 25485 11134 1 9 . 1 1 118 118 LYS CA C 118 57.891 57.891 58.328 -0.438 25485 11135 1 9 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.929 -0.024 25485 11136 1 9 . 1 1 118 118 LYS H H 118 7.940 7.940 7.728 0.212 25485 11137 1 9 . 1 1 119 119 GLU N N 119 113.749 113.749 118.051 -4.302 25485 11138 1 9 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.346 0.492 25485 11139 1 9 . 1 1 119 119 GLU C C 119 178.024 178.024 175.033 2.991 25485 11140 1 9 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.566 -0.291 25485 11141 1 9 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.883 0.803 25485 11142 1 9 . 1 1 119 119 GLU H H 119 7.763 7.763 7.507 0.256 25485 11143 1 9 . 1 1 120 120 ILE N N 120 111.144 111.144 112.148 -1.004 25485 11144 1 9 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.651 0.720 25485 11145 1 9 . 1 1 120 120 ILE C C 120 174.033 174.033 174.125 -0.092 25485 11146 1 9 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.368 1.085 25485 11147 1 9 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.986 1.943 25485 11148 1 9 . 1 1 120 120 ILE H H 120 7.518 7.518 7.461 0.057 25485 11149 1 9 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.426 0.236 25485 11150 1 9 . 1 1 121 121 PRO C C 121 174.784 174.784 176.090 -1.306 25485 11151 1 9 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.271 -1.256 25485 11152 1 9 . 1 1 121 121 PRO CB C 121 29.385 29.385 30.487 -1.102 25485 11153 1 9 . 1 1 122 122 LEU N N 122 121.531 121.531 118.879 2.652 25485 11154 1 9 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.454 -0.115 25485 11155 1 9 . 1 1 122 122 LEU C C 122 173.977 173.977 176.465 -2.488 25485 11156 1 9 . 1 1 122 122 LEU CA C 122 54.558 54.558 54.226 0.332 25485 11157 1 9 . 1 1 122 122 LEU CB C 122 45.399 45.399 43.170 2.229 25485 11158 1 9 . 1 1 122 122 LEU H H 122 6.847 6.847 7.072 -0.225 25485 11159 1 9 . 1 1 123 123 HIS N N 123 121.054 121.054 118.591 2.463 25485 11160 1 9 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.714 -0.107 25485 11161 1 9 . 1 1 123 123 HIS C C 123 172.820 172.820 173.672 -0.852 25485 11162 1 9 . 1 1 123 123 HIS CA C 123 54.509 54.509 54.967 -0.458 25485 11163 1 9 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.346 0.764 25485 11164 1 9 . 1 1 123 123 HIS H H 123 7.760 7.760 8.489 -0.729 25485 11165 1 9 . 1 1 124 124 PHE N N 124 120.465 120.465 123.961 -3.496 25485 11166 1 9 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.277 0.557 25485 11167 1 9 . 1 1 124 124 PHE C C 124 175.677 175.677 175.585 0.092 25485 11168 1 9 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.472 0.820 25485 11169 1 9 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.443 0.379 25485 11170 1 9 . 1 1 124 124 PHE H H 124 8.306 8.306 8.733 -0.427 25485 11171 1 9 . 1 1 125 125 ARG N N 125 124.008 124.008 123.031 0.977 25485 11172 1 9 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.773 -0.062 25485 11173 1 9 . 1 1 125 125 ARG C C 125 172.901 172.901 175.105 -2.204 25485 11174 1 9 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.806 -0.532 25485 11175 1 9 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.487 -0.665 25485 11176 1 9 . 1 1 125 125 ARG H H 125 8.426 8.426 9.113 -0.687 25485 11177 1 9 . 1 1 126 126 LYS N N 126 130.004 130.004 123.729 6.275 25485 11178 1 9 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.138 -0.755 25485 11179 1 9 . 1 1 126 126 LYS C C 126 176.126 176.126 175.596 0.530 25485 11180 1 9 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.824 0.357 25485 11181 1 9 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.740 -0.713 25485 11182 1 9 . 1 1 126 126 LYS H H 126 8.481 8.481 8.567 -0.086 25485 11183 1 9 . 1 1 127 127 VAL N N 127 125.288 125.288 119.447 5.841 25485 11184 1 9 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.134 0.371 25485 11185 1 9 . 1 1 127 127 VAL C C 127 175.565 175.565 175.124 0.441 25485 11186 1 9 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.697 -1.748 25485 11187 1 9 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.052 2.310 25485 11188 1 9 . 1 1 127 127 VAL H H 127 8.721 8.721 8.154 0.567 25485 11189 1 9 . 1 1 128 128 VAL N N 128 117.467 117.467 120.934 -3.467 25485 11190 1 9 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.007 0.322 25485 11191 1 9 . 1 1 128 128 VAL C C 128 174.622 174.622 174.776 -0.154 25485 11192 1 9 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.754 0.364 25485 11193 1 9 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.836 0.674 25485 11194 1 9 . 1 1 128 128 VAL H H 128 8.406 8.406 8.074 0.332 25485 11195 1 9 . 1 1 129 129 TRP N N 129 119.986 119.986 121.110 -1.124 25485 11196 1 9 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.840 -0.124 25485 11197 1 9 . 1 1 129 129 TRP C C 129 174.536 174.536 176.456 -1.920 25485 11198 1 9 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.901 -0.984 25485 11199 1 9 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.545 2.469 25485 11200 1 9 . 1 1 129 129 TRP H H 129 7.435 7.435 7.276 0.159 25485 11201 1 9 . 1 1 130 130 GLY N N 130 109.900 109.900 112.776 -2.876 25485 11202 1 9 . 1 1 130 130 GLY C C 130 173.187 173.187 173.861 -0.674 25485 11203 1 9 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.211 0.269 25485 11204 1 9 . 1 1 130 130 GLY H H 130 8.006 8.006 8.239 -0.233 25485 11205 1 9 . 1 1 131 131 THR N N 131 116.142 116.142 112.404 3.738 25485 11206 1 9 . 1 1 131 131 THR HA H 131 4.162 4.162 4.497 -0.335 25485 11207 1 9 . 1 1 131 131 THR C C 131 172.766 172.766 173.755 -0.989 25485 11208 1 9 . 1 1 131 131 THR CA C 131 63.212 63.212 61.456 1.756 25485 11209 1 9 . 1 1 131 131 THR CB C 131 69.308 69.308 70.217 -0.909 25485 11210 1 9 . 1 1 131 131 THR H H 131 8.233 8.233 8.226 0.007 25485 11211 1 9 . 1 1 132 132 ALA N N 132 129.807 129.807 123.928 5.879 25485 11212 1 9 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.585 -0.069 25485 11213 1 9 . 1 1 132 132 ALA C C 132 175.358 175.358 176.454 -1.096 25485 11214 1 9 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.736 -1.370 25485 11215 1 9 . 1 1 132 132 ALA CB C 132 22.798 22.798 20.958 1.840 25485 11216 1 9 . 1 1 132 132 ALA H H 132 7.962 7.962 8.513 -0.551 25485 11217 1 9 . 1 1 133 133 ASP N N 133 122.896 122.896 119.866 3.030 25485 11218 1 9 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.677 -0.256 25485 11219 1 9 . 1 1 133 133 ASP C C 133 177.314 177.314 176.705 0.609 25485 11220 1 9 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.550 1.369 25485 11221 1 9 . 1 1 133 133 ASP CB C 133 40.471 40.471 42.023 -1.552 25485 11222 1 9 . 1 1 133 133 ASP H H 133 8.251 8.251 8.156 0.095 25485 11223 1 9 . 1 1 134 134 ILE N N 134 125.472 125.472 120.521 4.951 25485 11224 1 9 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.447 -0.304 25485 11225 1 9 . 1 1 134 134 ILE C C 134 174.201 174.201 174.717 -0.516 25485 11226 1 9 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.357 -0.086 25485 11227 1 9 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.045 -0.335 25485 11228 1 9 . 1 1 134 134 ILE H H 134 8.802 8.802 7.817 0.985 25485 11229 1 9 . 1 1 135 135 MET N N 135 127.265 127.265 126.907 0.358 25485 11230 1 9 . 1 1 135 135 MET HA H 135 5.192 5.192 5.388 -0.196 25485 11231 1 9 . 1 1 135 135 MET C C 135 176.206 176.206 175.699 0.507 25485 11232 1 9 . 1 1 135 135 MET CA C 135 53.626 53.626 52.395 1.231 25485 11233 1 9 . 1 1 135 135 MET CB C 135 32.639 32.639 34.141 -1.502 25485 11234 1 9 . 1 1 135 135 MET H H 135 7.418 7.418 8.442 -1.024 25485 11235 1 9 . 1 1 136 136 ILE N N 136 125.440 125.440 124.030 1.410 25485 11236 1 9 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.828 0.761 25485 11237 1 9 . 1 1 136 136 ILE C C 136 175.190 175.190 175.802 -0.612 25485 11238 1 9 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.959 1.149 25485 11239 1 9 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.436 4.504 25485 11240 1 9 . 1 1 136 136 ILE H H 136 9.124 9.124 8.731 0.393 25485 11241 1 9 . 1 1 137 137 GLY N N 137 112.211 112.211 113.854 -1.643 25485 11242 1 9 . 1 1 137 137 GLY C C 137 170.855 170.855 171.758 -0.903 25485 11243 1 9 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.921 1.484 25485 11244 1 9 . 1 1 137 137 GLY H H 137 8.594 8.594 7.887 0.707 25485 11245 1 9 . 1 1 138 138 PHE N N 138 119.463 119.463 118.871 0.592 25485 11246 1 9 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.081 0.415 25485 11247 1 9 . 1 1 138 138 PHE C C 138 175.186 175.186 176.012 -0.826 25485 11248 1 9 . 1 1 138 138 PHE CA C 138 55.995 55.995 57.016 -1.021 25485 11249 1 9 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.470 -0.028 25485 11250 1 9 . 1 1 138 138 PHE H H 138 7.857 7.857 8.554 -0.697 25485 11251 1 9 . 1 1 139 139 ALA N N 139 123.914 123.914 124.904 -0.990 25485 11252 1 9 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.608 0.123 25485 11253 1 9 . 1 1 139 139 ALA C C 139 174.613 174.613 175.361 -0.748 25485 11254 1 9 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.587 -1.552 25485 11255 1 9 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.942 1.530 25485 11256 1 9 . 1 1 139 139 ALA H H 139 8.955 8.955 8.399 0.556 25485 11257 1 9 . 1 1 140 140 ARG N N 140 118.339 118.339 120.242 -1.903 25485 11258 1 9 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.831 0.275 25485 11259 1 9 . 1 1 140 140 ARG C C 140 176.201 176.201 178.258 -2.057 25485 11260 1 9 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.849 -0.683 25485 11261 1 9 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.658 0.811 25485 11262 1 9 . 1 1 140 140 ARG H H 140 8.546 8.546 8.497 0.049 25485 11263 1 9 . 1 1 141 141 GLY N N 141 108.916 108.916 108.918 -0.002 25485 11264 1 9 . 1 1 141 141 GLY C C 141 175.595 175.595 175.047 0.548 25485 11265 1 9 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.250 -0.960 25485 11266 1 9 . 1 1 141 141 GLY H H 141 8.989 8.989 9.249 -0.260 25485 11267 1 9 . 1 1 142 142 ALA N N 142 121.448 121.448 121.734 -0.286 25485 11268 1 9 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.422 -0.014 25485 11269 1 9 . 1 1 142 142 ALA C C 142 177.027 177.027 177.796 -0.769 25485 11270 1 9 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.274 1.003 25485 11271 1 9 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.057 -0.093 25485 11272 1 9 . 1 1 142 142 ALA H H 142 8.642 8.642 8.221 0.421 25485 11273 1 9 . 1 1 143 143 HIS N N 143 120.356 120.356 115.674 4.682 25485 11274 1 9 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.431 0.726 25485 11275 1 9 . 1 1 143 143 HIS C C 143 174.303 174.303 176.342 -2.039 25485 11276 1 9 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.548 -1.095 25485 11277 1 9 . 1 1 143 143 HIS CB C 143 27.791 27.791 30.090 -2.299 25485 11278 1 9 . 1 1 143 143 HIS H H 143 8.990 8.990 8.167 0.823 25485 11279 1 9 . 1 1 144 144 GLY N N 144 112.517 112.517 107.514 5.003 25485 11280 1 9 . 1 1 144 144 GLY C C 144 173.758 173.758 172.795 0.963 25485 11281 1 9 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.562 1.533 25485 11282 1 9 . 1 1 144 144 GLY H H 144 5.175 5.175 7.395 -2.220 25485 11283 1 9 . 1 1 145 145 ASP N N 145 117.762 117.762 118.546 -0.784 25485 11284 1 9 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.617 0.081 25485 11285 1 9 . 1 1 145 145 ASP C C 145 175.851 175.851 174.864 0.987 25485 11286 1 9 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.639 -0.680 25485 11287 1 9 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.433 -0.634 25485 11288 1 9 . 1 1 145 145 ASP H H 145 7.096 7.096 7.446 -0.350 25485 11289 1 9 . 1 1 146 146 SER N N 146 125.540 125.540 114.909 10.631 25485 11290 1 9 . 1 1 146 146 SER HA H 146 4.204 4.204 4.144 0.060 25485 11291 1 9 . 1 1 146 146 SER C C 146 172.319 172.319 173.429 -1.110 25485 11292 1 9 . 1 1 146 146 SER CA C 146 58.862 58.862 58.436 0.426 25485 11293 1 9 . 1 1 146 146 SER CB C 146 62.933 62.933 63.087 -0.154 25485 11294 1 9 . 1 1 146 146 SER H H 146 8.261 8.261 8.040 0.221 25485 11295 1 9 . 1 1 147 147 TYR N N 147 120.757 120.757 115.286 5.471 25485 11296 1 9 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.224 0.598 25485 11297 1 9 . 1 1 147 147 TYR C C 147 170.372 170.372 173.602 -3.230 25485 11298 1 9 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.297 -4.029 25485 11299 1 9 . 1 1 147 147 TYR CB C 147 38.296 38.296 36.678 1.618 25485 11300 1 9 . 1 1 147 147 TYR H H 147 7.450 7.450 8.244 -0.794 25485 11301 1 9 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.323 0.549 25485 11302 1 9 . 1 1 148 148 PRO C C 148 179.009 179.009 177.048 1.961 25485 11303 1 9 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.162 1.213 25485 11304 1 9 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.135 -1.226 25485 11305 1 9 . 1 1 149 149 PHE N N 149 120.514 120.514 118.769 1.745 25485 11306 1 9 . 1 1 149 149 PHE C C 149 176.813 176.813 175.974 0.839 25485 11307 1 9 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.684 -1.231 25485 11308 1 9 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.496 0.077 25485 11309 1 9 . 1 1 149 149 PHE H H 149 8.024 8.024 7.669 0.355 25485 11310 1 9 . 1 1 150 150 ASP N N 150 115.555 115.555 116.219 -0.664 25485 11311 1 9 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.339 0.500 25485 11312 1 9 . 1 1 150 150 ASP C C 150 177.007 177.007 176.154 0.853 25485 11313 1 9 . 1 1 150 150 ASP CA C 150 53.871 53.871 55.148 -1.277 25485 11314 1 9 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.427 2.509 25485 11315 1 9 . 1 1 150 150 ASP H H 150 7.511 7.511 7.846 -0.336 25485 11316 1 9 . 1 1 151 151 GLY N N 151 110.650 110.650 110.008 0.642 25485 11317 1 9 . 1 1 151 151 GLY C C 151 170.281 170.281 172.511 -2.230 25485 11318 1 9 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.788 -0.390 25485 11319 1 9 . 1 1 151 151 GLY H H 151 9.080 9.080 8.488 0.592 25485 11320 1 9 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.176 -0.120 25485 11321 1 9 . 1 1 152 152 PRO C C 152 178.300 178.300 176.648 1.652 25485 11322 1 9 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.233 0.618 25485 11323 1 9 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.956 -0.696 25485 11324 1 9 . 1 1 153 153 GLY N N 153 118.783 118.783 112.973 5.810 25485 11325 1 9 . 1 1 153 153 GLY C C 153 174.098 174.098 172.827 1.271 25485 11326 1 9 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.363 -0.757 25485 11327 1 9 . 1 1 153 153 GLY H H 153 11.431 11.431 8.122 3.309 25485 11328 1 9 . 1 1 154 154 ASN N N 154 120.679 120.679 120.045 0.634 25485 11329 1 9 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.357 -0.113 25485 11330 1 9 . 1 1 154 154 ASN C C 154 174.636 174.636 174.990 -0.354 25485 11331 1 9 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.125 2.543 25485 11332 1 9 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.556 -1.585 25485 11333 1 9 . 1 1 154 154 ASN H H 154 9.247 9.247 8.352 0.895 25485 11334 1 9 . 1 1 155 155 THR N N 155 118.252 118.252 110.949 7.303 25485 11335 1 9 . 1 1 155 155 THR HA H 155 5.577 5.577 3.992 1.585 25485 11336 1 9 . 1 1 155 155 THR C C 155 176.596 176.596 172.691 3.905 25485 11337 1 9 . 1 1 155 155 THR CA C 155 61.731 61.731 62.677 -0.946 25485 11338 1 9 . 1 1 155 155 THR CB C 155 71.325 71.325 68.746 2.579 25485 11339 1 9 . 1 1 155 155 THR H H 155 9.501 9.501 8.284 1.217 25485 11340 1 9 . 1 1 156 156 LEU N N 156 122.598 122.598 124.490 -1.892 25485 11341 1 9 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.642 0.229 25485 11342 1 9 . 1 1 156 156 LEU C C 156 175.655 175.655 175.138 0.517 25485 11343 1 9 . 1 1 156 156 LEU CA C 156 55.538 55.538 55.233 0.305 25485 11344 1 9 . 1 1 156 156 LEU CB C 156 44.511 44.511 44.911 -0.400 25485 11345 1 9 . 1 1 156 156 LEU H H 156 8.492 8.492 8.383 0.109 25485 11346 1 9 . 1 1 157 157 ALA N N 157 115.389 115.389 116.627 -1.238 25485 11347 1 9 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.464 0.571 25485 11348 1 9 . 1 1 157 157 ALA C C 157 175.739 175.739 174.872 0.867 25485 11349 1 9 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.519 -0.580 25485 11350 1 9 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.994 1.460 25485 11351 1 9 . 1 1 157 157 ALA H H 157 7.567 7.567 7.830 -0.263 25485 11352 1 9 . 1 1 158 158 HIS N N 158 111.900 111.900 118.219 -6.319 25485 11353 1 9 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.865 -0.260 25485 11354 1 9 . 1 1 158 158 HIS C C 158 170.186 170.186 172.317 -2.131 25485 11355 1 9 . 1 1 158 158 HIS CA C 158 56.075 56.075 53.936 2.139 25485 11356 1 9 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.019 -0.833 25485 11357 1 9 . 1 1 158 158 HIS H H 158 8.757 8.757 7.753 1.004 25485 11358 1 9 . 1 1 159 159 ALA N N 159 118.286 118.286 126.966 -8.680 25485 11359 1 9 . 1 1 159 159 ALA HA H 159 4.654 4.654 3.966 0.688 25485 11360 1 9 . 1 1 159 159 ALA C C 159 174.036 174.036 174.846 -0.810 25485 11361 1 9 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.449 0.684 25485 11362 1 9 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.777 2.260 25485 11363 1 9 . 1 1 159 159 ALA H H 159 6.110 6.110 8.069 -1.959 25485 11364 1 9 . 1 1 160 160 PHE N N 160 117.937 117.937 119.309 -1.372 25485 11365 1 9 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.873 -0.370 25485 11366 1 9 . 1 1 160 160 PHE C C 160 174.455 174.455 174.390 0.065 25485 11367 1 9 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.592 1.221 25485 11368 1 9 . 1 1 160 160 PHE CB C 160 42.194 42.194 42.303 -0.110 25485 11369 1 9 . 1 1 160 160 PHE H H 160 7.912 7.912 7.695 0.217 25485 11370 1 9 . 1 1 161 161 ALA N N 161 123.531 123.531 121.892 1.639 25485 11371 1 9 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.516 -0.025 25485 11372 1 9 . 1 1 161 161 ALA C C 161 175.503 175.503 175.599 -0.096 25485 11373 1 9 . 1 1 161 161 ALA CA C 161 50.633 50.633 48.993 1.640 25485 11374 1 9 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.270 -2.714 25485 11375 1 9 . 1 1 161 161 ALA H H 161 8.107 8.107 8.718 -0.611 25485 11376 1 9 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.124 -1.214 25485 11377 1 9 . 1 1 162 162 PRO C C 162 173.465 173.465 175.842 -2.377 25485 11378 1 9 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.399 1.858 25485 11379 1 9 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.584 1.657 25485 11380 1 9 . 1 1 163 163 GLY N N 163 107.206 107.206 109.967 -2.761 25485 11381 1 9 . 1 1 163 163 GLY C C 163 172.092 172.092 173.690 -1.598 25485 11382 1 9 . 1 1 163 163 GLY CA C 163 43.993 43.993 43.865 0.128 25485 11383 1 9 . 1 1 163 163 GLY H H 163 5.997 5.997 7.365 -1.368 25485 11384 1 9 . 1 1 165 165 GLY N N 165 103.110 103.110 108.658 -5.548 25485 11385 1 9 . 1 1 165 165 GLY C C 165 177.158 177.158 174.695 2.463 25485 11386 1 9 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.218 -0.975 25485 11387 1 9 . 1 1 165 165 GLY H H 165 9.145 9.145 7.982 1.163 25485 11388 1 9 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.258 -0.079 25485 11389 1 9 . 1 1 166 166 LEU C C 166 176.437 176.437 177.353 -0.916 25485 11390 1 9 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.985 0.215 25485 11391 1 9 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.348 -0.514 25485 11392 1 9 . 1 1 167 167 GLY N N 167 103.318 103.318 103.064 0.254 25485 11393 1 9 . 1 1 167 167 GLY C C 167 174.803 174.803 175.008 -0.205 25485 11394 1 9 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.703 2.530 25485 11395 1 9 . 1 1 167 167 GLY H H 167 7.768 7.768 7.493 0.275 25485 11396 1 9 . 1 1 168 168 GLY N N 168 121.051 121.051 107.600 13.451 25485 11397 1 9 . 1 1 168 168 GLY C C 168 172.122 172.122 173.454 -1.332 25485 11398 1 9 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.089 1.513 25485 11399 1 9 . 1 1 168 168 GLY H H 168 7.698 7.698 8.287 -0.589 25485 11400 1 9 . 1 1 169 169 ASP N N 169 123.641 123.641 120.131 3.510 25485 11401 1 9 . 1 1 169 169 ASP C C 169 173.942 173.942 173.810 0.132 25485 11402 1 9 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.040 2.802 25485 11403 1 9 . 1 1 169 169 ASP CB C 169 39.870 39.870 43.003 -3.133 25485 11404 1 9 . 1 1 169 169 ASP H H 169 8.595 8.595 7.677 0.918 25485 11405 1 9 . 1 1 170 170 ALA N N 170 119.366 119.366 120.762 -1.396 25485 11406 1 9 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.417 0.313 25485 11407 1 9 . 1 1 170 170 ALA C C 170 174.593 174.593 175.214 -0.621 25485 11408 1 9 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.782 0.342 25485 11409 1 9 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.099 1.236 25485 11410 1 9 . 1 1 170 170 ALA H H 170 8.324 8.324 8.362 -0.038 25485 11411 1 9 . 1 1 171 171 HIS N N 171 120.239 120.239 121.052 -0.813 25485 11412 1 9 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.144 0.604 25485 11413 1 9 . 1 1 171 171 HIS C C 171 172.949 172.949 173.825 -0.876 25485 11414 1 9 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.330 -2.606 25485 11415 1 9 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.613 1.928 25485 11416 1 9 . 1 1 171 171 HIS H H 171 8.499 8.499 7.771 0.728 25485 11417 1 9 . 1 1 172 172 PHE N N 172 121.125 121.125 121.143 -0.018 25485 11418 1 9 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.549 -0.021 25485 11419 1 9 . 1 1 172 172 PHE C C 172 173.875 173.875 173.981 -0.106 25485 11420 1 9 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.721 0.199 25485 11421 1 9 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.188 0.715 25485 11422 1 9 . 1 1 172 172 PHE H H 172 8.445 8.445 8.164 0.281 25485 11423 1 9 . 1 1 173 173 ASP N N 173 124.014 124.014 123.439 0.575 25485 11424 1 9 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.884 -0.970 25485 11425 1 9 . 1 1 173 173 ASP C C 173 178.613 178.613 177.811 0.802 25485 11426 1 9 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.709 1.089 25485 11427 1 9 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.347 -0.604 25485 11428 1 9 . 1 1 173 173 ASP H H 173 7.927 7.927 8.656 -0.729 25485 11429 1 9 . 1 1 174 174 GLU N N 174 132.469 132.469 126.551 5.918 25485 11430 1 9 . 1 1 174 174 GLU C C 174 176.442 176.442 177.291 -0.849 25485 11431 1 9 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.943 -1.759 25485 11432 1 9 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.756 0.529 25485 11433 1 9 . 1 1 174 174 GLU H H 174 9.528 9.528 8.698 0.830 25485 11434 1 9 . 1 1 175 175 ASP N N 175 117.394 117.394 117.936 -0.542 25485 11435 1 9 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.695 0.098 25485 11436 1 9 . 1 1 175 175 ASP C C 175 176.645 176.645 176.755 -0.110 25485 11437 1 9 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.444 0.487 25485 11438 1 9 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.870 -1.729 25485 11439 1 9 . 1 1 175 175 ASP H H 175 8.768 8.768 8.611 0.157 25485 11440 1 9 . 1 1 176 176 GLU N N 176 116.493 116.493 118.382 -1.889 25485 11441 1 9 . 1 1 176 176 GLU C C 176 175.038 175.038 175.844 -0.806 25485 11442 1 9 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.509 -1.844 25485 11443 1 9 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.787 -4.564 25485 11444 1 9 . 1 1 176 176 GLU H H 176 7.159 7.159 8.304 -1.145 25485 11445 1 9 . 1 1 177 177 ARG N N 177 122.186 122.186 118.064 4.122 25485 11446 1 9 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.525 0.164 25485 11447 1 9 . 1 1 177 177 ARG C C 177 174.482 174.482 174.263 0.219 25485 11448 1 9 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.745 -1.058 25485 11449 1 9 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.734 -1.650 25485 11450 1 9 . 1 1 177 177 ARG H H 177 7.560 7.560 8.126 -0.566 25485 11451 1 9 . 1 1 178 178 TRP N N 178 129.179 129.179 123.972 5.207 25485 11452 1 9 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.376 -0.276 25485 11453 1 9 . 1 1 178 178 TRP C C 178 176.298 176.298 176.517 -0.219 25485 11454 1 9 . 1 1 178 178 TRP CA C 178 56.813 56.813 55.985 0.828 25485 11455 1 9 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.475 -1.278 25485 11456 1 9 . 1 1 178 178 TRP H H 178 8.807 8.807 8.634 0.173 25485 11457 1 9 . 1 1 179 179 THR N N 179 112.792 112.792 112.661 0.131 25485 11458 1 9 . 1 1 179 179 THR HA H 179 4.985 4.985 4.652 0.333 25485 11459 1 9 . 1 1 179 179 THR C C 179 172.765 172.765 172.046 0.719 25485 11460 1 9 . 1 1 179 179 THR CA C 179 59.106 59.106 61.434 -2.328 25485 11461 1 9 . 1 1 179 179 THR CB C 179 71.786 71.786 69.768 2.018 25485 11462 1 9 . 1 1 179 179 THR H H 179 8.974 8.974 8.675 0.299 25485 11463 1 9 . 1 1 180 180 ASP N N 180 122.074 122.074 124.336 -2.262 25485 11464 1 9 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.366 -0.903 25485 11465 1 9 . 1 1 180 180 ASP C C 180 176.366 176.366 178.901 -2.535 25485 11466 1 9 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.638 -2.595 25485 11467 1 9 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.086 -0.358 25485 11468 1 9 . 1 1 180 180 ASP H H 180 8.485 8.485 8.643 -0.158 25485 11469 1 9 . 1 1 181 181 GLY N N 181 110.123 110.123 108.443 1.680 25485 11470 1 9 . 1 1 181 181 GLY C C 181 174.325 174.325 175.773 -1.448 25485 11471 1 9 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.897 0.764 25485 11472 1 9 . 1 1 181 181 GLY H H 181 8.569 8.569 8.411 0.158 25485 11473 1 9 . 1 1 182 182 SER N N 182 115.562 115.562 114.331 1.231 25485 11474 1 9 . 1 1 182 182 SER HA H 182 4.519 4.519 4.485 0.034 25485 11475 1 9 . 1 1 182 182 SER C C 182 173.783 173.783 174.453 -0.670 25485 11476 1 9 . 1 1 182 182 SER CA C 182 57.965 57.965 57.856 0.109 25485 11477 1 9 . 1 1 182 182 SER CB C 182 64.166 64.166 63.893 0.273 25485 11478 1 9 . 1 1 182 182 SER H H 182 8.160 8.160 7.600 0.560 25485 11479 1 9 . 1 1 183 183 SER N N 183 117.153 117.153 115.117 2.036 25485 11480 1 9 . 1 1 183 183 SER HA H 183 4.275 4.275 4.207 0.068 25485 11481 1 9 . 1 1 183 183 SER C C 183 173.333 173.333 174.207 -0.874 25485 11482 1 9 . 1 1 183 183 SER CA C 183 59.902 59.902 59.454 0.448 25485 11483 1 9 . 1 1 183 183 SER CB C 183 64.941 64.941 62.421 2.520 25485 11484 1 9 . 1 1 183 183 SER H H 183 7.796 7.796 8.122 -0.326 25485 11485 1 9 . 1 1 184 184 LEU N N 184 122.351 122.351 120.061 2.290 25485 11486 1 9 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.600 -0.208 25485 11487 1 9 . 1 1 184 184 LEU C C 184 176.250 176.250 176.961 -0.711 25485 11488 1 9 . 1 1 184 184 LEU CA C 184 55.575 55.575 56.333 -0.758 25485 11489 1 9 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.593 -0.512 25485 11490 1 9 . 1 1 184 184 LEU H H 184 8.092 8.092 7.903 0.189 25485 11491 1 9 . 1 1 185 185 GLY N N 185 108.871 108.871 106.181 2.690 25485 11492 1 9 . 1 1 185 185 GLY C C 185 172.375 172.375 173.381 -1.006 25485 11493 1 9 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.230 0.151 25485 11494 1 9 . 1 1 185 185 GLY H H 185 7.960 7.960 7.516 0.444 25485 11495 1 9 . 1 1 186 186 ILE N N 186 123.096 123.096 121.130 1.966 25485 11496 1 9 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.081 -0.240 25485 11497 1 9 . 1 1 186 186 ILE C C 186 175.350 175.350 175.884 -0.534 25485 11498 1 9 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.442 -1.041 25485 11499 1 9 . 1 1 186 186 ILE CB C 186 35.456 35.456 34.836 0.620 25485 11500 1 9 . 1 1 186 186 ILE H H 186 8.893 8.893 8.302 0.591 25485 11501 1 9 . 1 1 187 187 ASN N N 187 127.167 127.167 126.860 0.307 25485 11502 1 9 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.897 -0.544 25485 11503 1 9 . 1 1 187 187 ASN C C 187 175.849 175.849 176.345 -0.496 25485 11504 1 9 . 1 1 187 187 ASN CA C 187 55.714 55.714 53.155 2.559 25485 11505 1 9 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.995 0.135 25485 11506 1 9 . 1 1 187 187 ASN H H 187 8.580 8.580 8.317 0.263 25485 11507 1 9 . 1 1 188 188 PHE N N 188 129.985 129.985 127.856 2.129 25485 11508 1 9 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.364 0.209 25485 11509 1 9 . 1 1 188 188 PHE C C 188 175.578 175.578 177.313 -1.735 25485 11510 1 9 . 1 1 188 188 PHE CA C 188 61.728 61.728 61.956 -0.228 25485 11511 1 9 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.474 -0.042 25485 11512 1 9 . 1 1 188 188 PHE H H 188 9.361 9.361 8.618 0.743 25485 11513 1 9 . 1 1 189 189 LEU N N 189 119.113 119.113 120.442 -1.329 25485 11514 1 9 . 1 1 189 189 LEU HA H 189 3.801 3.801 3.999 -0.198 25485 11515 1 9 . 1 1 189 189 LEU C C 189 179.601 179.601 178.231 1.370 25485 11516 1 9 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.094 0.415 25485 11517 1 9 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.064 -1.187 25485 11518 1 9 . 1 1 189 189 LEU H H 189 8.562 8.562 8.012 0.549 25485 11519 1 9 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.449 0.468 25485 11520 1 9 . 1 1 190 190 TYR C C 190 177.621 177.621 177.765 -0.144 25485 11521 1 9 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.596 0.212 25485 11522 1 9 . 1 1 190 190 TYR CB C 190 39.769 39.769 38.034 1.735 25485 11523 1 9 . 1 1 191 191 ALA N N 191 120.352 120.352 120.967 -0.615 25485 11524 1 9 . 1 1 191 191 ALA HA H 191 4.315 4.315 3.976 0.339 25485 11525 1 9 . 1 1 191 191 ALA C C 191 180.252 180.252 178.809 1.443 25485 11526 1 9 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.754 0.428 25485 11527 1 9 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.404 0.738 25485 11528 1 9 . 1 1 191 191 ALA H H 191 7.993 7.993 8.916 -0.923 25485 11529 1 9 . 1 1 192 192 ALA N N 192 121.409 121.409 121.082 0.327 25485 11530 1 9 . 1 1 192 192 ALA HA H 192 4.057 4.057 3.975 0.082 25485 11531 1 9 . 1 1 192 192 ALA C C 192 178.575 178.575 179.522 -0.947 25485 11532 1 9 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.387 -0.202 25485 11533 1 9 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.047 -1.849 25485 11534 1 9 . 1 1 192 192 ALA H H 192 9.297 9.297 8.168 1.129 25485 11535 1 9 . 1 1 193 193 THR N N 193 116.996 116.996 113.647 3.349 25485 11536 1 9 . 1 1 193 193 THR HA H 193 3.833 3.833 4.083 -0.250 25485 11537 1 9 . 1 1 193 193 THR CA C 193 69.138 69.138 67.221 1.917 25485 11538 1 9 . 1 1 193 193 THR CB C 193 67.365 67.365 68.418 -1.053 25485 11539 1 9 . 1 1 193 193 THR H H 193 8.226 8.226 7.613 0.613 25485 11540 1 9 . 1 1 194 194 HIS N N 194 120.296 120.296 122.242 -1.946 25485 11541 1 9 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.358 -0.122 25485 11542 1 9 . 1 1 194 194 HIS C C 194 175.962 175.962 176.885 -0.923 25485 11543 1 9 . 1 1 194 194 HIS CA C 194 59.747 59.747 59.614 0.133 25485 11544 1 9 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.979 -2.060 25485 11545 1 9 . 1 1 194 194 HIS H H 194 7.782 7.782 7.474 0.308 25485 11546 1 9 . 1 1 195 195 ALA N N 195 121.290 121.290 122.252 -0.962 25485 11547 1 9 . 1 1 195 195 ALA HA H 195 4.156 4.156 4.010 0.146 25485 11548 1 9 . 1 1 195 195 ALA CA C 195 55.964 55.964 55.131 0.833 25485 11549 1 9 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.572 0.138 25485 11550 1 9 . 1 1 195 195 ALA H H 195 8.690 8.690 8.351 0.339 25485 11551 1 9 . 1 1 196 196 LEU N N 196 114.899 114.899 117.725 -2.826 25485 11552 1 9 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.043 0.127 25485 11553 1 9 . 1 1 196 196 LEU C C 196 177.946 177.946 179.445 -1.499 25485 11554 1 9 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.356 -1.128 25485 11555 1 9 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.960 -1.184 25485 11556 1 9 . 1 1 196 196 LEU H H 196 8.715 8.715 8.849 -0.134 25485 11557 1 9 . 1 1 197 197 GLY N N 197 107.901 107.901 105.103 2.798 25485 11558 1 9 . 1 1 197 197 GLY C C 197 178.641 178.641 175.687 2.954 25485 11559 1 9 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.507 1.060 25485 11560 1 9 . 1 1 197 197 GLY H H 197 7.546 7.546 8.084 -0.538 25485 11561 1 9 . 1 1 198 198 HIS N N 198 122.017 122.017 119.428 2.589 25485 11562 1 9 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.480 0.377 25485 11563 1 9 . 1 1 198 198 HIS C C 198 179.874 179.874 178.286 1.588 25485 11564 1 9 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.631 0.891 25485 11565 1 9 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.521 -1.975 25485 11566 1 9 . 1 1 198 198 HIS H H 198 7.196 7.196 7.536 -0.340 25485 11567 1 9 . 1 1 199 199 SER N N 199 118.486 118.486 114.469 4.017 25485 11568 1 9 . 1 1 199 199 SER HA H 199 4.490 4.490 4.544 -0.054 25485 11569 1 9 . 1 1 199 199 SER C C 199 174.493 174.493 175.843 -1.350 25485 11570 1 9 . 1 1 199 199 SER CA C 199 58.173 58.173 60.691 -2.518 25485 11571 1 9 . 1 1 199 199 SER CB C 199 63.589 63.589 63.170 0.419 25485 11572 1 9 . 1 1 199 199 SER H H 199 7.884 7.884 7.686 0.198 25485 11573 1 9 . 1 1 200 200 LEU N N 200 114.686 114.686 117.594 -2.908 25485 11574 1 9 . 1 1 200 200 LEU C C 200 177.720 177.720 177.114 0.606 25485 11575 1 9 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.578 0.259 25485 11576 1 9 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.693 0.664 25485 11577 1 9 . 1 1 200 200 LEU H H 200 7.108 7.108 7.085 0.023 25485 11578 1 9 . 1 1 201 201 GLY N N 201 108.363 108.363 106.031 2.332 25485 11579 1 9 . 1 1 201 201 GLY C C 201 174.008 174.008 174.625 -0.617 25485 11580 1 9 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.395 -0.981 25485 11581 1 9 . 1 1 201 201 GLY H H 201 8.195 8.195 7.595 0.600 25485 11582 1 9 . 1 1 202 202 MET N N 202 119.635 119.635 122.910 -3.275 25485 11583 1 9 . 1 1 202 202 MET HA H 202 4.473 4.473 4.212 0.261 25485 11584 1 9 . 1 1 202 202 MET C C 202 176.593 176.593 175.381 1.212 25485 11585 1 9 . 1 1 202 202 MET CA C 202 54.500 54.500 55.471 -0.971 25485 11586 1 9 . 1 1 202 202 MET CB C 202 32.161 32.161 32.618 -0.458 25485 11587 1 9 . 1 1 202 202 MET H H 202 8.182 8.182 7.235 0.947 25485 11588 1 9 . 1 1 203 203 GLY N N 203 109.749 109.749 112.193 -2.444 25485 11589 1 9 . 1 1 203 203 GLY C C 203 174.042 174.042 173.497 0.545 25485 11590 1 9 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.680 -0.676 25485 11591 1 9 . 1 1 203 203 GLY H H 203 8.405 8.405 8.299 0.106 25485 11592 1 9 . 1 1 204 204 HIS N N 204 115.732 115.732 118.338 -2.606 25485 11593 1 9 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.370 1.030 25485 11594 1 9 . 1 1 204 204 HIS C C 204 174.430 174.430 174.699 -0.269 25485 11595 1 9 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.202 -1.388 25485 11596 1 9 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.441 -0.615 25485 11597 1 9 . 1 1 204 204 HIS H H 204 8.364 8.364 8.567 -0.203 25485 11598 1 9 . 1 1 205 205 SER N N 205 115.484 115.484 116.587 -1.103 25485 11599 1 9 . 1 1 205 205 SER HA H 205 4.766 4.766 4.639 0.127 25485 11600 1 9 . 1 1 205 205 SER C C 205 173.611 173.611 174.831 -1.220 25485 11601 1 9 . 1 1 205 205 SER CA C 205 54.729 54.729 57.167 -2.438 25485 11602 1 9 . 1 1 205 205 SER CB C 205 65.855 65.855 65.328 0.527 25485 11603 1 9 . 1 1 205 205 SER H H 205 7.231 7.231 8.613 -1.382 25485 11604 1 9 . 1 1 206 206 SER N N 206 119.263 119.263 118.752 0.511 25485 11605 1 9 . 1 1 206 206 SER HA H 206 3.701 3.701 4.858 -1.157 25485 11606 1 9 . 1 1 206 206 SER C C 206 173.635 173.635 174.189 -0.554 25485 11607 1 9 . 1 1 206 206 SER CA C 206 63.846 63.846 58.775 5.071 25485 11608 1 9 . 1 1 206 206 SER CB C 206 63.764 63.764 63.950 -0.186 25485 11609 1 9 . 1 1 206 206 SER H H 206 8.289 8.289 8.963 -0.674 25485 11610 1 9 . 1 1 207 207 ASP N N 207 126.646 126.646 123.118 3.528 25485 11611 1 9 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.631 0.298 25485 11612 1 9 . 1 1 207 207 ASP C C 207 174.614 174.614 175.565 -0.951 25485 11613 1 9 . 1 1 207 207 ASP CA C 207 51.272 51.272 53.295 -2.023 25485 11614 1 9 . 1 1 207 207 ASP CB C 207 41.288 41.288 41.893 -0.605 25485 11615 1 9 . 1 1 207 207 ASP H H 207 8.541 8.541 7.755 0.786 25485 11616 1 9 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.726 0.061 25485 11617 1 9 . 1 1 208 208 PRO C C 208 177.467 177.467 175.663 1.804 25485 11618 1 9 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.672 -0.836 25485 11619 1 9 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.224 -0.627 25485 11620 1 9 . 1 1 209 209 ASN N N 209 116.020 116.020 112.960 3.060 25485 11621 1 9 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.645 -0.004 25485 11622 1 9 . 1 1 209 209 ASN C C 209 174.695 174.695 173.599 1.096 25485 11623 1 9 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.334 1.886 25485 11624 1 9 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.100 1.010 25485 11625 1 9 . 1 1 209 209 ASN H H 209 8.350 8.350 7.614 0.736 25485 11626 1 9 . 1 1 210 210 ALA N N 210 124.892 124.892 121.011 3.881 25485 11627 1 9 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.458 -0.363 25485 11628 1 9 . 1 1 210 210 ALA C C 210 179.495 179.495 177.945 1.550 25485 11629 1 9 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.630 1.424 25485 11630 1 9 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.828 -1.629 25485 11631 1 9 . 1 1 210 210 ALA H H 210 8.193 8.193 7.177 1.016 25485 11632 1 9 . 1 1 211 211 VAL N N 211 130.402 130.402 122.745 7.657 25485 11633 1 9 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.858 0.405 25485 11634 1 9 . 1 1 211 211 VAL C C 211 179.408 179.408 176.156 3.252 25485 11635 1 9 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.204 -0.152 25485 11636 1 9 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.086 -1.103 25485 11637 1 9 . 1 1 211 211 VAL H H 211 11.592 11.592 8.868 2.724 25485 11638 1 9 . 1 1 212 212 MET N N 212 113.285 113.285 115.627 -2.342 25485 11639 1 9 . 1 1 212 212 MET C C 212 176.996 176.996 174.929 2.067 25485 11640 1 9 . 1 1 212 212 MET CA C 212 53.614 53.614 53.124 0.490 25485 11641 1 9 . 1 1 212 212 MET CB C 212 26.975 26.975 31.757 -4.782 25485 11642 1 9 . 1 1 212 212 MET H H 212 7.724 7.724 7.628 0.096 25485 11643 1 9 . 1 1 213 213 TYR N N 213 129.919 129.919 124.243 5.676 25485 11644 1 9 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.391 1.305 25485 11645 1 9 . 1 1 213 213 TYR C C 213 178.411 178.411 175.619 2.792 25485 11646 1 9 . 1 1 213 213 TYR CA C 213 57.131 57.131 56.929 0.202 25485 11647 1 9 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.571 0.596 25485 11648 1 9 . 1 1 213 213 TYR H H 213 7.902 7.902 7.412 0.490 25485 11649 1 9 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.285 -0.810 25485 11650 1 9 . 1 1 214 214 PRO C C 214 177.694 177.694 176.210 1.484 25485 11651 1 9 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.145 1.883 25485 11652 1 9 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.618 1.205 25485 11653 1 9 . 1 1 215 215 THR N N 215 104.450 104.450 109.710 -5.260 25485 11654 1 9 . 1 1 215 215 THR HA H 215 4.444 4.444 4.215 0.229 25485 11655 1 9 . 1 1 215 215 THR C C 215 173.429 173.429 174.210 -0.781 25485 11656 1 9 . 1 1 215 215 THR CA C 215 60.528 60.528 60.450 0.078 25485 11657 1 9 . 1 1 215 215 THR CB C 215 69.614 69.614 67.496 2.119 25485 11658 1 9 . 1 1 215 215 THR H H 215 6.407 6.407 7.303 -0.896 25485 11659 1 9 . 1 1 216 216 TYR N N 216 124.618 124.618 124.355 0.263 25485 11660 1 9 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.344 -0.112 25485 11661 1 9 . 1 1 216 216 TYR C C 216 175.669 175.669 175.866 -0.197 25485 11662 1 9 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.327 0.260 25485 11663 1 9 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.369 2.522 25485 11664 1 9 . 1 1 216 216 TYR H H 216 8.331 8.331 7.412 0.919 25485 11665 1 9 . 1 1 217 217 GLY N N 217 116.089 116.089 114.651 1.438 25485 11666 1 9 . 1 1 217 217 GLY C C 217 173.560 173.560 173.296 0.264 25485 11667 1 9 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.475 0.843 25485 11668 1 9 . 1 1 217 217 GLY H H 217 7.695 7.695 8.495 -0.800 25485 11669 1 9 . 1 1 218 218 ASN N N 218 120.167 120.167 120.112 0.055 25485 11670 1 9 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.204 0.462 25485 11671 1 9 . 1 1 218 218 ASN C C 218 175.343 175.343 176.060 -0.717 25485 11672 1 9 . 1 1 218 218 ASN CA C 218 53.615 53.615 54.265 -0.650 25485 11673 1 9 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.249 0.297 25485 11674 1 9 . 1 1 218 218 ASN H H 218 8.237 8.237 8.343 -0.106 25485 11675 1 9 . 1 1 219 219 GLY N N 219 109.322 109.322 106.865 2.457 25485 11676 1 9 . 1 1 219 219 GLY C C 219 172.842 172.842 173.622 -0.780 25485 11677 1 9 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.199 0.519 25485 11678 1 9 . 1 1 219 219 GLY H H 219 8.027 8.027 7.750 0.277 25485 11679 1 9 . 1 1 220 220 ASP N N 220 123.006 123.006 120.332 2.674 25485 11680 1 9 . 1 1 220 220 ASP H H 220 8.273 8.273 8.297 -0.024 25485 11681 1 9 . 1 1 221 221 PRO C C 221 177.138 177.138 176.586 0.552 25485 11682 1 9 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.862 -5.799 25485 11683 1 9 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.831 -1.135 25485 11684 1 9 . 1 1 222 222 GLN N N 222 116.718 116.718 118.561 -1.843 25485 11685 1 9 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.348 -0.012 25485 11686 1 9 . 1 1 222 222 GLN C C 222 176.321 176.321 176.800 -0.479 25485 11687 1 9 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.933 -0.790 25485 11688 1 9 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.694 0.803 25485 11689 1 9 . 1 1 222 222 GLN H H 222 8.240 8.240 8.464 -0.224 25485 11690 1 9 . 1 1 223 223 ASN N N 223 118.368 118.368 115.315 3.053 25485 11691 1 9 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.836 0.080 25485 11692 1 9 . 1 1 223 223 ASN C C 223 173.271 173.271 174.341 -1.070 25485 11693 1 9 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.070 -0.474 25485 11694 1 9 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.987 -0.772 25485 11695 1 9 . 1 1 223 223 ASN H H 223 7.946 7.946 8.217 -0.271 25485 11696 1 9 . 1 1 224 224 PHE N N 224 118.429 118.429 119.493 -1.064 25485 11697 1 9 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.267 0.184 25485 11698 1 9 . 1 1 224 224 PHE C C 224 172.897 172.897 173.562 -0.665 25485 11699 1 9 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.103 0.306 25485 11700 1 9 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.732 0.969 25485 11701 1 9 . 1 1 224 224 PHE H H 224 6.992 6.992 7.933 -0.941 25485 11702 1 9 . 1 1 225 225 LYS N N 225 121.714 121.714 124.856 -3.142 25485 11703 1 9 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.760 0.670 25485 11704 1 9 . 1 1 225 225 LYS C C 225 174.664 174.664 175.119 -0.455 25485 11705 1 9 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.963 0.349 25485 11706 1 9 . 1 1 225 225 LYS CB C 225 34.727 34.727 35.711 -0.984 25485 11707 1 9 . 1 1 225 225 LYS H H 225 7.709 7.709 7.695 0.014 25485 11708 1 9 . 1 1 226 226 LEU N N 226 119.026 119.026 122.681 -3.655 25485 11709 1 9 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.868 0.272 25485 11710 1 9 . 1 1 226 226 LEU C C 226 177.495 177.495 176.151 1.344 25485 11711 1 9 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.004 0.595 25485 11712 1 9 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.315 -1.034 25485 11713 1 9 . 1 1 226 226 LEU H H 226 8.015 8.015 8.027 -0.012 25485 11714 1 9 . 1 1 227 227 SER N N 227 120.320 120.320 114.382 5.938 25485 11715 1 9 . 1 1 227 227 SER HA H 227 4.600 4.600 4.480 0.120 25485 11716 1 9 . 1 1 227 227 SER C C 227 175.492 175.492 174.687 0.805 25485 11717 1 9 . 1 1 227 227 SER CA C 227 57.239 57.239 57.977 -0.738 25485 11718 1 9 . 1 1 227 227 SER CB C 227 66.278 66.278 64.470 1.808 25485 11719 1 9 . 1 1 227 227 SER H H 227 9.654 9.654 7.961 1.693 25485 11720 1 9 . 1 1 228 228 GLN N N 228 127.511 127.511 124.465 3.046 25485 11721 1 9 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.906 0.788 25485 11722 1 9 . 1 1 228 228 GLN H H 228 8.248 8.248 8.953 -0.705 25485 11723 1 9 . 1 1 229 229 ASP N N 229 124.358 124.358 118.220 6.138 25485 11724 1 9 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.362 0.012 25485 11725 1 9 . 1 1 229 229 ASP C C 229 178.793 178.793 178.216 0.577 25485 11726 1 9 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.020 1.122 25485 11727 1 9 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.150 3.092 25485 11728 1 9 . 1 1 229 229 ASP H H 229 8.138 8.138 8.795 -0.657 25485 11729 1 9 . 1 1 230 230 ASP N N 230 119.694 119.694 119.482 0.212 25485 11730 1 9 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.467 -0.045 25485 11731 1 9 . 1 1 230 230 ASP C C 230 177.736 177.736 178.476 -0.740 25485 11732 1 9 . 1 1 230 230 ASP CA C 230 57.922 57.922 58.302 -0.380 25485 11733 1 9 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.062 2.174 25485 11734 1 9 . 1 1 230 230 ASP H H 230 7.393 7.393 8.166 -0.773 25485 11735 1 9 . 1 1 231 231 ILE N N 231 120.364 120.364 120.024 0.340 25485 11736 1 9 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.793 -0.128 25485 11737 1 9 . 1 1 231 231 ILE C C 231 177.631 177.631 177.693 -0.062 25485 11738 1 9 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.617 -0.118 25485 11739 1 9 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.007 0.506 25485 11740 1 9 . 1 1 231 231 ILE H H 231 8.115 8.115 7.970 0.145 25485 11741 1 9 . 1 1 232 232 LYS N N 232 119.156 119.156 120.146 -0.990 25485 11742 1 9 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.030 0.084 25485 11743 1 9 . 1 1 232 232 LYS C C 232 180.574 180.574 179.178 1.396 25485 11744 1 9 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.648 -0.088 25485 11745 1 9 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.700 0.097 25485 11746 1 9 . 1 1 232 232 LYS H H 232 8.607 8.607 8.587 0.020 25485 11747 1 9 . 1 1 233 233 GLY N N 233 106.425 106.425 107.977 -1.552 25485 11748 1 9 . 1 1 233 233 GLY C C 233 176.098 176.098 175.675 0.423 25485 11749 1 9 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.758 0.879 25485 11750 1 9 . 1 1 233 233 GLY H H 233 8.075 8.075 7.676 0.399 25485 11751 1 9 . 1 1 234 234 ILE N N 234 125.119 125.119 122.060 3.059 25485 11752 1 9 . 1 1 234 234 ILE C C 234 178.231 178.231 177.236 0.995 25485 11753 1 9 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.277 -1.684 25485 11754 1 9 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.392 -0.847 25485 11755 1 9 . 1 1 234 234 ILE H H 234 8.539 8.539 7.394 1.145 25485 11756 1 9 . 1 1 235 235 GLN N N 235 122.877 122.877 118.893 3.984 25485 11757 1 9 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.047 0.310 25485 11758 1 9 . 1 1 235 235 GLN C C 235 180.105 180.105 178.452 1.653 25485 11759 1 9 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.165 -1.278 25485 11760 1 9 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.557 -1.020 25485 11761 1 9 . 1 1 235 235 GLN H H 235 8.296 8.296 8.404 -0.108 25485 11762 1 9 . 1 1 236 236 LYS N N 236 123.678 123.678 118.717 4.961 25485 11763 1 9 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.307 -0.225 25485 11764 1 9 . 1 1 236 236 LYS C C 236 178.169 178.169 177.087 1.082 25485 11765 1 9 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.207 1.169 25485 11766 1 9 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.887 0.091 25485 11767 1 9 . 1 1 236 236 LYS H H 236 8.024 8.024 7.630 0.394 25485 11768 1 9 . 1 1 237 237 LEU N N 237 116.873 116.873 118.468 -1.595 25485 11769 1 9 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.148 -0.161 25485 11770 1 9 . 1 1 237 237 LEU C C 237 177.893 177.893 177.982 -0.089 25485 11771 1 9 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.523 0.916 25485 11772 1 9 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.608 1.005 25485 11773 1 9 . 1 1 237 237 LEU H H 237 6.888 6.888 7.520 -0.632 25485 11774 1 9 . 1 1 238 238 TYR N N 238 112.237 112.237 117.129 -4.892 25485 11775 1 9 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.495 0.156 25485 11776 1 9 . 1 1 238 238 TYR C C 238 176.082 176.082 176.263 -0.181 25485 11777 1 9 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.044 -0.408 25485 11778 1 9 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.542 1.856 25485 11779 1 9 . 1 1 238 238 TYR H H 238 7.445 7.445 8.214 -0.769 25485 11780 1 9 . 1 1 239 239 GLY N N 239 110.906 110.906 106.353 4.553 25485 11781 1 9 . 1 1 239 239 GLY C C 239 171.269 171.269 172.922 -1.653 25485 11782 1 9 . 1 1 239 239 GLY CA C 239 43.886 43.886 44.456 -0.570 25485 11783 1 9 . 1 1 239 239 GLY H H 239 8.443 8.443 8.116 0.327 25485 11784 1 9 . 1 1 240 240 LYS N N 240 114.281 114.281 122.171 -7.890 25485 11785 1 9 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.508 0.230 25485 11786 1 9 . 1 1 240 240 LYS C C 240 177.527 177.527 177.134 0.393 25485 11787 1 9 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.223 -0.265 25485 11788 1 9 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.537 0.738 25485 11789 1 9 . 1 1 240 240 LYS H H 240 7.873 7.873 8.346 -0.473 25485 11790 1 9 . 1 1 241 241 ARG N N 241 123.758 123.758 126.082 -2.324 25485 11791 1 9 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.275 -0.278 25485 11792 1 9 . 1 1 241 241 ARG C C 241 176.026 176.026 175.408 0.618 25485 11793 1 9 . 1 1 241 241 ARG CA C 241 57.492 57.492 57.589 -0.097 25485 11794 1 9 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.261 0.110 25485 11795 1 9 . 1 1 241 241 ARG H H 241 7.742 7.742 8.961 -1.219 25485 11796 1 9 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.255 0.085 25485 11797 1 9 . 1 1 246 246 LYS C C 246 175.403 175.403 176.992 -1.589 25485 11798 1 9 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.651 -0.142 25485 11799 1 9 . 1 1 246 246 LYS CB C 246 32.858 32.858 32.043 0.815 25485 11800 1 10 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.519 -0.212 25485 11801 1 10 . 1 1 2 2 GLN C C 2 176.492 176.492 174.983 1.509 25485 11802 1 10 . 1 1 2 2 GLN CA C 2 56.749 56.749 55.497 1.252 25485 11803 1 10 . 1 1 2 2 GLN CB C 2 28.654 28.654 29.967 -1.313 25485 11804 1 10 . 1 1 3 3 GLU N N 3 121.668 121.668 124.869 -3.201 25485 11805 1 10 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.348 -0.559 25485 11806 1 10 . 1 1 3 3 GLU C C 3 176.278 176.278 177.615 -1.337 25485 11807 1 10 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.909 -0.850 25485 11808 1 10 . 1 1 3 3 GLU CB C 3 29.691 29.691 30.156 -0.465 25485 11809 1 10 . 1 1 3 3 GLU H H 3 8.331 8.331 8.789 -0.458 25485 11810 1 10 . 1 1 4 4 ALA N N 4 124.493 124.493 122.814 1.679 25485 11811 1 10 . 1 1 4 4 ALA HA H 4 4.510 4.510 3.775 0.735 25485 11812 1 10 . 1 1 4 4 ALA C C 4 178.428 178.428 179.662 -1.234 25485 11813 1 10 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.987 -0.310 25485 11814 1 10 . 1 1 4 4 ALA CB C 4 18.709 18.709 17.411 1.298 25485 11815 1 10 . 1 1 4 4 ALA H H 4 8.131 8.131 7.568 0.563 25485 11816 1 10 . 1 1 5 5 GLY N N 5 108.204 108.204 107.975 0.229 25485 11817 1 10 . 1 1 5 5 GLY C C 5 174.858 174.858 175.573 -0.715 25485 11818 1 10 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.380 1.280 25485 11819 1 10 . 1 1 5 5 GLY H H 5 8.279 8.279 8.799 -0.520 25485 11820 1 10 . 1 1 6 6 GLY N N 6 108.820 108.820 108.218 0.602 25485 11821 1 10 . 1 1 6 6 GLY C C 6 174.189 174.189 174.078 0.111 25485 11822 1 10 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.435 -0.022 25485 11823 1 10 . 1 1 6 6 GLY H H 6 8.246 8.246 7.802 0.444 25485 11824 1 10 . 1 1 7 7 MET N N 7 119.938 119.938 119.859 0.079 25485 11825 1 10 . 1 1 7 7 MET HA H 7 4.659 4.659 4.674 -0.015 25485 11826 1 10 . 1 1 7 7 MET C C 7 176.191 176.191 175.337 0.854 25485 11827 1 10 . 1 1 7 7 MET CA C 7 54.799 54.799 54.943 -0.144 25485 11828 1 10 . 1 1 7 7 MET CB C 7 33.046 33.046 34.829 -1.783 25485 11829 1 10 . 1 1 7 7 MET H H 7 8.005 8.005 7.726 0.279 25485 11830 1 10 . 1 1 8 8 SER N N 8 118.919 118.919 116.448 2.471 25485 11831 1 10 . 1 1 8 8 SER HA H 8 4.239 4.239 4.449 -0.210 25485 11832 1 10 . 1 1 8 8 SER C C 8 174.949 174.949 175.541 -0.592 25485 11833 1 10 . 1 1 8 8 SER CA C 8 58.160 58.160 58.541 -0.381 25485 11834 1 10 . 1 1 8 8 SER CB C 8 65.440 65.440 63.744 1.696 25485 11835 1 10 . 1 1 8 8 SER H H 8 8.731 8.731 8.367 0.364 25485 11836 1 10 . 1 1 9 9 GLU N N 9 122.442 122.442 121.782 0.660 25485 11837 1 10 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.185 0.136 25485 11838 1 10 . 1 1 9 9 GLU C C 9 178.604 178.604 178.894 -0.290 25485 11839 1 10 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.852 -0.385 25485 11840 1 10 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.455 -0.279 25485 11841 1 10 . 1 1 9 9 GLU H H 9 8.901 8.901 9.003 -0.102 25485 11842 1 10 . 1 1 10 10 LEU N N 10 120.568 120.568 118.571 1.997 25485 11843 1 10 . 1 1 10 10 LEU C C 10 179.307 179.307 178.903 0.404 25485 11844 1 10 . 1 1 10 10 LEU CA C 10 57.480 57.480 57.851 -0.371 25485 11845 1 10 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.495 0.080 25485 11846 1 10 . 1 1 10 10 LEU H H 10 8.020 8.020 8.264 -0.244 25485 11847 1 10 . 1 1 11 11 GLN N N 11 119.930 119.930 118.590 1.340 25485 11848 1 10 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.066 0.068 25485 11849 1 10 . 1 1 11 11 GLN C C 11 178.330 178.330 178.946 -0.616 25485 11850 1 10 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.503 0.315 25485 11851 1 10 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.039 -0.175 25485 11852 1 10 . 1 1 11 11 GLN H H 11 7.811 7.811 7.616 0.195 25485 11853 1 10 . 1 1 12 12 TRP N N 12 121.031 121.031 121.065 -0.034 25485 11854 1 10 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.311 0.103 25485 11855 1 10 . 1 1 12 12 TRP C C 12 178.874 178.874 178.589 0.285 25485 11856 1 10 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.635 -0.128 25485 11857 1 10 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.871 -0.484 25485 11858 1 10 . 1 1 12 12 TRP H H 12 8.205 8.205 7.972 0.233 25485 11859 1 10 . 1 1 13 13 GLU N N 13 121.877 121.877 119.414 2.463 25485 11860 1 10 . 1 1 13 13 GLU C C 13 179.425 179.425 178.997 0.428 25485 11861 1 10 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.840 0.197 25485 11862 1 10 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.572 -0.650 25485 11863 1 10 . 1 1 13 13 GLU H H 13 8.434 8.434 8.609 -0.175 25485 11864 1 10 . 1 1 14 14 GLN N N 14 120.449 120.449 119.525 0.924 25485 11865 1 10 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.931 0.307 25485 11866 1 10 . 1 1 14 14 GLN C C 14 179.210 179.210 178.492 0.718 25485 11867 1 10 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.941 -0.059 25485 11868 1 10 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.606 -0.856 25485 11869 1 10 . 1 1 14 14 GLN H H 14 8.124 8.124 8.465 -0.341 25485 11870 1 10 . 1 1 15 15 ALA N N 15 123.114 123.114 121.247 1.867 25485 11871 1 10 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.128 0.262 25485 11872 1 10 . 1 1 15 15 ALA C C 15 179.352 179.352 179.453 -0.101 25485 11873 1 10 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.380 -0.415 25485 11874 1 10 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.104 0.559 25485 11875 1 10 . 1 1 15 15 ALA H H 15 8.344 8.344 7.666 0.678 25485 11876 1 10 . 1 1 16 16 GLN N N 16 117.718 117.718 118.197 -0.479 25485 11877 1 10 . 1 1 16 16 GLN HA H 16 3.782 3.782 4.106 -0.324 25485 11878 1 10 . 1 1 16 16 GLN C C 16 177.719 177.719 178.322 -0.603 25485 11879 1 10 . 1 1 16 16 GLN CA C 16 60.281 60.281 59.000 1.281 25485 11880 1 10 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.897 -0.361 25485 11881 1 10 . 1 1 16 16 GLN H H 16 8.500 8.500 7.887 0.613 25485 11882 1 10 . 1 1 17 17 ASP N N 17 120.040 120.040 120.621 -0.581 25485 11883 1 10 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.402 0.134 25485 11884 1 10 . 1 1 17 17 ASP C C 17 177.630 177.630 178.622 -0.992 25485 11885 1 10 . 1 1 17 17 ASP CA C 17 57.805 57.805 58.078 -0.273 25485 11886 1 10 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.597 1.267 25485 11887 1 10 . 1 1 17 17 ASP H H 17 7.871 7.871 8.499 -0.628 25485 11888 1 10 . 1 1 18 18 TYR N N 18 122.465 122.465 119.648 2.817 25485 11889 1 10 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.146 0.044 25485 11890 1 10 . 1 1 18 18 TYR C C 18 178.439 178.439 177.726 0.713 25485 11891 1 10 . 1 1 18 18 TYR CA C 18 61.846 61.846 61.351 0.495 25485 11892 1 10 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.494 1.446 25485 11893 1 10 . 1 1 18 18 TYR H H 18 8.244 8.244 8.156 0.088 25485 11894 1 10 . 1 1 19 19 LEU N N 19 117.635 117.635 118.839 -1.204 25485 11895 1 10 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.055 0.077 25485 11896 1 10 . 1 1 19 19 LEU C C 19 180.940 180.940 178.243 2.697 25485 11897 1 10 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.775 0.730 25485 11898 1 10 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.204 -0.606 25485 11899 1 10 . 1 1 19 19 LEU H H 19 8.713 8.713 7.734 0.979 25485 11900 1 10 . 1 1 20 20 LYS N N 20 124.594 124.594 119.925 4.669 25485 11901 1 10 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.099 -0.015 25485 11902 1 10 . 1 1 20 20 LYS C C 20 178.387 178.387 178.617 -0.230 25485 11903 1 10 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.487 0.318 25485 11904 1 10 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.382 0.074 25485 11905 1 10 . 1 1 20 20 LYS H H 20 8.815 8.815 7.632 1.183 25485 11906 1 10 . 1 1 21 21 ARG N N 21 117.535 117.535 117.749 -0.214 25485 11907 1 10 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.249 -0.530 25485 11908 1 10 . 1 1 21 21 ARG C C 21 178.498 178.498 178.880 -0.382 25485 11909 1 10 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.588 0.656 25485 11910 1 10 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.506 -0.065 25485 11911 1 10 . 1 1 21 21 ARG H H 21 7.810 7.810 7.640 0.170 25485 11912 1 10 . 1 1 22 22 PHE N N 22 112.113 112.113 120.620 -8.507 25485 11913 1 10 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.234 0.677 25485 11914 1 10 . 1 1 22 22 PHE C C 22 174.875 174.875 175.826 -0.951 25485 11915 1 10 . 1 1 22 22 PHE CA C 22 57.475 57.475 59.628 -2.153 25485 11916 1 10 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.056 0.113 25485 11917 1 10 . 1 1 22 22 PHE H H 22 8.010 8.010 7.501 0.509 25485 11918 1 10 . 1 1 23 23 TYR N N 23 116.187 116.187 115.987 0.200 25485 11919 1 10 . 1 1 23 23 TYR C C 23 173.455 173.455 176.672 -3.217 25485 11920 1 10 . 1 1 23 23 TYR CA C 23 58.427 58.427 60.626 -2.199 25485 11921 1 10 . 1 1 23 23 TYR CB C 23 39.529 39.529 39.426 0.103 25485 11922 1 10 . 1 1 23 23 TYR H H 23 7.680 7.680 7.411 0.269 25485 11923 1 10 . 1 1 24 24 LEU N N 24 115.570 115.570 111.334 4.236 25485 11924 1 10 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.323 -0.173 25485 11925 1 10 . 1 1 24 24 LEU C C 24 176.661 176.661 175.045 1.616 25485 11926 1 10 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.880 0.272 25485 11927 1 10 . 1 1 24 24 LEU CB C 24 36.863 36.863 42.939 -6.076 25485 11928 1 10 . 1 1 24 24 LEU H H 24 7.238 7.238 7.686 -0.448 25485 11929 1 10 . 1 1 25 25 TYR N N 25 119.901 119.901 119.448 0.453 25485 11930 1 10 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.709 -0.350 25485 11931 1 10 . 1 1 25 25 TYR C C 25 173.784 173.784 173.260 0.524 25485 11932 1 10 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.605 0.642 25485 11933 1 10 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.845 -0.766 25485 11934 1 10 . 1 1 25 25 TYR H H 25 7.845 7.845 7.997 -0.152 25485 11935 1 10 . 1 1 26 26 ASP N N 26 129.338 129.338 127.424 1.914 25485 11936 1 10 . 1 1 26 26 ASP HA H 26 4.451 4.451 4.948 -0.497 25485 11937 1 10 . 1 1 26 26 ASP C C 26 175.282 175.282 175.976 -0.694 25485 11938 1 10 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.732 -1.299 25485 11939 1 10 . 1 1 26 26 ASP CB C 26 41.249 41.249 41.005 0.244 25485 11940 1 10 . 1 1 26 26 ASP H H 26 8.108 8.108 8.843 -0.735 25485 11941 1 10 . 1 1 27 27 SER C C 27 175.204 175.204 175.742 -0.538 25485 11942 1 10 . 1 1 27 27 SER CA C 27 59.424 59.424 60.433 -1.009 25485 11943 1 10 . 1 1 27 27 SER CB C 27 63.535 63.535 63.459 0.076 25485 11944 1 10 . 1 1 28 28 GLU N N 28 122.058 122.058 119.348 2.710 25485 11945 1 10 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.288 0.037 25485 11946 1 10 . 1 1 28 28 GLU C C 28 177.073 177.073 177.403 -0.330 25485 11947 1 10 . 1 1 28 28 GLU CA C 28 57.212 57.212 57.622 -0.410 25485 11948 1 10 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.567 0.003 25485 11949 1 10 . 1 1 28 28 GLU H H 28 8.255 8.255 8.479 -0.224 25485 11950 1 10 . 1 1 29 29 THR N N 29 114.161 114.161 114.640 -0.479 25485 11951 1 10 . 1 1 29 29 THR HA H 29 4.260 4.260 4.268 -0.008 25485 11952 1 10 . 1 1 29 29 THR C C 29 174.591 174.591 174.255 0.336 25485 11953 1 10 . 1 1 29 29 THR CA C 29 61.976 61.976 63.419 -1.443 25485 11954 1 10 . 1 1 29 29 THR CB C 29 69.385 69.385 69.314 0.072 25485 11955 1 10 . 1 1 29 29 THR H H 29 7.498 7.498 7.530 -0.032 25485 11956 1 10 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.135 0.083 25485 11957 1 10 . 1 1 30 30 LYS H H 30 8.218 8.218 8.037 0.181 25485 11958 1 10 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.731 -0.307 25485 11959 1 10 . 1 1 31 31 ASN CB C 31 39.133 39.133 41.089 -1.956 25485 11960 1 10 . 1 1 32 32 ALA N N 32 126.484 126.484 123.157 3.327 25485 11961 1 10 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.094 0.202 25485 11962 1 10 . 1 1 32 32 ALA C C 32 178.012 178.012 178.025 -0.013 25485 11963 1 10 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.949 -1.189 25485 11964 1 10 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.221 -0.451 25485 11965 1 10 . 1 1 32 32 ALA H H 32 8.411 8.411 8.491 -0.080 25485 11966 1 10 . 1 1 33 33 ASN N N 33 116.885 116.885 115.634 1.251 25485 11967 1 10 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.549 0.149 25485 11968 1 10 . 1 1 33 33 ASN C C 33 176.240 176.240 176.567 -0.327 25485 11969 1 10 . 1 1 33 33 ASN CA C 33 54.187 54.187 54.765 -0.578 25485 11970 1 10 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.039 0.546 25485 11971 1 10 . 1 1 33 33 ASN H H 33 8.309 8.309 8.661 -0.352 25485 11972 1 10 . 1 1 34 34 SER N N 34 116.836 116.836 115.138 1.698 25485 11973 1 10 . 1 1 34 34 SER HA H 34 4.544 4.544 4.270 0.274 25485 11974 1 10 . 1 1 34 34 SER C C 34 175.253 175.253 176.233 -0.980 25485 11975 1 10 . 1 1 34 34 SER CA C 34 59.583 59.583 60.825 -1.242 25485 11976 1 10 . 1 1 34 34 SER CB C 34 63.919 63.919 62.568 1.351 25485 11977 1 10 . 1 1 34 34 SER H H 34 8.115 8.115 8.363 -0.248 25485 11978 1 10 . 1 1 35 35 LEU N N 35 125.355 125.355 123.164 2.191 25485 11979 1 10 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.392 -0.816 25485 11980 1 10 . 1 1 35 35 LEU C C 35 177.973 177.973 178.184 -0.211 25485 11981 1 10 . 1 1 35 35 LEU CA C 35 58.497 58.497 57.510 0.987 25485 11982 1 10 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.554 -0.862 25485 11983 1 10 . 1 1 35 35 LEU H H 35 8.312 8.312 7.532 0.780 25485 11984 1 10 . 1 1 36 36 GLU N N 36 119.201 119.201 118.746 0.455 25485 11985 1 10 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.892 0.022 25485 11986 1 10 . 1 1 36 36 GLU C C 36 178.141 178.141 178.804 -0.663 25485 11987 1 10 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.455 0.204 25485 11988 1 10 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.015 0.298 25485 11989 1 10 . 1 1 36 36 GLU H H 36 8.225 8.225 7.771 0.454 25485 11990 1 10 . 1 1 37 37 ALA N N 37 120.746 120.746 122.517 -1.771 25485 11991 1 10 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.066 0.013 25485 11992 1 10 . 1 1 37 37 ALA C C 37 181.485 181.485 179.780 1.705 25485 11993 1 10 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.991 0.468 25485 11994 1 10 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.342 -0.175 25485 11995 1 10 . 1 1 37 37 ALA H H 37 7.917 7.917 7.536 0.381 25485 11996 1 10 . 1 1 38 38 LYS N N 38 119.326 119.326 119.420 -0.094 25485 11997 1 10 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.126 0.205 25485 11998 1 10 . 1 1 38 38 LYS C C 38 177.946 177.946 178.943 -0.997 25485 11999 1 10 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.587 -0.883 25485 12000 1 10 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.231 -0.431 25485 12001 1 10 . 1 1 38 38 LYS H H 38 8.216 8.216 8.121 0.095 25485 12002 1 10 . 1 1 39 39 LEU N N 39 122.736 122.736 119.863 2.873 25485 12003 1 10 . 1 1 39 39 LEU HA H 39 3.941 3.941 4.025 -0.084 25485 12004 1 10 . 1 1 39 39 LEU C C 39 178.819 178.819 178.703 0.116 25485 12005 1 10 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.079 0.002 25485 12006 1 10 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.526 -0.898 25485 12007 1 10 . 1 1 39 39 LEU H H 39 8.666 8.666 8.332 0.334 25485 12008 1 10 . 1 1 40 40 LYS N N 40 118.411 118.411 118.951 -0.540 25485 12009 1 10 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.934 0.704 25485 12010 1 10 . 1 1 40 40 LYS C C 40 179.329 179.329 178.374 0.955 25485 12011 1 10 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.184 -0.051 25485 12012 1 10 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.282 -0.497 25485 12013 1 10 . 1 1 40 40 LYS H H 40 8.227 8.227 7.738 0.489 25485 12014 1 10 . 1 1 41 41 GLU N N 41 121.329 121.329 118.366 2.963 25485 12015 1 10 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.161 -0.068 25485 12016 1 10 . 1 1 41 41 GLU C C 41 178.989 178.989 179.024 -0.035 25485 12017 1 10 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.039 0.721 25485 12018 1 10 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.891 0.945 25485 12019 1 10 . 1 1 41 41 GLU H H 41 7.718 7.718 7.697 0.021 25485 12020 1 10 . 1 1 42 42 MET N N 42 123.817 123.817 119.850 3.967 25485 12021 1 10 . 1 1 42 42 MET HA H 42 4.107 4.107 4.403 -0.296 25485 12022 1 10 . 1 1 42 42 MET C C 42 177.719 177.719 177.628 0.091 25485 12023 1 10 . 1 1 42 42 MET CA C 42 59.912 59.912 58.999 0.913 25485 12024 1 10 . 1 1 42 42 MET CB C 42 30.506 30.506 32.805 -2.299 25485 12025 1 10 . 1 1 42 42 MET H H 42 7.657 7.657 7.613 0.044 25485 12026 1 10 . 1 1 43 43 GLN N N 43 119.998 119.998 118.198 1.800 25485 12027 1 10 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.071 -0.266 25485 12028 1 10 . 1 1 43 43 GLN C C 43 177.604 177.604 178.878 -1.274 25485 12029 1 10 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.740 1.225 25485 12030 1 10 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.763 -1.208 25485 12031 1 10 . 1 1 43 43 GLN H H 43 8.910 8.910 7.696 1.214 25485 12032 1 10 . 1 1 44 44 LYS N N 44 119.165 119.165 119.473 -0.308 25485 12033 1 10 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.280 -0.225 25485 12034 1 10 . 1 1 44 44 LYS C C 44 179.991 179.991 178.681 1.310 25485 12035 1 10 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.258 1.303 25485 12036 1 10 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.036 0.262 25485 12037 1 10 . 1 1 44 44 LYS H H 44 8.507 8.507 7.636 0.871 25485 12038 1 10 . 1 1 45 45 PHE N N 45 123.602 123.602 120.331 3.271 25485 12039 1 10 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.357 -0.456 25485 12040 1 10 . 1 1 45 45 PHE C C 45 177.606 177.606 177.102 0.504 25485 12041 1 10 . 1 1 45 45 PHE CA C 45 63.034 63.034 61.016 2.018 25485 12042 1 10 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.427 0.439 25485 12043 1 10 . 1 1 45 45 PHE H H 45 8.445 8.445 7.782 0.663 25485 12044 1 10 . 1 1 46 46 PHE N N 46 112.715 112.715 115.591 -2.876 25485 12045 1 10 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.569 0.028 25485 12046 1 10 . 1 1 46 46 PHE C C 46 175.285 175.285 177.286 -2.001 25485 12047 1 10 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.790 0.885 25485 12048 1 10 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.237 -0.778 25485 12049 1 10 . 1 1 46 46 PHE H H 46 8.272 8.272 8.421 -0.149 25485 12050 1 10 . 1 1 47 47 GLY N N 47 110.438 110.438 107.541 2.897 25485 12051 1 10 . 1 1 47 47 GLY C C 47 174.935 174.935 174.321 0.614 25485 12052 1 10 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.444 1.567 25485 12053 1 10 . 1 1 47 47 GLY H H 47 7.926 7.926 8.393 -0.467 25485 12054 1 10 . 1 1 48 48 LEU N N 48 121.830 121.830 119.032 2.798 25485 12055 1 10 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.633 0.291 25485 12056 1 10 . 1 1 48 48 LEU C C 48 174.009 174.009 175.865 -1.856 25485 12057 1 10 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.555 -1.720 25485 12058 1 10 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.829 0.634 25485 12059 1 10 . 1 1 48 48 LEU H H 48 8.762 8.762 7.617 1.145 25485 12060 1 10 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.390 -0.152 25485 12061 1 10 . 1 1 49 49 PRO C C 49 176.874 176.874 177.024 -0.150 25485 12062 1 10 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.923 -0.405 25485 12063 1 10 . 1 1 49 49 PRO CB C 49 31.079 31.079 32.010 -0.931 25485 12064 1 10 . 1 1 50 50 ILE N N 50 126.859 126.859 116.956 9.903 25485 12065 1 10 . 1 1 50 50 ILE HA H 50 4.101 4.101 3.999 0.102 25485 12066 1 10 . 1 1 50 50 ILE C C 50 176.540 176.540 175.212 1.328 25485 12067 1 10 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.185 -1.229 25485 12068 1 10 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.110 -0.717 25485 12069 1 10 . 1 1 50 50 ILE H H 50 8.548 8.548 7.953 0.595 25485 12070 1 10 . 1 1 51 51 THR N N 51 116.443 116.443 118.956 -2.513 25485 12071 1 10 . 1 1 51 51 THR HA H 51 4.584 4.584 4.518 0.066 25485 12072 1 10 . 1 1 51 51 THR C C 51 176.672 176.672 175.495 1.177 25485 12073 1 10 . 1 1 51 51 THR CA C 51 60.979 60.979 60.015 0.964 25485 12074 1 10 . 1 1 51 51 THR CB C 51 71.505 71.505 70.268 1.237 25485 12075 1 10 . 1 1 51 51 THR H H 51 8.001 8.001 7.812 0.189 25485 12076 1 10 . 1 1 52 52 GLY N N 52 112.719 112.719 110.525 2.194 25485 12077 1 10 . 1 1 52 52 GLY C C 52 170.609 170.609 173.764 -3.155 25485 12078 1 10 . 1 1 52 52 GLY CA C 52 46.746 46.746 46.129 0.617 25485 12079 1 10 . 1 1 52 52 GLY H H 52 9.499 9.499 8.725 0.774 25485 12080 1 10 . 1 1 53 53 MET N N 53 116.621 116.621 117.202 -0.581 25485 12081 1 10 . 1 1 53 53 MET HA H 53 4.023 4.023 4.712 -0.689 25485 12082 1 10 . 1 1 53 53 MET C C 53 174.695 174.695 174.581 0.114 25485 12083 1 10 . 1 1 53 53 MET CA C 53 53.460 53.460 54.130 -0.671 25485 12084 1 10 . 1 1 53 53 MET CB C 53 35.408 35.408 36.012 -0.604 25485 12085 1 10 . 1 1 53 53 MET H H 53 7.993 7.993 7.285 0.708 25485 12086 1 10 . 1 1 54 54 LEU N N 54 122.679 122.679 122.162 0.517 25485 12087 1 10 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.568 -0.817 25485 12088 1 10 . 1 1 54 54 LEU C C 54 174.784 174.784 174.152 0.632 25485 12089 1 10 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.852 -0.551 25485 12090 1 10 . 1 1 54 54 LEU CB C 54 42.010 42.010 44.086 -2.076 25485 12091 1 10 . 1 1 54 54 LEU H H 54 7.940 7.940 8.471 -0.531 25485 12092 1 10 . 1 1 55 55 ASN N N 55 115.797 115.797 121.923 -6.126 25485 12093 1 10 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.588 0.161 25485 12094 1 10 . 1 1 55 55 ASN C C 55 175.459 175.459 174.447 1.012 25485 12095 1 10 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.798 -1.955 25485 12096 1 10 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.929 1.428 25485 12097 1 10 . 1 1 55 55 ASN H H 55 6.543 6.543 8.539 -1.996 25485 12098 1 10 . 1 1 56 56 SER N N 56 121.507 121.507 115.905 5.602 25485 12099 1 10 . 1 1 56 56 SER HA H 56 4.638 4.638 4.403 0.235 25485 12100 1 10 . 1 1 56 56 SER C C 56 175.727 175.727 175.430 0.297 25485 12101 1 10 . 1 1 56 56 SER CA C 56 57.932 57.932 59.673 -1.741 25485 12102 1 10 . 1 1 56 56 SER CB C 56 63.786 63.786 63.852 -0.067 25485 12103 1 10 . 1 1 56 56 SER H H 56 8.213 8.213 8.350 -0.137 25485 12104 1 10 . 1 1 57 57 ARG N N 57 122.951 122.951 120.589 2.362 25485 12105 1 10 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.538 -0.337 25485 12106 1 10 . 1 1 57 57 ARG C C 57 178.560 178.560 178.769 -0.209 25485 12107 1 10 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.443 -0.011 25485 12108 1 10 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.912 -0.807 25485 12109 1 10 . 1 1 57 57 ARG H H 57 7.895 7.895 8.630 -0.735 25485 12110 1 10 . 1 1 58 58 VAL N N 58 118.778 118.778 120.438 -1.660 25485 12111 1 10 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.513 -0.182 25485 12112 1 10 . 1 1 58 58 VAL C C 58 177.370 177.370 177.952 -0.582 25485 12113 1 10 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.380 0.002 25485 12114 1 10 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.192 1.017 25485 12115 1 10 . 1 1 58 58 VAL H H 58 7.583 7.583 8.006 -0.423 25485 12116 1 10 . 1 1 59 59 ILE N N 59 119.159 119.159 118.519 0.640 25485 12117 1 10 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.656 -0.243 25485 12118 1 10 . 1 1 59 59 ILE C C 59 177.067 177.067 177.514 -0.447 25485 12119 1 10 . 1 1 59 59 ILE CA C 59 63.633 63.633 62.206 1.427 25485 12120 1 10 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.764 -0.068 25485 12121 1 10 . 1 1 59 59 ILE H H 59 7.323 7.323 8.046 -0.723 25485 12122 1 10 . 1 1 60 60 GLU N N 60 119.367 119.367 120.152 -0.785 25485 12123 1 10 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.906 -0.168 25485 12124 1 10 . 1 1 60 60 GLU C C 60 179.978 179.978 179.180 0.798 25485 12125 1 10 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.628 -0.370 25485 12126 1 10 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.409 -0.021 25485 12127 1 10 . 1 1 60 60 GLU H H 60 7.879 7.879 7.418 0.461 25485 12128 1 10 . 1 1 61 61 ILE N N 61 118.816 118.816 119.544 -0.728 25485 12129 1 10 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.672 -0.233 25485 12130 1 10 . 1 1 61 61 ILE C C 61 179.033 179.033 177.022 2.011 25485 12131 1 10 . 1 1 61 61 ILE CA C 61 64.838 64.838 65.549 -0.711 25485 12132 1 10 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.074 -1.175 25485 12133 1 10 . 1 1 61 61 ILE H H 61 7.246 7.246 7.523 -0.277 25485 12134 1 10 . 1 1 62 62 MET N N 62 119.986 119.986 114.550 5.436 25485 12135 1 10 . 1 1 62 62 MET HA H 62 3.444 3.444 3.846 -0.402 25485 12136 1 10 . 1 1 62 62 MET C C 62 176.185 176.185 176.748 -0.563 25485 12137 1 10 . 1 1 62 62 MET CA C 62 59.014 59.014 56.985 2.029 25485 12138 1 10 . 1 1 62 62 MET CB C 62 31.250 31.250 31.609 -0.359 25485 12139 1 10 . 1 1 62 62 MET H H 62 7.835 7.835 7.376 0.459 25485 12140 1 10 . 1 1 63 63 GLN N N 63 116.163 116.163 112.885 3.278 25485 12141 1 10 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.152 0.126 25485 12142 1 10 . 1 1 63 63 GLN C C 63 176.727 176.727 176.514 0.213 25485 12143 1 10 . 1 1 63 63 GLN CA C 63 56.138 56.138 55.791 0.347 25485 12144 1 10 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.930 -0.864 25485 12145 1 10 . 1 1 63 63 GLN H H 63 7.454 7.454 7.184 0.270 25485 12146 1 10 . 1 1 64 64 LYS N N 64 121.430 121.430 121.172 0.258 25485 12147 1 10 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.506 0.037 25485 12148 1 10 . 1 1 64 64 LYS C C 64 174.724 174.724 174.185 0.539 25485 12149 1 10 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.179 1.338 25485 12150 1 10 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.734 -1.137 25485 12151 1 10 . 1 1 64 64 LYS H H 64 7.483 7.483 7.687 -0.204 25485 12152 1 10 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.333 -1.897 25485 12153 1 10 . 1 1 65 65 PRO C C 65 176.158 176.158 175.861 0.297 25485 12154 1 10 . 1 1 65 65 PRO CA C 65 62.888 62.888 62.957 -0.069 25485 12155 1 10 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.247 -0.414 25485 12156 1 10 . 1 1 66 66 ARG N N 66 112.697 112.697 117.799 -5.102 25485 12157 1 10 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.761 -0.353 25485 12158 1 10 . 1 1 66 66 ARG C C 66 174.478 174.478 174.622 -0.144 25485 12159 1 10 . 1 1 66 66 ARG CA C 66 54.636 54.636 54.069 0.567 25485 12160 1 10 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.937 2.736 25485 12161 1 10 . 1 1 66 66 ARG H H 66 8.146 8.146 8.311 -0.165 25485 12162 1 10 . 1 1 67 67 CYS N N 67 121.740 121.740 119.223 2.517 25485 12163 1 10 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.302 0.138 25485 12164 1 10 . 1 1 67 67 CYS C C 67 175.659 175.659 176.709 -1.050 25485 12165 1 10 . 1 1 67 67 CYS CA C 67 59.195 59.195 60.900 -1.705 25485 12166 1 10 . 1 1 67 67 CYS CB C 67 30.206 30.206 28.500 1.706 25485 12167 1 10 . 1 1 67 67 CYS H H 67 7.757 7.757 8.814 -1.057 25485 12168 1 10 . 1 1 68 68 GLY N N 68 116.217 116.217 114.987 1.230 25485 12169 1 10 . 1 1 68 68 GLY C C 68 172.210 172.210 173.180 -0.970 25485 12170 1 10 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.405 1.154 25485 12171 1 10 . 1 1 68 68 GLY H H 68 9.704 9.704 9.209 0.495 25485 12172 1 10 . 1 1 69 69 VAL N N 69 126.372 126.372 119.673 6.699 25485 12173 1 10 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.428 -0.597 25485 12174 1 10 . 1 1 69 69 VAL C C 69 173.538 173.538 173.975 -0.437 25485 12175 1 10 . 1 1 69 69 VAL CA C 69 61.368 61.368 57.598 3.770 25485 12176 1 10 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.516 0.007 25485 12177 1 10 . 1 1 69 69 VAL H H 69 9.113 9.113 7.625 1.488 25485 12178 1 10 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.032 0.918 25485 12179 1 10 . 1 1 70 70 PRO C C 70 175.019 175.019 176.131 -1.112 25485 12180 1 10 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.335 1.013 25485 12181 1 10 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.706 -0.348 25485 12182 1 10 . 1 1 71 71 ASP N N 71 118.986 118.986 120.395 -1.409 25485 12183 1 10 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.749 -0.316 25485 12184 1 10 . 1 1 71 71 ASP C C 71 175.166 175.166 175.107 0.059 25485 12185 1 10 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.993 1.375 25485 12186 1 10 . 1 1 71 71 ASP CB C 71 39.864 39.864 40.858 -0.994 25485 12187 1 10 . 1 1 71 71 ASP H H 71 8.054 8.054 8.548 -0.494 25485 12188 1 10 . 1 1 72 72 VAL N N 72 112.953 112.953 115.017 -2.064 25485 12189 1 10 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.348 -0.052 25485 12190 1 10 . 1 1 72 72 VAL C C 72 174.330 174.330 174.527 -0.197 25485 12191 1 10 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.947 -1.302 25485 12192 1 10 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.943 -0.070 25485 12193 1 10 . 1 1 72 72 VAL H H 72 6.430 6.430 7.346 -0.916 25485 12194 1 10 . 1 1 73 73 ALA N N 73 125.869 125.869 129.993 -4.124 25485 12195 1 10 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.604 -0.299 25485 12196 1 10 . 1 1 73 73 ALA C C 73 177.382 177.382 176.446 0.936 25485 12197 1 10 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.381 0.668 25485 12198 1 10 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.869 -0.918 25485 12199 1 10 . 1 1 73 73 ALA H H 73 8.177 8.177 8.025 0.152 25485 12200 1 10 . 1 1 74 74 GLU N N 74 120.724 120.724 119.988 0.736 25485 12201 1 10 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.539 -0.436 25485 12202 1 10 . 1 1 74 74 GLU C C 74 176.246 176.246 174.544 1.702 25485 12203 1 10 . 1 1 74 74 GLU CA C 74 56.792 56.792 57.084 -0.292 25485 12204 1 10 . 1 1 74 74 GLU CB C 74 29.785 29.785 30.668 -0.883 25485 12205 1 10 . 1 1 74 74 GLU H H 74 8.381 8.381 8.653 -0.272 25485 12206 1 10 . 1 1 75 75 TYR N N 75 121.473 121.473 121.280 0.193 25485 12207 1 10 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.570 -0.125 25485 12208 1 10 . 1 1 75 75 TYR C C 75 175.633 175.633 174.641 0.992 25485 12209 1 10 . 1 1 75 75 TYR CA C 75 58.327 58.327 57.313 1.014 25485 12210 1 10 . 1 1 75 75 TYR CB C 75 38.413 38.413 40.704 -2.291 25485 12211 1 10 . 1 1 75 75 TYR H H 75 8.065 8.065 8.148 -0.083 25485 12212 1 10 . 1 1 76 76 SER N N 76 117.860 117.860 117.738 0.122 25485 12213 1 10 . 1 1 76 76 SER HA H 76 3.886 3.886 4.732 -0.846 25485 12214 1 10 . 1 1 76 76 SER C C 76 173.859 173.859 174.598 -0.739 25485 12215 1 10 . 1 1 76 76 SER CA C 76 58.250 58.250 58.050 0.200 25485 12216 1 10 . 1 1 76 76 SER CB C 76 64.117 64.117 64.397 -0.280 25485 12217 1 10 . 1 1 76 76 SER H H 76 7.748 7.748 8.731 -0.983 25485 12218 1 10 . 1 1 77 77 LEU N N 77 123.789 123.789 119.323 4.466 25485 12219 1 10 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.021 0.125 25485 12220 1 10 . 1 1 77 77 LEU C C 77 176.451 176.451 175.652 0.799 25485 12221 1 10 . 1 1 77 77 LEU CA C 77 55.464 55.464 54.941 0.522 25485 12222 1 10 . 1 1 77 77 LEU CB C 77 41.957 41.957 40.706 1.251 25485 12223 1 10 . 1 1 77 77 LEU H H 77 7.979 7.979 8.555 -0.576 25485 12224 1 10 . 1 1 78 78 PHE N N 78 119.275 119.275 119.569 -0.294 25485 12225 1 10 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.385 0.491 25485 12226 1 10 . 1 1 78 78 PHE C C 78 173.844 173.844 175.145 -1.301 25485 12227 1 10 . 1 1 78 78 PHE CA C 78 55.372 55.372 56.429 -1.057 25485 12228 1 10 . 1 1 78 78 PHE CB C 78 39.164 39.164 38.958 0.207 25485 12229 1 10 . 1 1 78 78 PHE H H 78 7.827 7.827 8.153 -0.326 25485 12230 1 10 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.354 0.002 25485 12231 1 10 . 1 1 79 79 PRO C C 79 176.433 176.433 175.823 0.610 25485 12232 1 10 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.314 1.536 25485 12233 1 10 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.458 -0.766 25485 12234 1 10 . 1 1 80 80 ASN N N 80 118.057 118.057 119.362 -1.305 25485 12235 1 10 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.565 0.082 25485 12236 1 10 . 1 1 80 80 ASN C C 80 174.305 174.305 174.679 -0.374 25485 12237 1 10 . 1 1 80 80 ASN CA C 80 52.860 52.860 53.718 -0.858 25485 12238 1 10 . 1 1 80 80 ASN CB C 80 39.583 39.583 37.327 2.256 25485 12239 1 10 . 1 1 80 80 ASN H H 80 8.068 8.068 8.460 -0.392 25485 12240 1 10 . 1 1 81 81 SER HA H 81 4.565 4.565 4.274 0.291 25485 12241 1 10 . 1 1 81 81 SER CA C 81 56.800 56.800 58.164 -1.364 25485 12242 1 10 . 1 1 81 81 SER CB C 81 63.128 63.128 63.170 -0.042 25485 12243 1 10 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.351 0.110 25485 12244 1 10 . 1 1 82 82 PRO C C 82 174.589 174.589 176.998 -2.409 25485 12245 1 10 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.396 -0.750 25485 12246 1 10 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.179 -0.925 25485 12247 1 10 . 1 1 83 83 LYS N N 83 114.578 114.578 118.463 -3.885 25485 12248 1 10 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.269 -0.116 25485 12249 1 10 . 1 1 83 83 LYS C C 83 175.308 175.308 177.190 -1.882 25485 12250 1 10 . 1 1 83 83 LYS CA C 83 54.407 54.407 56.122 -1.715 25485 12251 1 10 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.328 1.090 25485 12252 1 10 . 1 1 83 83 LYS H H 83 7.356 7.356 7.533 -0.177 25485 12253 1 10 . 1 1 84 84 TRP N N 84 122.455 122.455 120.607 1.848 25485 12254 1 10 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.629 -0.609 25485 12255 1 10 . 1 1 84 84 TRP C C 84 177.636 177.636 177.623 0.013 25485 12256 1 10 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.675 -1.204 25485 12257 1 10 . 1 1 84 84 TRP CB C 84 30.318 30.318 30.062 0.256 25485 12258 1 10 . 1 1 84 84 TRP H H 84 8.050 8.050 8.194 -0.144 25485 12259 1 10 . 1 1 85 85 THR N N 85 113.501 113.501 115.594 -2.093 25485 12260 1 10 . 1 1 85 85 THR HA H 85 4.573 4.573 4.470 0.103 25485 12261 1 10 . 1 1 85 85 THR C C 85 174.757 174.757 175.024 -0.267 25485 12262 1 10 . 1 1 85 85 THR CA C 85 62.130 62.130 62.369 -0.239 25485 12263 1 10 . 1 1 85 85 THR CB C 85 69.107 69.107 69.643 -0.536 25485 12264 1 10 . 1 1 85 85 THR H H 85 8.861 8.861 8.659 0.202 25485 12265 1 10 . 1 1 86 86 SER N N 86 117.270 117.270 119.575 -2.305 25485 12266 1 10 . 1 1 86 86 SER HA H 86 4.741 4.741 4.429 0.312 25485 12267 1 10 . 1 1 86 86 SER C C 86 173.457 173.457 174.735 -1.278 25485 12268 1 10 . 1 1 86 86 SER CA C 86 56.739 56.739 58.661 -1.922 25485 12269 1 10 . 1 1 86 86 SER CB C 86 64.717 64.717 64.227 0.490 25485 12270 1 10 . 1 1 86 86 SER H H 86 7.743 7.743 8.236 -0.493 25485 12271 1 10 . 1 1 87 87 LYS N N 87 120.329 120.329 120.266 0.063 25485 12272 1 10 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.319 -0.090 25485 12273 1 10 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.505 0.087 25485 12274 1 10 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.900 -0.777 25485 12275 1 10 . 1 1 87 87 LYS H H 87 8.285 8.285 8.456 -0.171 25485 12276 1 10 . 1 1 88 88 VAL N N 88 117.531 117.531 116.749 0.782 25485 12277 1 10 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.772 -0.117 25485 12278 1 10 . 1 1 88 88 VAL C C 88 174.868 174.868 174.197 0.671 25485 12279 1 10 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.475 -0.380 25485 12280 1 10 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.387 -1.692 25485 12281 1 10 . 1 1 88 88 VAL H H 88 7.428 7.428 7.338 0.090 25485 12282 1 10 . 1 1 89 89 VAL N N 89 131.452 131.452 126.028 5.424 25485 12283 1 10 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.210 -0.051 25485 12284 1 10 . 1 1 89 89 VAL C C 89 175.758 175.758 174.781 0.977 25485 12285 1 10 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.364 0.357 25485 12286 1 10 . 1 1 89 89 VAL CB C 89 34.173 34.173 35.089 -0.916 25485 12287 1 10 . 1 1 89 89 VAL H H 89 8.603 8.603 8.707 -0.104 25485 12288 1 10 . 1 1 90 90 THR N N 90 118.206 118.206 114.933 3.273 25485 12289 1 10 . 1 1 90 90 THR HA H 90 5.649 5.649 5.453 0.196 25485 12290 1 10 . 1 1 90 90 THR C C 90 174.579 174.579 173.700 0.879 25485 12291 1 10 . 1 1 90 90 THR CA C 90 58.959 58.959 59.171 -0.212 25485 12292 1 10 . 1 1 90 90 THR CB C 90 72.288 72.288 72.121 0.167 25485 12293 1 10 . 1 1 90 90 THR H H 90 9.021 9.021 8.240 0.781 25485 12294 1 10 . 1 1 91 91 TYR N N 91 118.117 118.117 115.556 2.561 25485 12295 1 10 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.338 0.360 25485 12296 1 10 . 1 1 91 91 TYR C C 91 171.233 171.233 172.633 -1.400 25485 12297 1 10 . 1 1 91 91 TYR CA C 91 55.432 55.432 56.031 -0.599 25485 12298 1 10 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.004 1.256 25485 12299 1 10 . 1 1 91 91 TYR H H 91 8.555 8.555 7.993 0.562 25485 12300 1 10 . 1 1 92 92 ARG N N 92 120.252 120.252 119.905 0.347 25485 12301 1 10 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.584 0.113 25485 12302 1 10 . 1 1 92 92 ARG C C 92 173.932 173.932 174.360 -0.428 25485 12303 1 10 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.445 0.396 25485 12304 1 10 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.678 0.008 25485 12305 1 10 . 1 1 92 92 ARG H H 92 8.520 8.520 8.779 -0.259 25485 12306 1 10 . 1 1 93 93 ILE N N 93 128.305 128.305 126.550 1.755 25485 12307 1 10 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.391 0.241 25485 12308 1 10 . 1 1 93 93 ILE C C 93 175.468 175.468 176.619 -1.151 25485 12309 1 10 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.466 0.762 25485 12310 1 10 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.683 0.542 25485 12311 1 10 . 1 1 93 93 ILE H H 93 8.886 8.886 8.703 0.183 25485 12312 1 10 . 1 1 94 94 VAL N N 94 126.647 126.647 128.162 -1.515 25485 12313 1 10 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.081 -0.085 25485 12314 1 10 . 1 1 94 94 VAL C C 94 175.670 175.670 176.336 -0.666 25485 12315 1 10 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.130 -0.716 25485 12316 1 10 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.663 0.356 25485 12317 1 10 . 1 1 94 94 VAL H H 94 9.517 9.517 8.910 0.607 25485 12318 1 10 . 1 1 95 95 SER N N 95 113.398 113.398 112.508 0.890 25485 12319 1 10 . 1 1 95 95 SER HA H 95 4.701 4.701 4.689 0.012 25485 12320 1 10 . 1 1 95 95 SER C C 95 170.684 170.684 172.722 -2.038 25485 12321 1 10 . 1 1 95 95 SER CA C 95 56.945 56.945 57.091 -0.146 25485 12322 1 10 . 1 1 95 95 SER CB C 95 65.276 65.276 64.364 0.912 25485 12323 1 10 . 1 1 95 95 SER H H 95 7.463 7.463 7.618 -0.155 25485 12324 1 10 . 1 1 96 96 TYR N N 96 116.512 116.512 120.888 -4.376 25485 12325 1 10 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.899 -0.635 25485 12326 1 10 . 1 1 96 96 TYR C C 96 174.856 174.856 174.472 0.384 25485 12327 1 10 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.514 2.123 25485 12328 1 10 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.920 1.242 25485 12329 1 10 . 1 1 96 96 TYR H H 96 8.240 8.240 8.234 0.006 25485 12330 1 10 . 1 1 97 97 THR CA C 97 57.798 57.798 61.209 -3.411 25485 12331 1 10 . 1 1 97 97 THR CB C 97 67.420 67.420 69.726 -2.306 25485 12332 1 10 . 1 1 98 98 ARG N N 98 128.156 128.156 124.931 3.225 25485 12333 1 10 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.176 0.149 25485 12334 1 10 . 1 1 98 98 ARG C C 98 177.625 177.625 176.665 0.960 25485 12335 1 10 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.663 -1.449 25485 12336 1 10 . 1 1 98 98 ARG CB C 98 29.480 29.480 30.022 -0.542 25485 12337 1 10 . 1 1 98 98 ARG H H 98 8.914 8.914 8.738 0.176 25485 12338 1 10 . 1 1 99 99 ASP N N 99 120.592 120.592 116.775 3.817 25485 12339 1 10 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.605 -0.224 25485 12340 1 10 . 1 1 99 99 ASP C C 99 175.679 175.679 174.965 0.714 25485 12341 1 10 . 1 1 99 99 ASP CA C 99 56.436 56.436 55.007 1.429 25485 12342 1 10 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.469 0.900 25485 12343 1 10 . 1 1 99 99 ASP H H 99 8.708 8.708 8.056 0.652 25485 12344 1 10 . 1 1 100 100 LEU N N 100 116.829 116.829 118.795 -1.966 25485 12345 1 10 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.695 0.261 25485 12346 1 10 . 1 1 100 100 LEU C C 100 173.335 173.335 174.153 -0.818 25485 12347 1 10 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.867 -0.830 25485 12348 1 10 . 1 1 100 100 LEU CB C 100 46.267 46.267 45.128 1.139 25485 12349 1 10 . 1 1 100 100 LEU H H 100 6.916 6.916 7.562 -0.646 25485 12350 1 10 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.110 0.065 25485 12351 1 10 . 1 1 102 102 HIS C C 102 177.649 177.649 177.529 0.120 25485 12352 1 10 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.361 -0.688 25485 12353 1 10 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.026 -1.592 25485 12354 1 10 . 1 1 103 103 ILE N N 103 115.170 115.170 117.866 -2.696 25485 12355 1 10 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.844 0.329 25485 12356 1 10 . 1 1 103 103 ILE C C 103 177.214 177.214 177.073 0.141 25485 12357 1 10 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.485 -1.320 25485 12358 1 10 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.760 0.006 25485 12359 1 10 . 1 1 103 103 ILE H H 103 8.234 8.234 8.111 0.123 25485 12360 1 10 . 1 1 104 104 THR N N 104 119.374 119.374 117.308 2.066 25485 12361 1 10 . 1 1 104 104 THR HA H 104 4.045 4.045 4.022 0.023 25485 12362 1 10 . 1 1 104 104 THR C C 104 175.612 175.612 176.485 -0.873 25485 12363 1 10 . 1 1 104 104 THR CA C 104 66.568 66.568 67.284 -0.716 25485 12364 1 10 . 1 1 104 104 THR CB C 104 68.077 68.077 68.561 -0.484 25485 12365 1 10 . 1 1 104 104 THR H H 104 6.947 6.947 7.692 -0.745 25485 12366 1 10 . 1 1 105 105 VAL N N 105 123.263 123.263 121.475 1.788 25485 12367 1 10 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.044 0.394 25485 12368 1 10 . 1 1 105 105 VAL C C 105 177.322 177.322 177.024 0.298 25485 12369 1 10 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.522 0.425 25485 12370 1 10 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.499 -0.230 25485 12371 1 10 . 1 1 105 105 VAL H H 105 7.407 7.407 8.140 -0.733 25485 12372 1 10 . 1 1 106 106 ASP N N 106 119.972 119.972 119.442 0.530 25485 12373 1 10 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.439 -0.117 25485 12374 1 10 . 1 1 106 106 ASP C C 106 179.747 179.747 178.342 1.405 25485 12375 1 10 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.390 0.845 25485 12376 1 10 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.861 -0.499 25485 12377 1 10 . 1 1 106 106 ASP H H 106 8.627 8.627 8.064 0.563 25485 12378 1 10 . 1 1 107 107 ARG N N 107 121.033 121.033 118.474 2.559 25485 12379 1 10 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.114 0.064 25485 12380 1 10 . 1 1 107 107 ARG C C 107 179.485 179.485 178.538 0.947 25485 12381 1 10 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.944 0.636 25485 12382 1 10 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.758 0.450 25485 12383 1 10 . 1 1 107 107 ARG H H 107 8.356 8.356 7.847 0.509 25485 12384 1 10 . 1 1 108 108 LEU N N 108 121.463 121.463 121.096 0.367 25485 12385 1 10 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.154 0.151 25485 12386 1 10 . 1 1 108 108 LEU C C 108 178.852 178.852 178.904 -0.052 25485 12387 1 10 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.570 0.312 25485 12388 1 10 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.490 -0.175 25485 12389 1 10 . 1 1 108 108 LEU H H 108 8.790 8.790 7.831 0.959 25485 12390 1 10 . 1 1 109 109 VAL N N 109 120.233 120.233 116.030 4.203 25485 12391 1 10 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.662 -0.262 25485 12392 1 10 . 1 1 109 109 VAL C C 109 177.019 177.019 177.648 -0.629 25485 12393 1 10 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.914 1.132 25485 12394 1 10 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.219 -0.030 25485 12395 1 10 . 1 1 109 109 VAL H H 109 8.787 8.787 7.982 0.805 25485 12396 1 10 . 1 1 110 110 SER N N 110 112.862 112.862 116.274 -3.412 25485 12397 1 10 . 1 1 110 110 SER HA H 110 4.300 4.300 4.117 0.183 25485 12398 1 10 . 1 1 110 110 SER C C 110 176.770 176.770 176.873 -0.103 25485 12399 1 10 . 1 1 110 110 SER CA C 110 61.744 61.744 61.709 0.035 25485 12400 1 10 . 1 1 110 110 SER CB C 110 62.742 62.742 62.861 -0.119 25485 12401 1 10 . 1 1 110 110 SER H H 110 7.605 7.605 7.896 -0.291 25485 12402 1 10 . 1 1 111 111 LYS N N 111 122.319 122.319 121.869 0.450 25485 12403 1 10 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.060 0.001 25485 12404 1 10 . 1 1 111 111 LYS C C 111 178.309 178.309 177.772 0.537 25485 12405 1 10 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.263 0.551 25485 12406 1 10 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.480 0.029 25485 12407 1 10 . 1 1 111 111 LYS H H 111 8.156 8.156 7.913 0.243 25485 12408 1 10 . 1 1 112 112 ALA N N 112 124.147 124.147 119.524 4.623 25485 12409 1 10 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.385 -0.286 25485 12410 1 10 . 1 1 112 112 ALA C C 112 179.445 179.445 179.043 0.402 25485 12411 1 10 . 1 1 112 112 ALA CA C 112 55.226 55.226 53.897 1.329 25485 12412 1 10 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.497 0.477 25485 12413 1 10 . 1 1 112 112 ALA H H 112 8.278 8.278 7.335 0.943 25485 12414 1 10 . 1 1 113 113 LEU N N 113 116.195 116.195 120.771 -4.576 25485 12415 1 10 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.141 -0.390 25485 12416 1 10 . 1 1 113 113 LEU C C 113 179.537 179.537 177.978 1.559 25485 12417 1 10 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.169 -0.425 25485 12418 1 10 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.999 -1.444 25485 12419 1 10 . 1 1 113 113 LEU H H 113 8.021 8.021 8.652 -0.631 25485 12420 1 10 . 1 1 114 114 ASN N N 114 116.570 116.570 117.709 -1.139 25485 12421 1 10 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.492 0.054 25485 12422 1 10 . 1 1 114 114 ASN C C 114 177.136 177.136 177.429 -0.293 25485 12423 1 10 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.527 -0.763 25485 12424 1 10 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.492 0.131 25485 12425 1 10 . 1 1 114 114 ASN H H 114 8.212 8.212 8.335 -0.123 25485 12426 1 10 . 1 1 115 115 MET N N 115 122.055 122.055 119.705 2.350 25485 12427 1 10 . 1 1 115 115 MET HA H 115 4.010 4.010 4.060 -0.050 25485 12428 1 10 . 1 1 115 115 MET C C 115 177.681 177.681 178.281 -0.600 25485 12429 1 10 . 1 1 115 115 MET CA C 115 59.445 59.445 58.896 0.549 25485 12430 1 10 . 1 1 115 115 MET CB C 115 31.616 31.616 32.413 -0.797 25485 12431 1 10 . 1 1 115 115 MET H H 115 7.937 7.937 7.878 0.059 25485 12432 1 10 . 1 1 116 116 TRP N N 116 117.115 117.115 118.658 -1.543 25485 12433 1 10 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.297 0.221 25485 12434 1 10 . 1 1 116 116 TRP C C 116 179.054 179.054 178.488 0.566 25485 12435 1 10 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.116 0.395 25485 12436 1 10 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.628 1.245 25485 12437 1 10 . 1 1 116 116 TRP H H 116 6.783 6.783 7.531 -0.748 25485 12438 1 10 . 1 1 117 117 GLY N N 117 104.511 104.511 105.475 -0.964 25485 12439 1 10 . 1 1 117 117 GLY C C 117 175.035 175.035 175.104 -0.069 25485 12440 1 10 . 1 1 117 117 GLY CA C 117 46.997 46.997 45.713 1.284 25485 12441 1 10 . 1 1 117 117 GLY H H 117 9.302 9.302 7.978 1.324 25485 12442 1 10 . 1 1 118 118 LYS N N 118 118.580 118.580 119.489 -0.909 25485 12443 1 10 . 1 1 118 118 LYS HA H 118 4.207 4.207 3.950 0.257 25485 12444 1 10 . 1 1 118 118 LYS C C 118 177.235 177.235 177.005 0.230 25485 12445 1 10 . 1 1 118 118 LYS CA C 118 57.891 57.891 58.231 -0.340 25485 12446 1 10 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.190 -0.285 25485 12447 1 10 . 1 1 118 118 LYS H H 118 7.940 7.940 7.997 -0.057 25485 12448 1 10 . 1 1 119 119 GLU N N 119 113.749 113.749 118.067 -4.318 25485 12449 1 10 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.313 0.525 25485 12450 1 10 . 1 1 119 119 GLU C C 119 178.024 178.024 175.624 2.400 25485 12451 1 10 . 1 1 119 119 GLU CA C 119 55.275 55.275 56.147 -0.872 25485 12452 1 10 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.627 1.059 25485 12453 1 10 . 1 1 119 119 GLU H H 119 7.763 7.763 7.545 0.218 25485 12454 1 10 . 1 1 120 120 ILE N N 120 111.144 111.144 111.855 -0.711 25485 12455 1 10 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.671 0.700 25485 12456 1 10 . 1 1 120 120 ILE C C 120 174.033 174.033 173.505 0.528 25485 12457 1 10 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.198 1.256 25485 12458 1 10 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.967 1.962 25485 12459 1 10 . 1 1 120 120 ILE H H 120 7.518 7.518 7.477 0.041 25485 12460 1 10 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.399 0.263 25485 12461 1 10 . 1 1 121 121 PRO C C 121 174.784 174.784 176.918 -2.134 25485 12462 1 10 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.296 -1.281 25485 12463 1 10 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.837 -2.452 25485 12464 1 10 . 1 1 122 122 LEU N N 122 121.531 121.531 118.980 2.551 25485 12465 1 10 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.285 0.054 25485 12466 1 10 . 1 1 122 122 LEU C C 122 173.977 173.977 176.297 -2.320 25485 12467 1 10 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.554 -0.996 25485 12468 1 10 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.776 2.623 25485 12469 1 10 . 1 1 122 122 LEU H H 122 6.847 6.847 7.508 -0.661 25485 12470 1 10 . 1 1 123 123 HIS N N 123 121.054 121.054 116.350 4.704 25485 12471 1 10 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.701 -0.094 25485 12472 1 10 . 1 1 123 123 HIS C C 123 172.820 172.820 173.405 -0.585 25485 12473 1 10 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.075 -0.566 25485 12474 1 10 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.598 0.512 25485 12475 1 10 . 1 1 123 123 HIS H H 123 7.760 7.760 8.492 -0.732 25485 12476 1 10 . 1 1 124 124 PHE N N 124 120.465 120.465 124.505 -4.040 25485 12477 1 10 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.413 0.421 25485 12478 1 10 . 1 1 124 124 PHE C C 124 175.677 175.677 175.671 0.006 25485 12479 1 10 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.315 0.977 25485 12480 1 10 . 1 1 124 124 PHE CB C 124 41.822 41.822 40.965 0.857 25485 12481 1 10 . 1 1 124 124 PHE H H 124 8.306 8.306 8.643 -0.337 25485 12482 1 10 . 1 1 125 125 ARG N N 125 124.008 124.008 123.970 0.038 25485 12483 1 10 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.798 -0.087 25485 12484 1 10 . 1 1 125 125 ARG C C 125 172.901 172.901 175.481 -2.580 25485 12485 1 10 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.748 -0.474 25485 12486 1 10 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.078 -0.256 25485 12487 1 10 . 1 1 125 125 ARG H H 125 8.426 8.426 8.970 -0.544 25485 12488 1 10 . 1 1 126 126 LYS N N 126 130.004 130.004 123.868 6.136 25485 12489 1 10 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.184 -0.801 25485 12490 1 10 . 1 1 126 126 LYS C C 126 176.126 176.126 175.885 0.241 25485 12491 1 10 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.660 0.521 25485 12492 1 10 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.773 -0.746 25485 12493 1 10 . 1 1 126 126 LYS H H 126 8.481 8.481 8.597 -0.116 25485 12494 1 10 . 1 1 127 127 VAL N N 127 125.288 125.288 119.762 5.526 25485 12495 1 10 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.193 0.312 25485 12496 1 10 . 1 1 127 127 VAL C C 127 175.565 175.565 174.838 0.727 25485 12497 1 10 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.863 -1.914 25485 12498 1 10 . 1 1 127 127 VAL CB C 127 34.362 34.362 31.964 2.398 25485 12499 1 10 . 1 1 127 127 VAL H H 127 8.721 8.721 8.110 0.611 25485 12500 1 10 . 1 1 128 128 VAL N N 128 117.467 117.467 119.486 -2.019 25485 12501 1 10 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.051 0.278 25485 12502 1 10 . 1 1 128 128 VAL C C 128 174.622 174.622 175.306 -0.684 25485 12503 1 10 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.457 0.661 25485 12504 1 10 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.411 0.099 25485 12505 1 10 . 1 1 128 128 VAL H H 128 8.406 8.406 7.973 0.433 25485 12506 1 10 . 1 1 129 129 TRP N N 129 119.986 119.986 121.548 -1.562 25485 12507 1 10 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.869 -0.153 25485 12508 1 10 . 1 1 129 129 TRP C C 129 174.536 174.536 176.582 -2.046 25485 12509 1 10 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.594 -0.677 25485 12510 1 10 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.371 2.643 25485 12511 1 10 . 1 1 129 129 TRP H H 129 7.435 7.435 7.267 0.168 25485 12512 1 10 . 1 1 130 130 GLY N N 130 109.900 109.900 112.670 -2.770 25485 12513 1 10 . 1 1 130 130 GLY C C 130 173.187 173.187 173.815 -0.628 25485 12514 1 10 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.222 0.258 25485 12515 1 10 . 1 1 130 130 GLY H H 130 8.006 8.006 8.220 -0.213 25485 12516 1 10 . 1 1 131 131 THR N N 131 116.142 116.142 115.021 1.121 25485 12517 1 10 . 1 1 131 131 THR HA H 131 4.162 4.162 4.555 -0.393 25485 12518 1 10 . 1 1 131 131 THR C C 131 172.766 172.766 173.541 -0.775 25485 12519 1 10 . 1 1 131 131 THR CA C 131 63.212 63.212 61.527 1.685 25485 12520 1 10 . 1 1 131 131 THR CB C 131 69.308 69.308 69.982 -0.674 25485 12521 1 10 . 1 1 131 131 THR H H 131 8.233 8.233 8.250 -0.017 25485 12522 1 10 . 1 1 132 132 ALA N N 132 129.807 129.807 123.948 5.859 25485 12523 1 10 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.512 0.004 25485 12524 1 10 . 1 1 132 132 ALA C C 132 175.358 175.358 176.606 -1.248 25485 12525 1 10 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.681 -1.315 25485 12526 1 10 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.253 1.545 25485 12527 1 10 . 1 1 132 132 ALA H H 132 7.962 7.962 8.406 -0.444 25485 12528 1 10 . 1 1 133 133 ASP N N 133 122.896 122.896 119.040 3.856 25485 12529 1 10 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.642 -0.221 25485 12530 1 10 . 1 1 133 133 ASP C C 133 177.314 177.314 176.869 0.445 25485 12531 1 10 . 1 1 133 133 ASP CA C 133 57.919 57.919 57.032 0.887 25485 12532 1 10 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.817 -1.346 25485 12533 1 10 . 1 1 133 133 ASP H H 133 8.251 8.251 8.207 0.044 25485 12534 1 10 . 1 1 134 134 ILE N N 134 125.472 125.472 121.283 4.189 25485 12535 1 10 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.358 -0.215 25485 12536 1 10 . 1 1 134 134 ILE C C 134 174.201 174.201 174.938 -0.737 25485 12537 1 10 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.434 -0.163 25485 12538 1 10 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.012 -0.302 25485 12539 1 10 . 1 1 134 134 ILE H H 134 8.802 8.802 7.655 1.147 25485 12540 1 10 . 1 1 135 135 MET N N 135 127.265 127.265 126.746 0.519 25485 12541 1 10 . 1 1 135 135 MET HA H 135 5.192 5.192 5.189 0.003 25485 12542 1 10 . 1 1 135 135 MET C C 135 176.206 176.206 175.570 0.636 25485 12543 1 10 . 1 1 135 135 MET CA C 135 53.626 53.626 53.101 0.525 25485 12544 1 10 . 1 1 135 135 MET CB C 135 32.639 32.639 33.806 -1.167 25485 12545 1 10 . 1 1 135 135 MET H H 135 7.418 7.418 9.056 -1.638 25485 12546 1 10 . 1 1 136 136 ILE N N 136 125.440 125.440 124.464 0.976 25485 12547 1 10 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.916 0.673 25485 12548 1 10 . 1 1 136 136 ILE C C 136 175.190 175.190 175.665 -0.475 25485 12549 1 10 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.957 1.151 25485 12550 1 10 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.566 4.374 25485 12551 1 10 . 1 1 136 136 ILE H H 136 9.124 9.124 9.106 0.018 25485 12552 1 10 . 1 1 137 137 GLY N N 137 112.211 112.211 114.731 -2.520 25485 12553 1 10 . 1 1 137 137 GLY C C 137 170.855 170.855 172.238 -1.383 25485 12554 1 10 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.436 0.969 25485 12555 1 10 . 1 1 137 137 GLY H H 137 8.594 8.594 8.212 0.382 25485 12556 1 10 . 1 1 138 138 PHE N N 138 119.463 119.463 118.598 0.865 25485 12557 1 10 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.616 -0.120 25485 12558 1 10 . 1 1 138 138 PHE C C 138 175.186 175.186 173.738 1.448 25485 12559 1 10 . 1 1 138 138 PHE CA C 138 55.995 55.995 54.393 1.602 25485 12560 1 10 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.190 0.252 25485 12561 1 10 . 1 1 138 138 PHE H H 138 7.857 7.857 8.230 -0.373 25485 12562 1 10 . 1 1 139 139 ALA N N 139 123.914 123.914 125.517 -1.603 25485 12563 1 10 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.598 0.133 25485 12564 1 10 . 1 1 139 139 ALA C C 139 174.613 174.613 175.754 -1.141 25485 12565 1 10 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.233 -1.198 25485 12566 1 10 . 1 1 139 139 ALA CB C 139 22.472 22.472 21.174 1.298 25485 12567 1 10 . 1 1 139 139 ALA H H 139 8.955 8.955 9.165 -0.210 25485 12568 1 10 . 1 1 140 140 ARG N N 140 118.339 118.339 120.458 -2.119 25485 12569 1 10 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.948 0.158 25485 12570 1 10 . 1 1 140 140 ARG C C 140 176.201 176.201 178.264 -2.063 25485 12571 1 10 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.786 -0.620 25485 12572 1 10 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.698 0.771 25485 12573 1 10 . 1 1 140 140 ARG H H 140 8.546 8.546 8.551 -0.005 25485 12574 1 10 . 1 1 141 141 GLY N N 141 108.916 108.916 109.591 -0.675 25485 12575 1 10 . 1 1 141 141 GLY C C 141 175.595 175.595 175.305 0.290 25485 12576 1 10 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.391 -1.101 25485 12577 1 10 . 1 1 141 141 GLY H H 141 8.989 8.989 9.327 -0.338 25485 12578 1 10 . 1 1 142 142 ALA N N 142 121.448 121.448 121.992 -0.544 25485 12579 1 10 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.320 0.088 25485 12580 1 10 . 1 1 142 142 ALA C C 142 177.027 177.027 177.741 -0.714 25485 12581 1 10 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.843 0.434 25485 12582 1 10 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.147 -0.183 25485 12583 1 10 . 1 1 142 142 ALA H H 142 8.642 8.642 8.261 0.381 25485 12584 1 10 . 1 1 143 143 HIS N N 143 120.356 120.356 114.813 5.543 25485 12585 1 10 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.514 0.643 25485 12586 1 10 . 1 1 143 143 HIS C C 143 174.303 174.303 176.222 -1.919 25485 12587 1 10 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.809 -0.356 25485 12588 1 10 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.644 -1.853 25485 12589 1 10 . 1 1 143 143 HIS H H 143 8.990 8.990 8.123 0.867 25485 12590 1 10 . 1 1 144 144 GLY N N 144 112.517 112.517 107.111 5.406 25485 12591 1 10 . 1 1 144 144 GLY C C 144 173.758 173.758 173.361 0.397 25485 12592 1 10 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.700 1.395 25485 12593 1 10 . 1 1 144 144 GLY H H 144 5.175 5.175 7.531 -2.356 25485 12594 1 10 . 1 1 145 145 ASP N N 145 117.762 117.762 119.408 -1.646 25485 12595 1 10 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.893 -0.195 25485 12596 1 10 . 1 1 145 145 ASP C C 145 175.851 175.851 175.237 0.614 25485 12597 1 10 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.941 -0.982 25485 12598 1 10 . 1 1 145 145 ASP CB C 145 41.799 41.799 43.965 -2.166 25485 12599 1 10 . 1 1 145 145 ASP H H 145 7.096 7.096 7.538 -0.442 25485 12600 1 10 . 1 1 146 146 SER N N 146 125.540 125.540 116.187 9.353 25485 12601 1 10 . 1 1 146 146 SER HA H 146 4.204 4.204 4.487 -0.283 25485 12602 1 10 . 1 1 146 146 SER C C 146 172.319 172.319 174.019 -1.700 25485 12603 1 10 . 1 1 146 146 SER CA C 146 58.862 58.862 58.192 0.670 25485 12604 1 10 . 1 1 146 146 SER CB C 146 62.933 62.933 63.881 -0.948 25485 12605 1 10 . 1 1 146 146 SER H H 146 8.261 8.261 8.280 -0.019 25485 12606 1 10 . 1 1 147 147 TYR N N 147 120.757 120.757 120.692 0.065 25485 12607 1 10 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.336 0.486 25485 12608 1 10 . 1 1 147 147 TYR C C 147 170.372 170.372 173.602 -3.230 25485 12609 1 10 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.111 -3.843 25485 12610 1 10 . 1 1 147 147 TYR CB C 147 38.296 38.296 38.505 -0.209 25485 12611 1 10 . 1 1 147 147 TYR H H 147 7.450 7.450 8.365 -0.915 25485 12612 1 10 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.507 0.365 25485 12613 1 10 . 1 1 148 148 PRO C C 148 179.009 179.009 175.931 3.078 25485 12614 1 10 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.569 0.806 25485 12615 1 10 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.257 -1.348 25485 12616 1 10 . 1 1 149 149 PHE N N 149 120.514 120.514 122.560 -2.046 25485 12617 1 10 . 1 1 149 149 PHE C C 149 176.813 176.813 176.059 0.754 25485 12618 1 10 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.035 -0.583 25485 12619 1 10 . 1 1 149 149 PHE CB C 149 38.573 38.573 39.738 -1.165 25485 12620 1 10 . 1 1 149 149 PHE H H 149 8.024 8.024 8.478 -0.454 25485 12621 1 10 . 1 1 150 150 ASP N N 150 115.555 115.555 116.394 -0.839 25485 12622 1 10 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.407 0.432 25485 12623 1 10 . 1 1 150 150 ASP C C 150 177.007 177.007 176.482 0.525 25485 12624 1 10 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.466 -0.595 25485 12625 1 10 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.594 2.342 25485 12626 1 10 . 1 1 150 150 ASP H H 150 7.511 7.511 8.497 -0.986 25485 12627 1 10 . 1 1 151 151 GLY N N 151 110.650 110.650 109.609 1.041 25485 12628 1 10 . 1 1 151 151 GLY C C 151 170.281 170.281 172.057 -1.776 25485 12629 1 10 . 1 1 151 151 GLY CA C 151 44.398 44.398 45.212 -0.814 25485 12630 1 10 . 1 1 151 151 GLY H H 151 9.080 9.080 8.168 0.912 25485 12631 1 10 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.138 -0.082 25485 12632 1 10 . 1 1 152 152 PRO C C 152 178.300 178.300 176.754 1.546 25485 12633 1 10 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.207 0.643 25485 12634 1 10 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.905 -0.645 25485 12635 1 10 . 1 1 153 153 GLY N N 153 118.783 118.783 113.232 5.551 25485 12636 1 10 . 1 1 153 153 GLY C C 153 174.098 174.098 173.196 0.902 25485 12637 1 10 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.497 -0.891 25485 12638 1 10 . 1 1 153 153 GLY H H 153 11.431 11.431 8.068 3.363 25485 12639 1 10 . 1 1 154 154 ASN N N 154 120.679 120.679 120.178 0.501 25485 12640 1 10 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.386 -0.142 25485 12641 1 10 . 1 1 154 154 ASN C C 154 174.636 174.636 175.178 -0.542 25485 12642 1 10 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.497 2.171 25485 12643 1 10 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.971 -2.000 25485 12644 1 10 . 1 1 154 154 ASN H H 154 9.247 9.247 8.397 0.850 25485 12645 1 10 . 1 1 155 155 THR N N 155 118.252 118.252 110.630 7.622 25485 12646 1 10 . 1 1 155 155 THR HA H 155 5.577 5.577 4.162 1.415 25485 12647 1 10 . 1 1 155 155 THR C C 155 176.596 176.596 173.058 3.538 25485 12648 1 10 . 1 1 155 155 THR CA C 155 61.731 61.731 63.161 -1.430 25485 12649 1 10 . 1 1 155 155 THR CB C 155 71.325 71.325 68.844 2.481 25485 12650 1 10 . 1 1 155 155 THR H H 155 9.501 9.501 8.276 1.225 25485 12651 1 10 . 1 1 156 156 LEU N N 156 122.598 122.598 124.649 -2.051 25485 12652 1 10 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.571 0.300 25485 12653 1 10 . 1 1 156 156 LEU C C 156 175.655 175.655 175.439 0.216 25485 12654 1 10 . 1 1 156 156 LEU CA C 156 55.538 55.538 55.238 0.300 25485 12655 1 10 . 1 1 156 156 LEU CB C 156 44.511 44.511 44.309 0.202 25485 12656 1 10 . 1 1 156 156 LEU H H 156 8.492 8.492 8.801 -0.309 25485 12657 1 10 . 1 1 157 157 ALA N N 157 115.389 115.389 115.515 -0.126 25485 12658 1 10 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.898 0.137 25485 12659 1 10 . 1 1 157 157 ALA C C 157 175.739 175.739 174.815 0.924 25485 12660 1 10 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.665 -0.726 25485 12661 1 10 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.567 1.887 25485 12662 1 10 . 1 1 157 157 ALA H H 157 7.567 7.567 7.848 -0.281 25485 12663 1 10 . 1 1 158 158 HIS N N 158 111.900 111.900 117.970 -6.070 25485 12664 1 10 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.845 -0.240 25485 12665 1 10 . 1 1 158 158 HIS C C 158 170.186 170.186 172.511 -2.325 25485 12666 1 10 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.321 1.754 25485 12667 1 10 . 1 1 158 158 HIS CB C 158 30.186 30.186 32.126 -1.940 25485 12668 1 10 . 1 1 158 158 HIS H H 158 8.757 8.757 8.111 0.646 25485 12669 1 10 . 1 1 159 159 ALA N N 159 118.286 118.286 125.891 -7.605 25485 12670 1 10 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.065 0.589 25485 12671 1 10 . 1 1 159 159 ALA C C 159 174.036 174.036 175.312 -1.276 25485 12672 1 10 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.556 0.577 25485 12673 1 10 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.616 2.421 25485 12674 1 10 . 1 1 159 159 ALA H H 159 6.110 6.110 8.326 -2.216 25485 12675 1 10 . 1 1 160 160 PHE N N 160 117.937 117.937 118.883 -0.946 25485 12676 1 10 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.802 -0.299 25485 12677 1 10 . 1 1 160 160 PHE C C 160 174.455 174.455 174.456 -0.001 25485 12678 1 10 . 1 1 160 160 PHE CA C 160 56.813 56.813 54.693 2.120 25485 12679 1 10 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.620 0.574 25485 12680 1 10 . 1 1 160 160 PHE H H 160 7.912 7.912 7.882 0.030 25485 12681 1 10 . 1 1 161 161 ALA N N 161 123.531 123.531 121.576 1.955 25485 12682 1 10 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.663 -0.172 25485 12683 1 10 . 1 1 161 161 ALA C C 161 175.503 175.503 175.664 -0.161 25485 12684 1 10 . 1 1 161 161 ALA CA C 161 50.633 50.633 48.728 1.905 25485 12685 1 10 . 1 1 161 161 ALA CB C 161 16.556 16.556 20.100 -3.544 25485 12686 1 10 . 1 1 161 161 ALA H H 161 8.107 8.107 8.410 -0.303 25485 12687 1 10 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.838 -0.928 25485 12688 1 10 . 1 1 162 162 PRO C C 162 173.465 173.465 175.749 -2.284 25485 12689 1 10 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.355 1.902 25485 12690 1 10 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.531 1.711 25485 12691 1 10 . 1 1 163 163 GLY N N 163 107.206 107.206 110.019 -2.813 25485 12692 1 10 . 1 1 163 163 GLY C C 163 172.092 172.092 173.416 -1.324 25485 12693 1 10 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.951 -0.958 25485 12694 1 10 . 1 1 163 163 GLY H H 163 5.997 5.997 7.644 -1.647 25485 12695 1 10 . 1 1 165 165 GLY N N 165 103.110 103.110 108.133 -5.023 25485 12696 1 10 . 1 1 165 165 GLY C C 165 177.158 177.158 174.060 3.098 25485 12697 1 10 . 1 1 165 165 GLY CA C 165 44.243 44.243 44.914 -0.671 25485 12698 1 10 . 1 1 165 165 GLY H H 165 9.145 9.145 8.012 1.133 25485 12699 1 10 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.211 -0.032 25485 12700 1 10 . 1 1 166 166 LEU C C 166 176.437 176.437 177.503 -1.066 25485 12701 1 10 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.183 0.017 25485 12702 1 10 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.279 -0.445 25485 12703 1 10 . 1 1 167 167 GLY N N 167 103.318 103.318 103.967 -0.649 25485 12704 1 10 . 1 1 167 167 GLY C C 167 174.803 174.803 175.023 -0.220 25485 12705 1 10 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.717 2.516 25485 12706 1 10 . 1 1 167 167 GLY H H 167 7.768 7.768 7.448 0.320 25485 12707 1 10 . 1 1 168 168 GLY N N 168 121.051 121.051 107.048 14.003 25485 12708 1 10 . 1 1 168 168 GLY C C 168 172.122 172.122 173.938 -1.816 25485 12709 1 10 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.393 1.209 25485 12710 1 10 . 1 1 168 168 GLY H H 168 7.698 7.698 8.200 -0.502 25485 12711 1 10 . 1 1 169 169 ASP N N 169 123.641 123.641 120.030 3.611 25485 12712 1 10 . 1 1 169 169 ASP C C 169 173.942 173.942 173.875 0.067 25485 12713 1 10 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.417 2.425 25485 12714 1 10 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.668 -2.798 25485 12715 1 10 . 1 1 169 169 ASP H H 169 8.595 8.595 7.804 0.791 25485 12716 1 10 . 1 1 170 170 ALA N N 170 119.366 119.366 120.052 -0.686 25485 12717 1 10 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.469 0.261 25485 12718 1 10 . 1 1 170 170 ALA C C 170 174.593 174.593 175.364 -0.771 25485 12719 1 10 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.843 0.281 25485 12720 1 10 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.251 1.084 25485 12721 1 10 . 1 1 170 170 ALA H H 170 8.324 8.324 8.356 -0.032 25485 12722 1 10 . 1 1 171 171 HIS N N 171 120.239 120.239 121.485 -1.246 25485 12723 1 10 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.559 0.189 25485 12724 1 10 . 1 1 171 171 HIS C C 171 172.949 172.949 174.037 -1.088 25485 12725 1 10 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.419 -2.695 25485 12726 1 10 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.297 1.244 25485 12727 1 10 . 1 1 171 171 HIS H H 171 8.499 8.499 7.919 0.580 25485 12728 1 10 . 1 1 172 172 PHE N N 172 121.125 121.125 121.802 -0.677 25485 12729 1 10 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.638 -0.110 25485 12730 1 10 . 1 1 172 172 PHE C C 172 173.875 173.875 174.214 -0.339 25485 12731 1 10 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.693 0.227 25485 12732 1 10 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.682 0.221 25485 12733 1 10 . 1 1 172 172 PHE H H 172 8.445 8.445 8.732 -0.287 25485 12734 1 10 . 1 1 173 173 ASP N N 173 124.014 124.014 122.886 1.128 25485 12735 1 10 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.554 -0.640 25485 12736 1 10 . 1 1 173 173 ASP C C 173 178.613 178.613 177.751 0.862 25485 12737 1 10 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.255 1.543 25485 12738 1 10 . 1 1 173 173 ASP CB C 173 40.743 40.743 40.662 0.081 25485 12739 1 10 . 1 1 173 173 ASP H H 173 7.927 7.927 8.757 -0.830 25485 12740 1 10 . 1 1 174 174 GLU N N 174 132.469 132.469 126.978 5.491 25485 12741 1 10 . 1 1 174 174 GLU C C 174 176.442 176.442 177.115 -0.673 25485 12742 1 10 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.706 -1.522 25485 12743 1 10 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.261 1.024 25485 12744 1 10 . 1 1 174 174 GLU H H 174 9.528 9.528 8.532 0.996 25485 12745 1 10 . 1 1 175 175 ASP N N 175 117.394 117.394 118.667 -1.273 25485 12746 1 10 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.605 0.188 25485 12747 1 10 . 1 1 175 175 ASP C C 175 176.645 176.645 176.565 0.080 25485 12748 1 10 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.293 0.638 25485 12749 1 10 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.453 -1.312 25485 12750 1 10 . 1 1 175 175 ASP H H 175 8.768 8.768 8.466 0.302 25485 12751 1 10 . 1 1 176 176 GLU N N 176 116.493 116.493 118.129 -1.636 25485 12752 1 10 . 1 1 176 176 GLU C C 176 175.038 175.038 175.715 -0.677 25485 12753 1 10 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.263 -1.598 25485 12754 1 10 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.560 -4.337 25485 12755 1 10 . 1 1 176 176 GLU H H 176 7.159 7.159 8.088 -0.929 25485 12756 1 10 . 1 1 177 177 ARG N N 177 122.186 122.186 118.941 3.245 25485 12757 1 10 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.297 0.392 25485 12758 1 10 . 1 1 177 177 ARG C C 177 174.482 174.482 174.240 0.242 25485 12759 1 10 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.826 -1.139 25485 12760 1 10 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.340 -1.256 25485 12761 1 10 . 1 1 177 177 ARG H H 177 7.560 7.560 8.069 -0.509 25485 12762 1 10 . 1 1 178 178 TRP N N 178 129.179 129.179 124.133 5.046 25485 12763 1 10 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.486 -0.386 25485 12764 1 10 . 1 1 178 178 TRP C C 178 176.298 176.298 176.515 -0.217 25485 12765 1 10 . 1 1 178 178 TRP CA C 178 56.813 56.813 55.667 1.146 25485 12766 1 10 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.872 -0.675 25485 12767 1 10 . 1 1 178 178 TRP H H 178 8.807 8.807 8.390 0.417 25485 12768 1 10 . 1 1 179 179 THR N N 179 112.792 112.792 115.410 -2.618 25485 12769 1 10 . 1 1 179 179 THR HA H 179 4.985 4.985 4.684 0.301 25485 12770 1 10 . 1 1 179 179 THR C C 179 172.765 172.765 172.302 0.463 25485 12771 1 10 . 1 1 179 179 THR CA C 179 59.106 59.106 60.729 -1.623 25485 12772 1 10 . 1 1 179 179 THR CB C 179 71.786 71.786 70.407 1.379 25485 12773 1 10 . 1 1 179 179 THR H H 179 8.974 8.974 8.613 0.361 25485 12774 1 10 . 1 1 180 180 ASP N N 180 122.074 122.074 123.994 -1.920 25485 12775 1 10 . 1 1 180 180 ASP HA H 180 4.463 4.463 4.875 -0.412 25485 12776 1 10 . 1 1 180 180 ASP C C 180 176.366 176.366 178.406 -2.040 25485 12777 1 10 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.238 -2.195 25485 12778 1 10 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.042 -0.314 25485 12779 1 10 . 1 1 180 180 ASP H H 180 8.485 8.485 8.839 -0.354 25485 12780 1 10 . 1 1 181 181 GLY N N 181 110.123 110.123 107.564 2.559 25485 12781 1 10 . 1 1 181 181 GLY C C 181 174.325 174.325 175.461 -1.136 25485 12782 1 10 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.800 0.861 25485 12783 1 10 . 1 1 181 181 GLY H H 181 8.569 8.569 8.670 -0.101 25485 12784 1 10 . 1 1 182 182 SER N N 182 115.562 115.562 115.359 0.203 25485 12785 1 10 . 1 1 182 182 SER HA H 182 4.519 4.519 4.557 -0.038 25485 12786 1 10 . 1 1 182 182 SER C C 182 173.783 173.783 173.541 0.242 25485 12787 1 10 . 1 1 182 182 SER CA C 182 57.965 57.965 58.094 -0.129 25485 12788 1 10 . 1 1 182 182 SER CB C 182 64.166 64.166 63.968 0.198 25485 12789 1 10 . 1 1 182 182 SER H H 182 8.160 8.160 7.957 0.203 25485 12790 1 10 . 1 1 183 183 SER N N 183 117.153 117.153 115.963 1.190 25485 12791 1 10 . 1 1 183 183 SER HA H 183 4.275 4.275 4.368 -0.093 25485 12792 1 10 . 1 1 183 183 SER C C 183 173.333 173.333 174.653 -1.320 25485 12793 1 10 . 1 1 183 183 SER CA C 183 59.902 59.902 59.117 0.785 25485 12794 1 10 . 1 1 183 183 SER CB C 183 64.941 64.941 62.071 2.870 25485 12795 1 10 . 1 1 183 183 SER H H 183 7.796 7.796 7.659 0.137 25485 12796 1 10 . 1 1 184 184 LEU N N 184 122.351 122.351 122.617 -0.266 25485 12797 1 10 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.594 -0.202 25485 12798 1 10 . 1 1 184 184 LEU C C 184 176.250 176.250 176.819 -0.569 25485 12799 1 10 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.642 -0.067 25485 12800 1 10 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.247 -1.166 25485 12801 1 10 . 1 1 184 184 LEU H H 184 8.092 8.092 8.114 -0.022 25485 12802 1 10 . 1 1 185 185 GLY N N 185 108.871 108.871 107.441 1.430 25485 12803 1 10 . 1 1 185 185 GLY C C 185 172.375 172.375 173.628 -1.253 25485 12804 1 10 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.842 -0.462 25485 12805 1 10 . 1 1 185 185 GLY H H 185 7.960 7.960 7.701 0.259 25485 12806 1 10 . 1 1 186 186 ILE N N 186 123.096 123.096 123.296 -0.200 25485 12807 1 10 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.367 -0.526 25485 12808 1 10 . 1 1 186 186 ILE C C 186 175.350 175.350 175.788 -0.438 25485 12809 1 10 . 1 1 186 186 ILE CA C 186 58.401 58.401 58.669 -0.268 25485 12810 1 10 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.173 0.283 25485 12811 1 10 . 1 1 186 186 ILE H H 186 8.893 8.893 7.691 1.202 25485 12812 1 10 . 1 1 187 187 ASN N N 187 127.167 127.167 126.552 0.615 25485 12813 1 10 . 1 1 187 187 ASN HA H 187 4.353 4.353 5.104 -0.751 25485 12814 1 10 . 1 1 187 187 ASN C C 187 175.849 175.849 177.085 -1.236 25485 12815 1 10 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.091 1.623 25485 12816 1 10 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.983 0.147 25485 12817 1 10 . 1 1 187 187 ASN H H 187 8.580 8.580 8.234 0.346 25485 12818 1 10 . 1 1 188 188 PHE N N 188 129.985 129.985 126.346 3.639 25485 12819 1 10 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.278 0.295 25485 12820 1 10 . 1 1 188 188 PHE C C 188 175.578 175.578 177.428 -1.850 25485 12821 1 10 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.390 -0.662 25485 12822 1 10 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.453 -0.021 25485 12823 1 10 . 1 1 188 188 PHE H H 188 9.361 9.361 8.553 0.808 25485 12824 1 10 . 1 1 189 189 LEU N N 189 119.113 119.113 119.086 0.027 25485 12825 1 10 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.112 -0.311 25485 12826 1 10 . 1 1 189 189 LEU C C 189 179.601 179.601 178.447 1.154 25485 12827 1 10 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.383 0.126 25485 12828 1 10 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.312 -1.435 25485 12829 1 10 . 1 1 189 189 LEU H H 189 8.562 8.562 8.294 0.268 25485 12830 1 10 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.978 -0.061 25485 12831 1 10 . 1 1 190 190 TYR C C 190 177.621 177.621 177.876 -0.255 25485 12832 1 10 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.085 -0.277 25485 12833 1 10 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.829 1.940 25485 12834 1 10 . 1 1 191 191 ALA N N 191 120.352 120.352 121.299 -0.947 25485 12835 1 10 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.153 0.162 25485 12836 1 10 . 1 1 191 191 ALA C C 191 180.252 180.252 179.045 1.207 25485 12837 1 10 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.823 0.359 25485 12838 1 10 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.558 0.584 25485 12839 1 10 . 1 1 191 191 ALA H H 191 7.993 7.993 8.983 -0.990 25485 12840 1 10 . 1 1 192 192 ALA N N 192 121.409 121.409 121.248 0.161 25485 12841 1 10 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.154 -0.097 25485 12842 1 10 . 1 1 192 192 ALA C C 192 178.575 178.575 179.613 -1.038 25485 12843 1 10 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.600 -0.415 25485 12844 1 10 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.244 -2.046 25485 12845 1 10 . 1 1 192 192 ALA H H 192 9.297 9.297 8.347 0.950 25485 12846 1 10 . 1 1 193 193 THR N N 193 116.996 116.996 114.363 2.633 25485 12847 1 10 . 1 1 193 193 THR HA H 193 3.833 3.833 4.222 -0.389 25485 12848 1 10 . 1 1 193 193 THR CA C 193 69.138 69.138 67.349 1.789 25485 12849 1 10 . 1 1 193 193 THR CB C 193 67.365 67.365 68.216 -0.851 25485 12850 1 10 . 1 1 193 193 THR H H 193 8.226 8.226 7.825 0.401 25485 12851 1 10 . 1 1 194 194 HIS N N 194 120.296 120.296 121.845 -1.549 25485 12852 1 10 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.116 0.120 25485 12853 1 10 . 1 1 194 194 HIS C C 194 175.962 175.962 176.943 -0.981 25485 12854 1 10 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.520 1.227 25485 12855 1 10 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.981 -2.062 25485 12856 1 10 . 1 1 194 194 HIS H H 194 7.782 7.782 7.658 0.124 25485 12857 1 10 . 1 1 195 195 ALA N N 195 121.290 121.290 122.735 -1.445 25485 12858 1 10 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.979 0.177 25485 12859 1 10 . 1 1 195 195 ALA CA C 195 55.964 55.964 55.137 0.827 25485 12860 1 10 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.576 0.134 25485 12861 1 10 . 1 1 195 195 ALA H H 195 8.690 8.690 8.559 0.131 25485 12862 1 10 . 1 1 196 196 LEU N N 196 114.899 114.899 118.313 -3.414 25485 12863 1 10 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.090 0.080 25485 12864 1 10 . 1 1 196 196 LEU C C 196 177.946 177.946 179.416 -1.470 25485 12865 1 10 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.484 -1.256 25485 12866 1 10 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.099 -1.323 25485 12867 1 10 . 1 1 196 196 LEU H H 196 8.715 8.715 8.888 -0.173 25485 12868 1 10 . 1 1 197 197 GLY N N 197 107.901 107.901 105.035 2.866 25485 12869 1 10 . 1 1 197 197 GLY C C 197 178.641 178.641 175.828 2.813 25485 12870 1 10 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.710 0.857 25485 12871 1 10 . 1 1 197 197 GLY H H 197 7.546 7.546 8.259 -0.713 25485 12872 1 10 . 1 1 198 198 HIS N N 198 122.017 122.017 119.921 2.096 25485 12873 1 10 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.562 0.295 25485 12874 1 10 . 1 1 198 198 HIS C C 198 179.874 179.874 178.234 1.640 25485 12875 1 10 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.501 1.021 25485 12876 1 10 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.529 -1.983 25485 12877 1 10 . 1 1 198 198 HIS H H 198 7.196 7.196 7.555 -0.359 25485 12878 1 10 . 1 1 199 199 SER N N 199 118.486 118.486 115.103 3.383 25485 12879 1 10 . 1 1 199 199 SER HA H 199 4.490 4.490 4.524 -0.034 25485 12880 1 10 . 1 1 199 199 SER C C 199 174.493 174.493 175.495 -1.002 25485 12881 1 10 . 1 1 199 199 SER CA C 199 58.173 58.173 60.812 -2.639 25485 12882 1 10 . 1 1 199 199 SER CB C 199 63.589 63.589 63.147 0.442 25485 12883 1 10 . 1 1 199 199 SER H H 199 7.884 7.884 7.798 0.086 25485 12884 1 10 . 1 1 200 200 LEU N N 200 114.686 114.686 117.805 -3.119 25485 12885 1 10 . 1 1 200 200 LEU C C 200 177.720 177.720 177.205 0.515 25485 12886 1 10 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.461 0.376 25485 12887 1 10 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.910 0.447 25485 12888 1 10 . 1 1 200 200 LEU H H 200 7.108 7.108 7.016 0.092 25485 12889 1 10 . 1 1 201 201 GLY N N 201 108.363 108.363 106.422 1.941 25485 12890 1 10 . 1 1 201 201 GLY C C 201 174.008 174.008 174.924 -0.916 25485 12891 1 10 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.495 -1.081 25485 12892 1 10 . 1 1 201 201 GLY H H 201 8.195 8.195 7.691 0.504 25485 12893 1 10 . 1 1 202 202 MET N N 202 119.635 119.635 120.696 -1.061 25485 12894 1 10 . 1 1 202 202 MET HA H 202 4.473 4.473 4.503 -0.030 25485 12895 1 10 . 1 1 202 202 MET C C 202 176.593 176.593 176.076 0.517 25485 12896 1 10 . 1 1 202 202 MET CA C 202 54.500 54.500 55.003 -0.503 25485 12897 1 10 . 1 1 202 202 MET CB C 202 32.161 32.161 32.411 -0.250 25485 12898 1 10 . 1 1 202 202 MET H H 202 8.182 8.182 7.471 0.711 25485 12899 1 10 . 1 1 203 203 GLY N N 203 109.749 109.749 108.110 1.639 25485 12900 1 10 . 1 1 203 203 GLY C C 203 174.042 174.042 173.502 0.540 25485 12901 1 10 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.265 -0.261 25485 12902 1 10 . 1 1 203 203 GLY H H 203 8.405 8.405 8.287 0.118 25485 12903 1 10 . 1 1 204 204 HIS N N 204 115.732 115.732 118.219 -2.487 25485 12904 1 10 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.701 0.699 25485 12905 1 10 . 1 1 204 204 HIS C C 204 174.430 174.430 174.691 -0.261 25485 12906 1 10 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.680 -1.866 25485 12907 1 10 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.217 -0.391 25485 12908 1 10 . 1 1 204 204 HIS H H 204 8.364 8.364 8.618 -0.254 25485 12909 1 10 . 1 1 205 205 SER N N 205 115.484 115.484 116.463 -0.979 25485 12910 1 10 . 1 1 205 205 SER HA H 205 4.766 4.766 4.573 0.193 25485 12911 1 10 . 1 1 205 205 SER C C 205 173.611 173.611 174.942 -1.331 25485 12912 1 10 . 1 1 205 205 SER CA C 205 54.729 54.729 57.612 -2.883 25485 12913 1 10 . 1 1 205 205 SER CB C 205 65.855 65.855 65.266 0.589 25485 12914 1 10 . 1 1 205 205 SER H H 205 7.231 7.231 8.402 -1.171 25485 12915 1 10 . 1 1 206 206 SER N N 206 119.263 119.263 118.148 1.115 25485 12916 1 10 . 1 1 206 206 SER HA H 206 3.701 3.701 4.939 -1.238 25485 12917 1 10 . 1 1 206 206 SER C C 206 173.635 173.635 175.110 -1.475 25485 12918 1 10 . 1 1 206 206 SER CA C 206 63.846 63.846 59.704 4.142 25485 12919 1 10 . 1 1 206 206 SER CB C 206 63.764 63.764 63.805 -0.041 25485 12920 1 10 . 1 1 206 206 SER H H 206 8.289 8.289 9.023 -0.734 25485 12921 1 10 . 1 1 207 207 ASP N N 207 126.646 126.646 123.982 2.664 25485 12922 1 10 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.684 0.245 25485 12923 1 10 . 1 1 207 207 ASP C C 207 174.614 174.614 175.294 -0.680 25485 12924 1 10 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.901 -1.629 25485 12925 1 10 . 1 1 207 207 ASP CB C 207 41.288 41.288 41.519 -0.231 25485 12926 1 10 . 1 1 207 207 ASP H H 207 8.541 8.541 8.100 0.441 25485 12927 1 10 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.363 0.424 25485 12928 1 10 . 1 1 208 208 PRO C C 208 177.467 177.467 175.591 1.876 25485 12929 1 10 . 1 1 208 208 PRO CA C 208 62.836 62.836 64.004 -1.168 25485 12930 1 10 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.166 -0.569 25485 12931 1 10 . 1 1 209 209 ASN N N 209 116.020 116.020 112.910 3.110 25485 12932 1 10 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.644 -0.003 25485 12933 1 10 . 1 1 209 209 ASN C C 209 174.695 174.695 173.653 1.042 25485 12934 1 10 . 1 1 209 209 ASN CA C 209 53.220 53.220 50.931 2.289 25485 12935 1 10 . 1 1 209 209 ASN CB C 209 39.110 39.110 37.704 1.406 25485 12936 1 10 . 1 1 209 209 ASN H H 209 8.350 8.350 7.957 0.393 25485 12937 1 10 . 1 1 210 210 ALA N N 210 124.892 124.892 121.149 3.743 25485 12938 1 10 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.536 -0.441 25485 12939 1 10 . 1 1 210 210 ALA C C 210 179.495 179.495 178.097 1.398 25485 12940 1 10 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.429 1.625 25485 12941 1 10 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.398 -1.199 25485 12942 1 10 . 1 1 210 210 ALA H H 210 8.193 8.193 7.282 0.911 25485 12943 1 10 . 1 1 211 211 VAL N N 211 130.402 130.402 124.088 6.314 25485 12944 1 10 . 1 1 211 211 VAL HA H 211 4.263 4.263 4.002 0.261 25485 12945 1 10 . 1 1 211 211 VAL C C 211 179.408 179.408 176.329 3.079 25485 12946 1 10 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.997 0.055 25485 12947 1 10 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.222 -1.239 25485 12948 1 10 . 1 1 211 211 VAL H H 211 11.592 11.592 8.643 2.949 25485 12949 1 10 . 1 1 212 212 MET N N 212 113.285 113.285 116.725 -3.440 25485 12950 1 10 . 1 1 212 212 MET C C 212 176.996 176.996 174.836 2.160 25485 12951 1 10 . 1 1 212 212 MET CA C 212 53.614 53.614 54.194 -0.580 25485 12952 1 10 . 1 1 212 212 MET CB C 212 26.975 26.975 32.466 -5.491 25485 12953 1 10 . 1 1 212 212 MET H H 212 7.724 7.724 7.781 -0.057 25485 12954 1 10 . 1 1 213 213 TYR N N 213 129.919 129.919 123.559 6.360 25485 12955 1 10 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.514 1.182 25485 12956 1 10 . 1 1 213 213 TYR C C 213 178.411 178.411 175.826 2.585 25485 12957 1 10 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.506 -0.375 25485 12958 1 10 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.187 0.980 25485 12959 1 10 . 1 1 213 213 TYR H H 213 7.902 7.902 7.427 0.475 25485 12960 1 10 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.495 -1.020 25485 12961 1 10 . 1 1 214 214 PRO C C 214 177.694 177.694 176.557 1.137 25485 12962 1 10 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.469 1.559 25485 12963 1 10 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.458 1.365 25485 12964 1 10 . 1 1 215 215 THR N N 215 104.450 104.450 110.741 -6.291 25485 12965 1 10 . 1 1 215 215 THR HA H 215 4.444 4.444 4.344 0.100 25485 12966 1 10 . 1 1 215 215 THR C C 215 173.429 173.429 174.006 -0.577 25485 12967 1 10 . 1 1 215 215 THR CA C 215 60.528 60.528 61.839 -1.310 25485 12968 1 10 . 1 1 215 215 THR CB C 215 69.614 69.614 68.546 1.068 25485 12969 1 10 . 1 1 215 215 THR H H 215 6.407 6.407 7.402 -0.995 25485 12970 1 10 . 1 1 216 216 TYR N N 216 124.618 124.618 120.633 3.985 25485 12971 1 10 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.137 0.095 25485 12972 1 10 . 1 1 216 216 TYR C C 216 175.669 175.669 175.653 0.016 25485 12973 1 10 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.024 -0.437 25485 12974 1 10 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.369 2.522 25485 12975 1 10 . 1 1 216 216 TYR H H 216 8.331 8.331 7.540 0.791 25485 12976 1 10 . 1 1 217 217 GLY N N 217 116.089 116.089 112.719 3.370 25485 12977 1 10 . 1 1 217 217 GLY C C 217 173.560 173.560 173.079 0.481 25485 12978 1 10 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.456 -0.138 25485 12979 1 10 . 1 1 217 217 GLY H H 217 7.695 7.695 8.480 -0.785 25485 12980 1 10 . 1 1 218 218 ASN N N 218 120.167 120.167 118.136 2.031 25485 12981 1 10 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.829 -0.163 25485 12982 1 10 . 1 1 218 218 ASN C C 218 175.343 175.343 176.185 -0.842 25485 12983 1 10 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.097 0.518 25485 12984 1 10 . 1 1 218 218 ASN CB C 218 38.546 38.546 40.125 -1.579 25485 12985 1 10 . 1 1 218 218 ASN H H 218 8.237 8.237 8.687 -0.450 25485 12986 1 10 . 1 1 219 219 GLY N N 219 109.322 109.322 110.162 -0.840 25485 12987 1 10 . 1 1 219 219 GLY C C 219 172.842 172.842 173.419 -0.577 25485 12988 1 10 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.945 -0.227 25485 12989 1 10 . 1 1 219 219 GLY H H 219 8.027 8.027 8.140 -0.113 25485 12990 1 10 . 1 1 220 220 ASP N N 220 123.006 123.006 122.318 0.688 25485 12991 1 10 . 1 1 220 220 ASP H H 220 8.273 8.273 8.355 -0.082 25485 12992 1 10 . 1 1 221 221 PRO C C 221 177.138 177.138 176.631 0.507 25485 12993 1 10 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.817 -5.754 25485 12994 1 10 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.922 -1.226 25485 12995 1 10 . 1 1 222 222 GLN N N 222 116.718 116.718 118.949 -2.231 25485 12996 1 10 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.283 0.053 25485 12997 1 10 . 1 1 222 222 GLN C C 222 176.321 176.321 176.370 -0.049 25485 12998 1 10 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.104 -0.961 25485 12999 1 10 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.228 0.269 25485 13000 1 10 . 1 1 222 222 GLN H H 222 8.240 8.240 8.533 -0.293 25485 13001 1 10 . 1 1 223 223 ASN N N 223 118.368 118.368 115.191 3.177 25485 13002 1 10 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.808 0.108 25485 13003 1 10 . 1 1 223 223 ASN C C 223 173.271 173.271 174.412 -1.141 25485 13004 1 10 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.117 -0.521 25485 13005 1 10 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.690 -0.475 25485 13006 1 10 . 1 1 223 223 ASN H H 223 7.946 7.946 8.094 -0.148 25485 13007 1 10 . 1 1 224 224 PHE N N 224 118.429 118.429 119.901 -1.472 25485 13008 1 10 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.150 0.301 25485 13009 1 10 . 1 1 224 224 PHE C C 224 172.897 172.897 173.416 -0.519 25485 13010 1 10 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.621 -0.212 25485 13011 1 10 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.552 1.149 25485 13012 1 10 . 1 1 224 224 PHE H H 224 6.992 6.992 7.945 -0.953 25485 13013 1 10 . 1 1 225 225 LYS N N 225 121.714 121.714 125.104 -3.390 25485 13014 1 10 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.752 0.678 25485 13015 1 10 . 1 1 225 225 LYS C C 225 174.664 174.664 174.556 0.108 25485 13016 1 10 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.806 0.506 25485 13017 1 10 . 1 1 225 225 LYS CB C 225 34.727 34.727 35.062 -0.334 25485 13018 1 10 . 1 1 225 225 LYS H H 225 7.709 7.709 7.686 0.023 25485 13019 1 10 . 1 1 226 226 LEU N N 226 119.026 119.026 121.333 -2.307 25485 13020 1 10 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.847 0.293 25485 13021 1 10 . 1 1 226 226 LEU C C 226 177.495 177.495 176.796 0.699 25485 13022 1 10 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.040 0.559 25485 13023 1 10 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.885 -0.604 25485 13024 1 10 . 1 1 226 226 LEU H H 226 8.015 8.015 7.985 0.030 25485 13025 1 10 . 1 1 227 227 SER N N 227 120.320 120.320 115.840 4.480 25485 13026 1 10 . 1 1 227 227 SER HA H 227 4.600 4.600 4.446 0.154 25485 13027 1 10 . 1 1 227 227 SER C C 227 175.492 175.492 175.031 0.461 25485 13028 1 10 . 1 1 227 227 SER CA C 227 57.239 57.239 57.507 -0.268 25485 13029 1 10 . 1 1 227 227 SER CB C 227 66.278 66.278 65.002 1.276 25485 13030 1 10 . 1 1 227 227 SER H H 227 9.654 9.654 7.815 1.839 25485 13031 1 10 . 1 1 228 228 GLN N N 228 127.511 127.511 124.123 3.388 25485 13032 1 10 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.933 0.761 25485 13033 1 10 . 1 1 228 228 GLN H H 228 8.248 8.248 9.056 -0.808 25485 13034 1 10 . 1 1 229 229 ASP N N 229 124.358 124.358 118.605 5.753 25485 13035 1 10 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.394 -0.020 25485 13036 1 10 . 1 1 229 229 ASP C C 229 178.793 178.793 178.223 0.570 25485 13037 1 10 . 1 1 229 229 ASP CA C 229 58.142 58.142 56.693 1.449 25485 13038 1 10 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.479 2.763 25485 13039 1 10 . 1 1 229 229 ASP H H 229 8.138 8.138 8.420 -0.282 25485 13040 1 10 . 1 1 230 230 ASP N N 230 119.694 119.694 120.365 -0.671 25485 13041 1 10 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.514 -0.092 25485 13042 1 10 . 1 1 230 230 ASP C C 230 177.736 177.736 178.534 -0.798 25485 13043 1 10 . 1 1 230 230 ASP CA C 230 57.922 57.922 58.412 -0.490 25485 13044 1 10 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.104 2.132 25485 13045 1 10 . 1 1 230 230 ASP H H 230 7.393 7.393 7.359 0.034 25485 13046 1 10 . 1 1 231 231 ILE N N 231 120.364 120.364 119.986 0.378 25485 13047 1 10 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.731 -0.066 25485 13048 1 10 . 1 1 231 231 ILE C C 231 177.631 177.631 177.652 -0.021 25485 13049 1 10 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.566 -0.067 25485 13050 1 10 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.964 0.549 25485 13051 1 10 . 1 1 231 231 ILE H H 231 8.115 8.115 8.009 0.106 25485 13052 1 10 . 1 1 232 232 LYS N N 232 119.156 119.156 120.475 -1.319 25485 13053 1 10 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.096 0.018 25485 13054 1 10 . 1 1 232 232 LYS C C 232 180.574 180.574 179.139 1.435 25485 13055 1 10 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.462 0.098 25485 13056 1 10 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.717 0.080 25485 13057 1 10 . 1 1 232 232 LYS H H 232 8.607 8.607 8.490 0.117 25485 13058 1 10 . 1 1 233 233 GLY N N 233 106.425 106.425 107.963 -1.538 25485 13059 1 10 . 1 1 233 233 GLY C C 233 176.098 176.098 175.878 0.220 25485 13060 1 10 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.678 0.959 25485 13061 1 10 . 1 1 233 233 GLY H H 233 8.075 8.075 7.633 0.442 25485 13062 1 10 . 1 1 234 234 ILE N N 234 125.119 125.119 122.626 2.493 25485 13063 1 10 . 1 1 234 234 ILE C C 234 178.231 178.231 177.731 0.500 25485 13064 1 10 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.297 -1.704 25485 13065 1 10 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.336 -0.790 25485 13066 1 10 . 1 1 234 234 ILE H H 234 8.539 8.539 7.549 0.990 25485 13067 1 10 . 1 1 235 235 GLN N N 235 122.877 122.877 118.754 4.123 25485 13068 1 10 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.063 0.294 25485 13069 1 10 . 1 1 235 235 GLN C C 235 180.105 180.105 178.254 1.851 25485 13070 1 10 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.028 -1.141 25485 13071 1 10 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.683 -1.146 25485 13072 1 10 . 1 1 235 235 GLN H H 235 8.296 8.296 8.595 -0.299 25485 13073 1 10 . 1 1 236 236 LYS N N 236 123.678 123.678 118.607 5.071 25485 13074 1 10 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.266 -0.184 25485 13075 1 10 . 1 1 236 236 LYS C C 236 178.169 178.169 177.820 0.349 25485 13076 1 10 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.731 0.645 25485 13077 1 10 . 1 1 236 236 LYS CB C 236 31.978 31.978 32.146 -0.168 25485 13078 1 10 . 1 1 236 236 LYS H H 236 8.024 8.024 7.701 0.323 25485 13079 1 10 . 1 1 237 237 LEU N N 237 116.873 116.873 119.142 -2.269 25485 13080 1 10 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.259 -0.272 25485 13081 1 10 . 1 1 237 237 LEU C C 237 177.893 177.893 178.156 -0.263 25485 13082 1 10 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.949 0.490 25485 13083 1 10 . 1 1 237 237 LEU CB C 237 43.613 43.613 43.029 0.584 25485 13084 1 10 . 1 1 237 237 LEU H H 237 6.888 6.888 7.419 -0.531 25485 13085 1 10 . 1 1 238 238 TYR N N 238 112.237 112.237 116.852 -4.615 25485 13086 1 10 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.560 0.091 25485 13087 1 10 . 1 1 238 238 TYR C C 238 176.082 176.082 176.372 -0.290 25485 13088 1 10 . 1 1 238 238 TYR CA C 238 59.636 59.636 59.192 0.444 25485 13089 1 10 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.543 1.855 25485 13090 1 10 . 1 1 238 238 TYR H H 238 7.445 7.445 8.793 -1.348 25485 13091 1 10 . 1 1 239 239 GLY N N 239 110.906 110.906 107.057 3.849 25485 13092 1 10 . 1 1 239 239 GLY C C 239 171.269 171.269 172.860 -1.591 25485 13093 1 10 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.468 -1.582 25485 13094 1 10 . 1 1 239 239 GLY H H 239 8.443 8.443 7.633 0.810 25485 13095 1 10 . 1 1 240 240 LYS N N 240 114.281 114.281 121.579 -7.298 25485 13096 1 10 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.624 0.114 25485 13097 1 10 . 1 1 240 240 LYS C C 240 177.527 177.527 175.932 1.595 25485 13098 1 10 . 1 1 240 240 LYS CA C 240 54.958 54.958 54.900 0.058 25485 13099 1 10 . 1 1 240 240 LYS CB C 240 34.275 34.275 35.235 -0.960 25485 13100 1 10 . 1 1 240 240 LYS H H 240 7.873 7.873 8.064 -0.191 25485 13101 1 10 . 1 1 241 241 ARG N N 241 123.758 123.758 120.248 3.510 25485 13102 1 10 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.379 -0.382 25485 13103 1 10 . 1 1 241 241 ARG C C 241 176.026 176.026 176.341 -0.315 25485 13104 1 10 . 1 1 241 241 ARG CA C 241 57.492 57.492 56.760 0.732 25485 13105 1 10 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.938 -0.567 25485 13106 1 10 . 1 1 241 241 ARG H H 241 7.742 7.742 8.441 -0.699 25485 13107 1 10 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.340 -0.000 25485 13108 1 10 . 1 1 246 246 LYS C C 246 175.403 175.403 174.870 0.533 25485 13109 1 10 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.686 -0.177 25485 13110 1 10 . 1 1 246 246 LYS CB C 246 32.858 32.858 33.411 -0.553 25485 13111 1 11 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.460 -0.153 25485 13112 1 11 . 1 1 2 2 GLN C C 2 176.492 176.492 175.077 1.415 25485 13113 1 11 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.588 0.161 25485 13114 1 11 . 1 1 2 2 GLN CB C 2 28.654 28.654 29.433 -0.779 25485 13115 1 11 . 1 1 3 3 GLU N N 3 121.668 121.668 122.810 -1.142 25485 13116 1 11 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.462 -0.673 25485 13117 1 11 . 1 1 3 3 GLU C C 3 176.278 176.278 177.503 -1.225 25485 13118 1 11 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.276 -0.217 25485 13119 1 11 . 1 1 3 3 GLU CB C 3 29.691 29.691 30.335 -0.644 25485 13120 1 11 . 1 1 3 3 GLU H H 3 8.331 8.331 8.916 -0.585 25485 13121 1 11 . 1 1 4 4 ALA N N 4 124.493 124.493 122.941 1.552 25485 13122 1 11 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.054 0.456 25485 13123 1 11 . 1 1 4 4 ALA C C 4 178.428 178.428 179.520 -1.092 25485 13124 1 11 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.866 -0.189 25485 13125 1 11 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.048 0.661 25485 13126 1 11 . 1 1 4 4 ALA H H 4 8.131 8.131 8.467 -0.336 25485 13127 1 11 . 1 1 5 5 GLY N N 5 108.204 108.204 106.901 1.303 25485 13128 1 11 . 1 1 5 5 GLY C C 5 174.858 174.858 175.668 -0.810 25485 13129 1 11 . 1 1 5 5 GLY CA C 5 47.661 47.661 45.944 1.717 25485 13130 1 11 . 1 1 5 5 GLY H H 5 8.279 8.279 8.669 -0.390 25485 13131 1 11 . 1 1 6 6 GLY N N 6 108.820 108.820 108.487 0.333 25485 13132 1 11 . 1 1 6 6 GLY C C 6 174.189 174.189 174.284 -0.095 25485 13133 1 11 . 1 1 6 6 GLY CA C 6 44.413 44.413 43.813 0.600 25485 13134 1 11 . 1 1 6 6 GLY H H 6 8.246 8.246 7.641 0.605 25485 13135 1 11 . 1 1 7 7 MET N N 7 119.938 119.938 119.451 0.487 25485 13136 1 11 . 1 1 7 7 MET HA H 7 4.659 4.659 4.542 0.117 25485 13137 1 11 . 1 1 7 7 MET C C 7 176.191 176.191 175.037 1.154 25485 13138 1 11 . 1 1 7 7 MET CA C 7 54.799 54.799 55.959 -1.160 25485 13139 1 11 . 1 1 7 7 MET CB C 7 33.046 33.046 34.297 -1.251 25485 13140 1 11 . 1 1 7 7 MET H H 7 8.005 8.005 7.629 0.376 25485 13141 1 11 . 1 1 8 8 SER N N 8 118.919 118.919 115.952 2.967 25485 13142 1 11 . 1 1 8 8 SER HA H 8 4.239 4.239 4.681 -0.442 25485 13143 1 11 . 1 1 8 8 SER C C 8 174.949 174.949 175.083 -0.134 25485 13144 1 11 . 1 1 8 8 SER CA C 8 58.160 58.160 57.341 0.819 25485 13145 1 11 . 1 1 8 8 SER CB C 8 65.440 65.440 65.103 0.337 25485 13146 1 11 . 1 1 8 8 SER H H 8 8.731 8.731 8.292 0.439 25485 13147 1 11 . 1 1 9 9 GLU N N 9 122.442 122.442 122.146 0.296 25485 13148 1 11 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.132 0.189 25485 13149 1 11 . 1 1 9 9 GLU C C 9 178.604 178.604 178.682 -0.078 25485 13150 1 11 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.440 0.027 25485 13151 1 11 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.618 -0.442 25485 13152 1 11 . 1 1 9 9 GLU H H 9 8.901 8.901 8.740 0.161 25485 13153 1 11 . 1 1 10 10 LEU N N 10 120.568 120.568 119.344 1.224 25485 13154 1 11 . 1 1 10 10 LEU C C 10 179.307 179.307 178.512 0.795 25485 13155 1 11 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.187 -0.707 25485 13156 1 11 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.607 -0.032 25485 13157 1 11 . 1 1 10 10 LEU H H 10 8.020 8.020 8.281 -0.261 25485 13158 1 11 . 1 1 11 11 GLN N N 11 119.930 119.930 118.239 1.691 25485 13159 1 11 . 1 1 11 11 GLN HA H 11 4.134 4.134 3.967 0.167 25485 13160 1 11 . 1 1 11 11 GLN C C 11 178.330 178.330 178.604 -0.274 25485 13161 1 11 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.492 0.326 25485 13162 1 11 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.262 -0.398 25485 13163 1 11 . 1 1 11 11 GLN H H 11 7.811 7.811 7.784 0.027 25485 13164 1 11 . 1 1 12 12 TRP N N 12 121.031 121.031 121.455 -0.424 25485 13165 1 11 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.343 0.071 25485 13166 1 11 . 1 1 12 12 TRP C C 12 178.874 178.874 178.023 0.851 25485 13167 1 11 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.042 0.465 25485 13168 1 11 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.517 -0.130 25485 13169 1 11 . 1 1 12 12 TRP H H 12 8.205 8.205 7.704 0.501 25485 13170 1 11 . 1 1 13 13 GLU N N 13 121.877 121.877 120.252 1.625 25485 13171 1 11 . 1 1 13 13 GLU C C 13 179.425 179.425 178.830 0.595 25485 13172 1 11 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.479 0.558 25485 13173 1 11 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.726 -0.804 25485 13174 1 11 . 1 1 13 13 GLU H H 13 8.434 8.434 8.463 -0.029 25485 13175 1 11 . 1 1 14 14 GLN N N 14 120.449 120.449 118.793 1.656 25485 13176 1 11 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.800 0.438 25485 13177 1 11 . 1 1 14 14 GLN C C 14 179.210 179.210 177.922 1.288 25485 13178 1 11 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.497 0.385 25485 13179 1 11 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.289 -0.539 25485 13180 1 11 . 1 1 14 14 GLN H H 14 8.124 8.124 8.286 -0.162 25485 13181 1 11 . 1 1 15 15 ALA N N 15 123.114 123.114 120.651 2.463 25485 13182 1 11 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.692 0.698 25485 13183 1 11 . 1 1 15 15 ALA C C 15 179.352 179.352 179.113 0.239 25485 13184 1 11 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.456 -0.491 25485 13185 1 11 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.808 0.855 25485 13186 1 11 . 1 1 15 15 ALA H H 15 8.344 8.344 7.512 0.832 25485 13187 1 11 . 1 1 16 16 GLN N N 16 117.718 117.718 117.585 0.133 25485 13188 1 11 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.937 -0.155 25485 13189 1 11 . 1 1 16 16 GLN C C 16 177.719 177.719 178.054 -0.335 25485 13190 1 11 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.774 1.507 25485 13191 1 11 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.565 -0.029 25485 13192 1 11 . 1 1 16 16 GLN H H 16 8.500 8.500 7.558 0.942 25485 13193 1 11 . 1 1 17 17 ASP N N 17 120.040 120.040 120.698 -0.658 25485 13194 1 11 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.418 0.118 25485 13195 1 11 . 1 1 17 17 ASP C C 17 177.630 177.630 179.072 -1.442 25485 13196 1 11 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.787 0.018 25485 13197 1 11 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.598 1.266 25485 13198 1 11 . 1 1 17 17 ASP H H 17 7.871 7.871 7.808 0.063 25485 13199 1 11 . 1 1 18 18 TYR N N 18 122.465 122.465 119.193 3.272 25485 13200 1 11 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.317 -0.127 25485 13201 1 11 . 1 1 18 18 TYR C C 18 178.439 178.439 177.808 0.631 25485 13202 1 11 . 1 1 18 18 TYR CA C 18 61.846 61.846 58.555 3.291 25485 13203 1 11 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.161 1.779 25485 13204 1 11 . 1 1 18 18 TYR H H 18 8.244 8.244 8.555 -0.311 25485 13205 1 11 . 1 1 19 19 LEU N N 19 117.635 117.635 118.975 -1.340 25485 13206 1 11 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.077 0.055 25485 13207 1 11 . 1 1 19 19 LEU C C 19 180.940 180.940 178.539 2.401 25485 13208 1 11 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.499 1.006 25485 13209 1 11 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.065 -0.467 25485 13210 1 11 . 1 1 19 19 LEU H H 19 8.713 8.713 7.912 0.801 25485 13211 1 11 . 1 1 20 20 LYS N N 20 124.594 124.594 117.885 6.709 25485 13212 1 11 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.073 0.011 25485 13213 1 11 . 1 1 20 20 LYS C C 20 178.387 178.387 178.231 0.156 25485 13214 1 11 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.393 0.412 25485 13215 1 11 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.331 0.126 25485 13216 1 11 . 1 1 20 20 LYS H H 20 8.815 8.815 7.700 1.115 25485 13217 1 11 . 1 1 21 21 ARG N N 21 117.535 117.535 118.110 -0.575 25485 13218 1 11 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.454 -0.735 25485 13219 1 11 . 1 1 21 21 ARG C C 21 178.498 178.498 178.425 0.073 25485 13220 1 11 . 1 1 21 21 ARG CA C 21 59.244 59.244 57.839 1.405 25485 13221 1 11 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.698 -0.257 25485 13222 1 11 . 1 1 21 21 ARG H H 21 7.810 7.810 7.388 0.422 25485 13223 1 11 . 1 1 22 22 PHE N N 22 112.113 112.113 121.565 -9.452 25485 13224 1 11 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.061 0.850 25485 13225 1 11 . 1 1 22 22 PHE C C 22 174.875 174.875 174.645 0.230 25485 13226 1 11 . 1 1 22 22 PHE CA C 22 57.475 57.475 60.227 -2.752 25485 13227 1 11 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.434 -0.265 25485 13228 1 11 . 1 1 22 22 PHE H H 22 8.010 8.010 7.661 0.349 25485 13229 1 11 . 1 1 23 23 TYR N N 23 116.187 116.187 118.979 -2.792 25485 13230 1 11 . 1 1 23 23 TYR C C 23 173.455 173.455 174.655 -1.200 25485 13231 1 11 . 1 1 23 23 TYR CA C 23 58.427 58.427 56.791 1.636 25485 13232 1 11 . 1 1 23 23 TYR CB C 23 39.529 39.529 38.093 1.436 25485 13233 1 11 . 1 1 23 23 TYR H H 23 7.680 7.680 7.448 0.232 25485 13234 1 11 . 1 1 24 24 LEU N N 24 115.570 115.570 117.763 -2.193 25485 13235 1 11 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.031 0.119 25485 13236 1 11 . 1 1 24 24 LEU C C 24 176.661 176.661 174.985 1.676 25485 13237 1 11 . 1 1 24 24 LEU CA C 24 56.152 56.152 54.881 1.271 25485 13238 1 11 . 1 1 24 24 LEU CB C 24 36.863 36.863 41.053 -4.190 25485 13239 1 11 . 1 1 24 24 LEU H H 24 7.238 7.238 7.235 0.003 25485 13240 1 11 . 1 1 25 25 TYR N N 25 119.901 119.901 122.834 -2.933 25485 13241 1 11 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.684 -0.325 25485 13242 1 11 . 1 1 25 25 TYR C C 25 173.784 173.784 175.029 -1.245 25485 13243 1 11 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.668 0.579 25485 13244 1 11 . 1 1 25 25 TYR CB C 25 39.079 39.079 38.087 0.991 25485 13245 1 11 . 1 1 25 25 TYR H H 25 7.845 7.845 8.579 -0.734 25485 13246 1 11 . 1 1 26 26 ASP N N 26 129.338 129.338 128.065 1.273 25485 13247 1 11 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.108 -0.657 25485 13248 1 11 . 1 1 26 26 ASP C C 26 175.282 175.282 176.050 -0.768 25485 13249 1 11 . 1 1 26 26 ASP CA C 26 52.433 52.433 54.079 -1.646 25485 13250 1 11 . 1 1 26 26 ASP CB C 26 41.249 41.249 41.733 -0.484 25485 13251 1 11 . 1 1 26 26 ASP H H 26 8.108 8.108 8.087 0.021 25485 13252 1 11 . 1 1 27 27 SER C C 27 175.204 175.204 176.106 -0.902 25485 13253 1 11 . 1 1 27 27 SER CA C 27 59.424 59.424 59.778 -0.354 25485 13254 1 11 . 1 1 27 27 SER CB C 27 63.535 63.535 63.640 -0.105 25485 13255 1 11 . 1 1 28 28 GLU N N 28 122.058 122.058 120.595 1.463 25485 13256 1 11 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.301 0.024 25485 13257 1 11 . 1 1 28 28 GLU C C 28 177.073 177.073 177.289 -0.216 25485 13258 1 11 . 1 1 28 28 GLU CA C 28 57.212 57.212 57.685 -0.473 25485 13259 1 11 . 1 1 28 28 GLU CB C 28 29.570 29.570 28.993 0.577 25485 13260 1 11 . 1 1 28 28 GLU H H 28 8.255 8.255 8.716 -0.461 25485 13261 1 11 . 1 1 29 29 THR N N 29 114.161 114.161 114.686 -0.525 25485 13262 1 11 . 1 1 29 29 THR HA H 29 4.260 4.260 4.228 0.032 25485 13263 1 11 . 1 1 29 29 THR C C 29 174.591 174.591 173.917 0.674 25485 13264 1 11 . 1 1 29 29 THR CA C 29 61.976 61.976 63.237 -1.261 25485 13265 1 11 . 1 1 29 29 THR CB C 29 69.385 69.385 68.899 0.486 25485 13266 1 11 . 1 1 29 29 THR H H 29 7.498 7.498 7.633 -0.135 25485 13267 1 11 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.416 -0.198 25485 13268 1 11 . 1 1 30 30 LYS H H 30 8.218 8.218 7.383 0.835 25485 13269 1 11 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.774 -0.350 25485 13270 1 11 . 1 1 31 31 ASN CB C 31 39.133 39.133 41.292 -2.159 25485 13271 1 11 . 1 1 32 32 ALA N N 32 126.484 126.484 123.427 3.057 25485 13272 1 11 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.232 0.064 25485 13273 1 11 . 1 1 32 32 ALA C C 32 178.012 178.012 178.701 -0.689 25485 13274 1 11 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.862 -1.102 25485 13275 1 11 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.041 -0.271 25485 13276 1 11 . 1 1 32 32 ALA H H 32 8.411 8.411 8.722 -0.311 25485 13277 1 11 . 1 1 33 33 ASN N N 33 116.885 116.885 116.340 0.545 25485 13278 1 11 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.728 -0.030 25485 13279 1 11 . 1 1 33 33 ASN C C 33 176.240 176.240 177.119 -0.879 25485 13280 1 11 . 1 1 33 33 ASN CA C 33 54.187 54.187 54.853 -0.666 25485 13281 1 11 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.002 0.583 25485 13282 1 11 . 1 1 33 33 ASN H H 33 8.309 8.309 8.517 -0.208 25485 13283 1 11 . 1 1 34 34 SER N N 34 116.836 116.836 117.166 -0.330 25485 13284 1 11 . 1 1 34 34 SER HA H 34 4.544 4.544 4.379 0.165 25485 13285 1 11 . 1 1 34 34 SER C C 34 175.253 175.253 175.914 -0.661 25485 13286 1 11 . 1 1 34 34 SER CA C 34 59.583 59.583 60.579 -0.996 25485 13287 1 11 . 1 1 34 34 SER CB C 34 63.919 63.919 63.136 0.783 25485 13288 1 11 . 1 1 34 34 SER H H 34 8.115 8.115 7.928 0.187 25485 13289 1 11 . 1 1 35 35 LEU N N 35 125.355 125.355 122.459 2.896 25485 13290 1 11 . 1 1 35 35 LEU HA H 35 3.576 3.576 3.965 -0.389 25485 13291 1 11 . 1 1 35 35 LEU C C 35 177.973 177.973 178.465 -0.492 25485 13292 1 11 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.452 0.045 25485 13293 1 11 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.339 -0.647 25485 13294 1 11 . 1 1 35 35 LEU H H 35 8.312 8.312 7.637 0.675 25485 13295 1 11 . 1 1 36 36 GLU N N 36 119.201 119.201 118.080 1.121 25485 13296 1 11 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.971 -0.057 25485 13297 1 11 . 1 1 36 36 GLU C C 36 178.141 178.141 178.551 -0.410 25485 13298 1 11 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.524 0.135 25485 13299 1 11 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.104 0.209 25485 13300 1 11 . 1 1 36 36 GLU H H 36 8.225 8.225 8.287 -0.062 25485 13301 1 11 . 1 1 37 37 ALA N N 37 120.746 120.746 122.913 -2.167 25485 13302 1 11 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.017 0.062 25485 13303 1 11 . 1 1 37 37 ALA C C 37 181.485 181.485 179.757 1.728 25485 13304 1 11 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.141 0.318 25485 13305 1 11 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.088 0.079 25485 13306 1 11 . 1 1 37 37 ALA H H 37 7.917 7.917 7.660 0.257 25485 13307 1 11 . 1 1 38 38 LYS N N 38 119.326 119.326 118.759 0.567 25485 13308 1 11 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.034 0.297 25485 13309 1 11 . 1 1 38 38 LYS C C 38 177.946 177.946 179.118 -1.172 25485 13310 1 11 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.459 -0.755 25485 13311 1 11 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.193 -0.393 25485 13312 1 11 . 1 1 38 38 LYS H H 38 8.216 8.216 8.102 0.114 25485 13313 1 11 . 1 1 39 39 LEU N N 39 122.736 122.736 119.933 2.803 25485 13314 1 11 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.913 0.028 25485 13315 1 11 . 1 1 39 39 LEU C C 39 178.819 178.819 178.706 0.113 25485 13316 1 11 . 1 1 39 39 LEU CA C 39 58.081 58.081 57.338 0.743 25485 13317 1 11 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.461 -0.833 25485 13318 1 11 . 1 1 39 39 LEU H H 39 8.666 8.666 8.050 0.616 25485 13319 1 11 . 1 1 40 40 LYS N N 40 118.411 118.411 119.827 -1.416 25485 13320 1 11 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.846 0.792 25485 13321 1 11 . 1 1 40 40 LYS C C 40 179.329 179.329 178.607 0.722 25485 13322 1 11 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.009 0.124 25485 13323 1 11 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.382 -0.597 25485 13324 1 11 . 1 1 40 40 LYS H H 40 8.227 8.227 8.109 0.118 25485 13325 1 11 . 1 1 41 41 GLU N N 41 121.329 121.329 117.850 3.479 25485 13326 1 11 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.074 0.019 25485 13327 1 11 . 1 1 41 41 GLU C C 41 178.989 178.989 178.936 0.053 25485 13328 1 11 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.032 0.728 25485 13329 1 11 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.784 1.052 25485 13330 1 11 . 1 1 41 41 GLU H H 41 7.718 7.718 7.782 -0.064 25485 13331 1 11 . 1 1 42 42 MET N N 42 123.817 123.817 118.544 5.273 25485 13332 1 11 . 1 1 42 42 MET HA H 42 4.107 4.107 4.161 -0.054 25485 13333 1 11 . 1 1 42 42 MET C C 42 177.719 177.719 177.793 -0.074 25485 13334 1 11 . 1 1 42 42 MET CA C 42 59.912 59.912 58.638 1.274 25485 13335 1 11 . 1 1 42 42 MET CB C 42 30.506 30.506 32.297 -1.791 25485 13336 1 11 . 1 1 42 42 MET H H 42 7.657 7.657 7.379 0.278 25485 13337 1 11 . 1 1 43 43 GLN N N 43 119.998 119.998 118.207 1.791 25485 13338 1 11 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.989 -0.184 25485 13339 1 11 . 1 1 43 43 GLN C C 43 177.604 177.604 178.847 -1.243 25485 13340 1 11 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.700 1.265 25485 13341 1 11 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.721 -1.167 25485 13342 1 11 . 1 1 43 43 GLN H H 43 8.910 8.910 7.588 1.322 25485 13343 1 11 . 1 1 44 44 LYS N N 44 119.165 119.165 119.605 -0.440 25485 13344 1 11 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.208 -0.153 25485 13345 1 11 . 1 1 44 44 LYS C C 44 179.991 179.991 178.482 1.509 25485 13346 1 11 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.643 0.918 25485 13347 1 11 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.136 0.162 25485 13348 1 11 . 1 1 44 44 LYS H H 44 8.507 8.507 7.525 0.982 25485 13349 1 11 . 1 1 45 45 PHE N N 45 123.602 123.602 119.618 3.984 25485 13350 1 11 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.356 -0.455 25485 13351 1 11 . 1 1 45 45 PHE C C 45 177.606 177.606 177.758 -0.152 25485 13352 1 11 . 1 1 45 45 PHE CA C 45 63.034 63.034 61.052 1.982 25485 13353 1 11 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.468 0.398 25485 13354 1 11 . 1 1 45 45 PHE H H 45 8.445 8.445 7.778 0.667 25485 13355 1 11 . 1 1 46 46 PHE N N 46 112.715 112.715 117.143 -4.428 25485 13356 1 11 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.481 0.116 25485 13357 1 11 . 1 1 46 46 PHE C C 46 175.285 175.285 176.809 -1.524 25485 13358 1 11 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.977 0.698 25485 13359 1 11 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.178 -0.719 25485 13360 1 11 . 1 1 46 46 PHE H H 46 8.272 8.272 8.594 -0.322 25485 13361 1 11 . 1 1 47 47 GLY N N 47 110.438 110.438 107.010 3.428 25485 13362 1 11 . 1 1 47 47 GLY C C 47 174.935 174.935 174.657 0.278 25485 13363 1 11 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.206 1.806 25485 13364 1 11 . 1 1 47 47 GLY H H 47 7.926 7.926 8.408 -0.482 25485 13365 1 11 . 1 1 48 48 LEU N N 48 121.830 121.830 119.549 2.281 25485 13366 1 11 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.716 0.208 25485 13367 1 11 . 1 1 48 48 LEU C C 48 174.009 174.009 176.058 -2.049 25485 13368 1 11 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.421 -1.586 25485 13369 1 11 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.927 0.536 25485 13370 1 11 . 1 1 48 48 LEU H H 48 8.762 8.762 7.595 1.167 25485 13371 1 11 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.404 -0.166 25485 13372 1 11 . 1 1 49 49 PRO C C 49 176.874 176.874 176.754 0.120 25485 13373 1 11 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.662 -0.144 25485 13374 1 11 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.843 -0.764 25485 13375 1 11 . 1 1 50 50 ILE N N 50 126.859 126.859 117.905 8.954 25485 13376 1 11 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.017 0.084 25485 13377 1 11 . 1 1 50 50 ILE C C 50 176.540 176.540 175.598 0.942 25485 13378 1 11 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.789 -0.833 25485 13379 1 11 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.146 -0.753 25485 13380 1 11 . 1 1 50 50 ILE H H 50 8.548 8.548 7.813 0.735 25485 13381 1 11 . 1 1 51 51 THR N N 51 116.443 116.443 117.393 -0.950 25485 13382 1 11 . 1 1 51 51 THR HA H 51 4.584 4.584 4.425 0.159 25485 13383 1 11 . 1 1 51 51 THR C C 51 176.672 176.672 175.618 1.054 25485 13384 1 11 . 1 1 51 51 THR CA C 51 60.979 60.979 60.521 0.458 25485 13385 1 11 . 1 1 51 51 THR CB C 51 71.505 71.505 69.933 1.572 25485 13386 1 11 . 1 1 51 51 THR H H 51 8.001 8.001 7.753 0.248 25485 13387 1 11 . 1 1 52 52 GLY N N 52 112.719 112.719 109.860 2.859 25485 13388 1 11 . 1 1 52 52 GLY C C 52 170.609 170.609 174.325 -3.716 25485 13389 1 11 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.820 0.926 25485 13390 1 11 . 1 1 52 52 GLY H H 52 9.499 9.499 8.402 1.097 25485 13391 1 11 . 1 1 53 53 MET N N 53 116.621 116.621 119.403 -2.782 25485 13392 1 11 . 1 1 53 53 MET HA H 53 4.023 4.023 4.548 -0.525 25485 13393 1 11 . 1 1 53 53 MET C C 53 174.695 174.695 174.341 0.354 25485 13394 1 11 . 1 1 53 53 MET CA C 53 53.460 53.460 54.926 -1.466 25485 13395 1 11 . 1 1 53 53 MET CB C 53 35.408 35.408 34.150 1.258 25485 13396 1 11 . 1 1 53 53 MET H H 53 7.993 7.993 7.558 0.435 25485 13397 1 11 . 1 1 54 54 LEU N N 54 122.679 122.679 124.387 -1.708 25485 13398 1 11 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.435 -0.684 25485 13399 1 11 . 1 1 54 54 LEU C C 54 174.784 174.784 174.112 0.672 25485 13400 1 11 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.172 0.129 25485 13401 1 11 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.647 -0.637 25485 13402 1 11 . 1 1 54 54 LEU H H 54 7.940 7.940 8.413 -0.473 25485 13403 1 11 . 1 1 55 55 ASN N N 55 115.797 115.797 117.358 -1.561 25485 13404 1 11 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.769 -0.020 25485 13405 1 11 . 1 1 55 55 ASN C C 55 175.459 175.459 174.726 0.733 25485 13406 1 11 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.693 -1.850 25485 13407 1 11 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.842 1.515 25485 13408 1 11 . 1 1 55 55 ASN H H 55 6.543 6.543 8.086 -1.543 25485 13409 1 11 . 1 1 56 56 SER N N 56 121.507 121.507 116.034 5.473 25485 13410 1 11 . 1 1 56 56 SER HA H 56 4.638 4.638 4.483 0.155 25485 13411 1 11 . 1 1 56 56 SER C C 56 175.727 175.727 175.560 0.167 25485 13412 1 11 . 1 1 56 56 SER CA C 56 57.932 57.932 59.618 -1.686 25485 13413 1 11 . 1 1 56 56 SER CB C 56 63.786 63.786 63.714 0.072 25485 13414 1 11 . 1 1 56 56 SER H H 56 8.213 8.213 8.004 0.209 25485 13415 1 11 . 1 1 57 57 ARG N N 57 122.951 122.951 122.489 0.462 25485 13416 1 11 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.230 -0.029 25485 13417 1 11 . 1 1 57 57 ARG C C 57 178.560 178.560 178.001 0.559 25485 13418 1 11 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.556 -0.124 25485 13419 1 11 . 1 1 57 57 ARG CB C 57 29.105 29.105 30.332 -1.227 25485 13420 1 11 . 1 1 57 57 ARG H H 57 7.895 7.895 8.596 -0.701 25485 13421 1 11 . 1 1 58 58 VAL N N 58 118.778 118.778 119.740 -0.962 25485 13422 1 11 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.633 -0.302 25485 13423 1 11 . 1 1 58 58 VAL C C 58 177.370 177.370 177.567 -0.197 25485 13424 1 11 . 1 1 58 58 VAL CA C 58 66.382 66.382 65.987 0.395 25485 13425 1 11 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.741 0.467 25485 13426 1 11 . 1 1 58 58 VAL H H 58 7.583 7.583 7.949 -0.366 25485 13427 1 11 . 1 1 59 59 ILE N N 59 119.159 119.159 118.112 1.047 25485 13428 1 11 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.762 -0.349 25485 13429 1 11 . 1 1 59 59 ILE C C 59 177.067 177.067 177.410 -0.343 25485 13430 1 11 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.243 0.390 25485 13431 1 11 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.959 -0.263 25485 13432 1 11 . 1 1 59 59 ILE H H 59 7.323 7.323 7.943 -0.620 25485 13433 1 11 . 1 1 60 60 GLU N N 60 119.367 119.367 120.685 -1.318 25485 13434 1 11 . 1 1 60 60 GLU HA H 60 3.738 3.738 4.011 -0.273 25485 13435 1 11 . 1 1 60 60 GLU C C 60 179.978 179.978 178.630 1.348 25485 13436 1 11 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.540 -0.282 25485 13437 1 11 . 1 1 60 60 GLU CB C 60 29.388 29.388 28.680 0.708 25485 13438 1 11 . 1 1 60 60 GLU H H 60 7.879 7.879 7.708 0.171 25485 13439 1 11 . 1 1 61 61 ILE N N 61 118.816 118.816 116.491 2.325 25485 13440 1 11 . 1 1 61 61 ILE HA H 61 3.439 3.439 4.006 -0.567 25485 13441 1 11 . 1 1 61 61 ILE C C 61 179.033 179.033 176.581 2.452 25485 13442 1 11 . 1 1 61 61 ILE CA C 61 64.838 64.838 63.279 1.559 25485 13443 1 11 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.101 -1.202 25485 13444 1 11 . 1 1 61 61 ILE H H 61 7.246 7.246 7.155 0.091 25485 13445 1 11 . 1 1 62 62 MET N N 62 119.986 119.986 115.820 4.166 25485 13446 1 11 . 1 1 62 62 MET HA H 62 3.444 3.444 4.377 -0.933 25485 13447 1 11 . 1 1 62 62 MET C C 62 176.185 176.185 177.609 -1.424 25485 13448 1 11 . 1 1 62 62 MET CA C 62 59.014 59.014 56.914 2.100 25485 13449 1 11 . 1 1 62 62 MET CB C 62 31.250 31.250 32.546 -1.296 25485 13450 1 11 . 1 1 62 62 MET H H 62 7.835 7.835 7.282 0.553 25485 13451 1 11 . 1 1 63 63 GLN N N 63 116.163 116.163 114.990 1.173 25485 13452 1 11 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.373 -0.095 25485 13453 1 11 . 1 1 63 63 GLN C C 63 176.727 176.727 176.521 0.206 25485 13454 1 11 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.501 -0.363 25485 13455 1 11 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.799 -0.733 25485 13456 1 11 . 1 1 63 63 GLN H H 63 7.454 7.454 7.675 -0.221 25485 13457 1 11 . 1 1 64 64 LYS N N 64 121.430 121.430 121.653 -0.223 25485 13458 1 11 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.573 -0.030 25485 13459 1 11 . 1 1 64 64 LYS C C 64 174.724 174.724 174.971 -0.247 25485 13460 1 11 . 1 1 64 64 LYS CA C 64 55.517 55.517 53.802 1.715 25485 13461 1 11 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.466 -0.869 25485 13462 1 11 . 1 1 64 64 LYS H H 64 7.483 7.483 7.530 -0.047 25485 13463 1 11 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.467 -2.031 25485 13464 1 11 . 1 1 65 65 PRO C C 65 176.158 176.158 176.186 -0.028 25485 13465 1 11 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.116 -0.228 25485 13466 1 11 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.414 -0.581 25485 13467 1 11 . 1 1 66 66 ARG N N 66 112.697 112.697 122.760 -10.063 25485 13468 1 11 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.587 -0.179 25485 13469 1 11 . 1 1 66 66 ARG C C 66 174.478 174.478 174.211 0.267 25485 13470 1 11 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.276 -1.641 25485 13471 1 11 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.755 2.918 25485 13472 1 11 . 1 1 66 66 ARG H H 66 8.146 8.146 8.671 -0.525 25485 13473 1 11 . 1 1 67 67 CYS N N 67 121.740 121.740 117.068 4.672 25485 13474 1 11 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.516 -0.076 25485 13475 1 11 . 1 1 67 67 CYS C C 67 175.659 175.659 175.260 0.399 25485 13476 1 11 . 1 1 67 67 CYS CA C 67 59.195 59.195 57.520 1.675 25485 13477 1 11 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.137 -0.931 25485 13478 1 11 . 1 1 67 67 CYS H H 67 7.757 7.757 8.040 -0.283 25485 13479 1 11 . 1 1 68 68 GLY N N 68 116.217 116.217 114.328 1.889 25485 13480 1 11 . 1 1 68 68 GLY C C 68 172.210 172.210 173.431 -1.221 25485 13481 1 11 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.059 1.500 25485 13482 1 11 . 1 1 68 68 GLY H H 68 9.704 9.704 9.123 0.581 25485 13483 1 11 . 1 1 69 69 VAL N N 69 126.372 126.372 121.339 5.033 25485 13484 1 11 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.404 -0.573 25485 13485 1 11 . 1 1 69 69 VAL C C 69 173.538 173.538 173.695 -0.157 25485 13486 1 11 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.436 2.932 25485 13487 1 11 . 1 1 69 69 VAL CB C 69 32.523 32.523 34.132 -1.609 25485 13488 1 11 . 1 1 69 69 VAL H H 69 9.113 9.113 7.267 1.846 25485 13489 1 11 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.285 0.665 25485 13490 1 11 . 1 1 70 70 PRO C C 70 175.019 175.019 175.916 -0.897 25485 13491 1 11 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.250 1.098 25485 13492 1 11 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.336 0.022 25485 13493 1 11 . 1 1 71 71 ASP N N 71 118.986 118.986 119.738 -0.752 25485 13494 1 11 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.393 0.040 25485 13495 1 11 . 1 1 71 71 ASP C C 71 175.166 175.166 176.599 -1.433 25485 13496 1 11 . 1 1 71 71 ASP CA C 71 55.368 55.368 55.879 -0.511 25485 13497 1 11 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.242 -1.378 25485 13498 1 11 . 1 1 71 71 ASP H H 71 8.054 8.054 7.607 0.447 25485 13499 1 11 . 1 1 72 72 VAL N N 72 112.953 112.953 115.955 -3.002 25485 13500 1 11 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.173 0.122 25485 13501 1 11 . 1 1 72 72 VAL C C 72 174.330 174.330 174.361 -0.031 25485 13502 1 11 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.918 -1.273 25485 13503 1 11 . 1 1 72 72 VAL CB C 72 33.872 33.872 32.279 1.593 25485 13504 1 11 . 1 1 72 72 VAL H H 72 6.430 6.430 6.744 -0.314 25485 13505 1 11 . 1 1 73 73 ALA N N 73 125.869 125.869 128.115 -2.246 25485 13506 1 11 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.611 -0.306 25485 13507 1 11 . 1 1 73 73 ALA C C 73 177.382 177.382 176.179 1.203 25485 13508 1 11 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.285 0.764 25485 13509 1 11 . 1 1 73 73 ALA CB C 73 19.951 19.951 21.358 -1.407 25485 13510 1 11 . 1 1 73 73 ALA H H 73 8.177 8.177 8.102 0.075 25485 13511 1 11 . 1 1 74 74 GLU N N 74 120.724 120.724 119.600 1.124 25485 13512 1 11 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.425 -0.322 25485 13513 1 11 . 1 1 74 74 GLU C C 74 176.246 176.246 174.290 1.956 25485 13514 1 11 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.758 0.034 25485 13515 1 11 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.061 -1.276 25485 13516 1 11 . 1 1 74 74 GLU H H 74 8.381 8.381 8.402 -0.021 25485 13517 1 11 . 1 1 75 75 TYR N N 75 121.473 121.473 122.373 -0.900 25485 13518 1 11 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.663 -0.218 25485 13519 1 11 . 1 1 75 75 TYR C C 75 175.633 175.633 175.165 0.468 25485 13520 1 11 . 1 1 75 75 TYR CA C 75 58.327 58.327 57.371 0.956 25485 13521 1 11 . 1 1 75 75 TYR CB C 75 38.413 38.413 39.645 -1.232 25485 13522 1 11 . 1 1 75 75 TYR H H 75 8.065 8.065 8.463 -0.398 25485 13523 1 11 . 1 1 76 76 SER N N 76 117.860 117.860 117.572 0.288 25485 13524 1 11 . 1 1 76 76 SER HA H 76 3.886 3.886 4.118 -0.232 25485 13525 1 11 . 1 1 76 76 SER C C 76 173.859 173.859 175.156 -1.297 25485 13526 1 11 . 1 1 76 76 SER CA C 76 58.250 58.250 58.574 -0.324 25485 13527 1 11 . 1 1 76 76 SER CB C 76 64.117 64.117 63.105 1.012 25485 13528 1 11 . 1 1 76 76 SER H H 76 7.748 7.748 8.666 -0.918 25485 13529 1 11 . 1 1 77 77 LEU N N 77 123.789 123.789 119.709 4.080 25485 13530 1 11 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.845 0.301 25485 13531 1 11 . 1 1 77 77 LEU C C 77 176.451 176.451 176.329 0.122 25485 13532 1 11 . 1 1 77 77 LEU CA C 77 55.464 55.464 56.675 -1.211 25485 13533 1 11 . 1 1 77 77 LEU CB C 77 41.957 41.957 41.616 0.341 25485 13534 1 11 . 1 1 77 77 LEU H H 77 7.979 7.979 8.431 -0.452 25485 13535 1 11 . 1 1 78 78 PHE N N 78 119.275 119.275 112.631 6.644 25485 13536 1 11 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.824 0.052 25485 13537 1 11 . 1 1 78 78 PHE C C 78 173.844 173.844 173.055 0.789 25485 13538 1 11 . 1 1 78 78 PHE CA C 78 55.372 55.372 54.742 0.630 25485 13539 1 11 . 1 1 78 78 PHE CB C 78 39.164 39.164 37.921 1.243 25485 13540 1 11 . 1 1 78 78 PHE H H 78 7.827 7.827 7.386 0.441 25485 13541 1 11 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.427 -0.071 25485 13542 1 11 . 1 1 79 79 PRO C C 79 176.433 176.433 176.314 0.119 25485 13543 1 11 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.428 1.422 25485 13544 1 11 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.520 -0.828 25485 13545 1 11 . 1 1 80 80 ASN N N 80 118.057 118.057 120.499 -2.442 25485 13546 1 11 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.493 0.154 25485 13547 1 11 . 1 1 80 80 ASN C C 80 174.305 174.305 174.804 -0.499 25485 13548 1 11 . 1 1 80 80 ASN CA C 80 52.860 52.860 54.084 -1.224 25485 13549 1 11 . 1 1 80 80 ASN CB C 80 39.583 39.583 37.082 2.501 25485 13550 1 11 . 1 1 80 80 ASN H H 80 8.068 8.068 8.563 -0.495 25485 13551 1 11 . 1 1 81 81 SER HA H 81 4.565 4.565 4.255 0.310 25485 13552 1 11 . 1 1 81 81 SER CA C 81 56.800 56.800 58.782 -1.982 25485 13553 1 11 . 1 1 81 81 SER CB C 81 63.128 63.128 63.897 -0.769 25485 13554 1 11 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.446 0.015 25485 13555 1 11 . 1 1 82 82 PRO C C 82 174.589 174.589 176.405 -1.816 25485 13556 1 11 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.537 -0.891 25485 13557 1 11 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.291 -1.037 25485 13558 1 11 . 1 1 83 83 LYS N N 83 114.578 114.578 118.225 -3.647 25485 13559 1 11 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.427 -0.274 25485 13560 1 11 . 1 1 83 83 LYS C C 83 175.308 175.308 176.898 -1.590 25485 13561 1 11 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.874 -1.467 25485 13562 1 11 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.254 1.164 25485 13563 1 11 . 1 1 83 83 LYS H H 83 7.356 7.356 7.683 -0.327 25485 13564 1 11 . 1 1 84 84 TRP N N 84 122.455 122.455 120.050 2.405 25485 13565 1 11 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.685 -0.665 25485 13566 1 11 . 1 1 84 84 TRP C C 84 177.636 177.636 176.717 0.919 25485 13567 1 11 . 1 1 84 84 TRP CA C 84 57.471 57.471 56.938 0.533 25485 13568 1 11 . 1 1 84 84 TRP CB C 84 30.318 30.318 27.940 2.378 25485 13569 1 11 . 1 1 84 84 TRP H H 84 8.050 8.050 8.388 -0.338 25485 13570 1 11 . 1 1 85 85 THR N N 85 113.501 113.501 116.608 -3.107 25485 13571 1 11 . 1 1 85 85 THR HA H 85 4.573 4.573 4.488 0.085 25485 13572 1 11 . 1 1 85 85 THR C C 85 174.757 174.757 174.602 0.155 25485 13573 1 11 . 1 1 85 85 THR CA C 85 62.130 62.130 61.636 0.494 25485 13574 1 11 . 1 1 85 85 THR CB C 85 69.107 69.107 69.789 -0.682 25485 13575 1 11 . 1 1 85 85 THR H H 85 8.861 8.861 8.302 0.559 25485 13576 1 11 . 1 1 86 86 SER N N 86 117.270 117.270 117.895 -0.625 25485 13577 1 11 . 1 1 86 86 SER HA H 86 4.741 4.741 4.457 0.284 25485 13578 1 11 . 1 1 86 86 SER C C 86 173.457 173.457 174.833 -1.376 25485 13579 1 11 . 1 1 86 86 SER CA C 86 56.739 56.739 58.759 -2.020 25485 13580 1 11 . 1 1 86 86 SER CB C 86 64.717 64.717 64.138 0.579 25485 13581 1 11 . 1 1 86 86 SER H H 86 7.743 7.743 8.018 -0.275 25485 13582 1 11 . 1 1 87 87 LYS N N 87 120.329 120.329 119.279 1.050 25485 13583 1 11 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.343 -0.114 25485 13584 1 11 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.386 0.206 25485 13585 1 11 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.387 -0.264 25485 13586 1 11 . 1 1 87 87 LYS H H 87 8.285 8.285 8.380 -0.095 25485 13587 1 11 . 1 1 88 88 VAL N N 88 117.531 117.531 117.679 -0.148 25485 13588 1 11 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.978 -0.323 25485 13589 1 11 . 1 1 88 88 VAL C C 88 174.868 174.868 174.264 0.604 25485 13590 1 11 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.427 -0.332 25485 13591 1 11 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.529 -1.834 25485 13592 1 11 . 1 1 88 88 VAL H H 88 7.428 7.428 7.406 0.022 25485 13593 1 11 . 1 1 89 89 VAL N N 89 131.452 131.452 124.782 6.670 25485 13594 1 11 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.701 -0.542 25485 13595 1 11 . 1 1 89 89 VAL C C 89 175.758 175.758 175.221 0.537 25485 13596 1 11 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.336 0.385 25485 13597 1 11 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.224 -0.051 25485 13598 1 11 . 1 1 89 89 VAL H H 89 8.603 8.603 8.705 -0.102 25485 13599 1 11 . 1 1 90 90 THR N N 90 118.206 118.206 116.597 1.609 25485 13600 1 11 . 1 1 90 90 THR HA H 90 5.649 5.649 5.441 0.208 25485 13601 1 11 . 1 1 90 90 THR C C 90 174.579 174.579 173.404 1.175 25485 13602 1 11 . 1 1 90 90 THR CA C 90 58.959 58.959 59.200 -0.241 25485 13603 1 11 . 1 1 90 90 THR CB C 90 72.288 72.288 72.580 -0.292 25485 13604 1 11 . 1 1 90 90 THR H H 90 9.021 9.021 8.978 0.043 25485 13605 1 11 . 1 1 91 91 TYR N N 91 118.117 118.117 116.051 2.066 25485 13606 1 11 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.502 0.196 25485 13607 1 11 . 1 1 91 91 TYR C C 91 171.233 171.233 172.879 -1.646 25485 13608 1 11 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.731 -0.299 25485 13609 1 11 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.110 1.150 25485 13610 1 11 . 1 1 91 91 TYR H H 91 8.555 8.555 8.105 0.450 25485 13611 1 11 . 1 1 92 92 ARG N N 92 120.252 120.252 119.922 0.330 25485 13612 1 11 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.588 0.109 25485 13613 1 11 . 1 1 92 92 ARG C C 92 173.932 173.932 174.455 -0.523 25485 13614 1 11 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.252 0.589 25485 13615 1 11 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.926 -0.240 25485 13616 1 11 . 1 1 92 92 ARG H H 92 8.520 8.520 8.736 -0.216 25485 13617 1 11 . 1 1 93 93 ILE N N 93 128.305 128.305 126.909 1.396 25485 13618 1 11 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.402 0.230 25485 13619 1 11 . 1 1 93 93 ILE C C 93 175.468 175.468 176.440 -0.972 25485 13620 1 11 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.187 1.041 25485 13621 1 11 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.646 0.579 25485 13622 1 11 . 1 1 93 93 ILE H H 93 8.886 8.886 8.785 0.101 25485 13623 1 11 . 1 1 94 94 VAL N N 94 126.647 126.647 125.883 0.764 25485 13624 1 11 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.220 -0.224 25485 13625 1 11 . 1 1 94 94 VAL C C 94 175.670 175.670 176.281 -0.611 25485 13626 1 11 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.104 0.310 25485 13627 1 11 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.442 0.577 25485 13628 1 11 . 1 1 94 94 VAL H H 94 9.517 9.517 8.795 0.722 25485 13629 1 11 . 1 1 95 95 SER N N 95 113.398 113.398 113.890 -0.492 25485 13630 1 11 . 1 1 95 95 SER HA H 95 4.701 4.701 4.654 0.047 25485 13631 1 11 . 1 1 95 95 SER C C 95 170.684 170.684 172.424 -1.740 25485 13632 1 11 . 1 1 95 95 SER CA C 95 56.945 56.945 57.264 -0.319 25485 13633 1 11 . 1 1 95 95 SER CB C 95 65.276 65.276 65.166 0.110 25485 13634 1 11 . 1 1 95 95 SER H H 95 7.463 7.463 7.626 -0.163 25485 13635 1 11 . 1 1 96 96 TYR N N 96 116.512 116.512 119.016 -2.504 25485 13636 1 11 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.617 -0.353 25485 13637 1 11 . 1 1 96 96 TYR C C 96 174.856 174.856 174.435 0.421 25485 13638 1 11 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.516 2.121 25485 13639 1 11 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.589 1.574 25485 13640 1 11 . 1 1 96 96 TYR H H 96 8.240 8.240 8.189 0.051 25485 13641 1 11 . 1 1 97 97 THR CA C 97 57.798 57.798 60.655 -2.857 25485 13642 1 11 . 1 1 97 97 THR CB C 97 67.420 67.420 69.582 -2.162 25485 13643 1 11 . 1 1 98 98 ARG N N 98 128.156 128.156 124.728 3.428 25485 13644 1 11 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.142 0.183 25485 13645 1 11 . 1 1 98 98 ARG C C 98 177.625 177.625 176.272 1.353 25485 13646 1 11 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.331 -1.117 25485 13647 1 11 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.733 -0.253 25485 13648 1 11 . 1 1 98 98 ARG H H 98 8.914 8.914 8.697 0.217 25485 13649 1 11 . 1 1 99 99 ASP N N 99 120.592 120.592 117.956 2.636 25485 13650 1 11 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.654 -0.273 25485 13651 1 11 . 1 1 99 99 ASP C C 99 175.679 175.679 175.479 0.200 25485 13652 1 11 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.816 1.621 25485 13653 1 11 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.569 0.801 25485 13654 1 11 . 1 1 99 99 ASP H H 99 8.708 8.708 8.408 0.300 25485 13655 1 11 . 1 1 100 100 LEU N N 100 116.829 116.829 119.568 -2.739 25485 13656 1 11 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.698 0.258 25485 13657 1 11 . 1 1 100 100 LEU C C 100 173.335 173.335 174.225 -0.890 25485 13658 1 11 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.972 -0.935 25485 13659 1 11 . 1 1 100 100 LEU CB C 100 46.267 46.267 43.931 2.337 25485 13660 1 11 . 1 1 100 100 LEU H H 100 6.916 6.916 7.243 -0.327 25485 13661 1 11 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.192 -0.017 25485 13662 1 11 . 1 1 102 102 HIS C C 102 177.649 177.649 177.580 0.069 25485 13663 1 11 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.263 -0.590 25485 13664 1 11 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.121 -1.687 25485 13665 1 11 . 1 1 103 103 ILE N N 103 115.170 115.170 118.321 -3.151 25485 13666 1 11 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.820 0.353 25485 13667 1 11 . 1 1 103 103 ILE C C 103 177.214 177.214 177.135 0.079 25485 13668 1 11 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.064 -0.899 25485 13669 1 11 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.930 -0.165 25485 13670 1 11 . 1 1 103 103 ILE H H 103 8.234 8.234 8.225 0.009 25485 13671 1 11 . 1 1 104 104 THR N N 104 119.374 119.374 117.521 1.853 25485 13672 1 11 . 1 1 104 104 THR HA H 104 4.045 4.045 3.969 0.076 25485 13673 1 11 . 1 1 104 104 THR C C 104 175.612 175.612 176.485 -0.873 25485 13674 1 11 . 1 1 104 104 THR CA C 104 66.568 66.568 67.273 -0.705 25485 13675 1 11 . 1 1 104 104 THR CB C 104 68.077 68.077 68.775 -0.698 25485 13676 1 11 . 1 1 104 104 THR H H 104 6.947 6.947 7.687 -0.740 25485 13677 1 11 . 1 1 105 105 VAL N N 105 123.263 123.263 121.343 1.920 25485 13678 1 11 . 1 1 105 105 VAL HA H 105 3.438 3.438 2.896 0.542 25485 13679 1 11 . 1 1 105 105 VAL C C 105 177.322 177.322 177.048 0.274 25485 13680 1 11 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.298 0.649 25485 13681 1 11 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.522 -0.253 25485 13682 1 11 . 1 1 105 105 VAL H H 105 7.407 7.407 7.870 -0.463 25485 13683 1 11 . 1 1 106 106 ASP N N 106 119.972 119.972 119.560 0.412 25485 13684 1 11 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.472 -0.150 25485 13685 1 11 . 1 1 106 106 ASP C C 106 179.747 179.747 178.380 1.367 25485 13686 1 11 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.187 1.048 25485 13687 1 11 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.906 -0.544 25485 13688 1 11 . 1 1 106 106 ASP H H 106 8.627 8.627 7.837 0.790 25485 13689 1 11 . 1 1 107 107 ARG N N 107 121.033 121.033 119.369 1.664 25485 13690 1 11 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.141 0.037 25485 13691 1 11 . 1 1 107 107 ARG C C 107 179.485 179.485 178.501 0.984 25485 13692 1 11 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.712 0.868 25485 13693 1 11 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.380 0.828 25485 13694 1 11 . 1 1 107 107 ARG H H 107 8.356 8.356 7.924 0.432 25485 13695 1 11 . 1 1 108 108 LEU N N 108 121.463 121.463 120.770 0.693 25485 13696 1 11 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.190 0.115 25485 13697 1 11 . 1 1 108 108 LEU C C 108 178.852 178.852 178.894 -0.042 25485 13698 1 11 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.593 0.289 25485 13699 1 11 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.245 0.070 25485 13700 1 11 . 1 1 108 108 LEU H H 108 8.790 8.790 7.701 1.089 25485 13701 1 11 . 1 1 109 109 VAL N N 109 120.233 120.233 116.815 3.418 25485 13702 1 11 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.672 -0.272 25485 13703 1 11 . 1 1 109 109 VAL C C 109 177.019 177.019 177.655 -0.636 25485 13704 1 11 . 1 1 109 109 VAL CA C 109 68.046 68.046 67.058 0.988 25485 13705 1 11 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.253 -0.064 25485 13706 1 11 . 1 1 109 109 VAL H H 109 8.787 8.787 7.880 0.907 25485 13707 1 11 . 1 1 110 110 SER N N 110 112.862 112.862 116.076 -3.214 25485 13708 1 11 . 1 1 110 110 SER HA H 110 4.300 4.300 4.137 0.163 25485 13709 1 11 . 1 1 110 110 SER C C 110 176.770 176.770 176.850 -0.080 25485 13710 1 11 . 1 1 110 110 SER CA C 110 61.744 61.744 61.523 0.221 25485 13711 1 11 . 1 1 110 110 SER CB C 110 62.742 62.742 62.912 -0.170 25485 13712 1 11 . 1 1 110 110 SER H H 110 7.605 7.605 7.944 -0.339 25485 13713 1 11 . 1 1 111 111 LYS N N 111 122.319 122.319 122.279 0.040 25485 13714 1 11 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.078 -0.017 25485 13715 1 11 . 1 1 111 111 LYS C C 111 178.309 178.309 178.244 0.065 25485 13716 1 11 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.173 0.641 25485 13717 1 11 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.563 -0.054 25485 13718 1 11 . 1 1 111 111 LYS H H 111 8.156 8.156 7.975 0.181 25485 13719 1 11 . 1 1 112 112 ALA N N 112 124.147 124.147 120.342 3.805 25485 13720 1 11 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.307 -0.208 25485 13721 1 11 . 1 1 112 112 ALA C C 112 179.445 179.445 178.791 0.654 25485 13722 1 11 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.009 1.217 25485 13723 1 11 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.404 0.570 25485 13724 1 11 . 1 1 112 112 ALA H H 112 8.278 8.278 7.578 0.700 25485 13725 1 11 . 1 1 113 113 LEU N N 113 116.195 116.195 120.361 -4.166 25485 13726 1 11 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.110 -0.359 25485 13727 1 11 . 1 1 113 113 LEU C C 113 179.537 179.537 178.121 1.416 25485 13728 1 11 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.100 -0.356 25485 13729 1 11 . 1 1 113 113 LEU CB C 113 40.555 40.555 42.008 -1.453 25485 13730 1 11 . 1 1 113 113 LEU H H 113 8.021 8.021 8.579 -0.558 25485 13731 1 11 . 1 1 114 114 ASN N N 114 116.570 116.570 117.847 -1.277 25485 13732 1 11 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.582 -0.036 25485 13733 1 11 . 1 1 114 114 ASN C C 114 177.136 177.136 177.391 -0.255 25485 13734 1 11 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.037 -0.273 25485 13735 1 11 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.202 0.421 25485 13736 1 11 . 1 1 114 114 ASN H H 114 8.212 8.212 8.332 -0.120 25485 13737 1 11 . 1 1 115 115 MET N N 115 122.055 122.055 119.294 2.761 25485 13738 1 11 . 1 1 115 115 MET HA H 115 4.010 4.010 3.966 0.044 25485 13739 1 11 . 1 1 115 115 MET C C 115 177.681 177.681 177.683 -0.002 25485 13740 1 11 . 1 1 115 115 MET CA C 115 59.445 59.445 59.110 0.335 25485 13741 1 11 . 1 1 115 115 MET CB C 115 31.616 31.616 32.274 -0.658 25485 13742 1 11 . 1 1 115 115 MET H H 115 7.937 7.937 7.623 0.314 25485 13743 1 11 . 1 1 116 116 TRP N N 116 117.115 117.115 118.039 -0.924 25485 13744 1 11 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.246 0.272 25485 13745 1 11 . 1 1 116 116 TRP C C 116 179.054 179.054 179.180 -0.126 25485 13746 1 11 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.087 0.423 25485 13747 1 11 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.573 1.300 25485 13748 1 11 . 1 1 116 116 TRP H H 116 6.783 6.783 7.367 -0.584 25485 13749 1 11 . 1 1 117 117 GLY N N 117 104.511 104.511 106.624 -2.113 25485 13750 1 11 . 1 1 117 117 GLY C C 117 175.035 175.035 175.782 -0.747 25485 13751 1 11 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.348 0.649 25485 13752 1 11 . 1 1 117 117 GLY H H 117 9.302 9.302 8.007 1.295 25485 13753 1 11 . 1 1 118 118 LYS N N 118 118.580 118.580 119.861 -1.281 25485 13754 1 11 . 1 1 118 118 LYS HA H 118 4.207 4.207 3.970 0.237 25485 13755 1 11 . 1 1 118 118 LYS C C 118 177.235 177.235 177.462 -0.227 25485 13756 1 11 . 1 1 118 118 LYS CA C 118 57.891 57.891 58.048 -0.157 25485 13757 1 11 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.382 -0.477 25485 13758 1 11 . 1 1 118 118 LYS H H 118 7.940 7.940 7.817 0.123 25485 13759 1 11 . 1 1 119 119 GLU N N 119 113.749 113.749 116.781 -3.032 25485 13760 1 11 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.343 0.495 25485 13761 1 11 . 1 1 119 119 GLU C C 119 178.024 178.024 175.500 2.524 25485 13762 1 11 . 1 1 119 119 GLU CA C 119 55.275 55.275 56.002 -0.727 25485 13763 1 11 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.998 0.688 25485 13764 1 11 . 1 1 119 119 GLU H H 119 7.763 7.763 7.463 0.300 25485 13765 1 11 . 1 1 120 120 ILE N N 120 111.144 111.144 113.247 -2.103 25485 13766 1 11 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.661 0.710 25485 13767 1 11 . 1 1 120 120 ILE C C 120 174.033 174.033 174.245 -0.212 25485 13768 1 11 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.609 0.845 25485 13769 1 11 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.767 2.162 25485 13770 1 11 . 1 1 120 120 ILE H H 120 7.518 7.518 7.510 0.008 25485 13771 1 11 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.435 0.227 25485 13772 1 11 . 1 1 121 121 PRO C C 121 174.784 174.784 176.374 -1.590 25485 13773 1 11 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.053 -1.038 25485 13774 1 11 . 1 1 121 121 PRO CB C 121 29.385 29.385 30.200 -0.815 25485 13775 1 11 . 1 1 122 122 LEU N N 122 121.531 121.531 118.679 2.852 25485 13776 1 11 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.449 -0.110 25485 13777 1 11 . 1 1 122 122 LEU C C 122 173.977 173.977 177.067 -3.090 25485 13778 1 11 . 1 1 122 122 LEU CA C 122 54.558 54.558 54.673 -0.116 25485 13779 1 11 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.985 2.414 25485 13780 1 11 . 1 1 122 122 LEU H H 122 6.847 6.847 7.363 -0.516 25485 13781 1 11 . 1 1 123 123 HIS N N 123 121.054 121.054 116.530 4.524 25485 13782 1 11 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.699 -0.092 25485 13783 1 11 . 1 1 123 123 HIS C C 123 172.820 172.820 173.642 -0.822 25485 13784 1 11 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.086 -0.577 25485 13785 1 11 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.859 0.251 25485 13786 1 11 . 1 1 123 123 HIS H H 123 7.760 7.760 8.445 -0.685 25485 13787 1 11 . 1 1 124 124 PHE N N 124 120.465 120.465 124.505 -4.040 25485 13788 1 11 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.527 0.307 25485 13789 1 11 . 1 1 124 124 PHE C C 124 175.677 175.677 175.691 -0.014 25485 13790 1 11 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.469 0.823 25485 13791 1 11 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.355 0.466 25485 13792 1 11 . 1 1 124 124 PHE H H 124 8.306 8.306 8.696 -0.390 25485 13793 1 11 . 1 1 125 125 ARG N N 125 124.008 124.008 123.648 0.360 25485 13794 1 11 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.885 -0.174 25485 13795 1 11 . 1 1 125 125 ARG C C 125 172.901 172.901 175.227 -2.326 25485 13796 1 11 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.843 -0.569 25485 13797 1 11 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.447 -0.625 25485 13798 1 11 . 1 1 125 125 ARG H H 125 8.426 8.426 8.811 -0.385 25485 13799 1 11 . 1 1 126 126 LYS N N 126 130.004 130.004 124.946 5.058 25485 13800 1 11 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.217 -0.834 25485 13801 1 11 . 1 1 126 126 LYS C C 126 176.126 176.126 175.818 0.308 25485 13802 1 11 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.969 0.211 25485 13803 1 11 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.080 -0.053 25485 13804 1 11 . 1 1 126 126 LYS H H 126 8.481 8.481 8.563 -0.082 25485 13805 1 11 . 1 1 127 127 VAL N N 127 125.288 125.288 121.098 4.190 25485 13806 1 11 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.246 0.259 25485 13807 1 11 . 1 1 127 127 VAL C C 127 175.565 175.565 174.754 0.811 25485 13808 1 11 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.489 -1.540 25485 13809 1 11 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.765 1.597 25485 13810 1 11 . 1 1 127 127 VAL H H 127 8.721 8.721 8.181 0.540 25485 13811 1 11 . 1 1 128 128 VAL N N 128 117.467 117.467 117.810 -0.343 25485 13812 1 11 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.110 0.219 25485 13813 1 11 . 1 1 128 128 VAL C C 128 174.622 174.622 174.682 -0.060 25485 13814 1 11 . 1 1 128 128 VAL CA C 128 62.118 62.118 60.806 1.312 25485 13815 1 11 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.829 0.681 25485 13816 1 11 . 1 1 128 128 VAL H H 128 8.406 8.406 8.004 0.402 25485 13817 1 11 . 1 1 129 129 TRP N N 129 119.986 119.986 122.094 -2.108 25485 13818 1 11 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.884 -0.168 25485 13819 1 11 . 1 1 129 129 TRP C C 129 174.536 174.536 176.458 -1.922 25485 13820 1 11 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.723 -0.806 25485 13821 1 11 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.389 2.625 25485 13822 1 11 . 1 1 129 129 TRP H H 129 7.435 7.435 7.315 0.120 25485 13823 1 11 . 1 1 130 130 GLY N N 130 109.900 109.900 112.588 -2.688 25485 13824 1 11 . 1 1 130 130 GLY C C 130 173.187 173.187 173.901 -0.714 25485 13825 1 11 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.464 0.016 25485 13826 1 11 . 1 1 130 130 GLY H H 130 8.006 8.006 8.410 -0.404 25485 13827 1 11 . 1 1 131 131 THR N N 131 116.142 116.142 116.103 0.039 25485 13828 1 11 . 1 1 131 131 THR HA H 131 4.162 4.162 4.466 -0.304 25485 13829 1 11 . 1 1 131 131 THR C C 131 172.766 172.766 173.094 -0.328 25485 13830 1 11 . 1 1 131 131 THR CA C 131 63.212 63.212 61.547 1.665 25485 13831 1 11 . 1 1 131 131 THR CB C 131 69.308 69.308 70.196 -0.888 25485 13832 1 11 . 1 1 131 131 THR H H 131 8.233 8.233 8.145 0.088 25485 13833 1 11 . 1 1 132 132 ALA N N 132 129.807 129.807 124.801 5.006 25485 13834 1 11 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.682 -0.166 25485 13835 1 11 . 1 1 132 132 ALA C C 132 175.358 175.358 176.593 -1.235 25485 13836 1 11 . 1 1 132 132 ALA CA C 132 49.366 49.366 49.864 -0.498 25485 13837 1 11 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.551 1.247 25485 13838 1 11 . 1 1 132 132 ALA H H 132 7.962 7.962 8.524 -0.562 25485 13839 1 11 . 1 1 133 133 ASP N N 133 122.896 122.896 120.164 2.732 25485 13840 1 11 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.479 -0.058 25485 13841 1 11 . 1 1 133 133 ASP C C 133 177.314 177.314 177.168 0.146 25485 13842 1 11 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.396 1.523 25485 13843 1 11 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.253 -0.782 25485 13844 1 11 . 1 1 133 133 ASP H H 133 8.251 8.251 8.290 -0.039 25485 13845 1 11 . 1 1 134 134 ILE N N 134 125.472 125.472 122.706 2.766 25485 13846 1 11 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.419 -0.276 25485 13847 1 11 . 1 1 134 134 ILE C C 134 174.201 174.201 175.202 -1.001 25485 13848 1 11 . 1 1 134 134 ILE CA C 134 61.271 61.271 60.758 0.513 25485 13849 1 11 . 1 1 134 134 ILE CB C 134 38.710 38.710 37.385 1.325 25485 13850 1 11 . 1 1 134 134 ILE H H 134 8.802 8.802 8.316 0.486 25485 13851 1 11 . 1 1 135 135 MET N N 135 127.265 127.265 127.817 -0.552 25485 13852 1 11 . 1 1 135 135 MET HA H 135 5.192 5.192 5.311 -0.119 25485 13853 1 11 . 1 1 135 135 MET C C 135 176.206 176.206 175.544 0.662 25485 13854 1 11 . 1 1 135 135 MET CA C 135 53.626 53.626 52.602 1.024 25485 13855 1 11 . 1 1 135 135 MET CB C 135 32.639 32.639 33.684 -1.045 25485 13856 1 11 . 1 1 135 135 MET H H 135 7.418 7.418 8.408 -0.990 25485 13857 1 11 . 1 1 136 136 ILE N N 136 125.440 125.440 123.194 2.246 25485 13858 1 11 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.897 0.692 25485 13859 1 11 . 1 1 136 136 ILE C C 136 175.190 175.190 175.804 -0.614 25485 13860 1 11 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.880 1.228 25485 13861 1 11 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.963 3.977 25485 13862 1 11 . 1 1 136 136 ILE H H 136 9.124 9.124 8.873 0.251 25485 13863 1 11 . 1 1 137 137 GLY N N 137 112.211 112.211 114.613 -2.402 25485 13864 1 11 . 1 1 137 137 GLY C C 137 170.855 170.855 171.795 -0.940 25485 13865 1 11 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.119 1.286 25485 13866 1 11 . 1 1 137 137 GLY H H 137 8.594 8.594 8.162 0.432 25485 13867 1 11 . 1 1 138 138 PHE N N 138 119.463 119.463 119.550 -0.087 25485 13868 1 11 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.081 0.415 25485 13869 1 11 . 1 1 138 138 PHE C C 138 175.186 175.186 175.736 -0.550 25485 13870 1 11 . 1 1 138 138 PHE CA C 138 55.995 55.995 57.505 -1.510 25485 13871 1 11 . 1 1 138 138 PHE CB C 138 41.442 41.442 42.205 -0.763 25485 13872 1 11 . 1 1 138 138 PHE H H 138 7.857 7.857 8.475 -0.618 25485 13873 1 11 . 1 1 139 139 ALA N N 139 123.914 123.914 123.760 0.154 25485 13874 1 11 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.611 0.120 25485 13875 1 11 . 1 1 139 139 ALA C C 139 174.613 174.613 175.087 -0.474 25485 13876 1 11 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.449 -1.414 25485 13877 1 11 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.557 1.915 25485 13878 1 11 . 1 1 139 139 ALA H H 139 8.955 8.955 8.493 0.462 25485 13879 1 11 . 1 1 140 140 ARG N N 140 118.339 118.339 120.463 -2.124 25485 13880 1 11 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.874 0.232 25485 13881 1 11 . 1 1 140 140 ARG C C 140 176.201 176.201 178.238 -2.037 25485 13882 1 11 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.976 -0.810 25485 13883 1 11 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.920 0.549 25485 13884 1 11 . 1 1 140 140 ARG H H 140 8.546 8.546 8.461 0.085 25485 13885 1 11 . 1 1 141 141 GLY N N 141 108.916 108.916 108.653 0.263 25485 13886 1 11 . 1 1 141 141 GLY C C 141 175.595 175.595 174.898 0.697 25485 13887 1 11 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.246 -0.956 25485 13888 1 11 . 1 1 141 141 GLY H H 141 8.989 8.989 8.930 0.059 25485 13889 1 11 . 1 1 142 142 ALA N N 142 121.448 121.448 121.234 0.214 25485 13890 1 11 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.321 0.087 25485 13891 1 11 . 1 1 142 142 ALA C C 142 177.027 177.027 177.525 -0.498 25485 13892 1 11 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.236 1.041 25485 13893 1 11 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.006 -0.042 25485 13894 1 11 . 1 1 142 142 ALA H H 142 8.642 8.642 8.064 0.578 25485 13895 1 11 . 1 1 143 143 HIS N N 143 120.356 120.356 114.716 5.640 25485 13896 1 11 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.481 0.676 25485 13897 1 11 . 1 1 143 143 HIS C C 143 174.303 174.303 176.044 -1.741 25485 13898 1 11 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.674 -0.221 25485 13899 1 11 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.523 -1.732 25485 13900 1 11 . 1 1 143 143 HIS H H 143 8.990 8.990 7.949 1.041 25485 13901 1 11 . 1 1 144 144 GLY N N 144 112.517 112.517 108.202 4.315 25485 13902 1 11 . 1 1 144 144 GLY C C 144 173.758 173.758 173.079 0.679 25485 13903 1 11 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.769 1.326 25485 13904 1 11 . 1 1 144 144 GLY H H 144 5.175 5.175 7.693 -2.518 25485 13905 1 11 . 1 1 145 145 ASP N N 145 117.762 117.762 118.113 -0.351 25485 13906 1 11 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.683 0.015 25485 13907 1 11 . 1 1 145 145 ASP C C 145 175.851 175.851 175.076 0.775 25485 13908 1 11 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.950 -0.991 25485 13909 1 11 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.302 -0.503 25485 13910 1 11 . 1 1 145 145 ASP H H 145 7.096 7.096 7.364 -0.268 25485 13911 1 11 . 1 1 146 146 SER N N 146 125.540 125.540 115.438 10.102 25485 13912 1 11 . 1 1 146 146 SER HA H 146 4.204 4.204 4.238 -0.034 25485 13913 1 11 . 1 1 146 146 SER C C 146 172.319 172.319 174.028 -1.709 25485 13914 1 11 . 1 1 146 146 SER CA C 146 58.862 58.862 58.933 -0.071 25485 13915 1 11 . 1 1 146 146 SER CB C 146 62.933 62.933 63.288 -0.355 25485 13916 1 11 . 1 1 146 146 SER H H 146 8.261 8.261 8.550 -0.289 25485 13917 1 11 . 1 1 147 147 TYR N N 147 120.757 120.757 115.971 4.786 25485 13918 1 11 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.304 0.518 25485 13919 1 11 . 1 1 147 147 TYR C C 147 170.372 170.372 174.005 -3.633 25485 13920 1 11 . 1 1 147 147 TYR CA C 147 53.268 53.268 56.585 -3.317 25485 13921 1 11 . 1 1 147 147 TYR CB C 147 38.296 38.296 36.650 1.646 25485 13922 1 11 . 1 1 147 147 TYR H H 147 7.450 7.450 8.234 -0.784 25485 13923 1 11 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.594 0.278 25485 13924 1 11 . 1 1 148 148 PRO C C 148 179.009 179.009 176.424 2.585 25485 13925 1 11 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.502 0.873 25485 13926 1 11 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.518 -1.609 25485 13927 1 11 . 1 1 149 149 PHE N N 149 120.514 120.514 119.397 1.117 25485 13928 1 11 . 1 1 149 149 PHE C C 149 176.813 176.813 175.840 0.973 25485 13929 1 11 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.303 -0.850 25485 13930 1 11 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.422 0.151 25485 13931 1 11 . 1 1 149 149 PHE H H 149 8.024 8.024 8.548 -0.524 25485 13932 1 11 . 1 1 150 150 ASP N N 150 115.555 115.555 118.746 -3.191 25485 13933 1 11 . 1 1 150 150 ASP HA H 150 4.839 4.839 3.943 0.896 25485 13934 1 11 . 1 1 150 150 ASP C C 150 177.007 177.007 175.265 1.742 25485 13935 1 11 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.547 -0.676 25485 13936 1 11 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.083 2.853 25485 13937 1 11 . 1 1 150 150 ASP H H 150 7.511 7.511 7.659 -0.148 25485 13938 1 11 . 1 1 151 151 GLY N N 151 110.650 110.650 109.355 1.295 25485 13939 1 11 . 1 1 151 151 GLY C C 151 170.281 170.281 172.024 -1.743 25485 13940 1 11 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.617 -0.219 25485 13941 1 11 . 1 1 151 151 GLY H H 151 9.080 9.080 7.583 1.497 25485 13942 1 11 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.532 -0.476 25485 13943 1 11 . 1 1 152 152 PRO C C 152 178.300 178.300 176.824 1.476 25485 13944 1 11 . 1 1 152 152 PRO CA C 152 63.850 63.850 62.946 0.904 25485 13945 1 11 . 1 1 152 152 PRO CB C 152 31.260 31.260 32.116 -0.856 25485 13946 1 11 . 1 1 153 153 GLY N N 153 118.783 118.783 113.777 5.006 25485 13947 1 11 . 1 1 153 153 GLY C C 153 174.098 174.098 173.567 0.531 25485 13948 1 11 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.442 -0.836 25485 13949 1 11 . 1 1 153 153 GLY H H 153 11.431 11.431 9.162 2.269 25485 13950 1 11 . 1 1 154 154 ASN N N 154 120.679 120.679 122.385 -1.706 25485 13951 1 11 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.328 -0.084 25485 13952 1 11 . 1 1 154 154 ASN C C 154 174.636 174.636 174.648 -0.012 25485 13953 1 11 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.671 1.997 25485 13954 1 11 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.485 -1.514 25485 13955 1 11 . 1 1 154 154 ASN H H 154 9.247 9.247 8.567 0.680 25485 13956 1 11 . 1 1 155 155 THR N N 155 118.252 118.252 112.617 5.635 25485 13957 1 11 . 1 1 155 155 THR HA H 155 5.577 5.577 4.203 1.374 25485 13958 1 11 . 1 1 155 155 THR C C 155 176.596 176.596 173.268 3.328 25485 13959 1 11 . 1 1 155 155 THR CA C 155 61.731 61.731 63.189 -1.458 25485 13960 1 11 . 1 1 155 155 THR CB C 155 71.325 71.325 68.612 2.713 25485 13961 1 11 . 1 1 155 155 THR H H 155 9.501 9.501 8.523 0.978 25485 13962 1 11 . 1 1 156 156 LEU N N 156 122.598 122.598 121.676 0.922 25485 13963 1 11 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.462 0.409 25485 13964 1 11 . 1 1 156 156 LEU C C 156 175.655 175.655 176.054 -0.399 25485 13965 1 11 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.241 -0.703 25485 13966 1 11 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.963 1.548 25485 13967 1 11 . 1 1 156 156 LEU H H 156 8.492 8.492 8.088 0.404 25485 13968 1 11 . 1 1 157 157 ALA N N 157 115.389 115.389 115.253 0.136 25485 13969 1 11 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.459 0.576 25485 13970 1 11 . 1 1 157 157 ALA C C 157 175.739 175.739 175.118 0.621 25485 13971 1 11 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.419 -0.480 25485 13972 1 11 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.878 1.576 25485 13973 1 11 . 1 1 157 157 ALA H H 157 7.567 7.567 7.686 -0.119 25485 13974 1 11 . 1 1 158 158 HIS N N 158 111.900 111.900 117.975 -6.075 25485 13975 1 11 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.821 -0.216 25485 13976 1 11 . 1 1 158 158 HIS C C 158 170.186 170.186 172.320 -2.134 25485 13977 1 11 . 1 1 158 158 HIS CA C 158 56.075 56.075 53.930 2.145 25485 13978 1 11 . 1 1 158 158 HIS CB C 158 30.186 30.186 30.569 -0.383 25485 13979 1 11 . 1 1 158 158 HIS H H 158 8.757 8.757 7.729 1.028 25485 13980 1 11 . 1 1 159 159 ALA N N 159 118.286 118.286 125.701 -7.415 25485 13981 1 11 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.049 0.605 25485 13982 1 11 . 1 1 159 159 ALA C C 159 174.036 174.036 174.849 -0.813 25485 13983 1 11 . 1 1 159 159 ALA CA C 159 51.133 51.133 49.767 1.366 25485 13984 1 11 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.834 2.203 25485 13985 1 11 . 1 1 159 159 ALA H H 159 6.110 6.110 8.019 -1.909 25485 13986 1 11 . 1 1 160 160 PHE N N 160 117.937 117.937 117.295 0.642 25485 13987 1 11 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.743 -0.240 25485 13988 1 11 . 1 1 160 160 PHE C C 160 174.455 174.455 174.618 -0.163 25485 13989 1 11 . 1 1 160 160 PHE CA C 160 56.813 56.813 56.326 0.487 25485 13990 1 11 . 1 1 160 160 PHE CB C 160 42.194 42.194 42.622 -0.428 25485 13991 1 11 . 1 1 160 160 PHE H H 160 7.912 7.912 7.764 0.148 25485 13992 1 11 . 1 1 161 161 ALA N N 161 123.531 123.531 122.347 1.184 25485 13993 1 11 . 1 1 161 161 ALA HA H 161 4.491 4.491 5.043 -0.552 25485 13994 1 11 . 1 1 161 161 ALA C C 161 175.503 175.503 176.446 -0.943 25485 13995 1 11 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.312 1.321 25485 13996 1 11 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.512 -2.956 25485 13997 1 11 . 1 1 161 161 ALA H H 161 8.107 8.107 8.623 -0.516 25485 13998 1 11 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.404 -1.494 25485 13999 1 11 . 1 1 162 162 PRO C C 162 173.465 173.465 176.206 -2.741 25485 14000 1 11 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.905 1.352 25485 14001 1 11 . 1 1 162 162 PRO CB C 162 31.242 31.242 30.305 0.937 25485 14002 1 11 . 1 1 163 163 GLY N N 163 107.206 107.206 110.705 -3.499 25485 14003 1 11 . 1 1 163 163 GLY C C 163 172.092 172.092 173.721 -1.629 25485 14004 1 11 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.510 -0.517 25485 14005 1 11 . 1 1 163 163 GLY H H 163 5.997 5.997 7.952 -1.955 25485 14006 1 11 . 1 1 165 165 GLY N N 165 103.110 103.110 106.974 -3.864 25485 14007 1 11 . 1 1 165 165 GLY C C 165 177.158 177.158 175.177 1.981 25485 14008 1 11 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.037 -0.794 25485 14009 1 11 . 1 1 165 165 GLY H H 165 9.145 9.145 7.828 1.317 25485 14010 1 11 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.156 0.023 25485 14011 1 11 . 1 1 166 166 LEU C C 166 176.437 176.437 177.111 -0.674 25485 14012 1 11 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.203 -0.003 25485 14013 1 11 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.178 -0.344 25485 14014 1 11 . 1 1 167 167 GLY N N 167 103.318 103.318 103.568 -0.250 25485 14015 1 11 . 1 1 167 167 GLY C C 167 174.803 174.803 174.274 0.529 25485 14016 1 11 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.424 2.809 25485 14017 1 11 . 1 1 167 167 GLY H H 167 7.768 7.768 7.394 0.374 25485 14018 1 11 . 1 1 168 168 GLY N N 168 121.051 121.051 106.424 14.627 25485 14019 1 11 . 1 1 168 168 GLY C C 168 172.122 172.122 173.995 -1.873 25485 14020 1 11 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.212 1.390 25485 14021 1 11 . 1 1 168 168 GLY H H 168 7.698 7.698 7.901 -0.203 25485 14022 1 11 . 1 1 169 169 ASP N N 169 123.641 123.641 120.919 2.722 25485 14023 1 11 . 1 1 169 169 ASP C C 169 173.942 173.942 173.911 0.031 25485 14024 1 11 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.839 2.003 25485 14025 1 11 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.043 -2.173 25485 14026 1 11 . 1 1 169 169 ASP H H 169 8.595 8.595 7.608 0.987 25485 14027 1 11 . 1 1 170 170 ALA N N 170 119.366 119.366 123.126 -3.760 25485 14028 1 11 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.355 0.375 25485 14029 1 11 . 1 1 170 170 ALA C C 170 174.593 174.593 175.140 -0.547 25485 14030 1 11 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.548 0.576 25485 14031 1 11 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.277 1.058 25485 14032 1 11 . 1 1 170 170 ALA H H 170 8.324 8.324 8.635 -0.311 25485 14033 1 11 . 1 1 171 171 HIS N N 171 120.239 120.239 121.084 -0.845 25485 14034 1 11 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.262 0.486 25485 14035 1 11 . 1 1 171 171 HIS C C 171 172.949 172.949 173.731 -0.782 25485 14036 1 11 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.152 -2.428 25485 14037 1 11 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.869 1.672 25485 14038 1 11 . 1 1 171 171 HIS H H 171 8.499 8.499 7.684 0.815 25485 14039 1 11 . 1 1 172 172 PHE N N 172 121.125 121.125 120.770 0.355 25485 14040 1 11 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.405 0.123 25485 14041 1 11 . 1 1 172 172 PHE C C 172 173.875 173.875 173.974 -0.099 25485 14042 1 11 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.533 0.387 25485 14043 1 11 . 1 1 172 172 PHE CB C 172 41.903 41.903 40.525 1.378 25485 14044 1 11 . 1 1 172 172 PHE H H 172 8.445 8.445 8.077 0.368 25485 14045 1 11 . 1 1 173 173 ASP N N 173 124.014 124.014 123.338 0.676 25485 14046 1 11 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.895 -0.981 25485 14047 1 11 . 1 1 173 173 ASP C C 173 178.613 178.613 177.971 0.642 25485 14048 1 11 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.981 0.817 25485 14049 1 11 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.440 -0.697 25485 14050 1 11 . 1 1 173 173 ASP H H 173 7.927 7.927 8.643 -0.716 25485 14051 1 11 . 1 1 174 174 GLU N N 174 132.469 132.469 126.599 5.870 25485 14052 1 11 . 1 1 174 174 GLU C C 174 176.442 176.442 177.296 -0.854 25485 14053 1 11 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.904 -1.720 25485 14054 1 11 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.738 0.547 25485 14055 1 11 . 1 1 174 174 GLU H H 174 9.528 9.528 8.814 0.714 25485 14056 1 11 . 1 1 175 175 ASP N N 175 117.394 117.394 117.984 -0.590 25485 14057 1 11 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.775 0.018 25485 14058 1 11 . 1 1 175 175 ASP C C 175 176.645 176.645 176.841 -0.196 25485 14059 1 11 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.636 0.295 25485 14060 1 11 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.823 -1.682 25485 14061 1 11 . 1 1 175 175 ASP H H 175 8.768 8.768 8.700 0.068 25485 14062 1 11 . 1 1 176 176 GLU N N 176 116.493 116.493 119.122 -2.629 25485 14063 1 11 . 1 1 176 176 GLU C C 176 175.038 175.038 175.955 -0.917 25485 14064 1 11 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.088 -1.423 25485 14065 1 11 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.671 -4.448 25485 14066 1 11 . 1 1 176 176 GLU H H 176 7.159 7.159 8.240 -1.081 25485 14067 1 11 . 1 1 177 177 ARG N N 177 122.186 122.186 118.847 3.339 25485 14068 1 11 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.536 0.153 25485 14069 1 11 . 1 1 177 177 ARG C C 177 174.482 174.482 174.460 0.022 25485 14070 1 11 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.941 -1.254 25485 14071 1 11 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.469 -1.385 25485 14072 1 11 . 1 1 177 177 ARG H H 177 7.560 7.560 8.157 -0.597 25485 14073 1 11 . 1 1 178 178 TRP N N 178 129.179 129.179 123.874 5.305 25485 14074 1 11 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.479 -0.379 25485 14075 1 11 . 1 1 178 178 TRP C C 178 176.298 176.298 176.485 -0.187 25485 14076 1 11 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.080 0.733 25485 14077 1 11 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.422 -1.225 25485 14078 1 11 . 1 1 178 178 TRP H H 178 8.807 8.807 8.657 0.150 25485 14079 1 11 . 1 1 179 179 THR N N 179 112.792 112.792 113.673 -0.881 25485 14080 1 11 . 1 1 179 179 THR HA H 179 4.985 4.985 4.661 0.324 25485 14081 1 11 . 1 1 179 179 THR C C 179 172.765 172.765 172.629 0.136 25485 14082 1 11 . 1 1 179 179 THR CA C 179 59.106 59.106 61.416 -2.310 25485 14083 1 11 . 1 1 179 179 THR CB C 179 71.786 71.786 70.824 0.962 25485 14084 1 11 . 1 1 179 179 THR H H 179 8.974 8.974 8.320 0.654 25485 14085 1 11 . 1 1 180 180 ASP N N 180 122.074 122.074 124.819 -2.745 25485 14086 1 11 . 1 1 180 180 ASP HA H 180 4.463 4.463 4.905 -0.442 25485 14087 1 11 . 1 1 180 180 ASP C C 180 176.366 176.366 178.385 -2.019 25485 14088 1 11 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.892 -2.849 25485 14089 1 11 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.091 -0.363 25485 14090 1 11 . 1 1 180 180 ASP H H 180 8.485 8.485 8.958 -0.473 25485 14091 1 11 . 1 1 181 181 GLY N N 181 110.123 110.123 108.368 1.755 25485 14092 1 11 . 1 1 181 181 GLY C C 181 174.325 174.325 175.641 -1.316 25485 14093 1 11 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.679 0.982 25485 14094 1 11 . 1 1 181 181 GLY H H 181 8.569 8.569 8.696 -0.127 25485 14095 1 11 . 1 1 182 182 SER N N 182 115.562 115.562 114.979 0.583 25485 14096 1 11 . 1 1 182 182 SER HA H 182 4.519 4.519 4.454 0.065 25485 14097 1 11 . 1 1 182 182 SER C C 182 173.783 173.783 173.984 -0.201 25485 14098 1 11 . 1 1 182 182 SER CA C 182 57.965 57.965 58.091 -0.126 25485 14099 1 11 . 1 1 182 182 SER CB C 182 64.166 64.166 64.148 0.018 25485 14100 1 11 . 1 1 182 182 SER H H 182 8.160 8.160 7.612 0.548 25485 14101 1 11 . 1 1 183 183 SER N N 183 117.153 117.153 115.116 2.037 25485 14102 1 11 . 1 1 183 183 SER HA H 183 4.275 4.275 4.386 -0.111 25485 14103 1 11 . 1 1 183 183 SER C C 183 173.333 173.333 174.370 -1.037 25485 14104 1 11 . 1 1 183 183 SER CA C 183 59.902 59.902 58.949 0.953 25485 14105 1 11 . 1 1 183 183 SER CB C 183 64.941 64.941 62.255 2.686 25485 14106 1 11 . 1 1 183 183 SER H H 183 7.796 7.796 7.788 0.008 25485 14107 1 11 . 1 1 184 184 LEU N N 184 122.351 122.351 119.320 3.031 25485 14108 1 11 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.497 -0.105 25485 14109 1 11 . 1 1 184 184 LEU C C 184 176.250 176.250 176.091 0.159 25485 14110 1 11 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.528 0.047 25485 14111 1 11 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.876 -0.795 25485 14112 1 11 . 1 1 184 184 LEU H H 184 8.092 8.092 7.861 0.231 25485 14113 1 11 . 1 1 185 185 GLY N N 185 108.871 108.871 107.624 1.247 25485 14114 1 11 . 1 1 185 185 GLY C C 185 172.375 172.375 174.095 -1.720 25485 14115 1 11 . 1 1 185 185 GLY CA C 185 44.380 44.380 43.987 0.393 25485 14116 1 11 . 1 1 185 185 GLY H H 185 7.960 7.960 7.540 0.420 25485 14117 1 11 . 1 1 186 186 ILE N N 186 123.096 123.096 122.102 0.994 25485 14118 1 11 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.111 -0.270 25485 14119 1 11 . 1 1 186 186 ILE C C 186 175.350 175.350 175.857 -0.507 25485 14120 1 11 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.075 -0.674 25485 14121 1 11 . 1 1 186 186 ILE CB C 186 35.456 35.456 34.973 0.483 25485 14122 1 11 . 1 1 186 186 ILE H H 186 8.893 8.893 8.140 0.753 25485 14123 1 11 . 1 1 187 187 ASN N N 187 127.167 127.167 127.118 0.049 25485 14124 1 11 . 1 1 187 187 ASN HA H 187 4.353 4.353 5.018 -0.665 25485 14125 1 11 . 1 1 187 187 ASN C C 187 175.849 175.849 177.059 -1.210 25485 14126 1 11 . 1 1 187 187 ASN CA C 187 55.714 55.714 53.161 2.553 25485 14127 1 11 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.105 1.025 25485 14128 1 11 . 1 1 187 187 ASN H H 187 8.580 8.580 8.251 0.329 25485 14129 1 11 . 1 1 188 188 PHE N N 188 129.985 129.985 126.854 3.131 25485 14130 1 11 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.390 0.183 25485 14131 1 11 . 1 1 188 188 PHE C C 188 175.578 175.578 177.557 -1.979 25485 14132 1 11 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.484 -0.756 25485 14133 1 11 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.622 -0.190 25485 14134 1 11 . 1 1 188 188 PHE H H 188 9.361 9.361 8.295 1.066 25485 14135 1 11 . 1 1 189 189 LEU N N 189 119.113 119.113 119.135 -0.022 25485 14136 1 11 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.199 -0.398 25485 14137 1 11 . 1 1 189 189 LEU C C 189 179.601 179.601 178.465 1.136 25485 14138 1 11 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.246 0.263 25485 14139 1 11 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.112 -1.235 25485 14140 1 11 . 1 1 189 189 LEU H H 189 8.562 8.562 8.257 0.305 25485 14141 1 11 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.985 -0.068 25485 14142 1 11 . 1 1 190 190 TYR C C 190 177.621 177.621 177.411 0.210 25485 14143 1 11 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.946 -0.138 25485 14144 1 11 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.900 1.869 25485 14145 1 11 . 1 1 191 191 ALA N N 191 120.352 120.352 121.732 -1.380 25485 14146 1 11 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.126 0.189 25485 14147 1 11 . 1 1 191 191 ALA C C 191 180.252 180.252 178.877 1.375 25485 14148 1 11 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.723 0.459 25485 14149 1 11 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.503 0.639 25485 14150 1 11 . 1 1 191 191 ALA H H 191 7.993 7.993 9.072 -1.079 25485 14151 1 11 . 1 1 192 192 ALA N N 192 121.409 121.409 121.347 0.062 25485 14152 1 11 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.111 -0.054 25485 14153 1 11 . 1 1 192 192 ALA C C 192 178.575 178.575 179.498 -0.923 25485 14154 1 11 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.552 -0.367 25485 14155 1 11 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.283 -2.085 25485 14156 1 11 . 1 1 192 192 ALA H H 192 9.297 9.297 8.501 0.796 25485 14157 1 11 . 1 1 193 193 THR N N 193 116.996 116.996 113.090 3.906 25485 14158 1 11 . 1 1 193 193 THR HA H 193 3.833 3.833 4.128 -0.295 25485 14159 1 11 . 1 1 193 193 THR CA C 193 69.138 69.138 67.063 2.075 25485 14160 1 11 . 1 1 193 193 THR CB C 193 67.365 67.365 68.007 -0.642 25485 14161 1 11 . 1 1 193 193 THR H H 193 8.226 8.226 7.855 0.371 25485 14162 1 11 . 1 1 194 194 HIS N N 194 120.296 120.296 122.635 -2.339 25485 14163 1 11 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.377 -0.141 25485 14164 1 11 . 1 1 194 194 HIS C C 194 175.962 175.962 177.079 -1.117 25485 14165 1 11 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.218 1.529 25485 14166 1 11 . 1 1 194 194 HIS CB C 194 27.919 27.919 30.025 -2.106 25485 14167 1 11 . 1 1 194 194 HIS H H 194 7.782 7.782 7.493 0.289 25485 14168 1 11 . 1 1 195 195 ALA N N 195 121.290 121.290 122.345 -1.055 25485 14169 1 11 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.910 0.246 25485 14170 1 11 . 1 1 195 195 ALA CA C 195 55.964 55.964 55.209 0.755 25485 14171 1 11 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.468 0.242 25485 14172 1 11 . 1 1 195 195 ALA H H 195 8.690 8.690 8.397 0.293 25485 14173 1 11 . 1 1 196 196 LEU N N 196 114.899 114.899 118.019 -3.120 25485 14174 1 11 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.234 -0.064 25485 14175 1 11 . 1 1 196 196 LEU C C 196 177.946 177.946 179.749 -1.803 25485 14176 1 11 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.179 -0.951 25485 14177 1 11 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.956 -1.180 25485 14178 1 11 . 1 1 196 196 LEU H H 196 8.715 8.715 8.829 -0.114 25485 14179 1 11 . 1 1 197 197 GLY N N 197 107.901 107.901 105.235 2.666 25485 14180 1 11 . 1 1 197 197 GLY C C 197 178.641 178.641 175.644 2.997 25485 14181 1 11 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.522 1.045 25485 14182 1 11 . 1 1 197 197 GLY H H 197 7.546 7.546 8.178 -0.632 25485 14183 1 11 . 1 1 198 198 HIS N N 198 122.017 122.017 120.233 1.784 25485 14184 1 11 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.421 0.436 25485 14185 1 11 . 1 1 198 198 HIS C C 198 179.874 179.874 178.289 1.585 25485 14186 1 11 . 1 1 198 198 HIS CA C 198 58.522 58.522 58.028 0.494 25485 14187 1 11 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.576 -2.030 25485 14188 1 11 . 1 1 198 198 HIS H H 198 7.196 7.196 7.573 -0.377 25485 14189 1 11 . 1 1 199 199 SER N N 199 118.486 118.486 115.596 2.890 25485 14190 1 11 . 1 1 199 199 SER HA H 199 4.490 4.490 4.431 0.059 25485 14191 1 11 . 1 1 199 199 SER C C 199 174.493 174.493 176.202 -1.709 25485 14192 1 11 . 1 1 199 199 SER CA C 199 58.173 58.173 61.002 -2.829 25485 14193 1 11 . 1 1 199 199 SER CB C 199 63.589 63.589 63.061 0.528 25485 14194 1 11 . 1 1 199 199 SER H H 199 7.884 7.884 7.847 0.037 25485 14195 1 11 . 1 1 200 200 LEU N N 200 114.686 114.686 118.633 -3.947 25485 14196 1 11 . 1 1 200 200 LEU C C 200 177.720 177.720 177.566 0.154 25485 14197 1 11 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.468 0.369 25485 14198 1 11 . 1 1 200 200 LEU CB C 200 42.357 42.357 40.393 1.964 25485 14199 1 11 . 1 1 200 200 LEU H H 200 7.108 7.108 6.865 0.243 25485 14200 1 11 . 1 1 201 201 GLY N N 201 108.363 108.363 106.562 1.801 25485 14201 1 11 . 1 1 201 201 GLY C C 201 174.008 174.008 174.674 -0.666 25485 14202 1 11 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.704 -1.290 25485 14203 1 11 . 1 1 201 201 GLY H H 201 8.195 8.195 8.015 0.180 25485 14204 1 11 . 1 1 202 202 MET N N 202 119.635 119.635 121.539 -1.904 25485 14205 1 11 . 1 1 202 202 MET HA H 202 4.473 4.473 4.321 0.152 25485 14206 1 11 . 1 1 202 202 MET C C 202 176.593 176.593 175.343 1.250 25485 14207 1 11 . 1 1 202 202 MET CA C 202 54.500 54.500 55.733 -1.233 25485 14208 1 11 . 1 1 202 202 MET CB C 202 32.161 32.161 33.211 -1.050 25485 14209 1 11 . 1 1 202 202 MET H H 202 8.182 8.182 7.191 0.991 25485 14210 1 11 . 1 1 203 203 GLY N N 203 109.749 109.749 112.415 -2.666 25485 14211 1 11 . 1 1 203 203 GLY C C 203 174.042 174.042 174.070 -0.028 25485 14212 1 11 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.584 -0.580 25485 14213 1 11 . 1 1 203 203 GLY H H 203 8.405 8.405 8.347 0.058 25485 14214 1 11 . 1 1 204 204 HIS N N 204 115.732 115.732 118.923 -3.191 25485 14215 1 11 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.407 0.993 25485 14216 1 11 . 1 1 204 204 HIS C C 204 174.430 174.430 174.447 -0.017 25485 14217 1 11 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.945 -2.131 25485 14218 1 11 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.610 -0.784 25485 14219 1 11 . 1 1 204 204 HIS H H 204 8.364 8.364 8.688 -0.324 25485 14220 1 11 . 1 1 205 205 SER N N 205 115.484 115.484 113.920 1.564 25485 14221 1 11 . 1 1 205 205 SER HA H 205 4.766 4.766 4.745 0.021 25485 14222 1 11 . 1 1 205 205 SER C C 205 173.611 173.611 174.554 -0.943 25485 14223 1 11 . 1 1 205 205 SER CA C 205 54.729 54.729 57.526 -2.797 25485 14224 1 11 . 1 1 205 205 SER CB C 205 65.855 65.855 66.384 -0.529 25485 14225 1 11 . 1 1 205 205 SER H H 205 7.231 7.231 8.335 -1.104 25485 14226 1 11 . 1 1 206 206 SER N N 206 119.263 119.263 117.913 1.350 25485 14227 1 11 . 1 1 206 206 SER HA H 206 3.701 3.701 4.852 -1.151 25485 14228 1 11 . 1 1 206 206 SER C C 206 173.635 173.635 174.494 -0.859 25485 14229 1 11 . 1 1 206 206 SER CA C 206 63.846 63.846 59.446 4.400 25485 14230 1 11 . 1 1 206 206 SER CB C 206 63.764 63.764 63.948 -0.184 25485 14231 1 11 . 1 1 206 206 SER H H 206 8.289 8.289 9.030 -0.741 25485 14232 1 11 . 1 1 207 207 ASP N N 207 126.646 126.646 122.666 3.980 25485 14233 1 11 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.612 0.317 25485 14234 1 11 . 1 1 207 207 ASP C C 207 174.614 174.614 175.259 -0.645 25485 14235 1 11 . 1 1 207 207 ASP CA C 207 51.272 51.272 53.239 -1.967 25485 14236 1 11 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.170 -0.882 25485 14237 1 11 . 1 1 207 207 ASP H H 207 8.541 8.541 8.074 0.467 25485 14238 1 11 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.275 0.512 25485 14239 1 11 . 1 1 208 208 PRO C C 208 177.467 177.467 175.582 1.885 25485 14240 1 11 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.692 -0.856 25485 14241 1 11 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.241 -0.644 25485 14242 1 11 . 1 1 209 209 ASN N N 209 116.020 116.020 112.594 3.426 25485 14243 1 11 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.627 0.014 25485 14244 1 11 . 1 1 209 209 ASN C C 209 174.695 174.695 173.866 0.829 25485 14245 1 11 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.353 1.867 25485 14246 1 11 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.513 0.597 25485 14247 1 11 . 1 1 209 209 ASN H H 209 8.350 8.350 7.837 0.513 25485 14248 1 11 . 1 1 210 210 ALA N N 210 124.892 124.892 121.636 3.256 25485 14249 1 11 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.420 -0.325 25485 14250 1 11 . 1 1 210 210 ALA C C 210 179.495 179.495 177.927 1.568 25485 14251 1 11 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.304 1.750 25485 14252 1 11 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.585 -1.386 25485 14253 1 11 . 1 1 210 210 ALA H H 210 8.193 8.193 7.308 0.885 25485 14254 1 11 . 1 1 211 211 VAL N N 211 130.402 130.402 123.668 6.734 25485 14255 1 11 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.709 0.554 25485 14256 1 11 . 1 1 211 211 VAL C C 211 179.408 179.408 176.167 3.241 25485 14257 1 11 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.741 0.311 25485 14258 1 11 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.105 -1.122 25485 14259 1 11 . 1 1 211 211 VAL H H 211 11.592 11.592 8.487 3.105 25485 14260 1 11 . 1 1 212 212 MET N N 212 113.285 113.285 113.996 -0.711 25485 14261 1 11 . 1 1 212 212 MET C C 212 176.996 176.996 175.123 1.873 25485 14262 1 11 . 1 1 212 212 MET CA C 212 53.614 53.614 52.817 0.797 25485 14263 1 11 . 1 1 212 212 MET CB C 212 26.975 26.975 30.641 -3.666 25485 14264 1 11 . 1 1 212 212 MET H H 212 7.724 7.724 7.512 0.212 25485 14265 1 11 . 1 1 213 213 TYR N N 213 129.919 129.919 123.979 5.940 25485 14266 1 11 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.366 1.330 25485 14267 1 11 . 1 1 213 213 TYR C C 213 178.411 178.411 175.553 2.858 25485 14268 1 11 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.222 -0.091 25485 14269 1 11 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.553 0.613 25485 14270 1 11 . 1 1 213 213 TYR H H 213 7.902 7.902 7.217 0.685 25485 14271 1 11 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.447 -0.972 25485 14272 1 11 . 1 1 214 214 PRO C C 214 177.694 177.694 176.543 1.151 25485 14273 1 11 . 1 1 214 214 PRO CA C 214 66.028 66.028 63.935 2.093 25485 14274 1 11 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.941 0.882 25485 14275 1 11 . 1 1 215 215 THR N N 215 104.450 104.450 114.064 -9.614 25485 14276 1 11 . 1 1 215 215 THR HA H 215 4.444 4.444 4.234 0.210 25485 14277 1 11 . 1 1 215 215 THR C C 215 173.429 173.429 173.510 -0.081 25485 14278 1 11 . 1 1 215 215 THR CA C 215 60.528 60.528 61.047 -0.519 25485 14279 1 11 . 1 1 215 215 THR CB C 215 69.614 69.614 66.351 3.263 25485 14280 1 11 . 1 1 215 215 THR H H 215 6.407 6.407 7.340 -0.933 25485 14281 1 11 . 1 1 216 216 TYR N N 216 124.618 124.618 125.171 -0.553 25485 14282 1 11 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.218 0.014 25485 14283 1 11 . 1 1 216 216 TYR C C 216 175.669 175.669 175.777 -0.108 25485 14284 1 11 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.984 -0.397 25485 14285 1 11 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.479 2.412 25485 14286 1 11 . 1 1 216 216 TYR H H 216 8.331 8.331 7.742 0.589 25485 14287 1 11 . 1 1 217 217 GLY N N 217 116.089 116.089 116.274 -0.185 25485 14288 1 11 . 1 1 217 217 GLY C C 217 173.560 173.560 172.848 0.712 25485 14289 1 11 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.286 1.032 25485 14290 1 11 . 1 1 217 217 GLY H H 217 7.695 7.695 8.313 -0.618 25485 14291 1 11 . 1 1 218 218 ASN N N 218 120.167 120.167 119.139 1.028 25485 14292 1 11 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.769 -0.103 25485 14293 1 11 . 1 1 218 218 ASN C C 218 175.343 175.343 175.118 0.225 25485 14294 1 11 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.673 -0.058 25485 14295 1 11 . 1 1 218 218 ASN CB C 218 38.546 38.546 39.567 -1.021 25485 14296 1 11 . 1 1 218 218 ASN H H 218 8.237 8.237 8.123 0.114 25485 14297 1 11 . 1 1 219 219 GLY N N 219 109.322 109.322 109.411 -0.089 25485 14298 1 11 . 1 1 219 219 GLY C C 219 172.842 172.842 173.281 -0.439 25485 14299 1 11 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.637 0.081 25485 14300 1 11 . 1 1 219 219 GLY H H 219 8.027 8.027 8.250 -0.223 25485 14301 1 11 . 1 1 220 220 ASP N N 220 123.006 123.006 121.628 1.378 25485 14302 1 11 . 1 1 220 220 ASP H H 220 8.273 8.273 8.384 -0.111 25485 14303 1 11 . 1 1 221 221 PRO C C 221 177.138 177.138 176.889 0.249 25485 14304 1 11 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.768 -5.705 25485 14305 1 11 . 1 1 221 221 PRO CB C 221 31.696 31.696 33.016 -1.320 25485 14306 1 11 . 1 1 222 222 GLN N N 222 116.718 116.718 119.013 -2.295 25485 14307 1 11 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.251 0.085 25485 14308 1 11 . 1 1 222 222 GLN C C 222 176.321 176.321 176.552 -0.231 25485 14309 1 11 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.118 -0.975 25485 14310 1 11 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.540 0.958 25485 14311 1 11 . 1 1 222 222 GLN H H 222 8.240 8.240 8.494 -0.254 25485 14312 1 11 . 1 1 223 223 ASN N N 223 118.368 118.368 115.011 3.357 25485 14313 1 11 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.815 0.101 25485 14314 1 11 . 1 1 223 223 ASN C C 223 173.271 173.271 174.167 -0.896 25485 14315 1 11 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.099 -0.503 25485 14316 1 11 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.800 -0.585 25485 14317 1 11 . 1 1 223 223 ASN H H 223 7.946 7.946 8.312 -0.366 25485 14318 1 11 . 1 1 224 224 PHE N N 224 118.429 118.429 118.251 0.178 25485 14319 1 11 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.252 0.199 25485 14320 1 11 . 1 1 224 224 PHE C C 224 172.897 172.897 173.607 -0.710 25485 14321 1 11 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.288 0.121 25485 14322 1 11 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.014 0.688 25485 14323 1 11 . 1 1 224 224 PHE H H 224 6.992 6.992 7.748 -0.756 25485 14324 1 11 . 1 1 225 225 LYS N N 225 121.714 121.714 124.778 -3.064 25485 14325 1 11 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.700 0.730 25485 14326 1 11 . 1 1 225 225 LYS C C 225 174.664 174.664 174.156 0.508 25485 14327 1 11 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.157 0.154 25485 14328 1 11 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.010 0.717 25485 14329 1 11 . 1 1 225 225 LYS H H 225 7.709 7.709 8.016 -0.307 25485 14330 1 11 . 1 1 226 226 LEU N N 226 119.026 119.026 120.848 -1.822 25485 14331 1 11 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.982 0.158 25485 14332 1 11 . 1 1 226 226 LEU C C 226 177.495 177.495 176.778 0.717 25485 14333 1 11 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.236 0.363 25485 14334 1 11 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.013 -0.732 25485 14335 1 11 . 1 1 226 226 LEU H H 226 8.015 8.015 8.091 -0.076 25485 14336 1 11 . 1 1 227 227 SER N N 227 120.320 120.320 115.502 4.818 25485 14337 1 11 . 1 1 227 227 SER HA H 227 4.600 4.600 4.416 0.184 25485 14338 1 11 . 1 1 227 227 SER C C 227 175.492 175.492 175.098 0.394 25485 14339 1 11 . 1 1 227 227 SER CA C 227 57.239 57.239 57.384 -0.145 25485 14340 1 11 . 1 1 227 227 SER CB C 227 66.278 66.278 65.584 0.694 25485 14341 1 11 . 1 1 227 227 SER H H 227 9.654 9.654 7.996 1.658 25485 14342 1 11 . 1 1 228 228 GLN N N 228 127.511 127.511 124.806 2.705 25485 14343 1 11 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.886 0.808 25485 14344 1 11 . 1 1 228 228 GLN H H 228 8.248 8.248 9.082 -0.834 25485 14345 1 11 . 1 1 229 229 ASP N N 229 124.358 124.358 118.124 6.234 25485 14346 1 11 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.353 0.021 25485 14347 1 11 . 1 1 229 229 ASP C C 229 178.793 178.793 178.012 0.781 25485 14348 1 11 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.280 0.862 25485 14349 1 11 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.315 2.927 25485 14350 1 11 . 1 1 229 229 ASP H H 229 8.138 8.138 8.467 -0.329 25485 14351 1 11 . 1 1 230 230 ASP N N 230 119.694 119.694 120.342 -0.648 25485 14352 1 11 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.528 -0.106 25485 14353 1 11 . 1 1 230 230 ASP C C 230 177.736 177.736 178.553 -0.817 25485 14354 1 11 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.238 0.684 25485 14355 1 11 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.869 2.367 25485 14356 1 11 . 1 1 230 230 ASP H H 230 7.393 7.393 7.494 -0.101 25485 14357 1 11 . 1 1 231 231 ILE N N 231 120.364 120.364 119.936 0.428 25485 14358 1 11 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.759 -0.094 25485 14359 1 11 . 1 1 231 231 ILE C C 231 177.631 177.631 177.660 -0.029 25485 14360 1 11 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.682 -0.183 25485 14361 1 11 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.926 0.587 25485 14362 1 11 . 1 1 231 231 ILE H H 231 8.115 8.115 8.084 0.031 25485 14363 1 11 . 1 1 232 232 LYS N N 232 119.156 119.156 120.673 -1.517 25485 14364 1 11 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.126 -0.012 25485 14365 1 11 . 1 1 232 232 LYS C C 232 180.574 180.574 179.163 1.411 25485 14366 1 11 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.134 0.426 25485 14367 1 11 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.343 0.454 25485 14368 1 11 . 1 1 232 232 LYS H H 232 8.607 8.607 8.353 0.254 25485 14369 1 11 . 1 1 233 233 GLY N N 233 106.425 106.425 107.790 -1.365 25485 14370 1 11 . 1 1 233 233 GLY C C 233 176.098 176.098 176.011 0.087 25485 14371 1 11 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.673 0.964 25485 14372 1 11 . 1 1 233 233 GLY H H 233 8.075 8.075 7.550 0.525 25485 14373 1 11 . 1 1 234 234 ILE N N 234 125.119 125.119 122.288 2.831 25485 14374 1 11 . 1 1 234 234 ILE C C 234 178.231 178.231 177.425 0.806 25485 14375 1 11 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.625 -2.032 25485 14376 1 11 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.432 -0.886 25485 14377 1 11 . 1 1 234 234 ILE H H 234 8.539 8.539 7.477 1.062 25485 14378 1 11 . 1 1 235 235 GLN N N 235 122.877 122.877 118.536 4.341 25485 14379 1 11 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.027 0.330 25485 14380 1 11 . 1 1 235 235 GLN C C 235 180.105 180.105 178.174 1.931 25485 14381 1 11 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.434 -1.547 25485 14382 1 11 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.711 -1.174 25485 14383 1 11 . 1 1 235 235 GLN H H 235 8.296 8.296 8.678 -0.382 25485 14384 1 11 . 1 1 236 236 LYS N N 236 123.678 123.678 118.091 5.587 25485 14385 1 11 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.252 -0.170 25485 14386 1 11 . 1 1 236 236 LYS C C 236 178.169 178.169 177.539 0.630 25485 14387 1 11 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.524 0.852 25485 14388 1 11 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.804 0.174 25485 14389 1 11 . 1 1 236 236 LYS H H 236 8.024 8.024 7.560 0.464 25485 14390 1 11 . 1 1 237 237 LEU N N 237 116.873 116.873 119.224 -2.351 25485 14391 1 11 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.352 -0.365 25485 14392 1 11 . 1 1 237 237 LEU C C 237 177.893 177.893 177.768 0.125 25485 14393 1 11 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.486 0.953 25485 14394 1 11 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.871 0.742 25485 14395 1 11 . 1 1 237 237 LEU H H 237 6.888 6.888 7.558 -0.670 25485 14396 1 11 . 1 1 238 238 TYR N N 238 112.237 112.237 117.529 -5.292 25485 14397 1 11 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.495 0.156 25485 14398 1 11 . 1 1 238 238 TYR C C 238 176.082 176.082 176.875 -0.793 25485 14399 1 11 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.192 -0.556 25485 14400 1 11 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.993 1.405 25485 14401 1 11 . 1 1 238 238 TYR H H 238 7.445 7.445 8.742 -1.297 25485 14402 1 11 . 1 1 239 239 GLY N N 239 110.906 110.906 106.461 4.445 25485 14403 1 11 . 1 1 239 239 GLY C C 239 171.269 171.269 172.664 -1.395 25485 14404 1 11 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.209 -1.323 25485 14405 1 11 . 1 1 239 239 GLY H H 239 8.443 8.443 7.921 0.522 25485 14406 1 11 . 1 1 240 240 LYS N N 240 114.281 114.281 122.410 -8.129 25485 14407 1 11 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.515 0.223 25485 14408 1 11 . 1 1 240 240 LYS C C 240 177.527 177.527 176.163 1.364 25485 14409 1 11 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.815 -0.857 25485 14410 1 11 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.823 0.452 25485 14411 1 11 . 1 1 240 240 LYS H H 240 7.873 7.873 8.342 -0.469 25485 14412 1 11 . 1 1 241 241 ARG N N 241 123.758 123.758 121.044 2.714 25485 14413 1 11 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.507 -0.510 25485 14414 1 11 . 1 1 241 241 ARG C C 241 176.026 176.026 175.043 0.983 25485 14415 1 11 . 1 1 241 241 ARG CA C 241 57.492 57.492 55.475 2.017 25485 14416 1 11 . 1 1 241 241 ARG CB C 241 30.371 30.371 31.913 -1.542 25485 14417 1 11 . 1 1 241 241 ARG H H 241 7.742 7.742 8.377 -0.634 25485 14418 1 11 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.179 0.161 25485 14419 1 11 . 1 1 246 246 LYS C C 246 175.403 175.403 176.532 -1.129 25485 14420 1 11 . 1 1 246 246 LYS CA C 246 56.509 56.509 57.009 -0.500 25485 14421 1 11 . 1 1 246 246 LYS CB C 246 32.858 32.858 32.761 0.097 25485 14422 1 12 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.526 -0.219 25485 14423 1 12 . 1 1 2 2 GLN C C 2 176.492 176.492 175.187 1.305 25485 14424 1 12 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.499 0.250 25485 14425 1 12 . 1 1 2 2 GLN CB C 2 28.654 28.654 29.592 -0.938 25485 14426 1 12 . 1 1 3 3 GLU N N 3 121.668 121.668 124.515 -2.847 25485 14427 1 12 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.429 -0.640 25485 14428 1 12 . 1 1 3 3 GLU C C 3 176.278 176.278 177.318 -1.040 25485 14429 1 12 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.058 0.001 25485 14430 1 12 . 1 1 3 3 GLU CB C 3 29.691 29.691 30.121 -0.430 25485 14431 1 12 . 1 1 3 3 GLU H H 3 8.331 8.331 8.873 -0.542 25485 14432 1 12 . 1 1 4 4 ALA N N 4 124.493 124.493 122.902 1.591 25485 14433 1 12 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.172 0.338 25485 14434 1 12 . 1 1 4 4 ALA C C 4 178.428 178.428 179.906 -1.478 25485 14435 1 12 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.790 -0.113 25485 14436 1 12 . 1 1 4 4 ALA CB C 4 18.709 18.709 17.958 0.751 25485 14437 1 12 . 1 1 4 4 ALA H H 4 8.131 8.131 8.563 -0.432 25485 14438 1 12 . 1 1 5 5 GLY N N 5 108.204 108.204 108.484 -0.280 25485 14439 1 12 . 1 1 5 5 GLY C C 5 174.858 174.858 175.556 -0.698 25485 14440 1 12 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.298 1.363 25485 14441 1 12 . 1 1 5 5 GLY H H 5 8.279 8.279 8.633 -0.354 25485 14442 1 12 . 1 1 6 6 GLY N N 6 108.820 108.820 108.203 0.617 25485 14443 1 12 . 1 1 6 6 GLY C C 6 174.189 174.189 173.733 0.456 25485 14444 1 12 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.428 -0.015 25485 14445 1 12 . 1 1 6 6 GLY H H 6 8.246 8.246 7.734 0.512 25485 14446 1 12 . 1 1 7 7 MET N N 7 119.938 119.938 120.915 -0.977 25485 14447 1 12 . 1 1 7 7 MET HA H 7 4.659 4.659 4.518 0.141 25485 14448 1 12 . 1 1 7 7 MET C C 7 176.191 176.191 176.281 -0.090 25485 14449 1 12 . 1 1 7 7 MET CA C 7 54.799 54.799 56.000 -1.201 25485 14450 1 12 . 1 1 7 7 MET CB C 7 33.046 33.046 33.919 -0.872 25485 14451 1 12 . 1 1 7 7 MET H H 7 8.005 8.005 7.759 0.246 25485 14452 1 12 . 1 1 8 8 SER N N 8 118.919 118.919 115.574 3.345 25485 14453 1 12 . 1 1 8 8 SER HA H 8 4.239 4.239 4.832 -0.593 25485 14454 1 12 . 1 1 8 8 SER C C 8 174.949 174.949 174.809 0.140 25485 14455 1 12 . 1 1 8 8 SER CA C 8 58.160 58.160 56.596 1.564 25485 14456 1 12 . 1 1 8 8 SER CB C 8 65.440 65.440 65.628 -0.188 25485 14457 1 12 . 1 1 8 8 SER H H 8 8.731 8.731 8.128 0.603 25485 14458 1 12 . 1 1 9 9 GLU N N 9 122.442 122.442 121.192 1.250 25485 14459 1 12 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.151 0.170 25485 14460 1 12 . 1 1 9 9 GLU C C 9 178.604 178.604 178.579 0.025 25485 14461 1 12 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.212 0.254 25485 14462 1 12 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.286 -0.110 25485 14463 1 12 . 1 1 9 9 GLU H H 9 8.901 8.901 9.015 -0.114 25485 14464 1 12 . 1 1 10 10 LEU N N 10 120.568 120.568 118.282 2.286 25485 14465 1 12 . 1 1 10 10 LEU C C 10 179.307 179.307 179.394 -0.087 25485 14466 1 12 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.351 -0.871 25485 14467 1 12 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.077 0.498 25485 14468 1 12 . 1 1 10 10 LEU H H 10 8.020 8.020 8.396 -0.376 25485 14469 1 12 . 1 1 11 11 GLN N N 11 119.930 119.930 118.977 0.953 25485 14470 1 12 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.110 0.024 25485 14471 1 12 . 1 1 11 11 GLN C C 11 178.330 178.330 178.642 -0.312 25485 14472 1 12 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.425 -0.607 25485 14473 1 12 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.489 -0.625 25485 14474 1 12 . 1 1 11 11 GLN H H 11 7.811 7.811 7.794 0.017 25485 14475 1 12 . 1 1 12 12 TRP N N 12 121.031 121.031 120.350 0.681 25485 14476 1 12 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.442 -0.028 25485 14477 1 12 . 1 1 12 12 TRP C C 12 178.874 178.874 178.111 0.763 25485 14478 1 12 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.255 0.252 25485 14479 1 12 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.818 -0.431 25485 14480 1 12 . 1 1 12 12 TRP H H 12 8.205 8.205 7.972 0.233 25485 14481 1 12 . 1 1 13 13 GLU N N 13 121.877 121.877 119.950 1.927 25485 14482 1 12 . 1 1 13 13 GLU C C 13 179.425 179.425 178.862 0.563 25485 14483 1 12 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.801 0.236 25485 14484 1 12 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.443 -0.521 25485 14485 1 12 . 1 1 13 13 GLU H H 13 8.434 8.434 8.375 0.059 25485 14486 1 12 . 1 1 14 14 GLN N N 14 120.449 120.449 119.040 1.409 25485 14487 1 12 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.876 0.362 25485 14488 1 12 . 1 1 14 14 GLN C C 14 179.210 179.210 178.185 1.025 25485 14489 1 12 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.598 0.284 25485 14490 1 12 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.441 -0.691 25485 14491 1 12 . 1 1 14 14 GLN H H 14 8.124 8.124 8.382 -0.258 25485 14492 1 12 . 1 1 15 15 ALA N N 15 123.114 123.114 121.694 1.420 25485 14493 1 12 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.149 0.241 25485 14494 1 12 . 1 1 15 15 ALA C C 15 179.352 179.352 179.660 -0.308 25485 14495 1 12 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.762 -0.797 25485 14496 1 12 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.111 0.552 25485 14497 1 12 . 1 1 15 15 ALA H H 15 8.344 8.344 7.688 0.656 25485 14498 1 12 . 1 1 16 16 GLN N N 16 117.718 117.718 116.543 1.175 25485 14499 1 12 . 1 1 16 16 GLN HA H 16 3.782 3.782 4.048 -0.266 25485 14500 1 12 . 1 1 16 16 GLN C C 16 177.719 177.719 178.276 -0.557 25485 14501 1 12 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.796 1.485 25485 14502 1 12 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.517 0.019 25485 14503 1 12 . 1 1 16 16 GLN H H 16 8.500 8.500 7.701 0.799 25485 14504 1 12 . 1 1 17 17 ASP N N 17 120.040 120.040 120.200 -0.160 25485 14505 1 12 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.419 0.117 25485 14506 1 12 . 1 1 17 17 ASP C C 17 177.630 177.630 178.558 -0.928 25485 14507 1 12 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.015 0.790 25485 14508 1 12 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.547 1.317 25485 14509 1 12 . 1 1 17 17 ASP H H 17 7.871 7.871 7.607 0.264 25485 14510 1 12 . 1 1 18 18 TYR N N 18 122.465 122.465 119.493 2.972 25485 14511 1 12 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.140 0.050 25485 14512 1 12 . 1 1 18 18 TYR C C 18 178.439 178.439 177.877 0.562 25485 14513 1 12 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.667 1.179 25485 14514 1 12 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.020 1.920 25485 14515 1 12 . 1 1 18 18 TYR H H 18 8.244 8.244 8.199 0.045 25485 14516 1 12 . 1 1 19 19 LEU N N 19 117.635 117.635 116.745 0.890 25485 14517 1 12 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.880 0.252 25485 14518 1 12 . 1 1 19 19 LEU C C 19 180.940 180.940 178.296 2.644 25485 14519 1 12 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.757 0.748 25485 14520 1 12 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.731 -1.133 25485 14521 1 12 . 1 1 19 19 LEU H H 19 8.713 8.713 7.764 0.949 25485 14522 1 12 . 1 1 20 20 LYS N N 20 124.594 124.594 117.800 6.794 25485 14523 1 12 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.180 -0.096 25485 14524 1 12 . 1 1 20 20 LYS C C 20 178.387 178.387 177.768 0.619 25485 14525 1 12 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.036 0.769 25485 14526 1 12 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.365 0.091 25485 14527 1 12 . 1 1 20 20 LYS H H 20 8.815 8.815 7.798 1.017 25485 14528 1 12 . 1 1 21 21 ARG N N 21 117.535 117.535 117.383 0.152 25485 14529 1 12 . 1 1 21 21 ARG HA H 21 3.719 3.719 3.975 -0.256 25485 14530 1 12 . 1 1 21 21 ARG C C 21 178.498 178.498 178.541 -0.043 25485 14531 1 12 . 1 1 21 21 ARG CA C 21 59.244 59.244 57.837 1.407 25485 14532 1 12 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.455 -0.014 25485 14533 1 12 . 1 1 21 21 ARG H H 21 7.810 7.810 7.148 0.662 25485 14534 1 12 . 1 1 22 22 PHE N N 22 112.113 112.113 122.403 -10.290 25485 14535 1 12 . 1 1 22 22 PHE HA H 22 4.911 4.911 3.971 0.940 25485 14536 1 12 . 1 1 22 22 PHE C C 22 174.875 174.875 174.641 0.234 25485 14537 1 12 . 1 1 22 22 PHE CA C 22 57.475 57.475 60.699 -3.224 25485 14538 1 12 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.174 -0.005 25485 14539 1 12 . 1 1 22 22 PHE H H 22 8.010 8.010 7.606 0.404 25485 14540 1 12 . 1 1 23 23 TYR N N 23 116.187 116.187 114.955 1.232 25485 14541 1 12 . 1 1 23 23 TYR C C 23 173.455 173.455 175.112 -1.657 25485 14542 1 12 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.929 2.498 25485 14543 1 12 . 1 1 23 23 TYR CB C 23 39.529 39.529 37.004 2.525 25485 14544 1 12 . 1 1 23 23 TYR H H 23 7.680 7.680 7.421 0.259 25485 14545 1 12 . 1 1 24 24 LEU N N 24 115.570 115.570 117.895 -2.325 25485 14546 1 12 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.766 0.384 25485 14547 1 12 . 1 1 24 24 LEU C C 24 176.661 176.661 175.833 0.828 25485 14548 1 12 . 1 1 24 24 LEU CA C 24 56.152 56.152 57.487 -1.335 25485 14549 1 12 . 1 1 24 24 LEU CB C 24 36.863 36.863 40.773 -3.910 25485 14550 1 12 . 1 1 24 24 LEU H H 24 7.238 7.238 7.653 -0.415 25485 14551 1 12 . 1 1 25 25 TYR N N 25 119.901 119.901 119.205 0.696 25485 14552 1 12 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.797 -0.438 25485 14553 1 12 . 1 1 25 25 TYR C C 25 173.784 173.784 173.694 0.090 25485 14554 1 12 . 1 1 25 25 TYR CA C 25 58.247 58.247 56.866 1.381 25485 14555 1 12 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.712 -0.633 25485 14556 1 12 . 1 1 25 25 TYR H H 25 7.845 7.845 8.237 -0.392 25485 14557 1 12 . 1 1 26 26 ASP N N 26 129.338 129.338 127.516 1.822 25485 14558 1 12 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.001 -0.550 25485 14559 1 12 . 1 1 26 26 ASP C C 26 175.282 175.282 176.472 -1.190 25485 14560 1 12 . 1 1 26 26 ASP CA C 26 52.433 52.433 54.326 -1.893 25485 14561 1 12 . 1 1 26 26 ASP CB C 26 41.249 41.249 41.058 0.191 25485 14562 1 12 . 1 1 26 26 ASP H H 26 8.108 8.108 8.708 -0.600 25485 14563 1 12 . 1 1 27 27 SER C C 27 175.204 175.204 176.076 -0.872 25485 14564 1 12 . 1 1 27 27 SER CA C 27 59.424 59.424 60.260 -0.836 25485 14565 1 12 . 1 1 27 27 SER CB C 27 63.535 63.535 63.468 0.067 25485 14566 1 12 . 1 1 28 28 GLU N N 28 122.058 122.058 121.363 0.695 25485 14567 1 12 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.190 0.135 25485 14568 1 12 . 1 1 28 28 GLU C C 28 177.073 177.073 176.305 0.768 25485 14569 1 12 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.067 -0.855 25485 14570 1 12 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.217 0.353 25485 14571 1 12 . 1 1 28 28 GLU H H 28 8.255 8.255 8.700 -0.445 25485 14572 1 12 . 1 1 29 29 THR N N 29 114.161 114.161 111.336 2.825 25485 14573 1 12 . 1 1 29 29 THR HA H 29 4.260 4.260 4.353 -0.093 25485 14574 1 12 . 1 1 29 29 THR C C 29 174.591 174.591 175.135 -0.544 25485 14575 1 12 . 1 1 29 29 THR CA C 29 61.976 61.976 61.708 0.268 25485 14576 1 12 . 1 1 29 29 THR CB C 29 69.385 69.385 68.266 1.119 25485 14577 1 12 . 1 1 29 29 THR H H 29 7.498 7.498 7.515 -0.017 25485 14578 1 12 . 1 1 30 30 LYS HA H 30 4.218 4.218 3.975 0.243 25485 14579 1 12 . 1 1 30 30 LYS H H 30 8.218 8.218 7.421 0.797 25485 14580 1 12 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.477 -0.053 25485 14581 1 12 . 1 1 31 31 ASN CB C 31 39.133 39.133 38.536 0.597 25485 14582 1 12 . 1 1 32 32 ALA N N 32 126.484 126.484 122.214 4.270 25485 14583 1 12 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.127 0.169 25485 14584 1 12 . 1 1 32 32 ALA C C 32 178.012 178.012 178.884 -0.872 25485 14585 1 12 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.419 -0.659 25485 14586 1 12 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.337 -0.567 25485 14587 1 12 . 1 1 32 32 ALA H H 32 8.411 8.411 8.517 -0.106 25485 14588 1 12 . 1 1 33 33 ASN N N 33 116.885 116.885 116.362 0.523 25485 14589 1 12 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.510 0.188 25485 14590 1 12 . 1 1 33 33 ASN C C 33 176.240 176.240 177.675 -1.435 25485 14591 1 12 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.842 -1.655 25485 14592 1 12 . 1 1 33 33 ASN CB C 33 38.585 38.585 37.285 1.300 25485 14593 1 12 . 1 1 33 33 ASN H H 33 8.309 8.309 8.633 -0.324 25485 14594 1 12 . 1 1 34 34 SER N N 34 116.836 116.836 116.700 0.136 25485 14595 1 12 . 1 1 34 34 SER HA H 34 4.544 4.544 4.310 0.234 25485 14596 1 12 . 1 1 34 34 SER C C 34 175.253 175.253 175.977 -0.724 25485 14597 1 12 . 1 1 34 34 SER CA C 34 59.583 59.583 61.351 -1.768 25485 14598 1 12 . 1 1 34 34 SER CB C 34 63.919 63.919 62.805 1.114 25485 14599 1 12 . 1 1 34 34 SER H H 34 8.115 8.115 8.230 -0.115 25485 14600 1 12 . 1 1 35 35 LEU N N 35 125.355 125.355 120.622 4.733 25485 14601 1 12 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.114 -0.538 25485 14602 1 12 . 1 1 35 35 LEU C C 35 177.973 177.973 178.032 -0.059 25485 14603 1 12 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.024 0.473 25485 14604 1 12 . 1 1 35 35 LEU CB C 35 40.692 40.692 40.501 0.191 25485 14605 1 12 . 1 1 35 35 LEU H H 35 8.312 8.312 8.090 0.222 25485 14606 1 12 . 1 1 36 36 GLU N N 36 119.201 119.201 120.935 -1.734 25485 14607 1 12 . 1 1 36 36 GLU HA H 36 3.914 3.914 4.009 -0.095 25485 14608 1 12 . 1 1 36 36 GLU C C 36 178.141 178.141 178.651 -0.510 25485 14609 1 12 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.454 0.205 25485 14610 1 12 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.050 1.263 25485 14611 1 12 . 1 1 36 36 GLU H H 36 8.225 8.225 8.261 -0.036 25485 14612 1 12 . 1 1 37 37 ALA N N 37 120.746 120.746 122.714 -1.968 25485 14613 1 12 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.110 -0.031 25485 14614 1 12 . 1 1 37 37 ALA C C 37 181.485 181.485 179.585 1.900 25485 14615 1 12 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.795 0.663 25485 14616 1 12 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.164 0.003 25485 14617 1 12 . 1 1 37 37 ALA H H 37 7.917 7.917 7.657 0.260 25485 14618 1 12 . 1 1 38 38 LYS N N 38 119.326 119.326 120.623 -1.297 25485 14619 1 12 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.245 0.086 25485 14620 1 12 . 1 1 38 38 LYS C C 38 177.946 177.946 178.970 -1.024 25485 14621 1 12 . 1 1 38 38 LYS CA C 38 57.704 57.704 59.381 -1.677 25485 14622 1 12 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.518 -0.718 25485 14623 1 12 . 1 1 38 38 LYS H H 38 8.216 8.216 7.912 0.304 25485 14624 1 12 . 1 1 39 39 LEU N N 39 122.736 122.736 118.471 4.265 25485 14625 1 12 . 1 1 39 39 LEU HA H 39 3.941 3.941 4.119 -0.178 25485 14626 1 12 . 1 1 39 39 LEU C C 39 178.819 178.819 179.046 -0.227 25485 14627 1 12 . 1 1 39 39 LEU CA C 39 58.081 58.081 57.856 0.225 25485 14628 1 12 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.669 -1.041 25485 14629 1 12 . 1 1 39 39 LEU H H 39 8.666 8.666 8.515 0.151 25485 14630 1 12 . 1 1 40 40 LYS N N 40 118.411 118.411 119.837 -1.426 25485 14631 1 12 . 1 1 40 40 LYS HA H 40 4.638 4.638 4.027 0.611 25485 14632 1 12 . 1 1 40 40 LYS C C 40 179.329 179.329 178.785 0.544 25485 14633 1 12 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.713 0.420 25485 14634 1 12 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.523 -0.738 25485 14635 1 12 . 1 1 40 40 LYS H H 40 8.227 8.227 7.917 0.310 25485 14636 1 12 . 1 1 41 41 GLU N N 41 121.329 121.329 118.800 2.529 25485 14637 1 12 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.112 -0.019 25485 14638 1 12 . 1 1 41 41 GLU C C 41 178.989 178.989 179.004 -0.015 25485 14639 1 12 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.003 0.757 25485 14640 1 12 . 1 1 41 41 GLU CB C 41 29.836 29.836 29.180 0.656 25485 14641 1 12 . 1 1 41 41 GLU H H 41 7.718 7.718 8.332 -0.614 25485 14642 1 12 . 1 1 42 42 MET N N 42 123.817 123.817 119.832 3.985 25485 14643 1 12 . 1 1 42 42 MET HA H 42 4.107 4.107 4.402 -0.295 25485 14644 1 12 . 1 1 42 42 MET C C 42 177.719 177.719 177.780 -0.061 25485 14645 1 12 . 1 1 42 42 MET CA C 42 59.912 59.912 58.937 0.975 25485 14646 1 12 . 1 1 42 42 MET CB C 42 30.506 30.506 32.842 -2.336 25485 14647 1 12 . 1 1 42 42 MET H H 42 7.657 7.657 7.930 -0.273 25485 14648 1 12 . 1 1 43 43 GLN N N 43 119.998 119.998 117.620 2.378 25485 14649 1 12 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.115 -0.310 25485 14650 1 12 . 1 1 43 43 GLN C C 43 177.604 177.604 178.519 -0.915 25485 14651 1 12 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.943 1.022 25485 14652 1 12 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.748 -1.193 25485 14653 1 12 . 1 1 43 43 GLN H H 43 8.910 8.910 7.729 1.181 25485 14654 1 12 . 1 1 44 44 LYS N N 44 119.165 119.165 118.380 0.785 25485 14655 1 12 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.184 -0.129 25485 14656 1 12 . 1 1 44 44 LYS C C 44 179.991 179.991 178.658 1.333 25485 14657 1 12 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.854 0.707 25485 14658 1 12 . 1 1 44 44 LYS CB C 44 32.298 32.298 31.671 0.627 25485 14659 1 12 . 1 1 44 44 LYS H H 44 8.507 8.507 7.781 0.726 25485 14660 1 12 . 1 1 45 45 PHE N N 45 123.602 123.602 119.859 3.743 25485 14661 1 12 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.291 -0.390 25485 14662 1 12 . 1 1 45 45 PHE C C 45 177.606 177.606 176.307 1.299 25485 14663 1 12 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.200 2.834 25485 14664 1 12 . 1 1 45 45 PHE CB C 45 39.866 39.866 38.976 0.890 25485 14665 1 12 . 1 1 45 45 PHE H H 45 8.445 8.445 7.484 0.961 25485 14666 1 12 . 1 1 46 46 PHE N N 46 112.715 112.715 115.284 -2.569 25485 14667 1 12 . 1 1 46 46 PHE HA H 46 4.597 4.597 3.915 0.682 25485 14668 1 12 . 1 1 46 46 PHE C C 46 175.285 175.285 177.200 -1.915 25485 14669 1 12 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.947 0.728 25485 14670 1 12 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.333 -0.874 25485 14671 1 12 . 1 1 46 46 PHE H H 46 8.272 8.272 7.615 0.657 25485 14672 1 12 . 1 1 47 47 GLY N N 47 110.438 110.438 106.747 3.691 25485 14673 1 12 . 1 1 47 47 GLY C C 47 174.935 174.935 174.333 0.602 25485 14674 1 12 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.222 1.789 25485 14675 1 12 . 1 1 47 47 GLY H H 47 7.926 7.926 8.560 -0.634 25485 14676 1 12 . 1 1 48 48 LEU N N 48 121.830 121.830 119.401 2.429 25485 14677 1 12 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.605 0.319 25485 14678 1 12 . 1 1 48 48 LEU C C 48 174.009 174.009 175.763 -1.754 25485 14679 1 12 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.572 -1.737 25485 14680 1 12 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.785 0.678 25485 14681 1 12 . 1 1 48 48 LEU H H 48 8.762 8.762 7.620 1.142 25485 14682 1 12 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.373 -0.135 25485 14683 1 12 . 1 1 49 49 PRO C C 49 176.874 176.874 176.685 0.189 25485 14684 1 12 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.808 -0.290 25485 14685 1 12 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.979 -0.900 25485 14686 1 12 . 1 1 50 50 ILE N N 50 126.859 126.859 117.644 9.215 25485 14687 1 12 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.015 0.086 25485 14688 1 12 . 1 1 50 50 ILE C C 50 176.540 176.540 175.404 1.136 25485 14689 1 12 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.230 -1.274 25485 14690 1 12 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.198 -0.805 25485 14691 1 12 . 1 1 50 50 ILE H H 50 8.548 8.548 7.874 0.674 25485 14692 1 12 . 1 1 51 51 THR N N 51 116.443 116.443 119.699 -3.256 25485 14693 1 12 . 1 1 51 51 THR HA H 51 4.584 4.584 4.500 0.084 25485 14694 1 12 . 1 1 51 51 THR C C 51 176.672 176.672 175.320 1.352 25485 14695 1 12 . 1 1 51 51 THR CA C 51 60.979 60.979 59.569 1.410 25485 14696 1 12 . 1 1 51 51 THR CB C 51 71.505 71.505 70.877 0.628 25485 14697 1 12 . 1 1 51 51 THR H H 51 8.001 8.001 7.781 0.220 25485 14698 1 12 . 1 1 52 52 GLY N N 52 112.719 112.719 108.409 4.310 25485 14699 1 12 . 1 1 52 52 GLY C C 52 170.609 170.609 174.098 -3.489 25485 14700 1 12 . 1 1 52 52 GLY CA C 52 46.746 46.746 46.045 0.701 25485 14701 1 12 . 1 1 52 52 GLY H H 52 9.499 9.499 8.682 0.817 25485 14702 1 12 . 1 1 53 53 MET N N 53 116.621 116.621 118.569 -1.948 25485 14703 1 12 . 1 1 53 53 MET HA H 53 4.023 4.023 4.636 -0.613 25485 14704 1 12 . 1 1 53 53 MET C C 53 174.695 174.695 174.390 0.305 25485 14705 1 12 . 1 1 53 53 MET CA C 53 53.460 53.460 54.599 -1.139 25485 14706 1 12 . 1 1 53 53 MET CB C 53 35.408 35.408 35.987 -0.579 25485 14707 1 12 . 1 1 53 53 MET H H 53 7.993 7.993 7.484 0.509 25485 14708 1 12 . 1 1 54 54 LEU N N 54 122.679 122.679 121.805 0.874 25485 14709 1 12 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.347 -0.596 25485 14710 1 12 . 1 1 54 54 LEU C C 54 174.784 174.784 173.968 0.816 25485 14711 1 12 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.112 0.189 25485 14712 1 12 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.374 -0.364 25485 14713 1 12 . 1 1 54 54 LEU H H 54 7.940 7.940 8.369 -0.429 25485 14714 1 12 . 1 1 55 55 ASN N N 55 115.797 115.797 118.190 -2.393 25485 14715 1 12 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.446 0.303 25485 14716 1 12 . 1 1 55 55 ASN C C 55 175.459 175.459 174.555 0.904 25485 14717 1 12 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.294 -1.450 25485 14718 1 12 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.581 1.776 25485 14719 1 12 . 1 1 55 55 ASN H H 55 6.543 6.543 7.926 -1.383 25485 14720 1 12 . 1 1 56 56 SER N N 56 121.507 121.507 115.844 5.663 25485 14721 1 12 . 1 1 56 56 SER HA H 56 4.638 4.638 4.384 0.254 25485 14722 1 12 . 1 1 56 56 SER C C 56 175.727 175.727 175.957 -0.230 25485 14723 1 12 . 1 1 56 56 SER CA C 56 57.932 57.932 60.322 -2.390 25485 14724 1 12 . 1 1 56 56 SER CB C 56 63.786 63.786 63.471 0.315 25485 14725 1 12 . 1 1 56 56 SER H H 56 8.213 8.213 8.010 0.203 25485 14726 1 12 . 1 1 57 57 ARG N N 57 122.951 122.951 121.766 1.185 25485 14727 1 12 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.260 -0.059 25485 14728 1 12 . 1 1 57 57 ARG C C 57 178.560 178.560 178.054 0.506 25485 14729 1 12 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.396 0.036 25485 14730 1 12 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.749 -0.644 25485 14731 1 12 . 1 1 57 57 ARG H H 57 7.895 7.895 8.381 -0.486 25485 14732 1 12 . 1 1 58 58 VAL N N 58 118.778 118.778 120.309 -1.531 25485 14733 1 12 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.542 -0.211 25485 14734 1 12 . 1 1 58 58 VAL C C 58 177.370 177.370 177.571 -0.201 25485 14735 1 12 . 1 1 58 58 VAL CA C 58 66.382 66.382 65.854 0.528 25485 14736 1 12 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.194 1.015 25485 14737 1 12 . 1 1 58 58 VAL H H 58 7.583 7.583 8.022 -0.439 25485 14738 1 12 . 1 1 59 59 ILE N N 59 119.159 119.159 118.050 1.109 25485 14739 1 12 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.632 -0.219 25485 14740 1 12 . 1 1 59 59 ILE C C 59 177.067 177.067 177.855 -0.788 25485 14741 1 12 . 1 1 59 59 ILE CA C 59 63.633 63.633 62.995 0.638 25485 14742 1 12 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.753 -0.057 25485 14743 1 12 . 1 1 59 59 ILE H H 59 7.323 7.323 7.964 -0.641 25485 14744 1 12 . 1 1 60 60 GLU N N 60 119.367 119.367 120.007 -0.640 25485 14745 1 12 . 1 1 60 60 GLU HA H 60 3.738 3.738 4.192 -0.454 25485 14746 1 12 . 1 1 60 60 GLU C C 60 179.978 179.978 179.384 0.594 25485 14747 1 12 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.614 -0.356 25485 14748 1 12 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.452 -0.064 25485 14749 1 12 . 1 1 60 60 GLU H H 60 7.879 7.879 7.452 0.427 25485 14750 1 12 . 1 1 61 61 ILE N N 61 118.816 118.816 114.111 4.705 25485 14751 1 12 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.847 -0.408 25485 14752 1 12 . 1 1 61 61 ILE C C 61 179.033 179.033 176.764 2.269 25485 14753 1 12 . 1 1 61 61 ILE CA C 61 64.838 64.838 63.799 1.039 25485 14754 1 12 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.378 -0.479 25485 14755 1 12 . 1 1 61 61 ILE H H 61 7.246 7.246 7.267 -0.021 25485 14756 1 12 . 1 1 62 62 MET N N 62 119.986 119.986 116.666 3.320 25485 14757 1 12 . 1 1 62 62 MET HA H 62 3.444 3.444 4.113 -0.669 25485 14758 1 12 . 1 1 62 62 MET C C 62 176.185 176.185 177.451 -1.266 25485 14759 1 12 . 1 1 62 62 MET CA C 62 59.014 59.014 57.105 1.909 25485 14760 1 12 . 1 1 62 62 MET CB C 62 31.250 31.250 32.856 -1.606 25485 14761 1 12 . 1 1 62 62 MET H H 62 7.835 7.835 7.176 0.659 25485 14762 1 12 . 1 1 63 63 GLN N N 63 116.163 116.163 115.751 0.412 25485 14763 1 12 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.177 0.101 25485 14764 1 12 . 1 1 63 63 GLN C C 63 176.727 176.727 176.574 0.153 25485 14765 1 12 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.569 -0.431 25485 14766 1 12 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.511 -0.445 25485 14767 1 12 . 1 1 63 63 GLN H H 63 7.454 7.454 7.779 -0.325 25485 14768 1 12 . 1 1 64 64 LYS N N 64 121.430 121.430 120.864 0.566 25485 14769 1 12 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.469 0.074 25485 14770 1 12 . 1 1 64 64 LYS C C 64 174.724 174.724 174.655 0.069 25485 14771 1 12 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.138 1.379 25485 14772 1 12 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.486 -0.889 25485 14773 1 12 . 1 1 64 64 LYS H H 64 7.483 7.483 7.507 -0.024 25485 14774 1 12 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.410 -1.974 25485 14775 1 12 . 1 1 65 65 PRO C C 65 176.158 176.158 175.620 0.538 25485 14776 1 12 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.156 -0.268 25485 14777 1 12 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.345 -0.512 25485 14778 1 12 . 1 1 66 66 ARG N N 66 112.697 112.697 121.591 -8.894 25485 14779 1 12 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.061 0.347 25485 14780 1 12 . 1 1 66 66 ARG C C 66 174.478 174.478 173.925 0.553 25485 14781 1 12 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.178 -1.542 25485 14782 1 12 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.724 2.949 25485 14783 1 12 . 1 1 66 66 ARG H H 66 8.146 8.146 8.486 -0.340 25485 14784 1 12 . 1 1 67 67 CYS N N 67 121.740 121.740 115.397 6.343 25485 14785 1 12 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.874 -0.434 25485 14786 1 12 . 1 1 67 67 CYS C C 67 175.659 175.659 175.651 0.008 25485 14787 1 12 . 1 1 67 67 CYS CA C 67 59.195 59.195 57.522 1.673 25485 14788 1 12 . 1 1 67 67 CYS CB C 67 30.206 30.206 32.101 -1.895 25485 14789 1 12 . 1 1 67 67 CYS H H 67 7.757 7.757 8.060 -0.303 25485 14790 1 12 . 1 1 68 68 GLY N N 68 116.217 116.217 111.020 5.197 25485 14791 1 12 . 1 1 68 68 GLY C C 68 172.210 172.210 173.006 -0.796 25485 14792 1 12 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.937 1.622 25485 14793 1 12 . 1 1 68 68 GLY H H 68 9.704 9.704 9.287 0.417 25485 14794 1 12 . 1 1 69 69 VAL N N 69 126.372 126.372 118.589 7.783 25485 14795 1 12 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.428 -0.597 25485 14796 1 12 . 1 1 69 69 VAL C C 69 173.538 173.538 173.815 -0.277 25485 14797 1 12 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.179 3.189 25485 14798 1 12 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.880 -0.358 25485 14799 1 12 . 1 1 69 69 VAL H H 69 9.113 9.113 7.379 1.734 25485 14800 1 12 . 1 1 70 70 PRO HA H 70 4.950 4.950 3.816 1.134 25485 14801 1 12 . 1 1 70 70 PRO C C 70 175.019 175.019 175.697 -0.678 25485 14802 1 12 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.084 1.264 25485 14803 1 12 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.217 0.141 25485 14804 1 12 . 1 1 71 71 ASP N N 71 118.986 118.986 119.210 -0.224 25485 14805 1 12 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.434 -0.001 25485 14806 1 12 . 1 1 71 71 ASP C C 71 175.166 175.166 175.944 -0.778 25485 14807 1 12 . 1 1 71 71 ASP CA C 71 55.368 55.368 54.184 1.184 25485 14808 1 12 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.794 -1.930 25485 14809 1 12 . 1 1 71 71 ASP H H 71 8.054 8.054 7.662 0.392 25485 14810 1 12 . 1 1 72 72 VAL N N 72 112.953 112.953 115.353 -2.400 25485 14811 1 12 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.362 -0.066 25485 14812 1 12 . 1 1 72 72 VAL C C 72 174.330 174.330 174.128 0.202 25485 14813 1 12 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.693 -1.048 25485 14814 1 12 . 1 1 72 72 VAL CB C 72 33.872 33.872 34.630 -0.758 25485 14815 1 12 . 1 1 72 72 VAL H H 72 6.430 6.430 7.002 -0.572 25485 14816 1 12 . 1 1 73 73 ALA N N 73 125.869 125.869 129.182 -3.313 25485 14817 1 12 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.608 -0.303 25485 14818 1 12 . 1 1 73 73 ALA C C 73 177.382 177.382 176.288 1.094 25485 14819 1 12 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.682 0.367 25485 14820 1 12 . 1 1 73 73 ALA CB C 73 19.951 19.951 21.129 -1.178 25485 14821 1 12 . 1 1 73 73 ALA H H 73 8.177 8.177 8.202 -0.025 25485 14822 1 12 . 1 1 74 74 GLU N N 74 120.724 120.724 119.088 1.636 25485 14823 1 12 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.394 -0.291 25485 14824 1 12 . 1 1 74 74 GLU C C 74 176.246 176.246 174.176 2.070 25485 14825 1 12 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.956 -0.164 25485 14826 1 12 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.200 -1.415 25485 14827 1 12 . 1 1 74 74 GLU H H 74 8.381 8.381 8.482 -0.101 25485 14828 1 12 . 1 1 75 75 TYR N N 75 121.473 121.473 124.466 -2.993 25485 14829 1 12 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.574 -0.129 25485 14830 1 12 . 1 1 75 75 TYR C C 75 175.633 175.633 174.589 1.044 25485 14831 1 12 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.231 0.096 25485 14832 1 12 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.344 0.068 25485 14833 1 12 . 1 1 75 75 TYR H H 75 8.065 8.065 8.581 -0.516 25485 14834 1 12 . 1 1 76 76 SER N N 76 117.860 117.860 119.249 -1.389 25485 14835 1 12 . 1 1 76 76 SER HA H 76 3.886 3.886 4.301 -0.415 25485 14836 1 12 . 1 1 76 76 SER C C 76 173.859 173.859 173.454 0.405 25485 14837 1 12 . 1 1 76 76 SER CA C 76 58.250 58.250 59.305 -1.055 25485 14838 1 12 . 1 1 76 76 SER CB C 76 64.117 64.117 63.609 0.508 25485 14839 1 12 . 1 1 76 76 SER H H 76 7.748 7.748 8.918 -1.170 25485 14840 1 12 . 1 1 77 77 LEU N N 77 123.789 123.789 122.352 1.437 25485 14841 1 12 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.676 -0.530 25485 14842 1 12 . 1 1 77 77 LEU C C 77 176.451 176.451 176.703 -0.252 25485 14843 1 12 . 1 1 77 77 LEU CA C 77 55.464 55.464 53.995 1.469 25485 14844 1 12 . 1 1 77 77 LEU CB C 77 41.957 41.957 41.379 0.578 25485 14845 1 12 . 1 1 77 77 LEU H H 77 7.979 7.979 8.436 -0.457 25485 14846 1 12 . 1 1 78 78 PHE N N 78 119.275 119.275 121.544 -2.269 25485 14847 1 12 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.263 0.613 25485 14848 1 12 . 1 1 78 78 PHE C C 78 173.844 173.844 174.333 -0.489 25485 14849 1 12 . 1 1 78 78 PHE CA C 78 55.372 55.372 60.738 -5.366 25485 14850 1 12 . 1 1 78 78 PHE CB C 78 39.164 39.164 37.251 1.913 25485 14851 1 12 . 1 1 78 78 PHE H H 78 7.827 7.827 8.649 -0.822 25485 14852 1 12 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.386 -0.030 25485 14853 1 12 . 1 1 79 79 PRO C C 79 176.433 176.433 175.688 0.745 25485 14854 1 12 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.975 0.875 25485 14855 1 12 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.316 -0.624 25485 14856 1 12 . 1 1 80 80 ASN N N 80 118.057 118.057 121.455 -3.398 25485 14857 1 12 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.813 -0.166 25485 14858 1 12 . 1 1 80 80 ASN C C 80 174.305 174.305 175.035 -0.730 25485 14859 1 12 . 1 1 80 80 ASN CA C 80 52.860 52.860 52.842 0.019 25485 14860 1 12 . 1 1 80 80 ASN CB C 80 39.583 39.583 39.333 0.250 25485 14861 1 12 . 1 1 80 80 ASN H H 80 8.068 8.068 8.519 -0.451 25485 14862 1 12 . 1 1 81 81 SER HA H 81 4.565 4.565 4.302 0.263 25485 14863 1 12 . 1 1 81 81 SER CA C 81 56.800 56.800 57.876 -1.076 25485 14864 1 12 . 1 1 81 81 SER CB C 81 63.128 63.128 63.908 -0.780 25485 14865 1 12 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.405 0.056 25485 14866 1 12 . 1 1 82 82 PRO C C 82 174.589 174.589 175.771 -1.182 25485 14867 1 12 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.295 -0.649 25485 14868 1 12 . 1 1 82 82 PRO CB C 82 31.254 31.254 31.975 -0.721 25485 14869 1 12 . 1 1 83 83 LYS N N 83 114.578 114.578 114.672 -0.094 25485 14870 1 12 . 1 1 83 83 LYS HA H 83 4.153 4.153 5.030 -0.877 25485 14871 1 12 . 1 1 83 83 LYS C C 83 175.308 175.308 175.530 -0.222 25485 14872 1 12 . 1 1 83 83 LYS CA C 83 54.407 54.407 53.633 0.774 25485 14873 1 12 . 1 1 83 83 LYS CB C 83 34.418 34.418 34.872 -0.454 25485 14874 1 12 . 1 1 83 83 LYS H H 83 7.356 7.356 7.258 0.098 25485 14875 1 12 . 1 1 84 84 TRP N N 84 122.455 122.455 121.251 1.204 25485 14876 1 12 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.709 -0.689 25485 14877 1 12 . 1 1 84 84 TRP C C 84 177.636 177.636 177.635 0.001 25485 14878 1 12 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.188 -0.717 25485 14879 1 12 . 1 1 84 84 TRP CB C 84 30.318 30.318 28.406 1.912 25485 14880 1 12 . 1 1 84 84 TRP H H 84 8.050 8.050 8.699 -0.649 25485 14881 1 12 . 1 1 85 85 THR N N 85 113.501 113.501 116.942 -3.441 25485 14882 1 12 . 1 1 85 85 THR HA H 85 4.573 4.573 4.409 0.164 25485 14883 1 12 . 1 1 85 85 THR C C 85 174.757 174.757 174.678 0.079 25485 14884 1 12 . 1 1 85 85 THR CA C 85 62.130 62.130 61.747 0.383 25485 14885 1 12 . 1 1 85 85 THR CB C 85 69.107 69.107 69.464 -0.357 25485 14886 1 12 . 1 1 85 85 THR H H 85 8.861 8.861 8.551 0.310 25485 14887 1 12 . 1 1 86 86 SER N N 86 117.270 117.270 118.117 -0.847 25485 14888 1 12 . 1 1 86 86 SER HA H 86 4.741 4.741 4.403 0.338 25485 14889 1 12 . 1 1 86 86 SER C C 86 173.457 173.457 174.697 -1.240 25485 14890 1 12 . 1 1 86 86 SER CA C 86 56.739 56.739 59.037 -2.298 25485 14891 1 12 . 1 1 86 86 SER CB C 86 64.717 64.717 64.017 0.700 25485 14892 1 12 . 1 1 86 86 SER H H 86 7.743 7.743 8.027 -0.284 25485 14893 1 12 . 1 1 87 87 LYS N N 87 120.329 120.329 119.274 1.055 25485 14894 1 12 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.303 -0.074 25485 14895 1 12 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.450 0.142 25485 14896 1 12 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.845 -0.722 25485 14897 1 12 . 1 1 87 87 LYS H H 87 8.285 8.285 8.321 -0.036 25485 14898 1 12 . 1 1 88 88 VAL N N 88 117.531 117.531 117.559 -0.028 25485 14899 1 12 . 1 1 88 88 VAL HA H 88 4.655 4.655 5.026 -0.371 25485 14900 1 12 . 1 1 88 88 VAL C C 88 174.868 174.868 174.285 0.583 25485 14901 1 12 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.642 -0.547 25485 14902 1 12 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.556 -1.861 25485 14903 1 12 . 1 1 88 88 VAL H H 88 7.428 7.428 7.382 0.046 25485 14904 1 12 . 1 1 89 89 VAL N N 89 131.452 131.452 125.556 5.896 25485 14905 1 12 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.581 -0.422 25485 14906 1 12 . 1 1 89 89 VAL C C 89 175.758 175.758 175.344 0.414 25485 14907 1 12 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.477 0.244 25485 14908 1 12 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.700 -0.527 25485 14909 1 12 . 1 1 89 89 VAL H H 89 8.603 8.603 8.640 -0.037 25485 14910 1 12 . 1 1 90 90 THR N N 90 118.206 118.206 116.653 1.553 25485 14911 1 12 . 1 1 90 90 THR HA H 90 5.649 5.649 5.606 0.043 25485 14912 1 12 . 1 1 90 90 THR C C 90 174.579 174.579 173.551 1.028 25485 14913 1 12 . 1 1 90 90 THR CA C 90 58.959 58.959 59.007 -0.048 25485 14914 1 12 . 1 1 90 90 THR CB C 90 72.288 72.288 72.429 -0.141 25485 14915 1 12 . 1 1 90 90 THR H H 90 9.021 9.021 8.302 0.719 25485 14916 1 12 . 1 1 91 91 TYR N N 91 118.117 118.117 115.316 2.801 25485 14917 1 12 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.489 0.209 25485 14918 1 12 . 1 1 91 91 TYR C C 91 171.233 171.233 172.862 -1.629 25485 14919 1 12 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.981 -0.549 25485 14920 1 12 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.186 1.074 25485 14921 1 12 . 1 1 91 91 TYR H H 91 8.555 8.555 7.990 0.565 25485 14922 1 12 . 1 1 92 92 ARG N N 92 120.252 120.252 120.181 0.071 25485 14923 1 12 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.654 0.043 25485 14924 1 12 . 1 1 92 92 ARG C C 92 173.932 173.932 174.543 -0.611 25485 14925 1 12 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.182 0.659 25485 14926 1 12 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.869 -0.183 25485 14927 1 12 . 1 1 92 92 ARG H H 92 8.520 8.520 8.512 0.008 25485 14928 1 12 . 1 1 93 93 ILE N N 93 128.305 128.305 126.711 1.594 25485 14929 1 12 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.418 0.214 25485 14930 1 12 . 1 1 93 93 ILE C C 93 175.468 175.468 176.406 -0.938 25485 14931 1 12 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.132 1.097 25485 14932 1 12 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.809 0.415 25485 14933 1 12 . 1 1 93 93 ILE H H 93 8.886 8.886 8.696 0.190 25485 14934 1 12 . 1 1 94 94 VAL N N 94 126.647 126.647 128.250 -1.603 25485 14935 1 12 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.150 -0.154 25485 14936 1 12 . 1 1 94 94 VAL C C 94 175.670 175.670 176.449 -0.779 25485 14937 1 12 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.147 0.267 25485 14938 1 12 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.400 0.619 25485 14939 1 12 . 1 1 94 94 VAL H H 94 9.517 9.517 8.628 0.889 25485 14940 1 12 . 1 1 95 95 SER N N 95 113.398 113.398 112.655 0.743 25485 14941 1 12 . 1 1 95 95 SER HA H 95 4.701 4.701 4.768 -0.067 25485 14942 1 12 . 1 1 95 95 SER C C 95 170.684 170.684 172.592 -1.908 25485 14943 1 12 . 1 1 95 95 SER CA C 95 56.945 56.945 57.338 -0.393 25485 14944 1 12 . 1 1 95 95 SER CB C 95 65.276 65.276 64.906 0.370 25485 14945 1 12 . 1 1 95 95 SER H H 95 7.463 7.463 7.625 -0.162 25485 14946 1 12 . 1 1 96 96 TYR N N 96 116.512 116.512 119.795 -3.283 25485 14947 1 12 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.660 -0.396 25485 14948 1 12 . 1 1 96 96 TYR C C 96 174.856 174.856 174.390 0.466 25485 14949 1 12 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.412 2.225 25485 14950 1 12 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.144 1.019 25485 14951 1 12 . 1 1 96 96 TYR H H 96 8.240 8.240 8.101 0.139 25485 14952 1 12 . 1 1 97 97 THR CA C 97 57.798 57.798 61.285 -3.487 25485 14953 1 12 . 1 1 97 97 THR CB C 97 67.420 67.420 69.476 -2.056 25485 14954 1 12 . 1 1 98 98 ARG N N 98 128.156 128.156 123.316 4.840 25485 14955 1 12 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.159 0.166 25485 14956 1 12 . 1 1 98 98 ARG C C 98 177.625 177.625 176.256 1.369 25485 14957 1 12 . 1 1 98 98 ARG CA C 98 57.214 57.214 57.982 -0.768 25485 14958 1 12 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.878 -0.398 25485 14959 1 12 . 1 1 98 98 ARG H H 98 8.914 8.914 8.555 0.359 25485 14960 1 12 . 1 1 99 99 ASP N N 99 120.592 120.592 117.375 3.217 25485 14961 1 12 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.674 -0.293 25485 14962 1 12 . 1 1 99 99 ASP C C 99 175.679 175.679 175.441 0.238 25485 14963 1 12 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.508 1.928 25485 14964 1 12 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.739 0.631 25485 14965 1 12 . 1 1 99 99 ASP H H 99 8.708 8.708 8.021 0.687 25485 14966 1 12 . 1 1 100 100 LEU N N 100 116.829 116.829 119.416 -2.587 25485 14967 1 12 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.667 0.289 25485 14968 1 12 . 1 1 100 100 LEU C C 100 173.335 173.335 174.239 -0.904 25485 14969 1 12 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.972 -0.935 25485 14970 1 12 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.221 2.046 25485 14971 1 12 . 1 1 100 100 LEU H H 100 6.916 6.916 7.237 -0.321 25485 14972 1 12 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.178 -0.003 25485 14973 1 12 . 1 1 102 102 HIS C C 102 177.649 177.649 177.596 0.053 25485 14974 1 12 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.244 -0.571 25485 14975 1 12 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.114 -1.680 25485 14976 1 12 . 1 1 103 103 ILE N N 103 115.170 115.170 118.084 -2.914 25485 14977 1 12 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.879 0.294 25485 14978 1 12 . 1 1 103 103 ILE C C 103 177.214 177.214 177.182 0.032 25485 14979 1 12 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.284 -1.119 25485 14980 1 12 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.919 -0.154 25485 14981 1 12 . 1 1 103 103 ILE H H 103 8.234 8.234 8.197 0.037 25485 14982 1 12 . 1 1 104 104 THR N N 104 119.374 119.374 117.041 2.333 25485 14983 1 12 . 1 1 104 104 THR HA H 104 4.045 4.045 4.039 0.006 25485 14984 1 12 . 1 1 104 104 THR C C 104 175.612 175.612 176.659 -1.047 25485 14985 1 12 . 1 1 104 104 THR CA C 104 66.568 66.568 67.098 -0.530 25485 14986 1 12 . 1 1 104 104 THR CB C 104 68.077 68.077 68.517 -0.440 25485 14987 1 12 . 1 1 104 104 THR H H 104 6.947 6.947 7.747 -0.800 25485 14988 1 12 . 1 1 105 105 VAL N N 105 123.263 123.263 121.504 1.759 25485 14989 1 12 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.173 0.265 25485 14990 1 12 . 1 1 105 105 VAL C C 105 177.322 177.322 177.173 0.149 25485 14991 1 12 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.166 0.781 25485 14992 1 12 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.102 0.168 25485 14993 1 12 . 1 1 105 105 VAL H H 105 7.407 7.407 8.033 -0.626 25485 14994 1 12 . 1 1 106 106 ASP N N 106 119.972 119.972 120.015 -0.043 25485 14995 1 12 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.468 -0.146 25485 14996 1 12 . 1 1 106 106 ASP C C 106 179.747 179.747 178.347 1.400 25485 14997 1 12 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.453 0.782 25485 14998 1 12 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.868 -0.506 25485 14999 1 12 . 1 1 106 106 ASP H H 106 8.627 8.627 8.123 0.504 25485 15000 1 12 . 1 1 107 107 ARG N N 107 121.033 121.033 118.510 2.523 25485 15001 1 12 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.139 0.039 25485 15002 1 12 . 1 1 107 107 ARG C C 107 179.485 179.485 178.591 0.894 25485 15003 1 12 . 1 1 107 107 ARG CA C 107 59.580 59.580 59.013 0.567 25485 15004 1 12 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.772 0.436 25485 15005 1 12 . 1 1 107 107 ARG H H 107 8.356 8.356 7.914 0.442 25485 15006 1 12 . 1 1 108 108 LEU N N 108 121.463 121.463 120.805 0.658 25485 15007 1 12 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.219 0.086 25485 15008 1 12 . 1 1 108 108 LEU C C 108 178.852 178.852 179.050 -0.198 25485 15009 1 12 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.470 0.412 25485 15010 1 12 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.484 -0.169 25485 15011 1 12 . 1 1 108 108 LEU H H 108 8.790 8.790 7.857 0.933 25485 15012 1 12 . 1 1 109 109 VAL N N 109 120.233 120.233 116.460 3.773 25485 15013 1 12 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.696 -0.296 25485 15014 1 12 . 1 1 109 109 VAL C C 109 177.019 177.019 177.672 -0.653 25485 15015 1 12 . 1 1 109 109 VAL CA C 109 68.046 68.046 67.139 0.907 25485 15016 1 12 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.500 -0.311 25485 15017 1 12 . 1 1 109 109 VAL H H 109 8.787 8.787 8.072 0.715 25485 15018 1 12 . 1 1 110 110 SER N N 110 112.862 112.862 115.722 -2.860 25485 15019 1 12 . 1 1 110 110 SER HA H 110 4.300 4.300 4.164 0.136 25485 15020 1 12 . 1 1 110 110 SER C C 110 176.770 176.770 176.910 -0.140 25485 15021 1 12 . 1 1 110 110 SER CA C 110 61.744 61.744 62.015 -0.271 25485 15022 1 12 . 1 1 110 110 SER CB C 110 62.742 62.742 62.948 -0.206 25485 15023 1 12 . 1 1 110 110 SER H H 110 7.605 7.605 7.857 -0.252 25485 15024 1 12 . 1 1 111 111 LYS N N 111 122.319 122.319 121.860 0.459 25485 15025 1 12 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.111 -0.050 25485 15026 1 12 . 1 1 111 111 LYS C C 111 178.309 178.309 178.209 0.100 25485 15027 1 12 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.319 0.495 25485 15028 1 12 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.506 0.003 25485 15029 1 12 . 1 1 111 111 LYS H H 111 8.156 8.156 8.047 0.109 25485 15030 1 12 . 1 1 112 112 ALA N N 112 124.147 124.147 120.315 3.832 25485 15031 1 12 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.496 -0.397 25485 15032 1 12 . 1 1 112 112 ALA C C 112 179.445 179.445 179.278 0.167 25485 15033 1 12 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.097 1.129 25485 15034 1 12 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.344 0.630 25485 15035 1 12 . 1 1 112 112 ALA H H 112 8.278 8.278 7.496 0.782 25485 15036 1 12 . 1 1 113 113 LEU N N 113 116.195 116.195 120.695 -4.500 25485 15037 1 12 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.112 -0.361 25485 15038 1 12 . 1 1 113 113 LEU C C 113 179.537 179.537 177.968 1.569 25485 15039 1 12 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.062 -0.318 25485 15040 1 12 . 1 1 113 113 LEU CB C 113 40.555 40.555 42.052 -1.497 25485 15041 1 12 . 1 1 113 113 LEU H H 113 8.021 8.021 8.594 -0.573 25485 15042 1 12 . 1 1 114 114 ASN N N 114 116.570 116.570 117.682 -1.112 25485 15043 1 12 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.582 -0.036 25485 15044 1 12 . 1 1 114 114 ASN C C 114 177.136 177.136 177.595 -0.459 25485 15045 1 12 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.363 -0.599 25485 15046 1 12 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.567 0.056 25485 15047 1 12 . 1 1 114 114 ASN H H 114 8.212 8.212 8.338 -0.126 25485 15048 1 12 . 1 1 115 115 MET N N 115 122.055 122.055 118.954 3.101 25485 15049 1 12 . 1 1 115 115 MET HA H 115 4.010 4.010 3.991 0.019 25485 15050 1 12 . 1 1 115 115 MET C C 115 177.681 177.681 177.893 -0.212 25485 15051 1 12 . 1 1 115 115 MET CA C 115 59.445 59.445 58.873 0.572 25485 15052 1 12 . 1 1 115 115 MET CB C 115 31.616 31.616 32.157 -0.541 25485 15053 1 12 . 1 1 115 115 MET H H 115 7.937 7.937 7.757 0.180 25485 15054 1 12 . 1 1 116 116 TRP N N 116 117.115 117.115 118.985 -1.870 25485 15055 1 12 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.270 0.248 25485 15056 1 12 . 1 1 116 116 TRP C C 116 179.054 179.054 179.452 -0.398 25485 15057 1 12 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.082 0.429 25485 15058 1 12 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.229 1.644 25485 15059 1 12 . 1 1 116 116 TRP H H 116 6.783 6.783 7.492 -0.709 25485 15060 1 12 . 1 1 117 117 GLY N N 117 104.511 104.511 106.301 -1.790 25485 15061 1 12 . 1 1 117 117 GLY C C 117 175.035 175.035 175.824 -0.789 25485 15062 1 12 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.268 0.729 25485 15063 1 12 . 1 1 117 117 GLY H H 117 9.302 9.302 7.887 1.415 25485 15064 1 12 . 1 1 118 118 LYS N N 118 118.580 118.580 119.858 -1.278 25485 15065 1 12 . 1 1 118 118 LYS HA H 118 4.207 4.207 3.991 0.215 25485 15066 1 12 . 1 1 118 118 LYS C C 118 177.235 177.235 177.388 -0.153 25485 15067 1 12 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.989 -0.098 25485 15068 1 12 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.410 -0.505 25485 15069 1 12 . 1 1 118 118 LYS H H 118 7.940 7.940 7.712 0.228 25485 15070 1 12 . 1 1 119 119 GLU N N 119 113.749 113.749 116.682 -2.933 25485 15071 1 12 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.361 0.477 25485 15072 1 12 . 1 1 119 119 GLU C C 119 178.024 178.024 175.474 2.550 25485 15073 1 12 . 1 1 119 119 GLU CA C 119 55.275 55.275 56.008 -0.733 25485 15074 1 12 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.904 0.782 25485 15075 1 12 . 1 1 119 119 GLU H H 119 7.763 7.763 7.508 0.255 25485 15076 1 12 . 1 1 120 120 ILE N N 120 111.144 111.144 113.319 -2.175 25485 15077 1 12 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.645 0.726 25485 15078 1 12 . 1 1 120 120 ILE C C 120 174.033 174.033 174.319 -0.286 25485 15079 1 12 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.547 0.907 25485 15080 1 12 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.853 2.076 25485 15081 1 12 . 1 1 120 120 ILE H H 120 7.518 7.518 7.490 0.028 25485 15082 1 12 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.449 0.213 25485 15083 1 12 . 1 1 121 121 PRO C C 121 174.784 174.784 176.369 -1.585 25485 15084 1 12 . 1 1 121 121 PRO CA C 121 62.015 62.015 62.995 -0.980 25485 15085 1 12 . 1 1 121 121 PRO CB C 121 29.385 29.385 30.052 -0.666 25485 15086 1 12 . 1 1 122 122 LEU N N 122 121.531 121.531 119.066 2.465 25485 15087 1 12 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.550 -0.211 25485 15088 1 12 . 1 1 122 122 LEU C C 122 173.977 173.977 176.669 -2.692 25485 15089 1 12 . 1 1 122 122 LEU CA C 122 54.558 54.558 54.433 0.125 25485 15090 1 12 . 1 1 122 122 LEU CB C 122 45.399 45.399 43.318 2.081 25485 15091 1 12 . 1 1 122 122 LEU H H 122 6.847 6.847 7.472 -0.625 25485 15092 1 12 . 1 1 123 123 HIS N N 123 121.054 121.054 118.497 2.557 25485 15093 1 12 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.799 -0.192 25485 15094 1 12 . 1 1 123 123 HIS C C 123 172.820 172.820 173.840 -1.020 25485 15095 1 12 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.285 -0.777 25485 15096 1 12 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.515 0.595 25485 15097 1 12 . 1 1 123 123 HIS H H 123 7.760 7.760 8.691 -0.931 25485 15098 1 12 . 1 1 124 124 PHE N N 124 120.465 120.465 124.874 -4.409 25485 15099 1 12 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.413 0.421 25485 15100 1 12 . 1 1 124 124 PHE C C 124 175.677 175.677 175.625 0.052 25485 15101 1 12 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.664 0.628 25485 15102 1 12 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.158 0.664 25485 15103 1 12 . 1 1 124 124 PHE H H 124 8.306 8.306 8.739 -0.433 25485 15104 1 12 . 1 1 125 125 ARG N N 125 124.008 124.008 124.488 -0.480 25485 15105 1 12 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.859 -0.148 25485 15106 1 12 . 1 1 125 125 ARG C C 125 172.901 172.901 175.268 -2.367 25485 15107 1 12 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.842 -0.568 25485 15108 1 12 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.306 -0.484 25485 15109 1 12 . 1 1 125 125 ARG H H 125 8.426 8.426 9.004 -0.578 25485 15110 1 12 . 1 1 126 126 LYS N N 126 130.004 130.004 123.489 6.515 25485 15111 1 12 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.114 -0.731 25485 15112 1 12 . 1 1 126 126 LYS C C 126 176.126 176.126 175.675 0.451 25485 15113 1 12 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.847 0.334 25485 15114 1 12 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.851 -0.824 25485 15115 1 12 . 1 1 126 126 LYS H H 126 8.481 8.481 8.589 -0.108 25485 15116 1 12 . 1 1 127 127 VAL N N 127 125.288 125.288 119.114 6.174 25485 15117 1 12 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.142 0.363 25485 15118 1 12 . 1 1 127 127 VAL C C 127 175.565 175.565 175.143 0.422 25485 15119 1 12 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.738 -1.789 25485 15120 1 12 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.041 2.321 25485 15121 1 12 . 1 1 127 127 VAL H H 127 8.721 8.721 8.207 0.514 25485 15122 1 12 . 1 1 128 128 VAL N N 128 117.467 117.467 121.395 -3.928 25485 15123 1 12 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.044 0.285 25485 15124 1 12 . 1 1 128 128 VAL C C 128 174.622 174.622 174.814 -0.192 25485 15125 1 12 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.381 0.737 25485 15126 1 12 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.019 0.491 25485 15127 1 12 . 1 1 128 128 VAL H H 128 8.406 8.406 8.078 0.328 25485 15128 1 12 . 1 1 129 129 TRP N N 129 119.986 119.986 120.697 -0.711 25485 15129 1 12 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.803 -0.087 25485 15130 1 12 . 1 1 129 129 TRP C C 129 174.536 174.536 176.309 -1.773 25485 15131 1 12 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.712 -0.795 25485 15132 1 12 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.920 2.094 25485 15133 1 12 . 1 1 129 129 TRP H H 129 7.435 7.435 7.214 0.221 25485 15134 1 12 . 1 1 130 130 GLY N N 130 109.900 109.900 113.620 -3.720 25485 15135 1 12 . 1 1 130 130 GLY C C 130 173.187 173.187 173.299 -0.112 25485 15136 1 12 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.363 0.117 25485 15137 1 12 . 1 1 130 130 GLY H H 130 8.006 8.006 8.170 -0.164 25485 15138 1 12 . 1 1 131 131 THR N N 131 116.142 116.142 112.869 3.273 25485 15139 1 12 . 1 1 131 131 THR HA H 131 4.162 4.162 4.424 -0.262 25485 15140 1 12 . 1 1 131 131 THR C C 131 172.766 172.766 173.763 -0.997 25485 15141 1 12 . 1 1 131 131 THR CA C 131 63.212 63.212 61.111 2.101 25485 15142 1 12 . 1 1 131 131 THR CB C 131 69.308 69.308 70.243 -0.935 25485 15143 1 12 . 1 1 131 131 THR H H 131 8.233 8.233 8.293 -0.060 25485 15144 1 12 . 1 1 132 132 ALA N N 132 129.807 129.807 124.764 5.043 25485 15145 1 12 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.552 -0.036 25485 15146 1 12 . 1 1 132 132 ALA C C 132 175.358 175.358 176.474 -1.116 25485 15147 1 12 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.715 -1.349 25485 15148 1 12 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.855 0.943 25485 15149 1 12 . 1 1 132 132 ALA H H 132 7.962 7.962 8.349 -0.387 25485 15150 1 12 . 1 1 133 133 ASP N N 133 122.896 122.896 119.348 3.548 25485 15151 1 12 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.517 -0.096 25485 15152 1 12 . 1 1 133 133 ASP C C 133 177.314 177.314 176.851 0.463 25485 15153 1 12 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.216 1.703 25485 15154 1 12 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.492 -1.021 25485 15155 1 12 . 1 1 133 133 ASP H H 133 8.251 8.251 8.159 0.092 25485 15156 1 12 . 1 1 134 134 ILE N N 134 125.472 125.472 121.986 3.486 25485 15157 1 12 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.331 -0.188 25485 15158 1 12 . 1 1 134 134 ILE C C 134 174.201 174.201 174.770 -0.569 25485 15159 1 12 . 1 1 134 134 ILE CA C 134 61.271 61.271 60.629 0.642 25485 15160 1 12 . 1 1 134 134 ILE CB C 134 38.710 38.710 37.492 1.218 25485 15161 1 12 . 1 1 134 134 ILE H H 134 8.802 8.802 8.107 0.695 25485 15162 1 12 . 1 1 135 135 MET N N 135 127.265 127.265 127.851 -0.586 25485 15163 1 12 . 1 1 135 135 MET HA H 135 5.192 5.192 5.305 -0.113 25485 15164 1 12 . 1 1 135 135 MET C C 135 176.206 176.206 175.307 0.899 25485 15165 1 12 . 1 1 135 135 MET CA C 135 53.626 53.626 52.647 0.979 25485 15166 1 12 . 1 1 135 135 MET CB C 135 32.639 32.639 33.798 -1.159 25485 15167 1 12 . 1 1 135 135 MET H H 135 7.418 7.418 8.098 -0.680 25485 15168 1 12 . 1 1 136 136 ILE N N 136 125.440 125.440 122.996 2.444 25485 15169 1 12 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.879 0.710 25485 15170 1 12 . 1 1 136 136 ILE C C 136 175.190 175.190 175.869 -0.679 25485 15171 1 12 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.895 1.213 25485 15172 1 12 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.883 4.057 25485 15173 1 12 . 1 1 136 136 ILE H H 136 9.124 9.124 8.685 0.439 25485 15174 1 12 . 1 1 137 137 GLY N N 137 112.211 112.211 114.469 -2.258 25485 15175 1 12 . 1 1 137 137 GLY C C 137 170.855 170.855 171.826 -0.971 25485 15176 1 12 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.024 1.381 25485 15177 1 12 . 1 1 137 137 GLY H H 137 8.594 8.594 8.141 0.453 25485 15178 1 12 . 1 1 138 138 PHE N N 138 119.463 119.463 119.739 -0.276 25485 15179 1 12 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.259 0.237 25485 15180 1 12 . 1 1 138 138 PHE C C 138 175.186 175.186 175.754 -0.568 25485 15181 1 12 . 1 1 138 138 PHE CA C 138 55.995 55.995 57.590 -1.595 25485 15182 1 12 . 1 1 138 138 PHE CB C 138 41.442 41.442 42.204 -0.762 25485 15183 1 12 . 1 1 138 138 PHE H H 138 7.857 7.857 8.495 -0.638 25485 15184 1 12 . 1 1 139 139 ALA N N 139 123.914 123.914 124.584 -0.670 25485 15185 1 12 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.579 0.152 25485 15186 1 12 . 1 1 139 139 ALA C C 139 174.613 174.613 174.761 -0.148 25485 15187 1 12 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.121 -1.087 25485 15188 1 12 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.459 2.013 25485 15189 1 12 . 1 1 139 139 ALA H H 139 8.955 8.955 8.557 0.398 25485 15190 1 12 . 1 1 140 140 ARG N N 140 118.339 118.339 119.648 -1.309 25485 15191 1 12 . 1 1 140 140 ARG HA H 140 5.106 5.106 5.105 0.001 25485 15192 1 12 . 1 1 140 140 ARG C C 140 176.201 176.201 178.370 -2.169 25485 15193 1 12 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.724 -0.558 25485 15194 1 12 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.204 1.265 25485 15195 1 12 . 1 1 140 140 ARG H H 140 8.546 8.546 8.574 -0.028 25485 15196 1 12 . 1 1 141 141 GLY N N 141 108.916 108.916 109.446 -0.530 25485 15197 1 12 . 1 1 141 141 GLY C C 141 175.595 175.595 175.764 -0.169 25485 15198 1 12 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.406 -1.116 25485 15199 1 12 . 1 1 141 141 GLY H H 141 8.989 8.989 9.191 -0.202 25485 15200 1 12 . 1 1 142 142 ALA N N 142 121.448 121.448 123.298 -1.850 25485 15201 1 12 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.189 0.219 25485 15202 1 12 . 1 1 142 142 ALA C C 142 177.027 177.027 178.192 -1.165 25485 15203 1 12 . 1 1 142 142 ALA CA C 142 53.277 53.277 53.595 -0.318 25485 15204 1 12 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.175 -0.211 25485 15205 1 12 . 1 1 142 142 ALA H H 142 8.642 8.642 8.379 0.263 25485 15206 1 12 . 1 1 143 143 HIS N N 143 120.356 120.356 114.715 5.641 25485 15207 1 12 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.415 0.742 25485 15208 1 12 . 1 1 143 143 HIS C C 143 174.303 174.303 176.263 -1.960 25485 15209 1 12 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.151 -0.698 25485 15210 1 12 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.692 -1.901 25485 15211 1 12 . 1 1 143 143 HIS H H 143 8.990 8.990 8.143 0.847 25485 15212 1 12 . 1 1 144 144 GLY N N 144 112.517 112.517 108.100 4.417 25485 15213 1 12 . 1 1 144 144 GLY C C 144 173.758 173.758 172.994 0.764 25485 15214 1 12 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.380 1.715 25485 15215 1 12 . 1 1 144 144 GLY H H 144 5.175 5.175 7.498 -2.323 25485 15216 1 12 . 1 1 145 145 ASP N N 145 117.762 117.762 120.081 -2.319 25485 15217 1 12 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.803 -0.105 25485 15218 1 12 . 1 1 145 145 ASP C C 145 175.851 175.851 175.650 0.201 25485 15219 1 12 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.723 -0.764 25485 15220 1 12 . 1 1 145 145 ASP CB C 145 41.799 41.799 43.704 -1.905 25485 15221 1 12 . 1 1 145 145 ASP H H 145 7.096 7.096 7.786 -0.690 25485 15222 1 12 . 1 1 146 146 SER N N 146 125.540 125.540 117.715 7.825 25485 15223 1 12 . 1 1 146 146 SER HA H 146 4.204 4.204 4.148 0.056 25485 15224 1 12 . 1 1 146 146 SER C C 146 172.319 172.319 173.615 -1.296 25485 15225 1 12 . 1 1 146 146 SER CA C 146 58.862 58.862 58.539 0.323 25485 15226 1 12 . 1 1 146 146 SER CB C 146 62.933 62.933 63.208 -0.275 25485 15227 1 12 . 1 1 146 146 SER H H 146 8.261 8.261 8.199 0.062 25485 15228 1 12 . 1 1 147 147 TYR N N 147 120.757 120.757 117.833 2.924 25485 15229 1 12 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.329 0.493 25485 15230 1 12 . 1 1 147 147 TYR C C 147 170.372 170.372 173.570 -3.198 25485 15231 1 12 . 1 1 147 147 TYR CA C 147 53.268 53.268 56.827 -3.558 25485 15232 1 12 . 1 1 147 147 TYR CB C 147 38.296 38.296 37.147 1.149 25485 15233 1 12 . 1 1 147 147 TYR H H 147 7.450 7.450 8.063 -0.613 25485 15234 1 12 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.577 0.295 25485 15235 1 12 . 1 1 148 148 PRO C C 148 179.009 179.009 177.073 1.936 25485 15236 1 12 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.548 0.827 25485 15237 1 12 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.649 -1.740 25485 15238 1 12 . 1 1 149 149 PHE N N 149 120.514 120.514 122.949 -2.435 25485 15239 1 12 . 1 1 149 149 PHE C C 149 176.813 176.813 176.442 0.371 25485 15240 1 12 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.512 -1.059 25485 15241 1 12 . 1 1 149 149 PHE CB C 149 38.573 38.573 39.265 -0.692 25485 15242 1 12 . 1 1 149 149 PHE H H 149 8.024 8.024 8.765 -0.741 25485 15243 1 12 . 1 1 150 150 ASP N N 150 115.555 115.555 117.308 -1.753 25485 15244 1 12 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.489 0.350 25485 15245 1 12 . 1 1 150 150 ASP C C 150 177.007 177.007 176.327 0.680 25485 15246 1 12 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.539 -0.668 25485 15247 1 12 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.358 2.578 25485 15248 1 12 . 1 1 150 150 ASP H H 150 7.511 7.511 8.565 -1.054 25485 15249 1 12 . 1 1 151 151 GLY N N 151 110.650 110.650 109.634 1.016 25485 15250 1 12 . 1 1 151 151 GLY C C 151 170.281 170.281 172.123 -1.842 25485 15251 1 12 . 1 1 151 151 GLY CA C 151 44.398 44.398 45.349 -0.951 25485 15252 1 12 . 1 1 151 151 GLY H H 151 9.080 9.080 8.215 0.865 25485 15253 1 12 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.221 -0.165 25485 15254 1 12 . 1 1 152 152 PRO C C 152 178.300 178.300 176.676 1.624 25485 15255 1 12 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.281 0.569 25485 15256 1 12 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.831 -0.571 25485 15257 1 12 . 1 1 153 153 GLY N N 153 118.783 118.783 112.727 6.056 25485 15258 1 12 . 1 1 153 153 GLY C C 153 174.098 174.098 173.287 0.811 25485 15259 1 12 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.320 -0.714 25485 15260 1 12 . 1 1 153 153 GLY H H 153 11.431 11.431 8.060 3.371 25485 15261 1 12 . 1 1 154 154 ASN N N 154 120.679 120.679 121.741 -1.062 25485 15262 1 12 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.237 0.007 25485 15263 1 12 . 1 1 154 154 ASN C C 154 174.636 174.636 174.579 0.057 25485 15264 1 12 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.529 2.139 25485 15265 1 12 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.522 -1.551 25485 15266 1 12 . 1 1 154 154 ASN H H 154 9.247 9.247 8.486 0.761 25485 15267 1 12 . 1 1 155 155 THR N N 155 118.252 118.252 111.753 6.499 25485 15268 1 12 . 1 1 155 155 THR HA H 155 5.577 5.577 4.359 1.218 25485 15269 1 12 . 1 1 155 155 THR C C 155 176.596 176.596 173.074 3.522 25485 15270 1 12 . 1 1 155 155 THR CA C 155 61.731 61.731 62.992 -1.261 25485 15271 1 12 . 1 1 155 155 THR CB C 155 71.325 71.325 68.729 2.596 25485 15272 1 12 . 1 1 155 155 THR H H 155 9.501 9.501 8.406 1.095 25485 15273 1 12 . 1 1 156 156 LEU N N 156 122.598 122.598 121.725 0.873 25485 15274 1 12 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.563 0.308 25485 15275 1 12 . 1 1 156 156 LEU C C 156 175.655 175.655 176.069 -0.414 25485 15276 1 12 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.380 -0.843 25485 15277 1 12 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.845 1.666 25485 15278 1 12 . 1 1 156 156 LEU H H 156 8.492 8.492 8.356 0.136 25485 15279 1 12 . 1 1 157 157 ALA N N 157 115.389 115.389 115.490 -0.101 25485 15280 1 12 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.898 0.137 25485 15281 1 12 . 1 1 157 157 ALA C C 157 175.739 175.739 175.200 0.539 25485 15282 1 12 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.643 -0.704 25485 15283 1 12 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.799 1.655 25485 15284 1 12 . 1 1 157 157 ALA H H 157 7.567 7.567 7.808 -0.241 25485 15285 1 12 . 1 1 158 158 HIS N N 158 111.900 111.900 118.486 -6.586 25485 15286 1 12 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.899 -0.294 25485 15287 1 12 . 1 1 158 158 HIS C C 158 170.186 170.186 172.592 -2.406 25485 15288 1 12 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.276 1.800 25485 15289 1 12 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.664 -1.478 25485 15290 1 12 . 1 1 158 158 HIS H H 158 8.757 8.757 8.120 0.637 25485 15291 1 12 . 1 1 159 159 ALA N N 159 118.286 118.286 126.488 -8.202 25485 15292 1 12 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.365 0.289 25485 15293 1 12 . 1 1 159 159 ALA C C 159 174.036 174.036 175.534 -1.498 25485 15294 1 12 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.541 0.592 25485 15295 1 12 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.690 2.347 25485 15296 1 12 . 1 1 159 159 ALA H H 159 6.110 6.110 8.339 -2.229 25485 15297 1 12 . 1 1 160 160 PHE N N 160 117.937 117.937 118.102 -0.165 25485 15298 1 12 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.784 -0.281 25485 15299 1 12 . 1 1 160 160 PHE C C 160 174.455 174.455 175.222 -0.767 25485 15300 1 12 . 1 1 160 160 PHE CA C 160 56.813 56.813 54.581 2.232 25485 15301 1 12 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.462 0.732 25485 15302 1 12 . 1 1 160 160 PHE H H 160 7.912 7.912 8.035 -0.123 25485 15303 1 12 . 1 1 161 161 ALA N N 161 123.531 123.531 122.801 0.730 25485 15304 1 12 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.709 -0.218 25485 15305 1 12 . 1 1 161 161 ALA C C 161 175.503 175.503 176.291 -0.788 25485 15306 1 12 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.970 0.663 25485 15307 1 12 . 1 1 161 161 ALA CB C 161 16.556 16.556 18.925 -2.369 25485 15308 1 12 . 1 1 161 161 ALA H H 161 8.107 8.107 8.467 -0.360 25485 15309 1 12 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.865 -1.955 25485 15310 1 12 . 1 1 162 162 PRO C C 162 173.465 173.465 176.090 -2.625 25485 15311 1 12 . 1 1 162 162 PRO CA C 162 64.257 64.257 63.269 0.988 25485 15312 1 12 . 1 1 162 162 PRO CB C 162 31.242 31.242 30.321 0.921 25485 15313 1 12 . 1 1 163 163 GLY N N 163 107.206 107.206 110.578 -3.372 25485 15314 1 12 . 1 1 163 163 GLY C C 163 172.092 172.092 173.007 -0.915 25485 15315 1 12 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.090 -0.097 25485 15316 1 12 . 1 1 163 163 GLY H H 163 5.997 5.997 8.087 -2.090 25485 15317 1 12 . 1 1 165 165 GLY N N 165 103.110 103.110 115.670 -12.560 25485 15318 1 12 . 1 1 165 165 GLY C C 165 177.158 177.158 174.567 2.591 25485 15319 1 12 . 1 1 165 165 GLY CA C 165 44.243 44.243 44.949 -0.706 25485 15320 1 12 . 1 1 165 165 GLY H H 165 9.145 9.145 8.373 0.772 25485 15321 1 12 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.257 -0.078 25485 15322 1 12 . 1 1 166 166 LEU C C 166 176.437 176.437 177.864 -1.427 25485 15323 1 12 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.197 0.003 25485 15324 1 12 . 1 1 166 166 LEU CB C 166 41.834 41.834 40.689 1.145 25485 15325 1 12 . 1 1 167 167 GLY N N 167 103.318 103.318 105.602 -2.284 25485 15326 1 12 . 1 1 167 167 GLY C C 167 174.803 174.803 174.927 -0.124 25485 15327 1 12 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.766 2.467 25485 15328 1 12 . 1 1 167 167 GLY H H 167 7.768 7.768 7.339 0.429 25485 15329 1 12 . 1 1 168 168 GLY N N 168 121.051 121.051 109.378 11.673 25485 15330 1 12 . 1 1 168 168 GLY C C 168 172.122 172.122 174.527 -2.405 25485 15331 1 12 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.327 1.275 25485 15332 1 12 . 1 1 168 168 GLY H H 168 7.698 7.698 8.494 -0.796 25485 15333 1 12 . 1 1 169 169 ASP N N 169 123.641 123.641 122.332 1.309 25485 15334 1 12 . 1 1 169 169 ASP C C 169 173.942 173.942 173.849 0.093 25485 15335 1 12 . 1 1 169 169 ASP CA C 169 55.842 55.842 54.632 1.210 25485 15336 1 12 . 1 1 169 169 ASP CB C 169 39.870 39.870 41.199 -1.329 25485 15337 1 12 . 1 1 169 169 ASP H H 169 8.595 8.595 7.644 0.951 25485 15338 1 12 . 1 1 170 170 ALA N N 170 119.366 119.366 124.218 -4.852 25485 15339 1 12 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.314 0.416 25485 15340 1 12 . 1 1 170 170 ALA C C 170 174.593 174.593 175.048 -0.455 25485 15341 1 12 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.644 0.480 25485 15342 1 12 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.167 1.168 25485 15343 1 12 . 1 1 170 170 ALA H H 170 8.324 8.324 8.488 -0.164 25485 15344 1 12 . 1 1 171 171 HIS N N 171 120.239 120.239 121.077 -0.838 25485 15345 1 12 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.250 0.498 25485 15346 1 12 . 1 1 171 171 HIS C C 171 172.949 172.949 173.870 -0.921 25485 15347 1 12 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.437 -2.713 25485 15348 1 12 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.064 1.477 25485 15349 1 12 . 1 1 171 171 HIS H H 171 8.499 8.499 7.741 0.758 25485 15350 1 12 . 1 1 172 172 PHE N N 172 121.125 121.125 121.360 -0.235 25485 15351 1 12 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.454 0.074 25485 15352 1 12 . 1 1 172 172 PHE C C 172 173.875 173.875 174.257 -0.382 25485 15353 1 12 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.619 0.301 25485 15354 1 12 . 1 1 172 172 PHE CB C 172 41.903 41.903 40.764 1.139 25485 15355 1 12 . 1 1 172 172 PHE H H 172 8.445 8.445 7.991 0.454 25485 15356 1 12 . 1 1 173 173 ASP N N 173 124.014 124.014 122.747 1.267 25485 15357 1 12 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.341 -0.427 25485 15358 1 12 . 1 1 173 173 ASP C C 173 178.613 178.613 177.872 0.741 25485 15359 1 12 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.456 1.342 25485 15360 1 12 . 1 1 173 173 ASP CB C 173 40.743 40.743 40.580 0.163 25485 15361 1 12 . 1 1 173 173 ASP H H 173 7.927 7.927 8.620 -0.693 25485 15362 1 12 . 1 1 174 174 GLU N N 174 132.469 132.469 126.824 5.645 25485 15363 1 12 . 1 1 174 174 GLU C C 174 176.442 176.442 177.142 -0.700 25485 15364 1 12 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.740 -1.556 25485 15365 1 12 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.156 1.129 25485 15366 1 12 . 1 1 174 174 GLU H H 174 9.528 9.528 8.636 0.892 25485 15367 1 12 . 1 1 175 175 ASP N N 175 117.394 117.394 118.615 -1.221 25485 15368 1 12 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.661 0.132 25485 15369 1 12 . 1 1 175 175 ASP C C 175 176.645 176.645 176.778 -0.133 25485 15370 1 12 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.364 0.567 25485 15371 1 12 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.486 -1.345 25485 15372 1 12 . 1 1 175 175 ASP H H 175 8.768 8.768 8.520 0.248 25485 15373 1 12 . 1 1 176 176 GLU N N 176 116.493 116.493 118.333 -1.840 25485 15374 1 12 . 1 1 176 176 GLU C C 176 175.038 175.038 176.128 -1.090 25485 15375 1 12 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.954 -2.289 25485 15376 1 12 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.527 -4.304 25485 15377 1 12 . 1 1 176 176 GLU H H 176 7.159 7.159 8.353 -1.194 25485 15378 1 12 . 1 1 177 177 ARG N N 177 122.186 122.186 118.615 3.571 25485 15379 1 12 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.498 0.191 25485 15380 1 12 . 1 1 177 177 ARG C C 177 174.482 174.482 174.339 0.143 25485 15381 1 12 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.790 -1.103 25485 15382 1 12 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.243 -1.159 25485 15383 1 12 . 1 1 177 177 ARG H H 177 7.560 7.560 8.198 -0.638 25485 15384 1 12 . 1 1 178 178 TRP N N 178 129.179 129.179 124.243 4.936 25485 15385 1 12 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.431 -0.331 25485 15386 1 12 . 1 1 178 178 TRP C C 178 176.298 176.298 176.400 -0.102 25485 15387 1 12 . 1 1 178 178 TRP CA C 178 56.813 56.813 55.981 0.832 25485 15388 1 12 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.282 -1.085 25485 15389 1 12 . 1 1 178 178 TRP H H 178 8.807 8.807 8.660 0.147 25485 15390 1 12 . 1 1 179 179 THR N N 179 112.792 112.792 112.856 -0.064 25485 15391 1 12 . 1 1 179 179 THR HA H 179 4.985 4.985 4.645 0.340 25485 15392 1 12 . 1 1 179 179 THR C C 179 172.765 172.765 172.181 0.584 25485 15393 1 12 . 1 1 179 179 THR CA C 179 59.106 59.106 61.660 -2.554 25485 15394 1 12 . 1 1 179 179 THR CB C 179 71.786 71.786 69.951 1.835 25485 15395 1 12 . 1 1 179 179 THR H H 179 8.974 8.974 8.752 0.222 25485 15396 1 12 . 1 1 180 180 ASP N N 180 122.074 122.074 124.868 -2.794 25485 15397 1 12 . 1 1 180 180 ASP HA H 180 4.463 4.463 4.992 -0.529 25485 15398 1 12 . 1 1 180 180 ASP C C 180 176.366 176.366 178.696 -2.330 25485 15399 1 12 . 1 1 180 180 ASP CA C 180 53.043 53.043 56.071 -3.028 25485 15400 1 12 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.116 -0.388 25485 15401 1 12 . 1 1 180 180 ASP H H 180 8.485 8.485 8.719 -0.234 25485 15402 1 12 . 1 1 181 181 GLY N N 181 110.123 110.123 108.962 1.161 25485 15403 1 12 . 1 1 181 181 GLY C C 181 174.325 174.325 175.593 -1.268 25485 15404 1 12 . 1 1 181 181 GLY CA C 181 47.661 47.661 47.095 0.566 25485 15405 1 12 . 1 1 181 181 GLY H H 181 8.569 8.569 8.471 0.098 25485 15406 1 12 . 1 1 182 182 SER N N 182 115.562 115.562 115.373 0.189 25485 15407 1 12 . 1 1 182 182 SER HA H 182 4.519 4.519 4.584 -0.065 25485 15408 1 12 . 1 1 182 182 SER C C 182 173.783 173.783 173.840 -0.057 25485 15409 1 12 . 1 1 182 182 SER CA C 182 57.965 57.965 57.906 0.059 25485 15410 1 12 . 1 1 182 182 SER CB C 182 64.166 64.166 64.072 0.094 25485 15411 1 12 . 1 1 182 182 SER H H 182 8.160 8.160 7.679 0.481 25485 15412 1 12 . 1 1 183 183 SER N N 183 117.153 117.153 114.661 2.492 25485 15413 1 12 . 1 1 183 183 SER HA H 183 4.275 4.275 4.184 0.091 25485 15414 1 12 . 1 1 183 183 SER C C 183 173.333 173.333 174.111 -0.778 25485 15415 1 12 . 1 1 183 183 SER CA C 183 59.902 59.902 59.500 0.402 25485 15416 1 12 . 1 1 183 183 SER CB C 183 64.941 64.941 61.944 2.997 25485 15417 1 12 . 1 1 183 183 SER H H 183 7.796 7.796 7.889 -0.093 25485 15418 1 12 . 1 1 184 184 LEU N N 184 122.351 122.351 118.205 4.146 25485 15419 1 12 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.447 -0.055 25485 15420 1 12 . 1 1 184 184 LEU C C 184 176.250 176.250 177.702 -1.452 25485 15421 1 12 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.856 -0.281 25485 15422 1 12 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.765 -0.684 25485 15423 1 12 . 1 1 184 184 LEU H H 184 8.092 8.092 7.794 0.298 25485 15424 1 12 . 1 1 185 185 GLY N N 185 108.871 108.871 106.456 2.415 25485 15425 1 12 . 1 1 185 185 GLY C C 185 172.375 172.375 173.283 -0.908 25485 15426 1 12 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.240 0.140 25485 15427 1 12 . 1 1 185 185 GLY H H 185 7.960 7.960 7.494 0.466 25485 15428 1 12 . 1 1 186 186 ILE N N 186 123.096 123.096 121.823 1.273 25485 15429 1 12 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.154 -0.313 25485 15430 1 12 . 1 1 186 186 ILE C C 186 175.350 175.350 175.929 -0.579 25485 15431 1 12 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.075 -0.674 25485 15432 1 12 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.098 0.358 25485 15433 1 12 . 1 1 186 186 ILE H H 186 8.893 8.893 8.283 0.610 25485 15434 1 12 . 1 1 187 187 ASN N N 187 127.167 127.167 127.050 0.117 25485 15435 1 12 . 1 1 187 187 ASN HA H 187 4.353 4.353 5.003 -0.650 25485 15436 1 12 . 1 1 187 187 ASN C C 187 175.849 175.849 176.925 -1.076 25485 15437 1 12 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.471 1.243 25485 15438 1 12 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.438 0.692 25485 15439 1 12 . 1 1 187 187 ASN H H 187 8.580 8.580 8.322 0.258 25485 15440 1 12 . 1 1 188 188 PHE N N 188 129.985 129.985 126.938 3.047 25485 15441 1 12 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.439 0.134 25485 15442 1 12 . 1 1 188 188 PHE C C 188 175.578 175.578 177.425 -1.847 25485 15443 1 12 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.290 -0.562 25485 15444 1 12 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.589 -0.157 25485 15445 1 12 . 1 1 188 188 PHE H H 188 9.361 9.361 8.475 0.886 25485 15446 1 12 . 1 1 189 189 LEU N N 189 119.113 119.113 119.791 -0.678 25485 15447 1 12 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.179 -0.378 25485 15448 1 12 . 1 1 189 189 LEU C C 189 179.601 179.601 178.504 1.097 25485 15449 1 12 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.356 0.153 25485 15450 1 12 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.343 -1.466 25485 15451 1 12 . 1 1 189 189 LEU H H 189 8.562 8.562 7.914 0.648 25485 15452 1 12 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.709 0.208 25485 15453 1 12 . 1 1 190 190 TYR C C 190 177.621 177.621 177.679 -0.058 25485 15454 1 12 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.129 -0.321 25485 15455 1 12 . 1 1 190 190 TYR CB C 190 39.769 39.769 38.088 1.681 25485 15456 1 12 . 1 1 191 191 ALA N N 191 120.352 120.352 121.278 -0.926 25485 15457 1 12 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.498 -0.183 25485 15458 1 12 . 1 1 191 191 ALA C C 191 180.252 180.252 179.196 1.056 25485 15459 1 12 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.328 0.854 25485 15460 1 12 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.840 0.302 25485 15461 1 12 . 1 1 191 191 ALA H H 191 7.993 7.993 8.988 -0.995 25485 15462 1 12 . 1 1 192 192 ALA N N 192 121.409 121.409 121.585 -0.176 25485 15463 1 12 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.071 -0.014 25485 15464 1 12 . 1 1 192 192 ALA C C 192 178.575 178.575 179.685 -1.110 25485 15465 1 12 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.607 -0.422 25485 15466 1 12 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.169 -1.971 25485 15467 1 12 . 1 1 192 192 ALA H H 192 9.297 9.297 8.497 0.800 25485 15468 1 12 . 1 1 193 193 THR N N 193 116.996 116.996 114.428 2.568 25485 15469 1 12 . 1 1 193 193 THR HA H 193 3.833 3.833 4.168 -0.335 25485 15470 1 12 . 1 1 193 193 THR CA C 193 69.138 69.138 67.159 1.979 25485 15471 1 12 . 1 1 193 193 THR CB C 193 67.365 67.365 68.305 -0.940 25485 15472 1 12 . 1 1 193 193 THR H H 193 8.226 8.226 7.740 0.486 25485 15473 1 12 . 1 1 194 194 HIS N N 194 120.296 120.296 122.944 -2.648 25485 15474 1 12 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.347 -0.111 25485 15475 1 12 . 1 1 194 194 HIS C C 194 175.962 175.962 176.709 -0.747 25485 15476 1 12 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.634 1.113 25485 15477 1 12 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.731 -1.812 25485 15478 1 12 . 1 1 194 194 HIS H H 194 7.782 7.782 7.638 0.143 25485 15479 1 12 . 1 1 195 195 ALA N N 195 121.290 121.290 122.661 -1.371 25485 15480 1 12 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.960 0.196 25485 15481 1 12 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.725 1.238 25485 15482 1 12 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.617 0.093 25485 15483 1 12 . 1 1 195 195 ALA H H 195 8.690 8.690 8.409 0.281 25485 15484 1 12 . 1 1 196 196 LEU N N 196 114.899 114.899 118.438 -3.539 25485 15485 1 12 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.197 -0.027 25485 15486 1 12 . 1 1 196 196 LEU C C 196 177.946 177.946 179.704 -1.758 25485 15487 1 12 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.277 -1.049 25485 15488 1 12 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.066 -1.290 25485 15489 1 12 . 1 1 196 196 LEU H H 196 8.715 8.715 8.852 -0.137 25485 15490 1 12 . 1 1 197 197 GLY N N 197 107.901 107.901 104.635 3.266 25485 15491 1 12 . 1 1 197 197 GLY C C 197 178.641 178.641 175.356 3.285 25485 15492 1 12 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.733 0.834 25485 15493 1 12 . 1 1 197 197 GLY H H 197 7.546 7.546 8.047 -0.501 25485 15494 1 12 . 1 1 198 198 HIS N N 198 122.017 122.017 120.015 2.002 25485 15495 1 12 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.372 0.485 25485 15496 1 12 . 1 1 198 198 HIS C C 198 179.874 179.874 178.405 1.469 25485 15497 1 12 . 1 1 198 198 HIS CA C 198 58.522 58.522 58.109 0.413 25485 15498 1 12 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.416 -1.869 25485 15499 1 12 . 1 1 198 198 HIS H H 198 7.196 7.196 7.241 -0.045 25485 15500 1 12 . 1 1 199 199 SER N N 199 118.486 118.486 115.720 2.766 25485 15501 1 12 . 1 1 199 199 SER HA H 199 4.490 4.490 4.673 -0.183 25485 15502 1 12 . 1 1 199 199 SER C C 199 174.493 174.493 175.836 -1.343 25485 15503 1 12 . 1 1 199 199 SER CA C 199 58.173 58.173 60.842 -2.669 25485 15504 1 12 . 1 1 199 199 SER CB C 199 63.589 63.589 63.180 0.409 25485 15505 1 12 . 1 1 199 199 SER H H 199 7.884 7.884 7.775 0.109 25485 15506 1 12 . 1 1 200 200 LEU N N 200 114.686 114.686 118.385 -3.699 25485 15507 1 12 . 1 1 200 200 LEU C C 200 177.720 177.720 177.247 0.473 25485 15508 1 12 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.234 0.603 25485 15509 1 12 . 1 1 200 200 LEU CB C 200 42.357 42.357 40.629 1.728 25485 15510 1 12 . 1 1 200 200 LEU H H 200 7.108 7.108 6.857 0.251 25485 15511 1 12 . 1 1 201 201 GLY N N 201 108.363 108.363 106.636 1.727 25485 15512 1 12 . 1 1 201 201 GLY C C 201 174.008 174.008 174.595 -0.587 25485 15513 1 12 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.662 -1.248 25485 15514 1 12 . 1 1 201 201 GLY H H 201 8.195 8.195 7.977 0.218 25485 15515 1 12 . 1 1 202 202 MET N N 202 119.635 119.635 122.900 -3.265 25485 15516 1 12 . 1 1 202 202 MET HA H 202 4.473 4.473 4.296 0.177 25485 15517 1 12 . 1 1 202 202 MET C C 202 176.593 176.593 175.527 1.066 25485 15518 1 12 . 1 1 202 202 MET CA C 202 54.500 54.500 55.682 -1.182 25485 15519 1 12 . 1 1 202 202 MET CB C 202 32.161 32.161 32.957 -0.796 25485 15520 1 12 . 1 1 202 202 MET H H 202 8.182 8.182 7.243 0.939 25485 15521 1 12 . 1 1 203 203 GLY N N 203 109.749 109.749 112.477 -2.728 25485 15522 1 12 . 1 1 203 203 GLY C C 203 174.042 174.042 173.711 0.331 25485 15523 1 12 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.840 -0.836 25485 15524 1 12 . 1 1 203 203 GLY H H 203 8.405 8.405 8.385 0.020 25485 15525 1 12 . 1 1 204 204 HIS N N 204 115.732 115.732 118.484 -2.752 25485 15526 1 12 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.592 0.808 25485 15527 1 12 . 1 1 204 204 HIS C C 204 174.430 174.430 174.579 -0.149 25485 15528 1 12 . 1 1 204 204 HIS CA C 204 54.814 54.814 57.331 -2.517 25485 15529 1 12 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.873 -1.047 25485 15530 1 12 . 1 1 204 204 HIS H H 204 8.364 8.364 8.763 -0.399 25485 15531 1 12 . 1 1 205 205 SER N N 205 115.484 115.484 115.656 -0.172 25485 15532 1 12 . 1 1 205 205 SER HA H 205 4.766 4.766 4.815 -0.049 25485 15533 1 12 . 1 1 205 205 SER C C 205 173.611 173.611 174.738 -1.127 25485 15534 1 12 . 1 1 205 205 SER CA C 205 54.729 54.729 57.557 -2.828 25485 15535 1 12 . 1 1 205 205 SER CB C 205 65.855 65.855 65.854 0.001 25485 15536 1 12 . 1 1 205 205 SER H H 205 7.231 7.231 8.434 -1.203 25485 15537 1 12 . 1 1 206 206 SER N N 206 119.263 119.263 118.713 0.550 25485 15538 1 12 . 1 1 206 206 SER HA H 206 3.701 3.701 4.861 -1.159 25485 15539 1 12 . 1 1 206 206 SER C C 206 173.635 173.635 174.296 -0.661 25485 15540 1 12 . 1 1 206 206 SER CA C 206 63.846 63.846 59.587 4.260 25485 15541 1 12 . 1 1 206 206 SER CB C 206 63.764 63.764 63.737 0.027 25485 15542 1 12 . 1 1 206 206 SER H H 206 8.289 8.289 8.826 -0.537 25485 15543 1 12 . 1 1 207 207 ASP N N 207 126.646 126.646 122.648 3.998 25485 15544 1 12 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.689 0.240 25485 15545 1 12 . 1 1 207 207 ASP C C 207 174.614 174.614 175.588 -0.974 25485 15546 1 12 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.842 -1.570 25485 15547 1 12 . 1 1 207 207 ASP CB C 207 41.288 41.288 41.752 -0.464 25485 15548 1 12 . 1 1 207 207 ASP H H 207 8.541 8.541 8.217 0.324 25485 15549 1 12 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.420 0.367 25485 15550 1 12 . 1 1 208 208 PRO C C 208 177.467 177.467 175.544 1.923 25485 15551 1 12 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.837 -1.001 25485 15552 1 12 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.640 -0.043 25485 15553 1 12 . 1 1 209 209 ASN N N 209 116.020 116.020 112.642 3.378 25485 15554 1 12 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.693 -0.052 25485 15555 1 12 . 1 1 209 209 ASN C C 209 174.695 174.695 173.647 1.048 25485 15556 1 12 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.241 1.979 25485 15557 1 12 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.662 0.448 25485 15558 1 12 . 1 1 209 209 ASN H H 209 8.350 8.350 7.881 0.469 25485 15559 1 12 . 1 1 210 210 ALA N N 210 124.892 124.892 123.072 1.820 25485 15560 1 12 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.510 -0.415 25485 15561 1 12 . 1 1 210 210 ALA C C 210 179.495 179.495 178.246 1.249 25485 15562 1 12 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.854 1.200 25485 15563 1 12 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.403 -1.204 25485 15564 1 12 . 1 1 210 210 ALA H H 210 8.193 8.193 7.197 0.996 25485 15565 1 12 . 1 1 211 211 VAL N N 211 130.402 130.402 123.286 7.116 25485 15566 1 12 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.727 0.536 25485 15567 1 12 . 1 1 211 211 VAL C C 211 179.408 179.408 176.578 2.830 25485 15568 1 12 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.072 -0.020 25485 15569 1 12 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.112 -1.129 25485 15570 1 12 . 1 1 211 211 VAL H H 211 11.592 11.592 8.768 2.824 25485 15571 1 12 . 1 1 212 212 MET N N 212 113.285 113.285 115.084 -1.799 25485 15572 1 12 . 1 1 212 212 MET C C 212 176.996 176.996 175.402 1.594 25485 15573 1 12 . 1 1 212 212 MET CA C 212 53.614 53.614 54.450 -0.836 25485 15574 1 12 . 1 1 212 212 MET CB C 212 26.975 26.975 31.709 -4.734 25485 15575 1 12 . 1 1 212 212 MET H H 212 7.724 7.724 7.718 0.006 25485 15576 1 12 . 1 1 213 213 TYR N N 213 129.919 129.919 124.344 5.575 25485 15577 1 12 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.433 1.263 25485 15578 1 12 . 1 1 213 213 TYR C C 213 178.411 178.411 175.050 3.361 25485 15579 1 12 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.599 -0.468 25485 15580 1 12 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.361 0.806 25485 15581 1 12 . 1 1 213 213 TYR H H 213 7.902 7.902 7.368 0.534 25485 15582 1 12 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.320 -0.845 25485 15583 1 12 . 1 1 214 214 PRO C C 214 177.694 177.694 176.649 1.045 25485 15584 1 12 . 1 1 214 214 PRO CA C 214 66.028 66.028 63.724 2.304 25485 15585 1 12 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.849 0.975 25485 15586 1 12 . 1 1 215 215 THR N N 215 104.450 104.450 114.010 -9.560 25485 15587 1 12 . 1 1 215 215 THR HA H 215 4.444 4.444 4.351 0.093 25485 15588 1 12 . 1 1 215 215 THR C C 215 173.429 173.429 173.738 -0.309 25485 15589 1 12 . 1 1 215 215 THR CA C 215 60.528 60.528 61.996 -1.468 25485 15590 1 12 . 1 1 215 215 THR CB C 215 69.614 69.614 66.872 2.742 25485 15591 1 12 . 1 1 215 215 THR H H 215 6.407 6.407 7.308 -0.901 25485 15592 1 12 . 1 1 216 216 TYR N N 216 124.618 124.618 124.011 0.607 25485 15593 1 12 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.400 -0.168 25485 15594 1 12 . 1 1 216 216 TYR C C 216 175.669 175.669 176.884 -1.215 25485 15595 1 12 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.081 -0.493 25485 15596 1 12 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.614 2.277 25485 15597 1 12 . 1 1 216 216 TYR H H 216 8.331 8.331 7.778 0.553 25485 15598 1 12 . 1 1 217 217 GLY N N 217 116.089 116.089 111.402 4.687 25485 15599 1 12 . 1 1 217 217 GLY C C 217 173.560 173.560 173.909 -0.349 25485 15600 1 12 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.391 0.927 25485 15601 1 12 . 1 1 217 217 GLY H H 217 7.695 7.695 8.345 -0.650 25485 15602 1 12 . 1 1 218 218 ASN N N 218 120.167 120.167 117.533 2.634 25485 15603 1 12 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.662 0.004 25485 15604 1 12 . 1 1 218 218 ASN C C 218 175.343 175.343 176.035 -0.692 25485 15605 1 12 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.558 0.057 25485 15606 1 12 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.842 -0.296 25485 15607 1 12 . 1 1 218 218 ASN H H 218 8.237 8.237 8.518 -0.281 25485 15608 1 12 . 1 1 219 219 GLY N N 219 109.322 109.322 108.325 0.997 25485 15609 1 12 . 1 1 219 219 GLY C C 219 172.842 172.842 172.999 -0.157 25485 15610 1 12 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.596 0.122 25485 15611 1 12 . 1 1 219 219 GLY H H 219 8.027 8.027 7.759 0.268 25485 15612 1 12 . 1 1 220 220 ASP N N 220 123.006 123.006 119.225 3.781 25485 15613 1 12 . 1 1 220 220 ASP H H 220 8.273 8.273 8.021 0.252 25485 15614 1 12 . 1 1 221 221 PRO C C 221 177.138 177.138 177.200 -0.062 25485 15615 1 12 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.820 -5.757 25485 15616 1 12 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.741 -1.045 25485 15617 1 12 . 1 1 222 222 GLN N N 222 116.718 116.718 122.946 -6.228 25485 15618 1 12 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.258 0.078 25485 15619 1 12 . 1 1 222 222 GLN C C 222 176.321 176.321 176.255 0.066 25485 15620 1 12 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.859 -0.716 25485 15621 1 12 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.064 0.433 25485 15622 1 12 . 1 1 222 222 GLN H H 222 8.240 8.240 8.678 -0.438 25485 15623 1 12 . 1 1 223 223 ASN N N 223 118.368 118.368 116.270 2.098 25485 15624 1 12 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.842 0.074 25485 15625 1 12 . 1 1 223 223 ASN C C 223 173.271 173.271 174.418 -1.147 25485 15626 1 12 . 1 1 223 223 ASN CA C 223 52.596 52.596 52.332 0.264 25485 15627 1 12 . 1 1 223 223 ASN CB C 223 39.215 39.215 38.688 0.527 25485 15628 1 12 . 1 1 223 223 ASN H H 223 7.946 7.946 8.172 -0.226 25485 15629 1 12 . 1 1 224 224 PHE N N 224 118.429 118.429 119.584 -1.155 25485 15630 1 12 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.707 -0.256 25485 15631 1 12 . 1 1 224 224 PHE C C 224 172.897 172.897 175.033 -2.136 25485 15632 1 12 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.664 0.745 25485 15633 1 12 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.943 -0.242 25485 15634 1 12 . 1 1 224 224 PHE H H 224 6.992 6.992 7.861 -0.869 25485 15635 1 12 . 1 1 225 225 LYS N N 225 121.714 121.714 120.853 0.861 25485 15636 1 12 . 1 1 225 225 LYS HA H 225 4.430 4.430 4.039 0.391 25485 15637 1 12 . 1 1 225 225 LYS C C 225 174.664 174.664 174.841 -0.177 25485 15638 1 12 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.292 0.020 25485 15639 1 12 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.518 0.209 25485 15640 1 12 . 1 1 225 225 LYS H H 225 7.709 7.709 8.162 -0.453 25485 15641 1 12 . 1 1 226 226 LEU N N 226 119.026 119.026 121.373 -2.347 25485 15642 1 12 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.071 0.069 25485 15643 1 12 . 1 1 226 226 LEU C C 226 177.495 177.495 176.617 0.878 25485 15644 1 12 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.466 0.133 25485 15645 1 12 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.498 -1.216 25485 15646 1 12 . 1 1 226 226 LEU H H 226 8.015 8.015 8.216 -0.201 25485 15647 1 12 . 1 1 227 227 SER N N 227 120.320 120.320 114.956 5.364 25485 15648 1 12 . 1 1 227 227 SER HA H 227 4.600 4.600 4.483 0.117 25485 15649 1 12 . 1 1 227 227 SER C C 227 175.492 175.492 175.298 0.194 25485 15650 1 12 . 1 1 227 227 SER CA C 227 57.239 57.239 57.228 0.011 25485 15651 1 12 . 1 1 227 227 SER CB C 227 66.278 66.278 64.886 1.392 25485 15652 1 12 . 1 1 227 227 SER H H 227 9.654 9.654 7.951 1.703 25485 15653 1 12 . 1 1 228 228 GLN N N 228 127.511 127.511 124.929 2.582 25485 15654 1 12 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.998 0.696 25485 15655 1 12 . 1 1 228 228 GLN H H 228 8.248 8.248 8.903 -0.655 25485 15656 1 12 . 1 1 229 229 ASP N N 229 124.358 124.358 118.282 6.076 25485 15657 1 12 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.337 0.037 25485 15658 1 12 . 1 1 229 229 ASP C C 229 178.793 178.793 178.370 0.423 25485 15659 1 12 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.566 0.575 25485 15660 1 12 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.402 2.840 25485 15661 1 12 . 1 1 229 229 ASP H H 229 8.138 8.138 8.474 -0.336 25485 15662 1 12 . 1 1 230 230 ASP N N 230 119.694 119.694 120.267 -0.573 25485 15663 1 12 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.493 -0.071 25485 15664 1 12 . 1 1 230 230 ASP C C 230 177.736 177.736 177.946 -0.210 25485 15665 1 12 . 1 1 230 230 ASP CA C 230 57.922 57.922 56.889 1.033 25485 15666 1 12 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.080 2.156 25485 15667 1 12 . 1 1 230 230 ASP H H 230 7.393 7.393 7.408 -0.015 25485 15668 1 12 . 1 1 231 231 ILE N N 231 120.364 120.364 120.289 0.075 25485 15669 1 12 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.658 0.007 25485 15670 1 12 . 1 1 231 231 ILE C C 231 177.631 177.631 177.770 -0.139 25485 15671 1 12 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.185 0.314 25485 15672 1 12 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.984 0.529 25485 15673 1 12 . 1 1 231 231 ILE H H 231 8.115 8.115 7.924 0.191 25485 15674 1 12 . 1 1 232 232 LYS N N 232 119.156 119.156 120.373 -1.217 25485 15675 1 12 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.043 0.071 25485 15676 1 12 . 1 1 232 232 LYS C C 232 180.574 180.574 179.009 1.565 25485 15677 1 12 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.615 -0.056 25485 15678 1 12 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.720 0.077 25485 15679 1 12 . 1 1 232 232 LYS H H 232 8.607 8.607 8.485 0.122 25485 15680 1 12 . 1 1 233 233 GLY N N 233 106.425 106.425 108.079 -1.654 25485 15681 1 12 . 1 1 233 233 GLY C C 233 176.098 176.098 175.860 0.238 25485 15682 1 12 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.771 0.866 25485 15683 1 12 . 1 1 233 233 GLY H H 233 8.075 8.075 7.817 0.258 25485 15684 1 12 . 1 1 234 234 ILE N N 234 125.119 125.119 122.059 3.060 25485 15685 1 12 . 1 1 234 234 ILE C C 234 178.231 178.231 177.498 0.733 25485 15686 1 12 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.459 -1.866 25485 15687 1 12 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.353 -0.807 25485 15688 1 12 . 1 1 234 234 ILE H H 234 8.539 8.539 7.531 1.008 25485 15689 1 12 . 1 1 235 235 GLN N N 235 122.877 122.877 118.915 3.962 25485 15690 1 12 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.104 0.253 25485 15691 1 12 . 1 1 235 235 GLN C C 235 180.105 180.105 178.417 1.688 25485 15692 1 12 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.209 -1.322 25485 15693 1 12 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.814 -1.278 25485 15694 1 12 . 1 1 235 235 GLN H H 235 8.296 8.296 8.495 -0.199 25485 15695 1 12 . 1 1 236 236 LYS N N 236 123.678 123.678 119.143 4.535 25485 15696 1 12 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.359 -0.277 25485 15697 1 12 . 1 1 236 236 LYS C C 236 178.169 178.169 177.583 0.586 25485 15698 1 12 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.635 0.741 25485 15699 1 12 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.830 0.148 25485 15700 1 12 . 1 1 236 236 LYS H H 236 8.024 8.024 7.827 0.197 25485 15701 1 12 . 1 1 237 237 LEU N N 237 116.873 116.873 118.702 -1.829 25485 15702 1 12 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.411 -0.424 25485 15703 1 12 . 1 1 237 237 LEU C C 237 177.893 177.893 177.109 0.784 25485 15704 1 12 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.050 1.389 25485 15705 1 12 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.904 0.709 25485 15706 1 12 . 1 1 237 237 LEU H H 237 6.888 6.888 7.303 -0.415 25485 15707 1 12 . 1 1 238 238 TYR N N 238 112.237 112.237 116.816 -4.579 25485 15708 1 12 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.432 0.219 25485 15709 1 12 . 1 1 238 238 TYR C C 238 176.082 176.082 176.962 -0.880 25485 15710 1 12 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.139 -0.502 25485 15711 1 12 . 1 1 238 238 TYR CB C 238 41.398 41.398 40.084 1.314 25485 15712 1 12 . 1 1 238 238 TYR H H 238 7.445 7.445 8.087 -0.642 25485 15713 1 12 . 1 1 239 239 GLY N N 239 110.906 110.906 106.708 4.198 25485 15714 1 12 . 1 1 239 239 GLY C C 239 171.269 171.269 172.630 -1.361 25485 15715 1 12 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.156 -1.270 25485 15716 1 12 . 1 1 239 239 GLY H H 239 8.443 8.443 7.908 0.535 25485 15717 1 12 . 1 1 240 240 LYS N N 240 114.281 114.281 123.321 -9.040 25485 15718 1 12 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.412 0.326 25485 15719 1 12 . 1 1 240 240 LYS C C 240 177.527 177.527 177.451 0.076 25485 15720 1 12 . 1 1 240 240 LYS CA C 240 54.958 54.958 56.132 -1.174 25485 15721 1 12 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.539 0.736 25485 15722 1 12 . 1 1 240 240 LYS H H 240 7.873 7.873 8.290 -0.417 25485 15723 1 12 . 1 1 241 241 ARG N N 241 123.758 123.758 124.522 -0.764 25485 15724 1 12 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.243 -0.246 25485 15725 1 12 . 1 1 241 241 ARG C C 241 176.026 176.026 175.449 0.577 25485 15726 1 12 . 1 1 241 241 ARG CA C 241 57.492 57.492 57.435 0.057 25485 15727 1 12 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.352 0.019 25485 15728 1 12 . 1 1 241 241 ARG H H 241 7.742 7.742 8.733 -0.991 25485 15729 1 12 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.646 -0.306 25485 15730 1 12 . 1 1 246 246 LYS C C 246 175.403 175.403 176.400 -0.997 25485 15731 1 12 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.682 0.827 25485 15732 1 12 . 1 1 246 246 LYS CB C 246 32.858 32.858 33.767 -0.909 25485 15733 1 13 . 1 1 2 2 GLN HA H 2 4.307 4.307 3.832 0.475 25485 15734 1 13 . 1 1 2 2 GLN C C 2 176.492 176.492 177.684 -1.192 25485 15735 1 13 . 1 1 2 2 GLN CA C 2 56.749 56.749 58.386 -1.637 25485 15736 1 13 . 1 1 2 2 GLN CB C 2 28.654 28.654 27.393 1.261 25485 15737 1 13 . 1 1 3 3 GLU N N 3 121.668 121.668 120.557 1.111 25485 15738 1 13 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.019 -0.230 25485 15739 1 13 . 1 1 3 3 GLU C C 3 176.278 176.278 178.363 -2.085 25485 15740 1 13 . 1 1 3 3 GLU CA C 3 57.059 57.059 58.808 -1.749 25485 15741 1 13 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.283 0.408 25485 15742 1 13 . 1 1 3 3 GLU H H 3 8.331 8.331 8.443 -0.112 25485 15743 1 13 . 1 1 4 4 ALA N N 4 124.493 124.493 122.141 2.352 25485 15744 1 13 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.200 0.310 25485 15745 1 13 . 1 1 4 4 ALA C C 4 178.428 178.428 180.095 -1.667 25485 15746 1 13 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.399 0.278 25485 15747 1 13 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.075 0.634 25485 15748 1 13 . 1 1 4 4 ALA H H 4 8.131 8.131 8.255 -0.124 25485 15749 1 13 . 1 1 5 5 GLY N N 5 108.204 108.204 108.240 -0.036 25485 15750 1 13 . 1 1 5 5 GLY C C 5 174.858 174.858 175.278 -0.420 25485 15751 1 13 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.395 1.266 25485 15752 1 13 . 1 1 5 5 GLY H H 5 8.279 8.279 8.130 0.149 25485 15753 1 13 . 1 1 6 6 GLY N N 6 108.820 108.820 107.933 0.887 25485 15754 1 13 . 1 1 6 6 GLY C C 6 174.189 174.189 173.747 0.442 25485 15755 1 13 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.016 0.397 25485 15756 1 13 . 1 1 6 6 GLY H H 6 8.246 8.246 7.661 0.585 25485 15757 1 13 . 1 1 7 7 MET N N 7 119.938 119.938 119.749 0.189 25485 15758 1 13 . 1 1 7 7 MET HA H 7 4.659 4.659 4.329 0.330 25485 15759 1 13 . 1 1 7 7 MET C C 7 176.191 176.191 176.330 -0.139 25485 15760 1 13 . 1 1 7 7 MET CA C 7 54.799 54.799 55.610 -0.811 25485 15761 1 13 . 1 1 7 7 MET CB C 7 33.046 33.046 33.276 -0.230 25485 15762 1 13 . 1 1 7 7 MET H H 7 8.005 8.005 7.440 0.565 25485 15763 1 13 . 1 1 8 8 SER N N 8 118.919 118.919 116.605 2.314 25485 15764 1 13 . 1 1 8 8 SER HA H 8 4.239 4.239 4.314 -0.075 25485 15765 1 13 . 1 1 8 8 SER C C 8 174.949 174.949 175.801 -0.852 25485 15766 1 13 . 1 1 8 8 SER CA C 8 58.160 58.160 58.784 -0.624 25485 15767 1 13 . 1 1 8 8 SER CB C 8 65.440 65.440 63.993 1.447 25485 15768 1 13 . 1 1 8 8 SER H H 8 8.731 8.731 8.349 0.382 25485 15769 1 13 . 1 1 9 9 GLU N N 9 122.442 122.442 122.856 -0.414 25485 15770 1 13 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.156 0.165 25485 15771 1 13 . 1 1 9 9 GLU C C 9 178.604 178.604 178.397 0.207 25485 15772 1 13 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.774 -0.307 25485 15773 1 13 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.717 -0.541 25485 15774 1 13 . 1 1 9 9 GLU H H 9 8.901 8.901 9.060 -0.159 25485 15775 1 13 . 1 1 10 10 LEU N N 10 120.568 120.568 119.788 0.780 25485 15776 1 13 . 1 1 10 10 LEU C C 10 179.307 179.307 178.769 0.538 25485 15777 1 13 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.514 -1.034 25485 15778 1 13 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.873 -0.298 25485 15779 1 13 . 1 1 10 10 LEU H H 10 8.020 8.020 7.766 0.254 25485 15780 1 13 . 1 1 11 11 GLN N N 11 119.930 119.930 118.751 1.179 25485 15781 1 13 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.181 -0.047 25485 15782 1 13 . 1 1 11 11 GLN C C 11 178.330 178.330 178.838 -0.508 25485 15783 1 13 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.504 0.314 25485 15784 1 13 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.195 -0.331 25485 15785 1 13 . 1 1 11 11 GLN H H 11 7.811 7.811 7.624 0.187 25485 15786 1 13 . 1 1 12 12 TRP N N 12 121.031 121.031 120.998 0.033 25485 15787 1 13 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.346 0.068 25485 15788 1 13 . 1 1 12 12 TRP C C 12 178.874 178.874 178.027 0.847 25485 15789 1 13 . 1 1 12 12 TRP CA C 12 60.507 60.507 59.665 0.842 25485 15790 1 13 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.926 -0.539 25485 15791 1 13 . 1 1 12 12 TRP H H 12 8.205 8.205 7.963 0.242 25485 15792 1 13 . 1 1 13 13 GLU N N 13 121.877 121.877 118.468 3.409 25485 15793 1 13 . 1 1 13 13 GLU C C 13 179.425 179.425 178.959 0.466 25485 15794 1 13 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.584 0.452 25485 15795 1 13 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.330 -0.408 25485 15796 1 13 . 1 1 13 13 GLU H H 13 8.434 8.434 8.280 0.154 25485 15797 1 13 . 1 1 14 14 GLN N N 14 120.449 120.449 119.213 1.236 25485 15798 1 13 . 1 1 14 14 GLN HA H 14 4.238 4.238 4.018 0.220 25485 15799 1 13 . 1 1 14 14 GLN C C 14 179.210 179.210 178.135 1.075 25485 15800 1 13 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.983 -0.101 25485 15801 1 13 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.282 -0.531 25485 15802 1 13 . 1 1 14 14 GLN H H 14 8.124 8.124 8.368 -0.244 25485 15803 1 13 . 1 1 15 15 ALA N N 15 123.114 123.114 121.503 1.611 25485 15804 1 13 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.863 0.527 25485 15805 1 13 . 1 1 15 15 ALA C C 15 179.352 179.352 179.460 -0.108 25485 15806 1 13 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.196 -0.231 25485 15807 1 13 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.104 0.559 25485 15808 1 13 . 1 1 15 15 ALA H H 15 8.344 8.344 7.479 0.865 25485 15809 1 13 . 1 1 16 16 GLN N N 16 117.718 117.718 116.764 0.954 25485 15810 1 13 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.866 -0.084 25485 15811 1 13 . 1 1 16 16 GLN C C 16 177.719 177.719 178.115 -0.396 25485 15812 1 13 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.665 1.616 25485 15813 1 13 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.410 0.126 25485 15814 1 13 . 1 1 16 16 GLN H H 16 8.500 8.500 7.408 1.092 25485 15815 1 13 . 1 1 17 17 ASP N N 17 120.040 120.040 120.000 0.040 25485 15816 1 13 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.448 0.088 25485 15817 1 13 . 1 1 17 17 ASP C C 17 177.630 177.630 178.382 -0.752 25485 15818 1 13 . 1 1 17 17 ASP CA C 17 57.805 57.805 56.469 1.336 25485 15819 1 13 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.672 1.192 25485 15820 1 13 . 1 1 17 17 ASP H H 17 7.871 7.871 7.677 0.194 25485 15821 1 13 . 1 1 18 18 TYR N N 18 122.465 122.465 119.273 3.192 25485 15822 1 13 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.184 0.006 25485 15823 1 13 . 1 1 18 18 TYR C C 18 178.439 178.439 177.816 0.623 25485 15824 1 13 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.839 1.007 25485 15825 1 13 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.501 1.439 25485 15826 1 13 . 1 1 18 18 TYR H H 18 8.244 8.244 8.367 -0.123 25485 15827 1 13 . 1 1 19 19 LEU N N 19 117.635 117.635 118.999 -1.364 25485 15828 1 13 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.015 0.117 25485 15829 1 13 . 1 1 19 19 LEU C C 19 180.940 180.940 177.828 3.112 25485 15830 1 13 . 1 1 19 19 LEU CA C 19 57.505 57.505 57.347 0.158 25485 15831 1 13 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.972 -1.374 25485 15832 1 13 . 1 1 19 19 LEU H H 19 8.713 8.713 7.920 0.793 25485 15833 1 13 . 1 1 20 20 LYS N N 20 124.594 124.594 116.977 7.617 25485 15834 1 13 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.265 -0.181 25485 15835 1 13 . 1 1 20 20 LYS C C 20 178.387 178.387 178.445 -0.058 25485 15836 1 13 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.853 0.952 25485 15837 1 13 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.294 0.162 25485 15838 1 13 . 1 1 20 20 LYS H H 20 8.815 8.815 7.554 1.261 25485 15839 1 13 . 1 1 21 21 ARG N N 21 117.535 117.535 118.422 -0.887 25485 15840 1 13 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.012 -0.293 25485 15841 1 13 . 1 1 21 21 ARG C C 21 178.498 178.498 176.718 1.780 25485 15842 1 13 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.179 1.065 25485 15843 1 13 . 1 1 21 21 ARG CB C 21 29.441 29.441 28.827 0.614 25485 15844 1 13 . 1 1 21 21 ARG H H 21 7.810 7.810 7.489 0.321 25485 15845 1 13 . 1 1 22 22 PHE N N 22 112.113 112.113 117.401 -5.288 25485 15846 1 13 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.214 0.697 25485 15847 1 13 . 1 1 22 22 PHE C C 22 174.875 174.875 176.486 -1.611 25485 15848 1 13 . 1 1 22 22 PHE CA C 22 57.475 57.475 60.857 -3.382 25485 15849 1 13 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.199 -0.030 25485 15850 1 13 . 1 1 22 22 PHE H H 22 8.010 8.010 7.662 0.348 25485 15851 1 13 . 1 1 23 23 TYR N N 23 116.187 116.187 116.366 -0.179 25485 15852 1 13 . 1 1 23 23 TYR C C 23 173.455 173.455 176.414 -2.959 25485 15853 1 13 . 1 1 23 23 TYR CA C 23 58.427 58.427 60.692 -2.265 25485 15854 1 13 . 1 1 23 23 TYR CB C 23 39.529 39.529 39.672 -0.143 25485 15855 1 13 . 1 1 23 23 TYR H H 23 7.680 7.680 7.406 0.274 25485 15856 1 13 . 1 1 24 24 LEU N N 24 115.570 115.570 113.530 2.040 25485 15857 1 13 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.597 -0.447 25485 15858 1 13 . 1 1 24 24 LEU C C 24 176.661 176.661 174.701 1.960 25485 15859 1 13 . 1 1 24 24 LEU CA C 24 56.152 56.152 54.150 2.002 25485 15860 1 13 . 1 1 24 24 LEU CB C 24 36.863 36.863 45.634 -8.771 25485 15861 1 13 . 1 1 24 24 LEU H H 24 7.238 7.238 7.858 -0.620 25485 15862 1 13 . 1 1 25 25 TYR N N 25 119.901 119.901 121.103 -1.202 25485 15863 1 13 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.676 -0.317 25485 15864 1 13 . 1 1 25 25 TYR C C 25 173.784 173.784 174.540 -0.756 25485 15865 1 13 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.523 0.724 25485 15866 1 13 . 1 1 25 25 TYR CB C 25 39.079 39.079 38.330 0.749 25485 15867 1 13 . 1 1 25 25 TYR H H 25 7.845 7.845 8.524 -0.679 25485 15868 1 13 . 1 1 26 26 ASP N N 26 129.338 129.338 127.451 1.887 25485 15869 1 13 . 1 1 26 26 ASP HA H 26 4.451 4.451 4.963 -0.512 25485 15870 1 13 . 1 1 26 26 ASP C C 26 175.282 175.282 176.661 -1.379 25485 15871 1 13 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.179 -0.746 25485 15872 1 13 . 1 1 26 26 ASP CB C 26 41.249 41.249 42.419 -1.170 25485 15873 1 13 . 1 1 26 26 ASP H H 26 8.108 8.108 8.251 -0.143 25485 15874 1 13 . 1 1 27 27 SER C C 27 175.204 175.204 175.798 -0.594 25485 15875 1 13 . 1 1 27 27 SER CA C 27 59.424 59.424 59.835 -0.411 25485 15876 1 13 . 1 1 27 27 SER CB C 27 63.535 63.535 63.538 -0.003 25485 15877 1 13 . 1 1 28 28 GLU N N 28 122.058 122.058 122.312 -0.254 25485 15878 1 13 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.251 0.074 25485 15879 1 13 . 1 1 28 28 GLU C C 28 177.073 177.073 177.424 -0.351 25485 15880 1 13 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.156 -0.944 25485 15881 1 13 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.488 0.082 25485 15882 1 13 . 1 1 28 28 GLU H H 28 8.255 8.255 8.390 -0.135 25485 15883 1 13 . 1 1 29 29 THR N N 29 114.161 114.161 113.095 1.066 25485 15884 1 13 . 1 1 29 29 THR HA H 29 4.260 4.260 4.221 0.039 25485 15885 1 13 . 1 1 29 29 THR C C 29 174.591 174.591 174.123 0.468 25485 15886 1 13 . 1 1 29 29 THR CA C 29 61.976 61.976 62.940 -0.964 25485 15887 1 13 . 1 1 29 29 THR CB C 29 69.385 69.385 69.135 0.250 25485 15888 1 13 . 1 1 29 29 THR H H 29 7.498 7.498 7.648 -0.150 25485 15889 1 13 . 1 1 30 30 LYS HA H 30 4.218 4.218 3.982 0.236 25485 15890 1 13 . 1 1 30 30 LYS H H 30 8.218 8.218 7.295 0.923 25485 15891 1 13 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.751 -0.327 25485 15892 1 13 . 1 1 31 31 ASN CB C 31 39.133 39.133 41.517 -2.384 25485 15893 1 13 . 1 1 32 32 ALA N N 32 126.484 126.484 124.414 2.070 25485 15894 1 13 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.161 0.135 25485 15895 1 13 . 1 1 32 32 ALA C C 32 178.012 178.012 178.596 -0.584 25485 15896 1 13 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.927 -1.167 25485 15897 1 13 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.041 -0.271 25485 15898 1 13 . 1 1 32 32 ALA H H 32 8.411 8.411 8.688 -0.277 25485 15899 1 13 . 1 1 33 33 ASN N N 33 116.885 116.885 116.089 0.796 25485 15900 1 13 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.593 0.105 25485 15901 1 13 . 1 1 33 33 ASN C C 33 176.240 176.240 177.646 -1.406 25485 15902 1 13 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.986 -1.799 25485 15903 1 13 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.337 0.248 25485 15904 1 13 . 1 1 33 33 ASN H H 33 8.309 8.309 8.234 0.075 25485 15905 1 13 . 1 1 34 34 SER N N 34 116.836 116.836 115.564 1.272 25485 15906 1 13 . 1 1 34 34 SER HA H 34 4.544 4.544 4.401 0.143 25485 15907 1 13 . 1 1 34 34 SER C C 34 175.253 175.253 175.928 -0.675 25485 15908 1 13 . 1 1 34 34 SER CA C 34 59.583 59.583 59.993 -0.410 25485 15909 1 13 . 1 1 34 34 SER CB C 34 63.919 63.919 63.153 0.766 25485 15910 1 13 . 1 1 34 34 SER H H 34 8.115 8.115 7.973 0.142 25485 15911 1 13 . 1 1 35 35 LEU N N 35 125.355 125.355 123.545 1.810 25485 15912 1 13 . 1 1 35 35 LEU HA H 35 3.576 3.576 3.963 -0.387 25485 15913 1 13 . 1 1 35 35 LEU C C 35 177.973 177.973 177.832 0.141 25485 15914 1 13 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.526 -0.029 25485 15915 1 13 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.606 -0.914 25485 15916 1 13 . 1 1 35 35 LEU H H 35 8.312 8.312 8.241 0.071 25485 15917 1 13 . 1 1 36 36 GLU N N 36 119.201 119.201 118.548 0.653 25485 15918 1 13 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.979 -0.065 25485 15919 1 13 . 1 1 36 36 GLU C C 36 178.141 178.141 178.540 -0.399 25485 15920 1 13 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.164 0.495 25485 15921 1 13 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.649 0.664 25485 15922 1 13 . 1 1 36 36 GLU H H 36 8.225 8.225 7.880 0.345 25485 15923 1 13 . 1 1 37 37 ALA N N 37 120.746 120.746 122.831 -2.085 25485 15924 1 13 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.000 0.079 25485 15925 1 13 . 1 1 37 37 ALA C C 37 181.485 181.485 179.666 1.819 25485 15926 1 13 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.015 0.444 25485 15927 1 13 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.386 -0.219 25485 15928 1 13 . 1 1 37 37 ALA H H 37 7.917 7.917 7.805 0.112 25485 15929 1 13 . 1 1 38 38 LYS N N 38 119.326 119.326 118.190 1.136 25485 15930 1 13 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.000 0.331 25485 15931 1 13 . 1 1 38 38 LYS C C 38 177.946 177.946 178.807 -0.861 25485 15932 1 13 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.642 -0.938 25485 15933 1 13 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.029 -0.229 25485 15934 1 13 . 1 1 38 38 LYS H H 38 8.216 8.216 8.038 0.178 25485 15935 1 13 . 1 1 39 39 LEU N N 39 122.736 122.736 121.906 0.830 25485 15936 1 13 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.905 0.036 25485 15937 1 13 . 1 1 39 39 LEU C C 39 178.819 178.819 178.849 -0.030 25485 15938 1 13 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.117 -0.036 25485 15939 1 13 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.354 -0.726 25485 15940 1 13 . 1 1 39 39 LEU H H 39 8.666 8.666 8.286 0.380 25485 15941 1 13 . 1 1 40 40 LYS N N 40 118.411 118.411 118.857 -0.446 25485 15942 1 13 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.889 0.749 25485 15943 1 13 . 1 1 40 40 LYS C C 40 179.329 179.329 178.594 0.735 25485 15944 1 13 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.536 0.597 25485 15945 1 13 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.192 -0.407 25485 15946 1 13 . 1 1 40 40 LYS H H 40 8.227 8.227 7.729 0.498 25485 15947 1 13 . 1 1 41 41 GLU N N 41 121.329 121.329 118.577 2.752 25485 15948 1 13 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.085 0.008 25485 15949 1 13 . 1 1 41 41 GLU C C 41 178.989 178.989 179.013 -0.024 25485 15950 1 13 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.050 0.710 25485 15951 1 13 . 1 1 41 41 GLU CB C 41 29.836 29.836 29.006 0.830 25485 15952 1 13 . 1 1 41 41 GLU H H 41 7.718 7.718 7.543 0.175 25485 15953 1 13 . 1 1 42 42 MET N N 42 123.817 123.817 120.563 3.254 25485 15954 1 13 . 1 1 42 42 MET HA H 42 4.107 4.107 4.358 -0.251 25485 15955 1 13 . 1 1 42 42 MET C C 42 177.719 177.719 178.015 -0.296 25485 15956 1 13 . 1 1 42 42 MET CA C 42 59.912 59.912 58.452 1.460 25485 15957 1 13 . 1 1 42 42 MET CB C 42 30.506 30.506 32.478 -1.972 25485 15958 1 13 . 1 1 42 42 MET H H 42 7.657 7.657 7.650 0.007 25485 15959 1 13 . 1 1 43 43 GLN N N 43 119.998 119.998 118.507 1.491 25485 15960 1 13 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.029 -0.224 25485 15961 1 13 . 1 1 43 43 GLN C C 43 177.604 177.604 178.961 -1.357 25485 15962 1 13 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.633 1.332 25485 15963 1 13 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.731 -1.176 25485 15964 1 13 . 1 1 43 43 GLN H H 43 8.910 8.910 7.878 1.032 25485 15965 1 13 . 1 1 44 44 LYS N N 44 119.165 119.165 119.494 -0.329 25485 15966 1 13 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.240 -0.185 25485 15967 1 13 . 1 1 44 44 LYS C C 44 179.991 179.991 179.202 0.789 25485 15968 1 13 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.289 1.272 25485 15969 1 13 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.091 0.207 25485 15970 1 13 . 1 1 44 44 LYS H H 44 8.507 8.507 7.551 0.956 25485 15971 1 13 . 1 1 45 45 PHE N N 45 123.602 123.602 120.336 3.266 25485 15972 1 13 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.372 -0.471 25485 15973 1 13 . 1 1 45 45 PHE C C 45 177.606 177.606 177.658 -0.052 25485 15974 1 13 . 1 1 45 45 PHE CA C 45 63.034 63.034 61.399 1.635 25485 15975 1 13 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.661 0.205 25485 15976 1 13 . 1 1 45 45 PHE H H 45 8.445 8.445 7.869 0.576 25485 15977 1 13 . 1 1 46 46 PHE N N 46 112.715 112.715 116.519 -3.804 25485 15978 1 13 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.458 0.139 25485 15979 1 13 . 1 1 46 46 PHE C C 46 175.285 175.285 176.758 -1.473 25485 15980 1 13 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.501 1.174 25485 15981 1 13 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.220 -0.761 25485 15982 1 13 . 1 1 46 46 PHE H H 46 8.272 8.272 8.590 -0.318 25485 15983 1 13 . 1 1 47 47 GLY N N 47 110.438 110.438 106.561 3.877 25485 15984 1 13 . 1 1 47 47 GLY C C 47 174.935 174.935 174.200 0.735 25485 15985 1 13 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.402 1.609 25485 15986 1 13 . 1 1 47 47 GLY H H 47 7.926 7.926 8.360 -0.434 25485 15987 1 13 . 1 1 48 48 LEU N N 48 121.830 121.830 119.245 2.585 25485 15988 1 13 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.640 0.284 25485 15989 1 13 . 1 1 48 48 LEU C C 48 174.009 174.009 175.803 -1.794 25485 15990 1 13 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.316 -1.481 25485 15991 1 13 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.931 0.532 25485 15992 1 13 . 1 1 48 48 LEU H H 48 8.762 8.762 7.598 1.163 25485 15993 1 13 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.385 -0.147 25485 15994 1 13 . 1 1 49 49 PRO C C 49 176.874 176.874 176.809 0.065 25485 15995 1 13 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.733 -0.215 25485 15996 1 13 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.832 -0.753 25485 15997 1 13 . 1 1 50 50 ILE N N 50 126.859 126.859 117.358 9.501 25485 15998 1 13 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.053 0.048 25485 15999 1 13 . 1 1 50 50 ILE C C 50 176.540 176.540 175.766 0.774 25485 16000 1 13 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.928 -0.972 25485 16001 1 13 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.516 -1.123 25485 16002 1 13 . 1 1 50 50 ILE H H 50 8.548 8.548 7.953 0.595 25485 16003 1 13 . 1 1 51 51 THR N N 51 116.443 116.443 118.782 -2.339 25485 16004 1 13 . 1 1 51 51 THR HA H 51 4.584 4.584 4.434 0.150 25485 16005 1 13 . 1 1 51 51 THR C C 51 176.672 176.672 175.561 1.111 25485 16006 1 13 . 1 1 51 51 THR CA C 51 60.979 60.979 61.123 -0.144 25485 16007 1 13 . 1 1 51 51 THR CB C 51 71.505 71.505 69.902 1.603 25485 16008 1 13 . 1 1 51 51 THR H H 51 8.001 8.001 8.132 -0.131 25485 16009 1 13 . 1 1 52 52 GLY N N 52 112.719 112.719 110.442 2.277 25485 16010 1 13 . 1 1 52 52 GLY C C 52 170.609 170.609 173.649 -3.040 25485 16011 1 13 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.752 0.994 25485 16012 1 13 . 1 1 52 52 GLY H H 52 9.499 9.499 8.691 0.808 25485 16013 1 13 . 1 1 53 53 MET N N 53 116.621 116.621 119.234 -2.613 25485 16014 1 13 . 1 1 53 53 MET HA H 53 4.023 4.023 4.701 -0.678 25485 16015 1 13 . 1 1 53 53 MET C C 53 174.695 174.695 174.116 0.579 25485 16016 1 13 . 1 1 53 53 MET CA C 53 53.460 53.460 54.711 -1.251 25485 16017 1 13 . 1 1 53 53 MET CB C 53 35.408 35.408 36.242 -0.834 25485 16018 1 13 . 1 1 53 53 MET H H 53 7.993 7.993 7.513 0.480 25485 16019 1 13 . 1 1 54 54 LEU N N 54 122.679 122.679 119.086 3.593 25485 16020 1 13 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.559 -0.808 25485 16021 1 13 . 1 1 54 54 LEU C C 54 174.784 174.784 174.846 -0.062 25485 16022 1 13 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.506 -0.205 25485 16023 1 13 . 1 1 54 54 LEU CB C 54 42.010 42.010 44.497 -2.487 25485 16024 1 13 . 1 1 54 54 LEU H H 54 7.940 7.940 8.349 -0.409 25485 16025 1 13 . 1 1 55 55 ASN N N 55 115.797 115.797 120.670 -4.873 25485 16026 1 13 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.917 -0.168 25485 16027 1 13 . 1 1 55 55 ASN C C 55 175.459 175.459 174.204 1.255 25485 16028 1 13 . 1 1 55 55 ASN CA C 55 51.843 51.843 54.746 -2.904 25485 16029 1 13 . 1 1 55 55 ASN CB C 55 40.357 40.357 39.167 1.190 25485 16030 1 13 . 1 1 55 55 ASN H H 55 6.543 6.543 8.755 -2.212 25485 16031 1 13 . 1 1 56 56 SER N N 56 121.507 121.507 115.387 6.120 25485 16032 1 13 . 1 1 56 56 SER HA H 56 4.638 4.638 4.674 -0.036 25485 16033 1 13 . 1 1 56 56 SER C C 56 175.727 175.727 175.401 0.326 25485 16034 1 13 . 1 1 56 56 SER CA C 56 57.932 57.932 59.040 -1.108 25485 16035 1 13 . 1 1 56 56 SER CB C 56 63.786 63.786 63.928 -0.143 25485 16036 1 13 . 1 1 56 56 SER H H 56 8.213 8.213 7.973 0.240 25485 16037 1 13 . 1 1 57 57 ARG N N 57 122.951 122.951 122.333 0.618 25485 16038 1 13 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.247 -0.046 25485 16039 1 13 . 1 1 57 57 ARG C C 57 178.560 178.560 178.397 0.163 25485 16040 1 13 . 1 1 57 57 ARG CA C 57 58.432 58.432 59.113 -0.681 25485 16041 1 13 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.815 -0.710 25485 16042 1 13 . 1 1 57 57 ARG H H 57 7.895 7.895 8.498 -0.603 25485 16043 1 13 . 1 1 58 58 VAL N N 58 118.778 118.778 118.744 0.034 25485 16044 1 13 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.666 -0.335 25485 16045 1 13 . 1 1 58 58 VAL C C 58 177.370 177.370 177.510 -0.140 25485 16046 1 13 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.108 0.274 25485 16047 1 13 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.391 0.818 25485 16048 1 13 . 1 1 58 58 VAL H H 58 7.583 7.583 7.924 -0.341 25485 16049 1 13 . 1 1 59 59 ILE N N 59 119.159 119.159 118.956 0.203 25485 16050 1 13 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.795 -0.382 25485 16051 1 13 . 1 1 59 59 ILE C C 59 177.067 177.067 178.239 -1.172 25485 16052 1 13 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.448 0.185 25485 16053 1 13 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.574 0.122 25485 16054 1 13 . 1 1 59 59 ILE H H 59 7.323 7.323 7.924 -0.601 25485 16055 1 13 . 1 1 60 60 GLU N N 60 119.367 119.367 120.030 -0.663 25485 16056 1 13 . 1 1 60 60 GLU HA H 60 3.738 3.738 4.002 -0.264 25485 16057 1 13 . 1 1 60 60 GLU C C 60 179.978 179.978 179.392 0.586 25485 16058 1 13 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.817 -0.559 25485 16059 1 13 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.592 -0.204 25485 16060 1 13 . 1 1 60 60 GLU H H 60 7.879 7.879 8.025 -0.146 25485 16061 1 13 . 1 1 61 61 ILE N N 61 118.816 118.816 118.374 0.442 25485 16062 1 13 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.916 -0.477 25485 16063 1 13 . 1 1 61 61 ILE C C 61 179.033 179.033 177.062 1.971 25485 16064 1 13 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.140 0.698 25485 16065 1 13 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.516 -1.617 25485 16066 1 13 . 1 1 61 61 ILE H H 61 7.246 7.246 7.336 -0.090 25485 16067 1 13 . 1 1 62 62 MET N N 62 119.986 119.986 116.122 3.864 25485 16068 1 13 . 1 1 62 62 MET HA H 62 3.444 3.444 4.267 -0.823 25485 16069 1 13 . 1 1 62 62 MET C C 62 176.185 176.185 178.634 -2.449 25485 16070 1 13 . 1 1 62 62 MET CA C 62 59.014 59.014 58.317 0.697 25485 16071 1 13 . 1 1 62 62 MET CB C 62 31.250 31.250 32.788 -1.538 25485 16072 1 13 . 1 1 62 62 MET H H 62 7.835 7.835 7.284 0.551 25485 16073 1 13 . 1 1 63 63 GLN N N 63 116.163 116.163 117.136 -0.973 25485 16074 1 13 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.220 0.058 25485 16075 1 13 . 1 1 63 63 GLN C C 63 176.727 176.727 176.359 0.368 25485 16076 1 13 . 1 1 63 63 GLN CA C 63 56.138 56.138 57.109 -0.972 25485 16077 1 13 . 1 1 63 63 GLN CB C 63 29.066 29.066 28.698 0.368 25485 16078 1 13 . 1 1 63 63 GLN H H 63 7.454 7.454 7.699 -0.245 25485 16079 1 13 . 1 1 64 64 LYS N N 64 121.430 121.430 121.476 -0.046 25485 16080 1 13 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.498 0.045 25485 16081 1 13 . 1 1 64 64 LYS C C 64 174.724 174.724 174.604 0.120 25485 16082 1 13 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.189 1.328 25485 16083 1 13 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.603 -1.006 25485 16084 1 13 . 1 1 64 64 LYS H H 64 7.483 7.483 7.295 0.188 25485 16085 1 13 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.512 -2.076 25485 16086 1 13 . 1 1 65 65 PRO C C 65 176.158 176.158 176.272 -0.114 25485 16087 1 13 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.224 -0.336 25485 16088 1 13 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.490 -0.658 25485 16089 1 13 . 1 1 66 66 ARG N N 66 112.697 112.697 120.244 -7.547 25485 16090 1 13 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.883 -0.475 25485 16091 1 13 . 1 1 66 66 ARG C C 66 174.478 174.478 175.158 -0.680 25485 16092 1 13 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.278 -1.641 25485 16093 1 13 . 1 1 66 66 ARG CB C 66 34.673 34.673 30.823 3.850 25485 16094 1 13 . 1 1 66 66 ARG H H 66 8.146 8.146 8.710 -0.564 25485 16095 1 13 . 1 1 67 67 CYS N N 67 121.740 121.740 117.969 3.771 25485 16096 1 13 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.720 -0.280 25485 16097 1 13 . 1 1 67 67 CYS C C 67 175.659 175.659 175.568 0.091 25485 16098 1 13 . 1 1 67 67 CYS CA C 67 59.195 59.195 57.783 1.412 25485 16099 1 13 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.785 -1.579 25485 16100 1 13 . 1 1 67 67 CYS H H 67 7.757 7.757 8.129 -0.372 25485 16101 1 13 . 1 1 68 68 GLY N N 68 116.217 116.217 112.844 3.373 25485 16102 1 13 . 1 1 68 68 GLY C C 68 172.210 172.210 172.678 -0.468 25485 16103 1 13 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.046 1.513 25485 16104 1 13 . 1 1 68 68 GLY H H 68 9.704 9.704 9.149 0.555 25485 16105 1 13 . 1 1 69 69 VAL N N 69 126.372 126.372 119.540 6.832 25485 16106 1 13 . 1 1 69 69 VAL HA H 69 3.831 3.831 3.990 -0.159 25485 16107 1 13 . 1 1 69 69 VAL C C 69 173.538 173.538 173.970 -0.432 25485 16108 1 13 . 1 1 69 69 VAL CA C 69 61.368 61.368 57.583 3.785 25485 16109 1 13 . 1 1 69 69 VAL CB C 69 32.523 32.523 31.861 0.662 25485 16110 1 13 . 1 1 69 69 VAL H H 69 9.113 9.113 7.109 2.004 25485 16111 1 13 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.421 0.529 25485 16112 1 13 . 1 1 70 70 PRO C C 70 175.019 175.019 176.307 -1.288 25485 16113 1 13 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.421 0.927 25485 16114 1 13 . 1 1 70 70 PRO CB C 70 32.358 32.358 33.146 -0.788 25485 16115 1 13 . 1 1 71 71 ASP N N 71 118.986 118.986 118.400 0.586 25485 16116 1 13 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.986 -0.553 25485 16117 1 13 . 1 1 71 71 ASP C C 71 175.166 175.166 175.480 -0.314 25485 16118 1 13 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.816 1.552 25485 16119 1 13 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.042 -1.178 25485 16120 1 13 . 1 1 71 71 ASP H H 71 8.054 8.054 8.636 -0.583 25485 16121 1 13 . 1 1 72 72 VAL N N 72 112.953 112.953 115.132 -2.179 25485 16122 1 13 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.591 -0.295 25485 16123 1 13 . 1 1 72 72 VAL C C 72 174.330 174.330 174.233 0.097 25485 16124 1 13 . 1 1 72 72 VAL CA C 72 59.645 59.645 61.210 -1.565 25485 16125 1 13 . 1 1 72 72 VAL CB C 72 33.872 33.872 34.581 -0.709 25485 16126 1 13 . 1 1 72 72 VAL H H 72 6.430 6.430 7.705 -1.275 25485 16127 1 13 . 1 1 73 73 ALA N N 73 125.869 125.869 128.902 -3.033 25485 16128 1 13 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.875 -0.570 25485 16129 1 13 . 1 1 73 73 ALA C C 73 177.382 177.382 176.470 0.912 25485 16130 1 13 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.723 0.326 25485 16131 1 13 . 1 1 73 73 ALA CB C 73 19.951 19.951 21.119 -1.168 25485 16132 1 13 . 1 1 73 73 ALA H H 73 8.177 8.177 8.429 -0.252 25485 16133 1 13 . 1 1 74 74 GLU N N 74 120.724 120.724 118.971 1.753 25485 16134 1 13 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.439 -0.336 25485 16135 1 13 . 1 1 74 74 GLU C C 74 176.246 176.246 175.054 1.192 25485 16136 1 13 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.993 -0.201 25485 16137 1 13 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.459 -1.674 25485 16138 1 13 . 1 1 74 74 GLU H H 74 8.381 8.381 8.519 -0.138 25485 16139 1 13 . 1 1 75 75 TYR N N 75 121.473 121.473 120.248 1.225 25485 16140 1 13 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.143 0.302 25485 16141 1 13 . 1 1 75 75 TYR C C 75 175.633 175.633 175.044 0.589 25485 16142 1 13 . 1 1 75 75 TYR CA C 75 58.327 58.327 59.101 -0.774 25485 16143 1 13 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.657 -0.244 25485 16144 1 13 . 1 1 75 75 TYR H H 75 8.065 8.065 8.435 -0.370 25485 16145 1 13 . 1 1 76 76 SER N N 76 117.860 117.860 116.223 1.637 25485 16146 1 13 . 1 1 76 76 SER HA H 76 3.886 3.886 4.268 -0.382 25485 16147 1 13 . 1 1 76 76 SER C C 76 173.859 173.859 174.746 -0.887 25485 16148 1 13 . 1 1 76 76 SER CA C 76 58.250 58.250 58.519 -0.269 25485 16149 1 13 . 1 1 76 76 SER CB C 76 64.117 64.117 62.975 1.142 25485 16150 1 13 . 1 1 76 76 SER H H 76 7.748 7.748 8.336 -0.588 25485 16151 1 13 . 1 1 77 77 LEU N N 77 123.789 123.789 119.276 4.513 25485 16152 1 13 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.386 0.760 25485 16153 1 13 . 1 1 77 77 LEU C C 77 176.451 176.451 175.852 0.599 25485 16154 1 13 . 1 1 77 77 LEU CA C 77 55.464 55.464 56.536 -1.072 25485 16155 1 13 . 1 1 77 77 LEU CB C 77 41.957 41.957 40.222 1.734 25485 16156 1 13 . 1 1 77 77 LEU H H 77 7.979 7.979 8.067 -0.088 25485 16157 1 13 . 1 1 78 78 PHE N N 78 119.275 119.275 113.802 5.473 25485 16158 1 13 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.250 0.626 25485 16159 1 13 . 1 1 78 78 PHE C C 78 173.844 173.844 173.674 0.170 25485 16160 1 13 . 1 1 78 78 PHE CA C 78 55.372 55.372 57.075 -1.703 25485 16161 1 13 . 1 1 78 78 PHE CB C 78 39.164 39.164 36.352 2.812 25485 16162 1 13 . 1 1 78 78 PHE H H 78 7.827 7.827 8.029 -0.202 25485 16163 1 13 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.285 0.071 25485 16164 1 13 . 1 1 79 79 PRO C C 79 176.433 176.433 176.193 0.240 25485 16165 1 13 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.440 1.410 25485 16166 1 13 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.441 -0.749 25485 16167 1 13 . 1 1 80 80 ASN N N 80 118.057 118.057 119.218 -1.161 25485 16168 1 13 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.806 -0.159 25485 16169 1 13 . 1 1 80 80 ASN C C 80 174.305 174.305 175.134 -0.829 25485 16170 1 13 . 1 1 80 80 ASN CA C 80 52.860 52.860 52.682 0.178 25485 16171 1 13 . 1 1 80 80 ASN CB C 80 39.583 39.583 39.163 0.420 25485 16172 1 13 . 1 1 80 80 ASN H H 80 8.068 8.068 8.310 -0.242 25485 16173 1 13 . 1 1 81 81 SER HA H 81 4.565 4.565 4.392 0.173 25485 16174 1 13 . 1 1 81 81 SER CA C 81 56.800 56.800 58.144 -1.344 25485 16175 1 13 . 1 1 81 81 SER CB C 81 63.128 63.128 64.030 -0.902 25485 16176 1 13 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.410 0.051 25485 16177 1 13 . 1 1 82 82 PRO C C 82 174.589 174.589 176.614 -2.025 25485 16178 1 13 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.670 -1.024 25485 16179 1 13 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.340 -1.086 25485 16180 1 13 . 1 1 83 83 LYS N N 83 114.578 114.578 117.911 -3.333 25485 16181 1 13 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.694 -0.541 25485 16182 1 13 . 1 1 83 83 LYS C C 83 175.308 175.308 175.981 -0.673 25485 16183 1 13 . 1 1 83 83 LYS CA C 83 54.407 54.407 54.748 -0.341 25485 16184 1 13 . 1 1 83 83 LYS CB C 83 34.418 34.418 34.484 -0.066 25485 16185 1 13 . 1 1 83 83 LYS H H 83 7.356 7.356 7.597 -0.241 25485 16186 1 13 . 1 1 84 84 TRP N N 84 122.455 122.455 122.841 -0.386 25485 16187 1 13 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.588 -0.568 25485 16188 1 13 . 1 1 84 84 TRP C C 84 177.636 177.636 176.847 0.789 25485 16189 1 13 . 1 1 84 84 TRP CA C 84 57.471 57.471 57.181 0.290 25485 16190 1 13 . 1 1 84 84 TRP CB C 84 30.318 30.318 28.401 1.917 25485 16191 1 13 . 1 1 84 84 TRP H H 84 8.050 8.050 8.440 -0.390 25485 16192 1 13 . 1 1 85 85 THR N N 85 113.501 113.501 113.324 0.177 25485 16193 1 13 . 1 1 85 85 THR HA H 85 4.573 4.573 4.462 0.111 25485 16194 1 13 . 1 1 85 85 THR C C 85 174.757 174.757 174.821 -0.064 25485 16195 1 13 . 1 1 85 85 THR CA C 85 62.130 62.130 61.375 0.755 25485 16196 1 13 . 1 1 85 85 THR CB C 85 69.107 69.107 69.699 -0.592 25485 16197 1 13 . 1 1 85 85 THR H H 85 8.861 8.861 8.117 0.744 25485 16198 1 13 . 1 1 86 86 SER N N 86 117.270 117.270 118.006 -0.736 25485 16199 1 13 . 1 1 86 86 SER HA H 86 4.741 4.741 4.387 0.354 25485 16200 1 13 . 1 1 86 86 SER C C 86 173.457 173.457 174.967 -1.510 25485 16201 1 13 . 1 1 86 86 SER CA C 86 56.739 56.739 58.147 -1.408 25485 16202 1 13 . 1 1 86 86 SER CB C 86 64.717 64.717 64.229 0.488 25485 16203 1 13 . 1 1 86 86 SER H H 86 7.743 7.743 7.854 -0.111 25485 16204 1 13 . 1 1 87 87 LYS N N 87 120.329 120.329 120.083 0.246 25485 16205 1 13 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.364 -0.135 25485 16206 1 13 . 1 1 87 87 LYS CA C 87 57.592 57.592 56.936 0.656 25485 16207 1 13 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.302 -0.179 25485 16208 1 13 . 1 1 87 87 LYS H H 87 8.285 8.285 8.454 -0.169 25485 16209 1 13 . 1 1 88 88 VAL N N 88 117.531 117.531 117.768 -0.237 25485 16210 1 13 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.789 -0.134 25485 16211 1 13 . 1 1 88 88 VAL C C 88 174.868 174.868 173.662 1.206 25485 16212 1 13 . 1 1 88 88 VAL CA C 88 60.095 60.095 61.706 -1.611 25485 16213 1 13 . 1 1 88 88 VAL CB C 88 33.695 33.695 36.037 -2.342 25485 16214 1 13 . 1 1 88 88 VAL H H 88 7.428 7.428 8.043 -0.615 25485 16215 1 13 . 1 1 89 89 VAL N N 89 131.452 131.452 125.328 6.124 25485 16216 1 13 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.397 -0.238 25485 16217 1 13 . 1 1 89 89 VAL C C 89 175.758 175.758 174.951 0.807 25485 16218 1 13 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.148 0.573 25485 16219 1 13 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.679 -0.506 25485 16220 1 13 . 1 1 89 89 VAL H H 89 8.603 8.603 8.411 0.192 25485 16221 1 13 . 1 1 90 90 THR N N 90 118.206 118.206 116.994 1.212 25485 16222 1 13 . 1 1 90 90 THR HA H 90 5.649 5.649 5.374 0.275 25485 16223 1 13 . 1 1 90 90 THR C C 90 174.579 174.579 173.451 1.128 25485 16224 1 13 . 1 1 90 90 THR CA C 90 58.959 58.959 59.503 -0.544 25485 16225 1 13 . 1 1 90 90 THR CB C 90 72.288 72.288 72.078 0.210 25485 16226 1 13 . 1 1 90 90 THR H H 90 9.021 9.021 8.242 0.779 25485 16227 1 13 . 1 1 91 91 TYR N N 91 118.117 118.117 118.842 -0.725 25485 16228 1 13 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.659 0.039 25485 16229 1 13 . 1 1 91 91 TYR C C 91 171.233 171.233 173.062 -1.829 25485 16230 1 13 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.123 0.309 25485 16231 1 13 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.434 0.826 25485 16232 1 13 . 1 1 91 91 TYR H H 91 8.555 8.555 8.044 0.511 25485 16233 1 13 . 1 1 92 92 ARG N N 92 120.252 120.252 120.082 0.170 25485 16234 1 13 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.711 -0.014 25485 16235 1 13 . 1 1 92 92 ARG C C 92 173.932 173.932 174.792 -0.860 25485 16236 1 13 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.617 0.224 25485 16237 1 13 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.661 0.025 25485 16238 1 13 . 1 1 92 92 ARG H H 92 8.520 8.520 9.069 -0.549 25485 16239 1 13 . 1 1 93 93 ILE N N 93 128.305 128.305 126.632 1.673 25485 16240 1 13 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.293 0.339 25485 16241 1 13 . 1 1 93 93 ILE C C 93 175.468 175.468 176.392 -0.924 25485 16242 1 13 . 1 1 93 93 ILE CA C 93 61.228 61.228 62.417 -1.189 25485 16243 1 13 . 1 1 93 93 ILE CB C 93 37.225 37.225 38.320 -1.095 25485 16244 1 13 . 1 1 93 93 ILE H H 93 8.886 8.886 8.761 0.125 25485 16245 1 13 . 1 1 94 94 VAL N N 94 126.647 126.647 128.611 -1.964 25485 16246 1 13 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.067 -0.071 25485 16247 1 13 . 1 1 94 94 VAL C C 94 175.670 175.670 176.097 -0.427 25485 16248 1 13 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.316 -0.902 25485 16249 1 13 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.526 0.493 25485 16250 1 13 . 1 1 94 94 VAL H H 94 9.517 9.517 8.760 0.757 25485 16251 1 13 . 1 1 95 95 SER N N 95 113.398 113.398 112.077 1.321 25485 16252 1 13 . 1 1 95 95 SER HA H 95 4.701 4.701 4.653 0.048 25485 16253 1 13 . 1 1 95 95 SER C C 95 170.684 170.684 172.732 -2.048 25485 16254 1 13 . 1 1 95 95 SER CA C 95 56.945 56.945 57.242 -0.297 25485 16255 1 13 . 1 1 95 95 SER CB C 95 65.276 65.276 64.816 0.460 25485 16256 1 13 . 1 1 95 95 SER H H 95 7.463 7.463 7.575 -0.112 25485 16257 1 13 . 1 1 96 96 TYR N N 96 116.512 116.512 119.203 -2.691 25485 16258 1 13 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.803 -0.539 25485 16259 1 13 . 1 1 96 96 TYR C C 96 174.856 174.856 174.569 0.287 25485 16260 1 13 . 1 1 96 96 TYR CA C 96 58.637 58.637 55.969 2.668 25485 16261 1 13 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.144 1.019 25485 16262 1 13 . 1 1 96 96 TYR H H 96 8.240 8.240 7.915 0.325 25485 16263 1 13 . 1 1 97 97 THR CA C 97 57.798 57.798 60.739 -2.941 25485 16264 1 13 . 1 1 97 97 THR CB C 97 67.420 67.420 69.474 -2.054 25485 16265 1 13 . 1 1 98 98 ARG N N 98 128.156 128.156 124.117 4.039 25485 16266 1 13 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.197 0.128 25485 16267 1 13 . 1 1 98 98 ARG C C 98 177.625 177.625 175.966 1.659 25485 16268 1 13 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.213 -0.999 25485 16269 1 13 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.637 -0.157 25485 16270 1 13 . 1 1 98 98 ARG H H 98 8.914 8.914 8.537 0.377 25485 16271 1 13 . 1 1 99 99 ASP N N 99 120.592 120.592 117.840 2.752 25485 16272 1 13 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.657 -0.276 25485 16273 1 13 . 1 1 99 99 ASP C C 99 175.679 175.679 175.275 0.404 25485 16274 1 13 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.873 1.563 25485 16275 1 13 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.724 0.646 25485 16276 1 13 . 1 1 99 99 ASP H H 99 8.708 8.708 8.135 0.573 25485 16277 1 13 . 1 1 100 100 LEU N N 100 116.829 116.829 119.558 -2.729 25485 16278 1 13 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.670 0.286 25485 16279 1 13 . 1 1 100 100 LEU C C 100 173.335 173.335 174.104 -0.769 25485 16280 1 13 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.948 -0.911 25485 16281 1 13 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.102 2.165 25485 16282 1 13 . 1 1 100 100 LEU H H 100 6.916 6.916 7.226 -0.310 25485 16283 1 13 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.105 0.070 25485 16284 1 13 . 1 1 102 102 HIS C C 102 177.649 177.649 177.318 0.331 25485 16285 1 13 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.470 -0.797 25485 16286 1 13 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.168 -1.734 25485 16287 1 13 . 1 1 103 103 ILE N N 103 115.170 115.170 118.455 -3.285 25485 16288 1 13 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.840 0.333 25485 16289 1 13 . 1 1 103 103 ILE C C 103 177.214 177.214 177.113 0.101 25485 16290 1 13 . 1 1 103 103 ILE CA C 103 63.165 63.165 63.426 -0.261 25485 16291 1 13 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.614 0.151 25485 16292 1 13 . 1 1 103 103 ILE H H 103 8.234 8.234 8.128 0.106 25485 16293 1 13 . 1 1 104 104 THR N N 104 119.374 119.374 116.761 2.613 25485 16294 1 13 . 1 1 104 104 THR HA H 104 4.045 4.045 3.995 0.050 25485 16295 1 13 . 1 1 104 104 THR C C 104 175.612 175.612 176.452 -0.840 25485 16296 1 13 . 1 1 104 104 THR CA C 104 66.568 66.568 67.148 -0.580 25485 16297 1 13 . 1 1 104 104 THR CB C 104 68.077 68.077 68.451 -0.374 25485 16298 1 13 . 1 1 104 104 THR H H 104 6.947 6.947 7.653 -0.706 25485 16299 1 13 . 1 1 105 105 VAL N N 105 123.263 123.263 121.286 1.977 25485 16300 1 13 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.207 0.231 25485 16301 1 13 . 1 1 105 105 VAL C C 105 177.322 177.322 177.261 0.061 25485 16302 1 13 . 1 1 105 105 VAL CA C 105 67.947 67.947 66.850 1.097 25485 16303 1 13 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.042 0.227 25485 16304 1 13 . 1 1 105 105 VAL H H 105 7.407 7.407 8.048 -0.641 25485 16305 1 13 . 1 1 106 106 ASP N N 106 119.972 119.972 120.132 -0.160 25485 16306 1 13 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.438 -0.116 25485 16307 1 13 . 1 1 106 106 ASP C C 106 179.747 179.747 178.130 1.617 25485 16308 1 13 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.333 0.902 25485 16309 1 13 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.901 -0.539 25485 16310 1 13 . 1 1 106 106 ASP H H 106 8.627 8.627 8.089 0.538 25485 16311 1 13 . 1 1 107 107 ARG N N 107 121.033 121.033 118.592 2.441 25485 16312 1 13 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.118 0.060 25485 16313 1 13 . 1 1 107 107 ARG C C 107 179.485 179.485 178.518 0.967 25485 16314 1 13 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.983 0.597 25485 16315 1 13 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.778 0.430 25485 16316 1 13 . 1 1 107 107 ARG H H 107 8.356 8.356 7.993 0.363 25485 16317 1 13 . 1 1 108 108 LEU N N 108 121.463 121.463 121.117 0.346 25485 16318 1 13 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.171 0.134 25485 16319 1 13 . 1 1 108 108 LEU C C 108 178.852 178.852 178.864 -0.012 25485 16320 1 13 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.559 0.324 25485 16321 1 13 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.497 -0.182 25485 16322 1 13 . 1 1 108 108 LEU H H 108 8.790 8.790 7.888 0.902 25485 16323 1 13 . 1 1 109 109 VAL N N 109 120.233 120.233 116.169 4.064 25485 16324 1 13 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.659 -0.259 25485 16325 1 13 . 1 1 109 109 VAL C C 109 177.019 177.019 177.673 -0.654 25485 16326 1 13 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.903 1.143 25485 16327 1 13 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.223 -0.034 25485 16328 1 13 . 1 1 109 109 VAL H H 109 8.787 8.787 7.810 0.977 25485 16329 1 13 . 1 1 110 110 SER N N 110 112.862 112.862 116.350 -3.488 25485 16330 1 13 . 1 1 110 110 SER HA H 110 4.300 4.300 4.159 0.141 25485 16331 1 13 . 1 1 110 110 SER C C 110 176.770 176.770 176.932 -0.162 25485 16332 1 13 . 1 1 110 110 SER CA C 110 61.744 61.744 61.971 -0.227 25485 16333 1 13 . 1 1 110 110 SER CB C 110 62.742 62.742 62.932 -0.190 25485 16334 1 13 . 1 1 110 110 SER H H 110 7.605 7.605 7.887 -0.282 25485 16335 1 13 . 1 1 111 111 LYS N N 111 122.319 122.319 122.045 0.274 25485 16336 1 13 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.119 -0.058 25485 16337 1 13 . 1 1 111 111 LYS C C 111 178.309 178.309 178.604 -0.295 25485 16338 1 13 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.323 0.491 25485 16339 1 13 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.587 -0.078 25485 16340 1 13 . 1 1 111 111 LYS H H 111 8.156 8.156 8.002 0.154 25485 16341 1 13 . 1 1 112 112 ALA N N 112 124.147 124.147 121.366 2.781 25485 16342 1 13 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.408 -0.309 25485 16343 1 13 . 1 1 112 112 ALA C C 112 179.445 179.445 179.014 0.431 25485 16344 1 13 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.256 0.970 25485 16345 1 13 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.299 0.675 25485 16346 1 13 . 1 1 112 112 ALA H H 112 8.278 8.278 7.576 0.702 25485 16347 1 13 . 1 1 113 113 LEU N N 113 116.195 116.195 120.361 -4.166 25485 16348 1 13 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.172 -0.421 25485 16349 1 13 . 1 1 113 113 LEU C C 113 179.537 179.537 178.361 1.176 25485 16350 1 13 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.933 -0.189 25485 16351 1 13 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.990 -1.435 25485 16352 1 13 . 1 1 113 113 LEU H H 113 8.021 8.021 8.614 -0.593 25485 16353 1 13 . 1 1 114 114 ASN N N 114 116.570 116.570 117.767 -1.197 25485 16354 1 13 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.584 -0.038 25485 16355 1 13 . 1 1 114 114 ASN C C 114 177.136 177.136 177.368 -0.232 25485 16356 1 13 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.056 -0.292 25485 16357 1 13 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.298 0.325 25485 16358 1 13 . 1 1 114 114 ASN H H 114 8.212 8.212 8.379 -0.167 25485 16359 1 13 . 1 1 115 115 MET N N 115 122.055 122.055 119.675 2.380 25485 16360 1 13 . 1 1 115 115 MET HA H 115 4.010 4.010 3.965 0.045 25485 16361 1 13 . 1 1 115 115 MET C C 115 177.681 177.681 177.928 -0.247 25485 16362 1 13 . 1 1 115 115 MET CA C 115 59.445 59.445 59.135 0.310 25485 16363 1 13 . 1 1 115 115 MET CB C 115 31.616 31.616 32.363 -0.747 25485 16364 1 13 . 1 1 115 115 MET H H 115 7.937 7.937 7.681 0.256 25485 16365 1 13 . 1 1 116 116 TRP N N 116 117.115 117.115 118.311 -1.196 25485 16366 1 13 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.277 0.241 25485 16367 1 13 . 1 1 116 116 TRP C C 116 179.054 179.054 179.329 -0.275 25485 16368 1 13 . 1 1 116 116 TRP CA C 116 59.511 59.511 58.829 0.682 25485 16369 1 13 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.326 1.547 25485 16370 1 13 . 1 1 116 116 TRP H H 116 6.783 6.783 7.513 -0.730 25485 16371 1 13 . 1 1 117 117 GLY N N 117 104.511 104.511 106.290 -1.779 25485 16372 1 13 . 1 1 117 117 GLY C C 117 175.035 175.035 175.900 -0.865 25485 16373 1 13 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.031 0.966 25485 16374 1 13 . 1 1 117 117 GLY H H 117 9.302 9.302 7.756 1.546 25485 16375 1 13 . 1 1 118 118 LYS N N 118 118.580 118.580 120.207 -1.627 25485 16376 1 13 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.093 0.114 25485 16377 1 13 . 1 1 118 118 LYS C C 118 177.235 177.235 177.015 0.220 25485 16378 1 13 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.499 0.392 25485 16379 1 13 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.213 -0.308 25485 16380 1 13 . 1 1 118 118 LYS H H 118 7.940 7.940 8.022 -0.082 25485 16381 1 13 . 1 1 119 119 GLU N N 119 113.749 113.749 116.856 -3.107 25485 16382 1 13 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.400 0.438 25485 16383 1 13 . 1 1 119 119 GLU C C 119 178.024 178.024 175.579 2.445 25485 16384 1 13 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.972 -0.697 25485 16385 1 13 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.544 1.142 25485 16386 1 13 . 1 1 119 119 GLU H H 119 7.763 7.763 7.473 0.290 25485 16387 1 13 . 1 1 120 120 ILE N N 120 111.144 111.144 113.513 -2.369 25485 16388 1 13 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.623 0.748 25485 16389 1 13 . 1 1 120 120 ILE C C 120 174.033 174.033 174.299 -0.266 25485 16390 1 13 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.405 1.049 25485 16391 1 13 . 1 1 120 120 ILE CB C 120 41.929 41.929 40.399 1.530 25485 16392 1 13 . 1 1 120 120 ILE H H 120 7.518 7.518 7.288 0.230 25485 16393 1 13 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.517 0.145 25485 16394 1 13 . 1 1 121 121 PRO C C 121 174.784 174.784 176.138 -1.354 25485 16395 1 13 . 1 1 121 121 PRO CA C 121 62.015 62.015 62.928 -0.913 25485 16396 1 13 . 1 1 121 121 PRO CB C 121 29.385 29.385 30.253 -0.868 25485 16397 1 13 . 1 1 122 122 LEU N N 122 121.531 121.531 118.841 2.690 25485 16398 1 13 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.472 -0.133 25485 16399 1 13 . 1 1 122 122 LEU C C 122 173.977 173.977 177.023 -3.046 25485 16400 1 13 . 1 1 122 122 LEU CA C 122 54.558 54.558 54.644 -0.086 25485 16401 1 13 . 1 1 122 122 LEU CB C 122 45.399 45.399 43.082 2.317 25485 16402 1 13 . 1 1 122 122 LEU H H 122 6.847 6.847 7.531 -0.684 25485 16403 1 13 . 1 1 123 123 HIS N N 123 121.054 121.054 116.333 4.721 25485 16404 1 13 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.673 -0.066 25485 16405 1 13 . 1 1 123 123 HIS C C 123 172.820 172.820 173.608 -0.788 25485 16406 1 13 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.068 -0.559 25485 16407 1 13 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.787 0.323 25485 16408 1 13 . 1 1 123 123 HIS H H 123 7.760 7.760 8.433 -0.673 25485 16409 1 13 . 1 1 124 124 PHE N N 124 120.465 120.465 124.368 -3.903 25485 16410 1 13 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.492 0.342 25485 16411 1 13 . 1 1 124 124 PHE C C 124 175.677 175.677 175.659 0.018 25485 16412 1 13 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.487 0.805 25485 16413 1 13 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.364 0.458 25485 16414 1 13 . 1 1 124 124 PHE H H 124 8.306 8.306 8.675 -0.369 25485 16415 1 13 . 1 1 125 125 ARG N N 125 124.008 124.008 123.287 0.721 25485 16416 1 13 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.831 -0.120 25485 16417 1 13 . 1 1 125 125 ARG C C 125 172.901 172.901 175.405 -2.504 25485 16418 1 13 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.909 -0.635 25485 16419 1 13 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.241 -0.419 25485 16420 1 13 . 1 1 125 125 ARG H H 125 8.426 8.426 8.984 -0.558 25485 16421 1 13 . 1 1 126 126 LYS N N 126 130.004 130.004 123.870 6.134 25485 16422 1 13 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.176 -0.793 25485 16423 1 13 . 1 1 126 126 LYS C C 126 176.126 176.126 175.681 0.445 25485 16424 1 13 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.831 0.350 25485 16425 1 13 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.650 -0.623 25485 16426 1 13 . 1 1 126 126 LYS H H 126 8.481 8.481 8.614 -0.133 25485 16427 1 13 . 1 1 127 127 VAL N N 127 125.288 125.288 120.511 4.777 25485 16428 1 13 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.165 0.340 25485 16429 1 13 . 1 1 127 127 VAL C C 127 175.565 175.565 175.039 0.526 25485 16430 1 13 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.578 -1.629 25485 16431 1 13 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.024 2.338 25485 16432 1 13 . 1 1 127 127 VAL H H 127 8.721 8.721 8.232 0.489 25485 16433 1 13 . 1 1 128 128 VAL N N 128 117.467 117.467 120.989 -3.522 25485 16434 1 13 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.033 0.296 25485 16435 1 13 . 1 1 128 128 VAL C C 128 174.622 174.622 174.765 -0.143 25485 16436 1 13 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.670 0.448 25485 16437 1 13 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.824 0.686 25485 16438 1 13 . 1 1 128 128 VAL H H 128 8.406 8.406 8.084 0.322 25485 16439 1 13 . 1 1 129 129 TRP N N 129 119.986 119.986 121.185 -1.199 25485 16440 1 13 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.851 -0.135 25485 16441 1 13 . 1 1 129 129 TRP C C 129 174.536 174.536 176.475 -1.939 25485 16442 1 13 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.929 -1.012 25485 16443 1 13 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.610 2.404 25485 16444 1 13 . 1 1 129 129 TRP H H 129 7.435 7.435 7.281 0.154 25485 16445 1 13 . 1 1 130 130 GLY N N 130 109.900 109.900 113.049 -3.149 25485 16446 1 13 . 1 1 130 130 GLY C C 130 173.187 173.187 173.949 -0.762 25485 16447 1 13 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.236 0.244 25485 16448 1 13 . 1 1 130 130 GLY H H 130 8.006 8.006 8.259 -0.253 25485 16449 1 13 . 1 1 131 131 THR N N 131 116.142 116.142 113.674 2.468 25485 16450 1 13 . 1 1 131 131 THR HA H 131 4.162 4.162 4.479 -0.317 25485 16451 1 13 . 1 1 131 131 THR C C 131 172.766 172.766 173.542 -0.776 25485 16452 1 13 . 1 1 131 131 THR CA C 131 63.212 63.212 61.277 1.935 25485 16453 1 13 . 1 1 131 131 THR CB C 131 69.308 69.308 69.988 -0.680 25485 16454 1 13 . 1 1 131 131 THR H H 131 8.233 8.233 8.229 0.004 25485 16455 1 13 . 1 1 132 132 ALA N N 132 129.807 129.807 123.973 5.834 25485 16456 1 13 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.611 -0.095 25485 16457 1 13 . 1 1 132 132 ALA C C 132 175.358 175.358 176.744 -1.386 25485 16458 1 13 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.689 -1.323 25485 16459 1 13 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.358 1.440 25485 16460 1 13 . 1 1 132 132 ALA H H 132 7.962 7.962 8.344 -0.382 25485 16461 1 13 . 1 1 133 133 ASP N N 133 122.896 122.896 119.221 3.675 25485 16462 1 13 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.575 -0.154 25485 16463 1 13 . 1 1 133 133 ASP C C 133 177.314 177.314 176.786 0.528 25485 16464 1 13 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.030 1.889 25485 16465 1 13 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.429 -0.958 25485 16466 1 13 . 1 1 133 133 ASP H H 133 8.251 8.251 8.073 0.178 25485 16467 1 13 . 1 1 134 134 ILE N N 134 125.472 125.472 120.695 4.777 25485 16468 1 13 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.371 -0.228 25485 16469 1 13 . 1 1 134 134 ILE C C 134 174.201 174.201 174.952 -0.751 25485 16470 1 13 . 1 1 134 134 ILE CA C 134 61.271 61.271 59.184 2.087 25485 16471 1 13 . 1 1 134 134 ILE CB C 134 38.710 38.710 37.124 1.586 25485 16472 1 13 . 1 1 134 134 ILE H H 134 8.802 8.802 8.387 0.415 25485 16473 1 13 . 1 1 135 135 MET N N 135 127.265 127.265 126.741 0.524 25485 16474 1 13 . 1 1 135 135 MET HA H 135 5.192 5.192 5.445 -0.253 25485 16475 1 13 . 1 1 135 135 MET C C 135 176.206 176.206 175.714 0.492 25485 16476 1 13 . 1 1 135 135 MET CA C 135 53.626 53.626 52.354 1.272 25485 16477 1 13 . 1 1 135 135 MET CB C 135 32.639 32.639 34.126 -1.487 25485 16478 1 13 . 1 1 135 135 MET H H 135 7.418 7.418 8.276 -0.858 25485 16479 1 13 . 1 1 136 136 ILE N N 136 125.440 125.440 124.373 1.067 25485 16480 1 13 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.898 0.691 25485 16481 1 13 . 1 1 136 136 ILE C C 136 175.190 175.190 175.869 -0.679 25485 16482 1 13 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.972 1.136 25485 16483 1 13 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.686 4.254 25485 16484 1 13 . 1 1 136 136 ILE H H 136 9.124 9.124 8.719 0.405 25485 16485 1 13 . 1 1 137 137 GLY N N 137 112.211 112.211 114.695 -2.484 25485 16486 1 13 . 1 1 137 137 GLY C C 137 170.855 170.855 171.735 -0.880 25485 16487 1 13 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.120 1.284 25485 16488 1 13 . 1 1 137 137 GLY H H 137 8.594 8.594 8.028 0.566 25485 16489 1 13 . 1 1 138 138 PHE N N 138 119.463 119.463 119.263 0.200 25485 16490 1 13 . 1 1 138 138 PHE HA H 138 5.496 5.496 4.920 0.576 25485 16491 1 13 . 1 1 138 138 PHE C C 138 175.186 175.186 175.464 -0.278 25485 16492 1 13 . 1 1 138 138 PHE CA C 138 55.995 55.995 57.624 -1.629 25485 16493 1 13 . 1 1 138 138 PHE CB C 138 41.442 41.442 42.450 -1.008 25485 16494 1 13 . 1 1 138 138 PHE H H 138 7.857 7.857 8.429 -0.572 25485 16495 1 13 . 1 1 139 139 ALA N N 139 123.914 123.914 123.401 0.513 25485 16496 1 13 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.573 0.158 25485 16497 1 13 . 1 1 139 139 ALA C C 139 174.613 174.613 174.977 -0.364 25485 16498 1 13 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.426 -1.391 25485 16499 1 13 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.444 2.028 25485 16500 1 13 . 1 1 139 139 ALA H H 139 8.955 8.955 8.392 0.563 25485 16501 1 13 . 1 1 140 140 ARG N N 140 118.339 118.339 119.935 -1.596 25485 16502 1 13 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.829 0.277 25485 16503 1 13 . 1 1 140 140 ARG C C 140 176.201 176.201 178.441 -2.240 25485 16504 1 13 . 1 1 140 140 ARG CA C 140 54.166 54.166 55.128 -0.962 25485 16505 1 13 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.351 1.118 25485 16506 1 13 . 1 1 140 140 ARG H H 140 8.546 8.546 8.519 0.027 25485 16507 1 13 . 1 1 141 141 GLY N N 141 108.916 108.916 108.650 0.266 25485 16508 1 13 . 1 1 141 141 GLY C C 141 175.595 175.595 174.906 0.689 25485 16509 1 13 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.220 -0.930 25485 16510 1 13 . 1 1 141 141 GLY H H 141 8.989 8.989 9.358 -0.369 25485 16511 1 13 . 1 1 142 142 ALA N N 142 121.448 121.448 121.374 0.074 25485 16512 1 13 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.505 -0.097 25485 16513 1 13 . 1 1 142 142 ALA C C 142 177.027 177.027 177.601 -0.574 25485 16514 1 13 . 1 1 142 142 ALA CA C 142 53.277 53.277 51.956 1.321 25485 16515 1 13 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.204 -0.240 25485 16516 1 13 . 1 1 142 142 ALA H H 142 8.642 8.642 8.176 0.466 25485 16517 1 13 . 1 1 143 143 HIS N N 143 120.356 120.356 116.436 3.920 25485 16518 1 13 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.434 0.723 25485 16519 1 13 . 1 1 143 143 HIS C C 143 174.303 174.303 176.295 -1.992 25485 16520 1 13 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.520 -1.067 25485 16521 1 13 . 1 1 143 143 HIS CB C 143 27.791 27.791 30.022 -2.231 25485 16522 1 13 . 1 1 143 143 HIS H H 143 8.990 8.990 8.107 0.883 25485 16523 1 13 . 1 1 144 144 GLY N N 144 112.517 112.517 107.642 4.875 25485 16524 1 13 . 1 1 144 144 GLY C C 144 173.758 173.758 172.926 0.832 25485 16525 1 13 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.550 1.545 25485 16526 1 13 . 1 1 144 144 GLY H H 144 5.175 5.175 7.639 -2.464 25485 16527 1 13 . 1 1 145 145 ASP N N 145 117.762 117.762 118.893 -1.131 25485 16528 1 13 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.647 0.051 25485 16529 1 13 . 1 1 145 145 ASP C C 145 175.851 175.851 174.650 1.201 25485 16530 1 13 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.968 -1.009 25485 16531 1 13 . 1 1 145 145 ASP CB C 145 41.799 41.799 41.917 -0.118 25485 16532 1 13 . 1 1 145 145 ASP H H 145 7.096 7.096 7.618 -0.522 25485 16533 1 13 . 1 1 146 146 SER N N 146 125.540 125.540 115.055 10.485 25485 16534 1 13 . 1 1 146 146 SER HA H 146 4.204 4.204 4.331 -0.127 25485 16535 1 13 . 1 1 146 146 SER C C 146 172.319 172.319 173.900 -1.581 25485 16536 1 13 . 1 1 146 146 SER CA C 146 58.862 58.862 58.835 0.027 25485 16537 1 13 . 1 1 146 146 SER CB C 146 62.933 62.933 63.621 -0.688 25485 16538 1 13 . 1 1 146 146 SER H H 146 8.261 8.261 8.308 -0.047 25485 16539 1 13 . 1 1 147 147 TYR N N 147 120.757 120.757 118.127 2.630 25485 16540 1 13 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.183 0.639 25485 16541 1 13 . 1 1 147 147 TYR C C 147 170.372 170.372 173.382 -3.010 25485 16542 1 13 . 1 1 147 147 TYR CA C 147 53.268 53.268 58.004 -4.736 25485 16543 1 13 . 1 1 147 147 TYR CB C 147 38.296 38.296 38.233 0.063 25485 16544 1 13 . 1 1 147 147 TYR H H 147 7.450 7.450 8.500 -1.050 25485 16545 1 13 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.407 0.465 25485 16546 1 13 . 1 1 148 148 PRO C C 148 179.009 179.009 176.820 2.189 25485 16547 1 13 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.203 1.172 25485 16548 1 13 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.142 -1.233 25485 16549 1 13 . 1 1 149 149 PHE N N 149 120.514 120.514 118.604 1.910 25485 16550 1 13 . 1 1 149 149 PHE C C 149 176.813 176.813 175.793 1.020 25485 16551 1 13 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.892 -1.439 25485 16552 1 13 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.499 0.074 25485 16553 1 13 . 1 1 149 149 PHE H H 149 8.024 8.024 7.824 0.200 25485 16554 1 13 . 1 1 150 150 ASP N N 150 115.555 115.555 118.128 -2.573 25485 16555 1 13 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.261 0.578 25485 16556 1 13 . 1 1 150 150 ASP C C 150 177.007 177.007 176.081 0.926 25485 16557 1 13 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.810 -0.939 25485 16558 1 13 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.982 1.954 25485 16559 1 13 . 1 1 150 150 ASP H H 150 7.511 7.511 7.726 -0.215 25485 16560 1 13 . 1 1 151 151 GLY N N 151 110.650 110.650 109.418 1.232 25485 16561 1 13 . 1 1 151 151 GLY C C 151 170.281 170.281 171.854 -1.573 25485 16562 1 13 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.613 -0.215 25485 16563 1 13 . 1 1 151 151 GLY H H 151 9.080 9.080 8.118 0.962 25485 16564 1 13 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.205 -0.149 25485 16565 1 13 . 1 1 152 152 PRO C C 152 178.300 178.300 176.768 1.532 25485 16566 1 13 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.320 0.530 25485 16567 1 13 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.917 -0.657 25485 16568 1 13 . 1 1 153 153 GLY N N 153 118.783 118.783 112.939 5.844 25485 16569 1 13 . 1 1 153 153 GLY C C 153 174.098 174.098 173.186 0.912 25485 16570 1 13 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.444 -0.838 25485 16571 1 13 . 1 1 153 153 GLY H H 153 11.431 11.431 8.104 3.327 25485 16572 1 13 . 1 1 154 154 ASN N N 154 120.679 120.679 123.166 -2.487 25485 16573 1 13 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.536 -0.292 25485 16574 1 13 . 1 1 154 154 ASN C C 154 174.636 174.636 174.685 -0.049 25485 16575 1 13 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.768 1.900 25485 16576 1 13 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.684 -1.713 25485 16577 1 13 . 1 1 154 154 ASN H H 154 9.247 9.247 8.572 0.675 25485 16578 1 13 . 1 1 155 155 THR N N 155 118.252 118.252 111.741 6.511 25485 16579 1 13 . 1 1 155 155 THR HA H 155 5.577 5.577 4.158 1.419 25485 16580 1 13 . 1 1 155 155 THR C C 155 176.596 176.596 173.130 3.466 25485 16581 1 13 . 1 1 155 155 THR CA C 155 61.731 61.731 63.039 -1.308 25485 16582 1 13 . 1 1 155 155 THR CB C 155 71.325 71.325 68.770 2.555 25485 16583 1 13 . 1 1 155 155 THR H H 155 9.501 9.501 8.601 0.900 25485 16584 1 13 . 1 1 156 156 LEU N N 156 122.598 122.598 121.881 0.717 25485 16585 1 13 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.540 0.331 25485 16586 1 13 . 1 1 156 156 LEU C C 156 175.655 175.655 175.939 -0.284 25485 16587 1 13 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.440 -0.902 25485 16588 1 13 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.736 1.775 25485 16589 1 13 . 1 1 156 156 LEU H H 156 8.492 8.492 8.304 0.188 25485 16590 1 13 . 1 1 157 157 ALA N N 157 115.389 115.389 115.275 0.114 25485 16591 1 13 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.441 0.594 25485 16592 1 13 . 1 1 157 157 ALA C C 157 175.739 175.739 175.039 0.700 25485 16593 1 13 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.347 -0.408 25485 16594 1 13 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.805 1.649 25485 16595 1 13 . 1 1 157 157 ALA H H 157 7.567 7.567 7.751 -0.184 25485 16596 1 13 . 1 1 158 158 HIS N N 158 111.900 111.900 118.117 -6.217 25485 16597 1 13 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.668 -0.063 25485 16598 1 13 . 1 1 158 158 HIS C C 158 170.186 170.186 172.367 -2.181 25485 16599 1 13 . 1 1 158 158 HIS CA C 158 56.075 56.075 53.929 2.146 25485 16600 1 13 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.590 -1.404 25485 16601 1 13 . 1 1 158 158 HIS H H 158 8.757 8.757 7.771 0.986 25485 16602 1 13 . 1 1 159 159 ALA N N 159 118.286 118.286 125.943 -7.657 25485 16603 1 13 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.076 0.578 25485 16604 1 13 . 1 1 159 159 ALA C C 159 174.036 174.036 175.532 -1.496 25485 16605 1 13 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.294 0.839 25485 16606 1 13 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.584 2.453 25485 16607 1 13 . 1 1 159 159 ALA H H 159 6.110 6.110 8.068 -1.958 25485 16608 1 13 . 1 1 160 160 PHE N N 160 117.937 117.937 118.265 -0.328 25485 16609 1 13 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.754 -0.251 25485 16610 1 13 . 1 1 160 160 PHE C C 160 174.455 174.455 174.903 -0.448 25485 16611 1 13 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.227 1.586 25485 16612 1 13 . 1 1 160 160 PHE CB C 160 42.194 42.194 42.190 0.004 25485 16613 1 13 . 1 1 160 160 PHE H H 160 7.912 7.912 7.922 -0.010 25485 16614 1 13 . 1 1 161 161 ALA N N 161 123.531 123.531 123.013 0.518 25485 16615 1 13 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.741 -0.250 25485 16616 1 13 . 1 1 161 161 ALA C C 161 175.503 175.503 175.965 -0.462 25485 16617 1 13 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.174 1.459 25485 16618 1 13 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.173 -2.617 25485 16619 1 13 . 1 1 161 161 ALA H H 161 8.107 8.107 8.431 -0.324 25485 16620 1 13 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.433 -1.523 25485 16621 1 13 . 1 1 162 162 PRO C C 162 173.465 173.465 175.897 -2.432 25485 16622 1 13 . 1 1 162 162 PRO CA C 162 64.257 64.257 63.187 1.070 25485 16623 1 13 . 1 1 162 162 PRO CB C 162 31.242 31.242 30.414 0.828 25485 16624 1 13 . 1 1 163 163 GLY N N 163 107.206 107.206 110.451 -3.245 25485 16625 1 13 . 1 1 163 163 GLY C C 163 172.092 172.092 173.498 -1.406 25485 16626 1 13 . 1 1 163 163 GLY CA C 163 43.993 43.993 43.895 0.098 25485 16627 1 13 . 1 1 163 163 GLY H H 163 5.997 5.997 7.821 -1.824 25485 16628 1 13 . 1 1 165 165 GLY N N 165 103.110 103.110 114.323 -11.213 25485 16629 1 13 . 1 1 165 165 GLY C C 165 177.158 177.158 173.501 3.657 25485 16630 1 13 . 1 1 165 165 GLY CA C 165 44.243 44.243 44.468 -0.224 25485 16631 1 13 . 1 1 165 165 GLY H H 165 9.145 9.145 7.609 1.536 25485 16632 1 13 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.250 -0.071 25485 16633 1 13 . 1 1 166 166 LEU C C 166 176.437 176.437 177.710 -1.273 25485 16634 1 13 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.413 0.787 25485 16635 1 13 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.637 -0.803 25485 16636 1 13 . 1 1 167 167 GLY N N 167 103.318 103.318 103.807 -0.489 25485 16637 1 13 . 1 1 167 167 GLY C C 167 174.803 174.803 174.798 0.005 25485 16638 1 13 . 1 1 167 167 GLY CA C 167 47.233 47.233 45.930 1.303 25485 16639 1 13 . 1 1 167 167 GLY H H 167 7.768 7.768 7.548 0.220 25485 16640 1 13 . 1 1 168 168 GLY N N 168 121.051 121.051 111.658 9.393 25485 16641 1 13 . 1 1 168 168 GLY C C 168 172.122 172.122 174.384 -2.262 25485 16642 1 13 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.112 1.490 25485 16643 1 13 . 1 1 168 168 GLY H H 168 7.698 7.698 7.952 -0.254 25485 16644 1 13 . 1 1 169 169 ASP N N 169 123.641 123.641 122.388 1.253 25485 16645 1 13 . 1 1 169 169 ASP C C 169 173.942 173.942 173.722 0.220 25485 16646 1 13 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.704 2.138 25485 16647 1 13 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.045 -2.175 25485 16648 1 13 . 1 1 169 169 ASP H H 169 8.595 8.595 7.643 0.952 25485 16649 1 13 . 1 1 170 170 ALA N N 170 119.366 119.366 121.620 -2.254 25485 16650 1 13 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.300 0.430 25485 16651 1 13 . 1 1 170 170 ALA C C 170 174.593 174.593 175.122 -0.529 25485 16652 1 13 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.672 0.452 25485 16653 1 13 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.194 1.141 25485 16654 1 13 . 1 1 170 170 ALA H H 170 8.324 8.324 8.391 -0.067 25485 16655 1 13 . 1 1 171 171 HIS N N 171 120.239 120.239 121.013 -0.774 25485 16656 1 13 . 1 1 171 171 HIS HA H 171 5.748 5.748 4.982 0.766 25485 16657 1 13 . 1 1 171 171 HIS C C 171 172.949 172.949 173.519 -0.570 25485 16658 1 13 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.270 -2.546 25485 16659 1 13 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.834 1.707 25485 16660 1 13 . 1 1 171 171 HIS H H 171 8.499 8.499 7.611 0.888 25485 16661 1 13 . 1 1 172 172 PHE N N 172 121.125 121.125 120.712 0.413 25485 16662 1 13 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.311 0.217 25485 16663 1 13 . 1 1 172 172 PHE C C 172 173.875 173.875 173.712 0.163 25485 16664 1 13 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.344 0.576 25485 16665 1 13 . 1 1 172 172 PHE CB C 172 41.903 41.903 40.534 1.369 25485 16666 1 13 . 1 1 172 172 PHE H H 172 8.445 8.445 7.901 0.544 25485 16667 1 13 . 1 1 173 173 ASP N N 173 124.014 124.014 122.945 1.069 25485 16668 1 13 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.949 -1.035 25485 16669 1 13 . 1 1 173 173 ASP C C 173 178.613 178.613 177.839 0.774 25485 16670 1 13 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.700 1.098 25485 16671 1 13 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.283 -0.540 25485 16672 1 13 . 1 1 173 173 ASP H H 173 7.927 7.927 8.549 -0.622 25485 16673 1 13 . 1 1 174 174 GLU N N 174 132.469 132.469 127.071 5.398 25485 16674 1 13 . 1 1 174 174 GLU C C 174 176.442 176.442 177.204 -0.762 25485 16675 1 13 . 1 1 174 174 GLU CA C 174 57.184 57.184 59.211 -2.027 25485 16676 1 13 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.861 0.424 25485 16677 1 13 . 1 1 174 174 GLU H H 174 9.528 9.528 8.415 1.113 25485 16678 1 13 . 1 1 175 175 ASP N N 175 117.394 117.394 117.928 -0.534 25485 16679 1 13 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.773 0.020 25485 16680 1 13 . 1 1 175 175 ASP C C 175 176.645 176.645 176.715 -0.070 25485 16681 1 13 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.502 0.429 25485 16682 1 13 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.194 -1.053 25485 16683 1 13 . 1 1 175 175 ASP H H 175 8.768 8.768 8.743 0.025 25485 16684 1 13 . 1 1 176 176 GLU N N 176 116.493 116.493 119.525 -3.032 25485 16685 1 13 . 1 1 176 176 GLU C C 176 175.038 175.038 176.101 -1.063 25485 16686 1 13 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.956 -2.292 25485 16687 1 13 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.656 -4.433 25485 16688 1 13 . 1 1 176 176 GLU H H 176 7.159 7.159 8.393 -1.234 25485 16689 1 13 . 1 1 177 177 ARG N N 177 122.186 122.186 119.718 2.468 25485 16690 1 13 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.502 0.187 25485 16691 1 13 . 1 1 177 177 ARG C C 177 174.482 174.482 174.575 -0.093 25485 16692 1 13 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.169 -1.482 25485 16693 1 13 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.839 -1.755 25485 16694 1 13 . 1 1 177 177 ARG H H 177 7.560 7.560 8.354 -0.794 25485 16695 1 13 . 1 1 178 178 TRP N N 178 129.179 129.179 124.724 4.455 25485 16696 1 13 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.481 -0.381 25485 16697 1 13 . 1 1 178 178 TRP C C 178 176.298 176.298 176.454 -0.156 25485 16698 1 13 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.063 0.750 25485 16699 1 13 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.053 -0.856 25485 16700 1 13 . 1 1 178 178 TRP H H 178 8.807 8.807 8.687 0.120 25485 16701 1 13 . 1 1 179 179 THR N N 179 112.792 112.792 113.774 -0.982 25485 16702 1 13 . 1 1 179 179 THR HA H 179 4.985 4.985 4.603 0.382 25485 16703 1 13 . 1 1 179 179 THR C C 179 172.765 172.765 172.092 0.673 25485 16704 1 13 . 1 1 179 179 THR CA C 179 59.106 59.106 61.451 -2.345 25485 16705 1 13 . 1 1 179 179 THR CB C 179 71.786 71.786 70.202 1.584 25485 16706 1 13 . 1 1 179 179 THR H H 179 8.974 8.974 8.680 0.294 25485 16707 1 13 . 1 1 180 180 ASP N N 180 122.074 122.074 124.909 -2.835 25485 16708 1 13 . 1 1 180 180 ASP HA H 180 4.463 4.463 4.825 -0.362 25485 16709 1 13 . 1 1 180 180 ASP C C 180 176.366 176.366 178.316 -1.950 25485 16710 1 13 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.569 -2.526 25485 16711 1 13 . 1 1 180 180 ASP CB C 180 41.728 41.728 41.951 -0.223 25485 16712 1 13 . 1 1 180 180 ASP H H 180 8.485 8.485 8.827 -0.342 25485 16713 1 13 . 1 1 181 181 GLY N N 181 110.123 110.123 107.729 2.394 25485 16714 1 13 . 1 1 181 181 GLY C C 181 174.325 174.325 175.611 -1.286 25485 16715 1 13 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.763 0.898 25485 16716 1 13 . 1 1 181 181 GLY H H 181 8.569 8.569 8.594 -0.025 25485 16717 1 13 . 1 1 182 182 SER N N 182 115.562 115.562 114.709 0.853 25485 16718 1 13 . 1 1 182 182 SER HA H 182 4.519 4.519 4.474 0.045 25485 16719 1 13 . 1 1 182 182 SER C C 182 173.783 173.783 173.977 -0.194 25485 16720 1 13 . 1 1 182 182 SER CA C 182 57.965 57.965 57.628 0.337 25485 16721 1 13 . 1 1 182 182 SER CB C 182 64.166 64.166 63.994 0.172 25485 16722 1 13 . 1 1 182 182 SER H H 182 8.160 8.160 7.588 0.572 25485 16723 1 13 . 1 1 183 183 SER N N 183 117.153 117.153 114.763 2.390 25485 16724 1 13 . 1 1 183 183 SER HA H 183 4.275 4.275 4.199 0.076 25485 16725 1 13 . 1 1 183 183 SER C C 183 173.333 173.333 174.215 -0.882 25485 16726 1 13 . 1 1 183 183 SER CA C 183 59.902 59.902 59.149 0.753 25485 16727 1 13 . 1 1 183 183 SER CB C 183 64.941 64.941 62.244 2.697 25485 16728 1 13 . 1 1 183 183 SER H H 183 7.796 7.796 7.824 -0.028 25485 16729 1 13 . 1 1 184 184 LEU N N 184 122.351 122.351 119.797 2.554 25485 16730 1 13 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.536 -0.144 25485 16731 1 13 . 1 1 184 184 LEU C C 184 176.250 176.250 177.343 -1.093 25485 16732 1 13 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.783 -0.208 25485 16733 1 13 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.745 -0.664 25485 16734 1 13 . 1 1 184 184 LEU H H 184 8.092 8.092 7.949 0.143 25485 16735 1 13 . 1 1 185 185 GLY N N 185 108.871 108.871 106.970 1.901 25485 16736 1 13 . 1 1 185 185 GLY C C 185 172.375 172.375 173.241 -0.866 25485 16737 1 13 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.368 0.012 25485 16738 1 13 . 1 1 185 185 GLY H H 185 7.960 7.960 7.476 0.484 25485 16739 1 13 . 1 1 186 186 ILE N N 186 123.096 123.096 122.328 0.768 25485 16740 1 13 . 1 1 186 186 ILE HA H 186 3.841 3.841 3.912 -0.071 25485 16741 1 13 . 1 1 186 186 ILE C C 186 175.350 175.350 175.749 -0.399 25485 16742 1 13 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.099 -0.698 25485 16743 1 13 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.231 0.225 25485 16744 1 13 . 1 1 186 186 ILE H H 186 8.893 8.893 8.078 0.815 25485 16745 1 13 . 1 1 187 187 ASN N N 187 127.167 127.167 126.571 0.596 25485 16746 1 13 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.792 -0.439 25485 16747 1 13 . 1 1 187 187 ASN C C 187 175.849 175.849 176.767 -0.918 25485 16748 1 13 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.337 1.377 25485 16749 1 13 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.811 0.319 25485 16750 1 13 . 1 1 187 187 ASN H H 187 8.580 8.580 8.162 0.418 25485 16751 1 13 . 1 1 188 188 PHE N N 188 129.985 129.985 127.196 2.789 25485 16752 1 13 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.378 0.195 25485 16753 1 13 . 1 1 188 188 PHE C C 188 175.578 175.578 177.639 -2.061 25485 16754 1 13 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.399 -0.671 25485 16755 1 13 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.434 -0.002 25485 16756 1 13 . 1 1 188 188 PHE H H 188 9.361 9.361 8.474 0.887 25485 16757 1 13 . 1 1 189 189 LEU N N 189 119.113 119.113 118.356 0.757 25485 16758 1 13 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.162 -0.361 25485 16759 1 13 . 1 1 189 189 LEU C C 189 179.601 179.601 178.727 0.874 25485 16760 1 13 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.120 0.389 25485 16761 1 13 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.224 -1.347 25485 16762 1 13 . 1 1 189 189 LEU H H 189 8.562 8.562 7.975 0.587 25485 16763 1 13 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.895 0.022 25485 16764 1 13 . 1 1 190 190 TYR C C 190 177.621 177.621 178.083 -0.462 25485 16765 1 13 . 1 1 190 190 TYR CA C 190 60.808 60.808 58.790 2.018 25485 16766 1 13 . 1 1 190 190 TYR CB C 190 39.769 39.769 36.414 3.354 25485 16767 1 13 . 1 1 191 191 ALA N N 191 120.352 120.352 121.685 -1.333 25485 16768 1 13 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.285 0.030 25485 16769 1 13 . 1 1 191 191 ALA C C 191 180.252 180.252 179.166 1.086 25485 16770 1 13 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.601 0.581 25485 16771 1 13 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.490 0.652 25485 16772 1 13 . 1 1 191 191 ALA H H 191 7.993 7.993 8.922 -0.929 25485 16773 1 13 . 1 1 192 192 ALA N N 192 121.409 121.409 121.622 -0.213 25485 16774 1 13 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.039 0.018 25485 16775 1 13 . 1 1 192 192 ALA C C 192 178.575 178.575 179.679 -1.104 25485 16776 1 13 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.542 -0.357 25485 16777 1 13 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.146 -1.948 25485 16778 1 13 . 1 1 192 192 ALA H H 192 9.297 9.297 8.538 0.759 25485 16779 1 13 . 1 1 193 193 THR N N 193 116.996 116.996 115.818 1.178 25485 16780 1 13 . 1 1 193 193 THR HA H 193 3.833 3.833 4.148 -0.315 25485 16781 1 13 . 1 1 193 193 THR CA C 193 69.138 69.138 68.373 0.765 25485 16782 1 13 . 1 1 193 193 THR CB C 193 67.365 67.365 68.882 -1.518 25485 16783 1 13 . 1 1 193 193 THR H H 193 8.226 8.226 7.839 0.387 25485 16784 1 13 . 1 1 194 194 HIS N N 194 120.296 120.296 121.814 -1.518 25485 16785 1 13 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.399 -0.163 25485 16786 1 13 . 1 1 194 194 HIS C C 194 175.962 175.962 176.886 -0.924 25485 16787 1 13 . 1 1 194 194 HIS CA C 194 59.747 59.747 57.917 1.830 25485 16788 1 13 . 1 1 194 194 HIS CB C 194 27.919 27.919 30.180 -2.261 25485 16789 1 13 . 1 1 194 194 HIS H H 194 7.782 7.782 7.664 0.118 25485 16790 1 13 . 1 1 195 195 ALA N N 195 121.290 121.290 122.531 -1.241 25485 16791 1 13 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.938 0.218 25485 16792 1 13 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.989 0.975 25485 16793 1 13 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.496 0.214 25485 16794 1 13 . 1 1 195 195 ALA H H 195 8.690 8.690 8.480 0.210 25485 16795 1 13 . 1 1 196 196 LEU N N 196 114.899 114.899 118.080 -3.181 25485 16796 1 13 . 1 1 196 196 LEU HA H 196 4.170 4.170 3.989 0.181 25485 16797 1 13 . 1 1 196 196 LEU C C 196 177.946 177.946 179.275 -1.329 25485 16798 1 13 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.528 -1.300 25485 16799 1 13 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.096 -1.320 25485 16800 1 13 . 1 1 196 196 LEU H H 196 8.715 8.715 8.778 -0.063 25485 16801 1 13 . 1 1 197 197 GLY N N 197 107.901 107.901 104.868 3.033 25485 16802 1 13 . 1 1 197 197 GLY C C 197 178.641 178.641 175.563 3.078 25485 16803 1 13 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.475 1.091 25485 16804 1 13 . 1 1 197 197 GLY H H 197 7.546 7.546 8.126 -0.580 25485 16805 1 13 . 1 1 198 198 HIS N N 198 122.017 122.017 119.687 2.330 25485 16806 1 13 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.454 0.403 25485 16807 1 13 . 1 1 198 198 HIS C C 198 179.874 179.874 178.193 1.681 25485 16808 1 13 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.878 0.644 25485 16809 1 13 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.387 -1.841 25485 16810 1 13 . 1 1 198 198 HIS H H 198 7.196 7.196 7.452 -0.256 25485 16811 1 13 . 1 1 199 199 SER N N 199 118.486 118.486 115.269 3.217 25485 16812 1 13 . 1 1 199 199 SER HA H 199 4.490 4.490 4.662 -0.172 25485 16813 1 13 . 1 1 199 199 SER C C 199 174.493 174.493 175.919 -1.426 25485 16814 1 13 . 1 1 199 199 SER CA C 199 58.173 58.173 60.456 -2.283 25485 16815 1 13 . 1 1 199 199 SER CB C 199 63.589 63.589 62.701 0.888 25485 16816 1 13 . 1 1 199 199 SER H H 199 7.884 7.884 7.781 0.103 25485 16817 1 13 . 1 1 200 200 LEU N N 200 114.686 114.686 117.714 -3.028 25485 16818 1 13 . 1 1 200 200 LEU C C 200 177.720 177.720 177.424 0.296 25485 16819 1 13 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.443 0.394 25485 16820 1 13 . 1 1 200 200 LEU CB C 200 42.357 42.357 40.619 1.738 25485 16821 1 13 . 1 1 200 200 LEU H H 200 7.108 7.108 6.770 0.338 25485 16822 1 13 . 1 1 201 201 GLY N N 201 108.363 108.363 106.633 1.730 25485 16823 1 13 . 1 1 201 201 GLY C C 201 174.008 174.008 174.645 -0.637 25485 16824 1 13 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.721 -1.307 25485 16825 1 13 . 1 1 201 201 GLY H H 201 8.195 8.195 7.759 0.436 25485 16826 1 13 . 1 1 202 202 MET N N 202 119.635 119.635 121.398 -1.763 25485 16827 1 13 . 1 1 202 202 MET HA H 202 4.473 4.473 4.340 0.133 25485 16828 1 13 . 1 1 202 202 MET C C 202 176.593 176.593 175.241 1.352 25485 16829 1 13 . 1 1 202 202 MET CA C 202 54.500 54.500 55.513 -1.013 25485 16830 1 13 . 1 1 202 202 MET CB C 202 32.161 32.161 33.310 -1.149 25485 16831 1 13 . 1 1 202 202 MET H H 202 8.182 8.182 7.121 1.061 25485 16832 1 13 . 1 1 203 203 GLY N N 203 109.749 109.749 111.478 -1.729 25485 16833 1 13 . 1 1 203 203 GLY C C 203 174.042 174.042 173.892 0.150 25485 16834 1 13 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.292 -0.288 25485 16835 1 13 . 1 1 203 203 GLY H H 203 8.405 8.405 8.280 0.125 25485 16836 1 13 . 1 1 204 204 HIS N N 204 115.732 115.732 118.924 -3.192 25485 16837 1 13 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.320 1.080 25485 16838 1 13 . 1 1 204 204 HIS C C 204 174.430 174.430 174.457 -0.027 25485 16839 1 13 . 1 1 204 204 HIS CA C 204 54.814 54.814 57.114 -2.300 25485 16840 1 13 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.407 -0.581 25485 16841 1 13 . 1 1 204 204 HIS H H 204 8.364 8.364 8.815 -0.451 25485 16842 1 13 . 1 1 205 205 SER N N 205 115.484 115.484 114.663 0.821 25485 16843 1 13 . 1 1 205 205 SER HA H 205 4.766 4.766 4.661 0.105 25485 16844 1 13 . 1 1 205 205 SER C C 205 173.611 173.611 174.931 -1.320 25485 16845 1 13 . 1 1 205 205 SER CA C 205 54.729 54.729 56.573 -1.844 25485 16846 1 13 . 1 1 205 205 SER CB C 205 65.855 65.855 64.726 1.129 25485 16847 1 13 . 1 1 205 205 SER H H 205 7.231 7.231 8.106 -0.875 25485 16848 1 13 . 1 1 206 206 SER N N 206 119.263 119.263 119.556 -0.293 25485 16849 1 13 . 1 1 206 206 SER HA H 206 3.701 3.701 4.632 -0.931 25485 16850 1 13 . 1 1 206 206 SER C C 206 173.635 173.635 174.546 -0.911 25485 16851 1 13 . 1 1 206 206 SER CA C 206 63.846 63.846 58.348 5.498 25485 16852 1 13 . 1 1 206 206 SER CB C 206 63.764 63.764 63.663 0.101 25485 16853 1 13 . 1 1 206 206 SER H H 206 8.289 8.289 8.814 -0.525 25485 16854 1 13 . 1 1 207 207 ASP N N 207 126.646 126.646 124.223 2.423 25485 16855 1 13 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.682 0.247 25485 16856 1 13 . 1 1 207 207 ASP C C 207 174.614 174.614 175.454 -0.840 25485 16857 1 13 . 1 1 207 207 ASP CA C 207 51.272 51.272 53.325 -2.053 25485 16858 1 13 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.666 -1.378 25485 16859 1 13 . 1 1 207 207 ASP H H 207 8.541 8.541 7.967 0.574 25485 16860 1 13 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.158 0.629 25485 16861 1 13 . 1 1 208 208 PRO C C 208 177.467 177.467 175.700 1.767 25485 16862 1 13 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.133 -0.297 25485 16863 1 13 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.869 -0.272 25485 16864 1 13 . 1 1 209 209 ASN N N 209 116.020 116.020 113.557 2.463 25485 16865 1 13 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.636 0.005 25485 16866 1 13 . 1 1 209 209 ASN C C 209 174.695 174.695 174.026 0.669 25485 16867 1 13 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.483 1.737 25485 16868 1 13 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.787 0.323 25485 16869 1 13 . 1 1 209 209 ASN H H 209 8.350 8.350 7.498 0.852 25485 16870 1 13 . 1 1 210 210 ALA N N 210 124.892 124.892 122.314 2.578 25485 16871 1 13 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.372 -0.277 25485 16872 1 13 . 1 1 210 210 ALA C C 210 179.495 179.495 178.578 0.917 25485 16873 1 13 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.454 1.600 25485 16874 1 13 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.944 -1.745 25485 16875 1 13 . 1 1 210 210 ALA H H 210 8.193 8.193 7.130 1.063 25485 16876 1 13 . 1 1 211 211 VAL N N 211 130.402 130.402 123.181 7.221 25485 16877 1 13 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.850 0.413 25485 16878 1 13 . 1 1 211 211 VAL C C 211 179.408 179.408 176.139 3.269 25485 16879 1 13 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.574 0.478 25485 16880 1 13 . 1 1 211 211 VAL CB C 211 30.983 30.983 31.930 -0.948 25485 16881 1 13 . 1 1 211 211 VAL H H 211 11.592 11.592 8.722 2.870 25485 16882 1 13 . 1 1 212 212 MET N N 212 113.285 113.285 112.673 0.612 25485 16883 1 13 . 1 1 212 212 MET C C 212 176.996 176.996 175.075 1.921 25485 16884 1 13 . 1 1 212 212 MET CA C 212 53.614 53.614 52.998 0.616 25485 16885 1 13 . 1 1 212 212 MET CB C 212 26.975 26.975 30.993 -4.018 25485 16886 1 13 . 1 1 212 212 MET H H 212 7.724 7.724 7.583 0.141 25485 16887 1 13 . 1 1 213 213 TYR N N 213 129.919 129.919 124.481 5.438 25485 16888 1 13 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.473 1.223 25485 16889 1 13 . 1 1 213 213 TYR C C 213 178.411 178.411 174.966 3.445 25485 16890 1 13 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.352 -0.222 25485 16891 1 13 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.127 1.040 25485 16892 1 13 . 1 1 213 213 TYR H H 213 7.902 7.902 7.144 0.758 25485 16893 1 13 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.373 -0.898 25485 16894 1 13 . 1 1 214 214 PRO C C 214 177.694 177.694 176.330 1.364 25485 16895 1 13 . 1 1 214 214 PRO CA C 214 66.028 66.028 63.816 2.212 25485 16896 1 13 . 1 1 214 214 PRO CB C 214 32.823 32.823 32.010 0.813 25485 16897 1 13 . 1 1 215 215 THR N N 215 104.450 104.450 114.195 -9.745 25485 16898 1 13 . 1 1 215 215 THR HA H 215 4.444 4.444 4.053 0.391 25485 16899 1 13 . 1 1 215 215 THR C C 215 173.429 173.429 173.532 -0.103 25485 16900 1 13 . 1 1 215 215 THR CA C 215 60.528 60.528 60.784 -0.256 25485 16901 1 13 . 1 1 215 215 THR CB C 215 69.614 69.614 66.131 3.483 25485 16902 1 13 . 1 1 215 215 THR H H 215 6.407 6.407 7.130 -0.723 25485 16903 1 13 . 1 1 216 216 TYR N N 216 124.618 124.618 124.060 0.558 25485 16904 1 13 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.299 -0.067 25485 16905 1 13 . 1 1 216 216 TYR C C 216 175.669 175.669 176.148 -0.479 25485 16906 1 13 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.916 -1.329 25485 16907 1 13 . 1 1 216 216 TYR CB C 216 40.891 40.891 39.005 1.886 25485 16908 1 13 . 1 1 216 216 TYR H H 216 8.331 8.331 7.602 0.729 25485 16909 1 13 . 1 1 217 217 GLY N N 217 116.089 116.089 111.786 4.303 25485 16910 1 13 . 1 1 217 217 GLY C C 217 173.560 173.560 174.076 -0.516 25485 16911 1 13 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.041 0.277 25485 16912 1 13 . 1 1 217 217 GLY H H 217 7.695 7.695 8.633 -0.938 25485 16913 1 13 . 1 1 218 218 ASN N N 218 120.167 120.167 117.428 2.739 25485 16914 1 13 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.801 -0.135 25485 16915 1 13 . 1 1 218 218 ASN C C 218 175.343 175.343 176.266 -0.923 25485 16916 1 13 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.131 0.484 25485 16917 1 13 . 1 1 218 218 ASN CB C 218 38.546 38.546 39.898 -1.352 25485 16918 1 13 . 1 1 218 218 ASN H H 218 8.237 8.237 8.804 -0.567 25485 16919 1 13 . 1 1 219 219 GLY N N 219 109.322 109.322 110.792 -1.470 25485 16920 1 13 . 1 1 219 219 GLY C C 219 172.842 172.842 173.882 -1.040 25485 16921 1 13 . 1 1 219 219 GLY CA C 219 44.718 44.718 45.110 -0.392 25485 16922 1 13 . 1 1 219 219 GLY H H 219 8.027 8.027 7.899 0.128 25485 16923 1 13 . 1 1 220 220 ASP N N 220 123.006 123.006 124.001 -0.995 25485 16924 1 13 . 1 1 220 220 ASP H H 220 8.273 8.273 8.190 0.083 25485 16925 1 13 . 1 1 221 221 PRO C C 221 177.138 177.138 176.862 0.276 25485 16926 1 13 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.486 -5.423 25485 16927 1 13 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.908 -1.212 25485 16928 1 13 . 1 1 222 222 GLN N N 222 116.718 116.718 118.937 -2.219 25485 16929 1 13 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.242 0.094 25485 16930 1 13 . 1 1 222 222 GLN C C 222 176.321 176.321 176.365 -0.044 25485 16931 1 13 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.850 -0.707 25485 16932 1 13 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.222 0.275 25485 16933 1 13 . 1 1 222 222 GLN H H 222 8.240 8.240 8.632 -0.392 25485 16934 1 13 . 1 1 223 223 ASN N N 223 118.368 118.368 114.389 3.979 25485 16935 1 13 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.785 0.131 25485 16936 1 13 . 1 1 223 223 ASN C C 223 173.271 173.271 174.791 -1.520 25485 16937 1 13 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.217 -0.621 25485 16938 1 13 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.531 -0.316 25485 16939 1 13 . 1 1 223 223 ASN H H 223 7.946 7.946 7.943 0.003 25485 16940 1 13 . 1 1 224 224 PHE N N 224 118.429 118.429 121.461 -3.032 25485 16941 1 13 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.149 0.302 25485 16942 1 13 . 1 1 224 224 PHE C C 224 172.897 172.897 173.223 -0.326 25485 16943 1 13 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.470 -0.061 25485 16944 1 13 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.400 0.301 25485 16945 1 13 . 1 1 224 224 PHE H H 224 6.992 6.992 7.841 -0.849 25485 16946 1 13 . 1 1 225 225 LYS N N 225 121.714 121.714 124.288 -2.574 25485 16947 1 13 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.808 0.622 25485 16948 1 13 . 1 1 225 225 LYS C C 225 174.664 174.664 174.307 0.357 25485 16949 1 13 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.308 0.004 25485 16950 1 13 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.151 0.576 25485 16951 1 13 . 1 1 225 225 LYS H H 225 7.709 7.709 7.696 0.013 25485 16952 1 13 . 1 1 226 226 LEU N N 226 119.026 119.026 121.170 -2.144 25485 16953 1 13 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.893 0.247 25485 16954 1 13 . 1 1 226 226 LEU C C 226 177.495 177.495 176.732 0.763 25485 16955 1 13 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.234 0.365 25485 16956 1 13 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.685 -0.404 25485 16957 1 13 . 1 1 226 226 LEU H H 226 8.015 8.015 7.849 0.166 25485 16958 1 13 . 1 1 227 227 SER N N 227 120.320 120.320 115.935 4.385 25485 16959 1 13 . 1 1 227 227 SER HA H 227 4.600 4.600 4.361 0.239 25485 16960 1 13 . 1 1 227 227 SER C C 227 175.492 175.492 175.391 0.101 25485 16961 1 13 . 1 1 227 227 SER CA C 227 57.239 57.239 57.715 -0.476 25485 16962 1 13 . 1 1 227 227 SER CB C 227 66.278 66.278 64.699 1.579 25485 16963 1 13 . 1 1 227 227 SER H H 227 9.654 9.654 8.041 1.613 25485 16964 1 13 . 1 1 228 228 GLN N N 228 127.511 127.511 124.656 2.855 25485 16965 1 13 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.958 0.736 25485 16966 1 13 . 1 1 228 228 GLN H H 228 8.248 8.248 8.829 -0.581 25485 16967 1 13 . 1 1 229 229 ASP N N 229 124.358 124.358 118.658 5.700 25485 16968 1 13 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.314 0.060 25485 16969 1 13 . 1 1 229 229 ASP C C 229 178.793 178.793 178.490 0.303 25485 16970 1 13 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.322 0.820 25485 16971 1 13 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.608 2.634 25485 16972 1 13 . 1 1 229 229 ASP H H 229 8.138 8.138 8.415 -0.277 25485 16973 1 13 . 1 1 230 230 ASP N N 230 119.694 119.694 120.003 -0.309 25485 16974 1 13 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.422 -0.000 25485 16975 1 13 . 1 1 230 230 ASP C C 230 177.736 177.736 178.075 -0.339 25485 16976 1 13 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.056 0.866 25485 16977 1 13 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.931 2.305 25485 16978 1 13 . 1 1 230 230 ASP H H 230 7.393 7.393 7.381 0.012 25485 16979 1 13 . 1 1 231 231 ILE N N 231 120.364 120.364 119.960 0.404 25485 16980 1 13 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.890 -0.225 25485 16981 1 13 . 1 1 231 231 ILE C C 231 177.631 177.631 178.271 -0.640 25485 16982 1 13 . 1 1 231 231 ILE CA C 231 65.499 65.499 64.557 0.942 25485 16983 1 13 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.041 0.472 25485 16984 1 13 . 1 1 231 231 ILE H H 231 8.115 8.115 7.904 0.211 25485 16985 1 13 . 1 1 232 232 LYS N N 232 119.156 119.156 120.209 -1.053 25485 16986 1 13 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.153 -0.039 25485 16987 1 13 . 1 1 232 232 LYS C C 232 180.574 180.574 179.134 1.440 25485 16988 1 13 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.275 0.285 25485 16989 1 13 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.863 -0.065 25485 16990 1 13 . 1 1 232 232 LYS H H 232 8.607 8.607 8.298 0.309 25485 16991 1 13 . 1 1 233 233 GLY N N 233 106.425 106.425 107.975 -1.550 25485 16992 1 13 . 1 1 233 233 GLY C C 233 176.098 176.098 175.819 0.279 25485 16993 1 13 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.601 1.036 25485 16994 1 13 . 1 1 233 233 GLY H H 233 8.075 8.075 7.765 0.310 25485 16995 1 13 . 1 1 234 234 ILE N N 234 125.119 125.119 122.298 2.821 25485 16996 1 13 . 1 1 234 234 ILE C C 234 178.231 178.231 177.296 0.935 25485 16997 1 13 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.370 -1.777 25485 16998 1 13 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.367 -0.820 25485 16999 1 13 . 1 1 234 234 ILE H H 234 8.539 8.539 7.753 0.786 25485 17000 1 13 . 1 1 235 235 GLN N N 235 122.877 122.877 118.518 4.359 25485 17001 1 13 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.023 0.334 25485 17002 1 13 . 1 1 235 235 GLN C C 235 180.105 180.105 178.189 1.916 25485 17003 1 13 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.449 -1.562 25485 17004 1 13 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.684 -1.147 25485 17005 1 13 . 1 1 235 235 GLN H H 235 8.296 8.296 8.214 0.082 25485 17006 1 13 . 1 1 236 236 LYS N N 236 123.678 123.678 117.749 5.929 25485 17007 1 13 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.252 -0.170 25485 17008 1 13 . 1 1 236 236 LYS C C 236 178.169 178.169 177.421 0.748 25485 17009 1 13 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.499 0.877 25485 17010 1 13 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.776 0.202 25485 17011 1 13 . 1 1 236 236 LYS H H 236 8.024 8.024 7.547 0.477 25485 17012 1 13 . 1 1 237 237 LEU N N 237 116.873 116.873 119.258 -2.385 25485 17013 1 13 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.366 -0.379 25485 17014 1 13 . 1 1 237 237 LEU C C 237 177.893 177.893 177.849 0.044 25485 17015 1 13 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.295 1.144 25485 17016 1 13 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.910 0.703 25485 17017 1 13 . 1 1 237 237 LEU H H 237 6.888 6.888 7.526 -0.638 25485 17018 1 13 . 1 1 238 238 TYR N N 238 112.237 112.237 117.455 -5.218 25485 17019 1 13 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.600 0.051 25485 17020 1 13 . 1 1 238 238 TYR C C 238 176.082 176.082 176.003 0.079 25485 17021 1 13 . 1 1 238 238 TYR CA C 238 59.636 59.636 59.722 -0.086 25485 17022 1 13 . 1 1 238 238 TYR CB C 238 41.398 41.398 40.118 1.280 25485 17023 1 13 . 1 1 238 238 TYR H H 238 7.445 7.445 8.554 -1.109 25485 17024 1 13 . 1 1 239 239 GLY N N 239 110.906 110.906 106.379 4.527 25485 17025 1 13 . 1 1 239 239 GLY C C 239 171.269 171.269 172.510 -1.241 25485 17026 1 13 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.345 -1.459 25485 17027 1 13 . 1 1 239 239 GLY H H 239 8.443 8.443 7.899 0.544 25485 17028 1 13 . 1 1 240 240 LYS N N 240 114.281 114.281 122.602 -8.321 25485 17029 1 13 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.486 0.252 25485 17030 1 13 . 1 1 240 240 LYS C C 240 177.527 177.527 175.801 1.726 25485 17031 1 13 . 1 1 240 240 LYS CA C 240 54.958 54.958 56.382 -1.424 25485 17032 1 13 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.531 0.744 25485 17033 1 13 . 1 1 240 240 LYS H H 240 7.873 7.873 8.417 -0.544 25485 17034 1 13 . 1 1 241 241 ARG N N 241 123.758 123.758 120.682 3.076 25485 17035 1 13 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.558 -0.561 25485 17036 1 13 . 1 1 241 241 ARG C C 241 176.026 176.026 176.228 -0.202 25485 17037 1 13 . 1 1 241 241 ARG CA C 241 57.492 57.492 55.802 1.690 25485 17038 1 13 . 1 1 241 241 ARG CB C 241 30.371 30.371 31.278 -0.907 25485 17039 1 13 . 1 1 241 241 ARG H H 241 7.742 7.742 8.326 -0.584 25485 17040 1 13 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.146 0.194 25485 17041 1 13 . 1 1 246 246 LYS C C 246 175.403 175.403 177.447 -2.044 25485 17042 1 13 . 1 1 246 246 LYS CA C 246 56.509 56.509 57.776 -1.267 25485 17043 1 13 . 1 1 246 246 LYS CB C 246 32.858 32.858 32.412 0.446 25485 17044 1 14 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.600 -0.293 25485 17045 1 14 . 1 1 2 2 GLN C C 2 176.492 176.492 175.944 0.548 25485 17046 1 14 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.202 0.547 25485 17047 1 14 . 1 1 2 2 GLN CB C 2 28.654 28.654 29.390 -0.736 25485 17048 1 14 . 1 1 3 3 GLU N N 3 121.668 121.668 121.645 0.023 25485 17049 1 14 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.398 -0.609 25485 17050 1 14 . 1 1 3 3 GLU C C 3 176.278 176.278 177.588 -1.310 25485 17051 1 14 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.184 -0.126 25485 17052 1 14 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.870 -0.179 25485 17053 1 14 . 1 1 3 3 GLU H H 3 8.331 8.331 8.603 -0.272 25485 17054 1 14 . 1 1 4 4 ALA N N 4 124.493 124.493 123.364 1.129 25485 17055 1 14 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.095 0.415 25485 17056 1 14 . 1 1 4 4 ALA C C 4 178.428 178.428 179.342 -0.914 25485 17057 1 14 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.841 -0.164 25485 17058 1 14 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.212 0.497 25485 17059 1 14 . 1 1 4 4 ALA H H 4 8.131 8.131 8.596 -0.465 25485 17060 1 14 . 1 1 5 5 GLY N N 5 108.204 108.204 107.482 0.722 25485 17061 1 14 . 1 1 5 5 GLY C C 5 174.858 174.858 175.506 -0.648 25485 17062 1 14 . 1 1 5 5 GLY CA C 5 47.661 47.661 45.911 1.750 25485 17063 1 14 . 1 1 5 5 GLY H H 5 8.279 8.279 8.545 -0.266 25485 17064 1 14 . 1 1 6 6 GLY N N 6 108.820 108.820 108.299 0.521 25485 17065 1 14 . 1 1 6 6 GLY C C 6 174.189 174.189 173.856 0.333 25485 17066 1 14 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.491 -0.078 25485 17067 1 14 . 1 1 6 6 GLY H H 6 8.246 8.246 7.865 0.381 25485 17068 1 14 . 1 1 7 7 MET N N 7 119.938 119.938 120.432 -0.494 25485 17069 1 14 . 1 1 7 7 MET HA H 7 4.659 4.659 4.629 0.030 25485 17070 1 14 . 1 1 7 7 MET C C 7 176.191 176.191 175.977 0.214 25485 17071 1 14 . 1 1 7 7 MET CA C 7 54.799 54.799 54.957 -0.158 25485 17072 1 14 . 1 1 7 7 MET CB C 7 33.046 33.046 34.608 -1.562 25485 17073 1 14 . 1 1 7 7 MET H H 7 8.005 8.005 7.858 0.147 25485 17074 1 14 . 1 1 8 8 SER N N 8 118.919 118.919 116.263 2.656 25485 17075 1 14 . 1 1 8 8 SER HA H 8 4.239 4.239 4.617 -0.378 25485 17076 1 14 . 1 1 8 8 SER C C 8 174.949 174.949 175.655 -0.706 25485 17077 1 14 . 1 1 8 8 SER CA C 8 58.160 58.160 57.679 0.481 25485 17078 1 14 . 1 1 8 8 SER CB C 8 65.440 65.440 64.706 0.734 25485 17079 1 14 . 1 1 8 8 SER H H 8 8.731 8.731 8.288 0.443 25485 17080 1 14 . 1 1 9 9 GLU N N 9 122.442 122.442 120.809 1.633 25485 17081 1 14 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.172 0.149 25485 17082 1 14 . 1 1 9 9 GLU C C 9 178.604 178.604 178.777 -0.173 25485 17083 1 14 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.351 0.116 25485 17084 1 14 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.496 -0.320 25485 17085 1 14 . 1 1 9 9 GLU H H 9 8.901 8.901 8.921 -0.020 25485 17086 1 14 . 1 1 10 10 LEU N N 10 120.568 120.568 120.070 0.498 25485 17087 1 14 . 1 1 10 10 LEU C C 10 179.307 179.307 179.065 0.242 25485 17088 1 14 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.275 -0.795 25485 17089 1 14 . 1 1 10 10 LEU CB C 10 41.575 41.575 42.099 -0.524 25485 17090 1 14 . 1 1 10 10 LEU H H 10 8.020 8.020 7.761 0.259 25485 17091 1 14 . 1 1 11 11 GLN N N 11 119.930 119.930 118.132 1.798 25485 17092 1 14 . 1 1 11 11 GLN HA H 11 4.134 4.134 3.982 0.152 25485 17093 1 14 . 1 1 11 11 GLN C C 11 178.330 178.330 178.416 -0.086 25485 17094 1 14 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.027 -0.209 25485 17095 1 14 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.605 -0.740 25485 17096 1 14 . 1 1 11 11 GLN H H 11 7.811 7.811 7.597 0.214 25485 17097 1 14 . 1 1 12 12 TRP N N 12 121.031 121.031 120.841 0.190 25485 17098 1 14 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.302 0.112 25485 17099 1 14 . 1 1 12 12 TRP C C 12 178.874 178.874 177.443 1.431 25485 17100 1 14 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.034 0.473 25485 17101 1 14 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.774 -0.387 25485 17102 1 14 . 1 1 12 12 TRP H H 12 8.205 8.205 7.754 0.451 25485 17103 1 14 . 1 1 13 13 GLU N N 13 121.877 121.877 119.223 2.654 25485 17104 1 14 . 1 1 13 13 GLU C C 13 179.425 179.425 179.027 0.398 25485 17105 1 14 . 1 1 13 13 GLU CA C 13 60.037 60.037 60.347 -0.310 25485 17106 1 14 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.262 -0.339 25485 17107 1 14 . 1 1 13 13 GLU H H 13 8.434 8.434 8.378 0.056 25485 17108 1 14 . 1 1 14 14 GLN N N 14 120.449 120.449 118.185 2.264 25485 17109 1 14 . 1 1 14 14 GLN HA H 14 4.238 4.238 4.012 0.226 25485 17110 1 14 . 1 1 14 14 GLN C C 14 179.210 179.210 177.916 1.294 25485 17111 1 14 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.493 0.389 25485 17112 1 14 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.209 -0.459 25485 17113 1 14 . 1 1 14 14 GLN H H 14 8.124 8.124 7.691 0.433 25485 17114 1 14 . 1 1 15 15 ALA N N 15 123.114 123.114 120.683 2.431 25485 17115 1 14 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.647 0.743 25485 17116 1 14 . 1 1 15 15 ALA C C 15 179.352 179.352 179.270 0.082 25485 17117 1 14 . 1 1 15 15 ALA CA C 15 54.965 54.965 54.825 0.140 25485 17118 1 14 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.778 0.885 25485 17119 1 14 . 1 1 15 15 ALA H H 15 8.344 8.344 7.177 1.167 25485 17120 1 14 . 1 1 16 16 GLN N N 16 117.718 117.718 117.269 0.449 25485 17121 1 14 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.935 -0.153 25485 17122 1 14 . 1 1 16 16 GLN C C 16 177.719 177.719 178.058 -0.339 25485 17123 1 14 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.882 1.399 25485 17124 1 14 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.494 0.042 25485 17125 1 14 . 1 1 16 16 GLN H H 16 8.500 8.500 7.514 0.986 25485 17126 1 14 . 1 1 17 17 ASP N N 17 120.040 120.040 120.164 -0.124 25485 17127 1 14 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.427 0.109 25485 17128 1 14 . 1 1 17 17 ASP C C 17 177.630 177.630 178.612 -0.982 25485 17129 1 14 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.250 0.555 25485 17130 1 14 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.877 0.987 25485 17131 1 14 . 1 1 17 17 ASP H H 17 7.871 7.871 7.804 0.067 25485 17132 1 14 . 1 1 18 18 TYR N N 18 122.465 122.465 118.920 3.545 25485 17133 1 14 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.148 0.042 25485 17134 1 14 . 1 1 18 18 TYR C C 18 178.439 178.439 177.963 0.476 25485 17135 1 14 . 1 1 18 18 TYR CA C 18 61.846 61.846 59.966 1.880 25485 17136 1 14 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.017 1.923 25485 17137 1 14 . 1 1 18 18 TYR H H 18 8.244 8.244 8.658 -0.414 25485 17138 1 14 . 1 1 19 19 LEU N N 19 117.635 117.635 117.960 -0.325 25485 17139 1 14 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.243 -0.111 25485 17140 1 14 . 1 1 19 19 LEU C C 19 180.940 180.940 178.066 2.874 25485 17141 1 14 . 1 1 19 19 LEU CA C 19 57.505 57.505 57.178 0.327 25485 17142 1 14 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.941 -1.343 25485 17143 1 14 . 1 1 19 19 LEU H H 19 8.713 8.713 7.414 1.299 25485 17144 1 14 . 1 1 20 20 LYS N N 20 124.594 124.594 119.038 5.556 25485 17145 1 14 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.096 -0.012 25485 17146 1 14 . 1 1 20 20 LYS C C 20 178.387 178.387 178.351 0.036 25485 17147 1 14 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.859 0.946 25485 17148 1 14 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.547 -0.091 25485 17149 1 14 . 1 1 20 20 LYS H H 20 8.815 8.815 7.408 1.407 25485 17150 1 14 . 1 1 21 21 ARG N N 21 117.535 117.535 116.339 1.196 25485 17151 1 14 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.151 -0.432 25485 17152 1 14 . 1 1 21 21 ARG C C 21 178.498 178.498 178.340 0.158 25485 17153 1 14 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.423 0.821 25485 17154 1 14 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.216 0.225 25485 17155 1 14 . 1 1 21 21 ARG H H 21 7.810 7.810 7.502 0.308 25485 17156 1 14 . 1 1 22 22 PHE N N 22 112.113 112.113 119.562 -7.449 25485 17157 1 14 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.438 0.473 25485 17158 1 14 . 1 1 22 22 PHE C C 22 174.875 174.875 174.845 0.030 25485 17159 1 14 . 1 1 22 22 PHE CA C 22 57.475 57.475 59.172 -1.697 25485 17160 1 14 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.755 -0.586 25485 17161 1 14 . 1 1 22 22 PHE H H 22 8.010 8.010 7.755 0.255 25485 17162 1 14 . 1 1 23 23 TYR N N 23 116.187 116.187 116.722 -0.535 25485 17163 1 14 . 1 1 23 23 TYR C C 23 173.455 173.455 176.546 -3.091 25485 17164 1 14 . 1 1 23 23 TYR CA C 23 58.427 58.427 59.129 -0.702 25485 17165 1 14 . 1 1 23 23 TYR CB C 23 39.529 39.529 40.986 -1.457 25485 17166 1 14 . 1 1 23 23 TYR H H 23 7.680 7.680 7.592 0.088 25485 17167 1 14 . 1 1 24 24 LEU N N 24 115.570 115.570 114.114 1.456 25485 17168 1 14 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.504 -0.354 25485 17169 1 14 . 1 1 24 24 LEU C C 24 176.661 176.661 174.789 1.872 25485 17170 1 14 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.971 0.181 25485 17171 1 14 . 1 1 24 24 LEU CB C 24 36.863 36.863 45.120 -8.257 25485 17172 1 14 . 1 1 24 24 LEU H H 24 7.238 7.238 7.887 -0.649 25485 17173 1 14 . 1 1 25 25 TYR N N 25 119.901 119.901 119.358 0.543 25485 17174 1 14 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.736 -0.377 25485 17175 1 14 . 1 1 25 25 TYR C C 25 173.784 173.784 173.777 0.007 25485 17176 1 14 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.256 0.991 25485 17177 1 14 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.857 -0.778 25485 17178 1 14 . 1 1 25 25 TYR H H 25 7.845 7.845 8.013 -0.168 25485 17179 1 14 . 1 1 26 26 ASP N N 26 129.338 129.338 127.165 2.173 25485 17180 1 14 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.006 -0.555 25485 17181 1 14 . 1 1 26 26 ASP C C 26 175.282 175.282 176.778 -1.496 25485 17182 1 14 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.550 -1.117 25485 17183 1 14 . 1 1 26 26 ASP CB C 26 41.249 41.249 40.845 0.404 25485 17184 1 14 . 1 1 26 26 ASP H H 26 8.108 8.108 8.487 -0.379 25485 17185 1 14 . 1 1 27 27 SER C C 27 175.204 175.204 175.838 -0.634 25485 17186 1 14 . 1 1 27 27 SER CA C 27 59.424 59.424 60.250 -0.826 25485 17187 1 14 . 1 1 27 27 SER CB C 27 63.535 63.535 63.876 -0.341 25485 17188 1 14 . 1 1 28 28 GLU N N 28 122.058 122.058 122.060 -0.002 25485 17189 1 14 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.209 0.116 25485 17190 1 14 . 1 1 28 28 GLU C C 28 177.073 177.073 177.072 0.001 25485 17191 1 14 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.331 -1.119 25485 17192 1 14 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.085 0.485 25485 17193 1 14 . 1 1 28 28 GLU H H 28 8.255 8.255 8.678 -0.423 25485 17194 1 14 . 1 1 29 29 THR N N 29 114.161 114.161 113.434 0.727 25485 17195 1 14 . 1 1 29 29 THR HA H 29 4.260 4.260 4.202 0.058 25485 17196 1 14 . 1 1 29 29 THR C C 29 174.591 174.591 173.913 0.678 25485 17197 1 14 . 1 1 29 29 THR CA C 29 61.976 61.976 63.297 -1.321 25485 17198 1 14 . 1 1 29 29 THR CB C 29 69.385 69.385 69.020 0.365 25485 17199 1 14 . 1 1 29 29 THR H H 29 7.498 7.498 7.624 -0.126 25485 17200 1 14 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.042 0.176 25485 17201 1 14 . 1 1 30 30 LYS H H 30 8.218 8.218 7.483 0.735 25485 17202 1 14 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.716 -0.292 25485 17203 1 14 . 1 1 31 31 ASN CB C 31 39.133 39.133 41.039 -1.906 25485 17204 1 14 . 1 1 32 32 ALA N N 32 126.484 126.484 125.724 0.760 25485 17205 1 14 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.169 0.127 25485 17206 1 14 . 1 1 32 32 ALA C C 32 178.012 178.012 178.690 -0.678 25485 17207 1 14 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.841 -1.081 25485 17208 1 14 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.028 -0.258 25485 17209 1 14 . 1 1 32 32 ALA H H 32 8.411 8.411 8.722 -0.311 25485 17210 1 14 . 1 1 33 33 ASN N N 33 116.885 116.885 116.067 0.818 25485 17211 1 14 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.608 0.090 25485 17212 1 14 . 1 1 33 33 ASN C C 33 176.240 176.240 177.237 -0.997 25485 17213 1 14 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.502 -1.315 25485 17214 1 14 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.229 0.356 25485 17215 1 14 . 1 1 33 33 ASN H H 33 8.309 8.309 8.395 -0.086 25485 17216 1 14 . 1 1 34 34 SER N N 34 116.836 116.836 115.830 1.006 25485 17217 1 14 . 1 1 34 34 SER HA H 34 4.544 4.544 4.332 0.212 25485 17218 1 14 . 1 1 34 34 SER C C 34 175.253 175.253 176.316 -1.063 25485 17219 1 14 . 1 1 34 34 SER CA C 34 59.583 59.583 60.610 -1.027 25485 17220 1 14 . 1 1 34 34 SER CB C 34 63.919 63.919 62.838 1.081 25485 17221 1 14 . 1 1 34 34 SER H H 34 8.115 8.115 8.214 -0.099 25485 17222 1 14 . 1 1 35 35 LEU N N 35 125.355 125.355 123.018 2.337 25485 17223 1 14 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.105 -0.529 25485 17224 1 14 . 1 1 35 35 LEU C C 35 177.973 177.973 177.947 0.026 25485 17225 1 14 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.308 0.189 25485 17226 1 14 . 1 1 35 35 LEU CB C 35 40.692 40.692 42.020 -1.328 25485 17227 1 14 . 1 1 35 35 LEU H H 35 8.312 8.312 8.371 -0.059 25485 17228 1 14 . 1 1 36 36 GLU N N 36 119.201 119.201 118.564 0.637 25485 17229 1 14 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.960 -0.046 25485 17230 1 14 . 1 1 36 36 GLU C C 36 178.141 178.141 178.713 -0.572 25485 17231 1 14 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.432 0.227 25485 17232 1 14 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.009 0.304 25485 17233 1 14 . 1 1 36 36 GLU H H 36 8.225 8.225 7.902 0.323 25485 17234 1 14 . 1 1 37 37 ALA N N 37 120.746 120.746 122.438 -1.692 25485 17235 1 14 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.054 0.025 25485 17236 1 14 . 1 1 37 37 ALA C C 37 181.485 181.485 179.738 1.747 25485 17237 1 14 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.136 0.323 25485 17238 1 14 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.162 0.005 25485 17239 1 14 . 1 1 37 37 ALA H H 37 7.917 7.917 7.678 0.239 25485 17240 1 14 . 1 1 38 38 LYS N N 38 119.326 119.326 118.953 0.373 25485 17241 1 14 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.097 0.234 25485 17242 1 14 . 1 1 38 38 LYS C C 38 177.946 177.946 178.855 -0.909 25485 17243 1 14 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.768 -1.064 25485 17244 1 14 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.638 -0.838 25485 17245 1 14 . 1 1 38 38 LYS H H 38 8.216 8.216 7.990 0.226 25485 17246 1 14 . 1 1 39 39 LEU N N 39 122.736 122.736 120.619 2.117 25485 17247 1 14 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.943 -0.002 25485 17248 1 14 . 1 1 39 39 LEU C C 39 178.819 178.819 178.702 0.117 25485 17249 1 14 . 1 1 39 39 LEU CA C 39 58.081 58.081 57.927 0.154 25485 17250 1 14 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.501 -0.873 25485 17251 1 14 . 1 1 39 39 LEU H H 39 8.666 8.666 8.360 0.306 25485 17252 1 14 . 1 1 40 40 LYS N N 40 118.411 118.411 118.950 -0.539 25485 17253 1 14 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.884 0.754 25485 17254 1 14 . 1 1 40 40 LYS C C 40 179.329 179.329 178.269 1.060 25485 17255 1 14 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.313 -0.180 25485 17256 1 14 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.307 -0.522 25485 17257 1 14 . 1 1 40 40 LYS H H 40 8.227 8.227 7.963 0.264 25485 17258 1 14 . 1 1 41 41 GLU N N 41 121.329 121.329 117.989 3.340 25485 17259 1 14 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.140 -0.047 25485 17260 1 14 . 1 1 41 41 GLU C C 41 178.989 178.989 179.007 -0.018 25485 17261 1 14 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.278 0.482 25485 17262 1 14 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.943 0.893 25485 17263 1 14 . 1 1 41 41 GLU H H 41 7.718 7.718 7.803 -0.085 25485 17264 1 14 . 1 1 42 42 MET N N 42 123.817 123.817 120.190 3.627 25485 17265 1 14 . 1 1 42 42 MET HA H 42 4.107 4.107 4.463 -0.356 25485 17266 1 14 . 1 1 42 42 MET C C 42 177.719 177.719 178.405 -0.686 25485 17267 1 14 . 1 1 42 42 MET CA C 42 59.912 59.912 58.713 1.199 25485 17268 1 14 . 1 1 42 42 MET CB C 42 30.506 30.506 32.426 -1.920 25485 17269 1 14 . 1 1 42 42 MET H H 42 7.657 7.657 7.355 0.302 25485 17270 1 14 . 1 1 43 43 GLN N N 43 119.998 119.998 119.028 0.970 25485 17271 1 14 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.927 -0.122 25485 17272 1 14 . 1 1 43 43 GLN C C 43 177.604 177.604 178.923 -1.319 25485 17273 1 14 . 1 1 43 43 GLN CA C 43 59.965 59.965 59.525 0.440 25485 17274 1 14 . 1 1 43 43 GLN CB C 43 26.555 26.555 28.194 -1.639 25485 17275 1 14 . 1 1 43 43 GLN H H 43 8.910 8.910 8.021 0.889 25485 17276 1 14 . 1 1 44 44 LYS N N 44 119.165 119.165 118.916 0.249 25485 17277 1 14 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.247 -0.192 25485 17278 1 14 . 1 1 44 44 LYS C C 44 179.991 179.991 178.957 1.034 25485 17279 1 14 . 1 1 44 44 LYS CA C 44 59.561 59.561 57.747 1.814 25485 17280 1 14 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.146 0.152 25485 17281 1 14 . 1 1 44 44 LYS H H 44 8.507 8.507 7.855 0.652 25485 17282 1 14 . 1 1 45 45 PHE N N 45 123.602 123.602 120.046 3.556 25485 17283 1 14 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.434 -0.533 25485 17284 1 14 . 1 1 45 45 PHE C C 45 177.606 177.606 176.655 0.951 25485 17285 1 14 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.712 2.322 25485 17286 1 14 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.365 0.501 25485 17287 1 14 . 1 1 45 45 PHE H H 45 8.445 8.445 7.554 0.891 25485 17288 1 14 . 1 1 46 46 PHE N N 46 112.715 112.715 115.733 -3.018 25485 17289 1 14 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.555 0.042 25485 17290 1 14 . 1 1 46 46 PHE C C 46 175.285 175.285 177.259 -1.974 25485 17291 1 14 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.523 1.152 25485 17292 1 14 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.130 -0.672 25485 17293 1 14 . 1 1 46 46 PHE H H 46 8.272 8.272 8.181 0.091 25485 17294 1 14 . 1 1 47 47 GLY N N 47 110.438 110.438 106.939 3.499 25485 17295 1 14 . 1 1 47 47 GLY C C 47 174.935 174.935 174.443 0.492 25485 17296 1 14 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.182 1.829 25485 17297 1 14 . 1 1 47 47 GLY H H 47 7.926 7.926 8.193 -0.267 25485 17298 1 14 . 1 1 48 48 LEU N N 48 121.830 121.830 119.376 2.454 25485 17299 1 14 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.719 0.205 25485 17300 1 14 . 1 1 48 48 LEU C C 48 174.009 174.009 176.108 -2.099 25485 17301 1 14 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.683 -1.848 25485 17302 1 14 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.876 0.587 25485 17303 1 14 . 1 1 48 48 LEU H H 48 8.762 8.762 7.628 1.134 25485 17304 1 14 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.379 -0.141 25485 17305 1 14 . 1 1 49 49 PRO C C 49 176.874 176.874 176.957 -0.083 25485 17306 1 14 . 1 1 49 49 PRO CA C 49 63.518 63.518 64.072 -0.554 25485 17307 1 14 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.867 -0.788 25485 17308 1 14 . 1 1 50 50 ILE N N 50 126.859 126.859 118.438 8.421 25485 17309 1 14 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.047 0.054 25485 17310 1 14 . 1 1 50 50 ILE C C 50 176.540 176.540 175.600 0.940 25485 17311 1 14 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.025 -1.069 25485 17312 1 14 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.070 -0.677 25485 17313 1 14 . 1 1 50 50 ILE H H 50 8.548 8.548 7.878 0.670 25485 17314 1 14 . 1 1 51 51 THR N N 51 116.443 116.443 118.179 -1.736 25485 17315 1 14 . 1 1 51 51 THR HA H 51 4.584 4.584 4.526 0.058 25485 17316 1 14 . 1 1 51 51 THR C C 51 176.672 176.672 175.246 1.426 25485 17317 1 14 . 1 1 51 51 THR CA C 51 60.979 60.979 60.413 0.566 25485 17318 1 14 . 1 1 51 51 THR CB C 51 71.505 71.505 71.043 0.461 25485 17319 1 14 . 1 1 51 51 THR H H 51 8.001 8.001 7.787 0.214 25485 17320 1 14 . 1 1 52 52 GLY N N 52 112.719 112.719 109.941 2.778 25485 17321 1 14 . 1 1 52 52 GLY C C 52 170.609 170.609 174.481 -3.872 25485 17322 1 14 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.960 0.786 25485 17323 1 14 . 1 1 52 52 GLY H H 52 9.499 9.499 8.568 0.931 25485 17324 1 14 . 1 1 53 53 MET N N 53 116.621 116.621 119.284 -2.663 25485 17325 1 14 . 1 1 53 53 MET HA H 53 4.023 4.023 4.564 -0.541 25485 17326 1 14 . 1 1 53 53 MET C C 53 174.695 174.695 174.587 0.108 25485 17327 1 14 . 1 1 53 53 MET CA C 53 53.460 53.460 54.837 -1.377 25485 17328 1 14 . 1 1 53 53 MET CB C 53 35.408 35.408 34.831 0.577 25485 17329 1 14 . 1 1 53 53 MET H H 53 7.993 7.993 7.593 0.400 25485 17330 1 14 . 1 1 54 54 LEU N N 54 122.679 122.679 122.832 -0.153 25485 17331 1 14 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.456 -0.705 25485 17332 1 14 . 1 1 54 54 LEU C C 54 174.784 174.784 174.584 0.200 25485 17333 1 14 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.386 -0.085 25485 17334 1 14 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.368 -0.358 25485 17335 1 14 . 1 1 54 54 LEU H H 54 7.940 7.940 8.432 -0.492 25485 17336 1 14 . 1 1 55 55 ASN N N 55 115.797 115.797 119.824 -4.027 25485 17337 1 14 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.702 0.047 25485 17338 1 14 . 1 1 55 55 ASN C C 55 175.459 175.459 174.602 0.857 25485 17339 1 14 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.899 -2.056 25485 17340 1 14 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.897 1.460 25485 17341 1 14 . 1 1 55 55 ASN H H 55 6.543 6.543 8.300 -1.757 25485 17342 1 14 . 1 1 56 56 SER N N 56 121.507 121.507 115.036 6.471 25485 17343 1 14 . 1 1 56 56 SER HA H 56 4.638 4.638 4.576 0.062 25485 17344 1 14 . 1 1 56 56 SER C C 56 175.727 175.727 175.802 -0.075 25485 17345 1 14 . 1 1 56 56 SER CA C 56 57.932 57.932 59.518 -1.586 25485 17346 1 14 . 1 1 56 56 SER CB C 56 63.786 63.786 63.515 0.271 25485 17347 1 14 . 1 1 56 56 SER H H 56 8.213 8.213 8.160 0.053 25485 17348 1 14 . 1 1 57 57 ARG N N 57 122.951 122.951 122.053 0.898 25485 17349 1 14 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.462 -0.261 25485 17350 1 14 . 1 1 57 57 ARG C C 57 178.560 178.560 178.025 0.535 25485 17351 1 14 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.559 -0.127 25485 17352 1 14 . 1 1 57 57 ARG CB C 57 29.105 29.105 30.128 -1.023 25485 17353 1 14 . 1 1 57 57 ARG H H 57 7.895 7.895 8.440 -0.545 25485 17354 1 14 . 1 1 58 58 VAL N N 58 118.778 118.778 121.035 -2.257 25485 17355 1 14 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.575 -0.244 25485 17356 1 14 . 1 1 58 58 VAL C C 58 177.370 177.370 177.936 -0.566 25485 17357 1 14 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.027 0.355 25485 17358 1 14 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.290 0.919 25485 17359 1 14 . 1 1 58 58 VAL H H 58 7.583 7.583 7.896 -0.313 25485 17360 1 14 . 1 1 59 59 ILE N N 59 119.159 119.159 117.894 1.265 25485 17361 1 14 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.593 -0.180 25485 17362 1 14 . 1 1 59 59 ILE C C 59 177.067 177.067 177.830 -0.763 25485 17363 1 14 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.487 0.146 25485 17364 1 14 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.844 -0.148 25485 17365 1 14 . 1 1 59 59 ILE H H 59 7.323 7.323 8.024 -0.701 25485 17366 1 14 . 1 1 60 60 GLU N N 60 119.367 119.367 119.092 0.275 25485 17367 1 14 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.977 -0.239 25485 17368 1 14 . 1 1 60 60 GLU C C 60 179.978 179.978 179.065 0.913 25485 17369 1 14 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.506 -0.248 25485 17370 1 14 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.508 -0.120 25485 17371 1 14 . 1 1 60 60 GLU H H 60 7.879 7.879 7.665 0.214 25485 17372 1 14 . 1 1 61 61 ILE N N 61 118.816 118.816 117.590 1.226 25485 17373 1 14 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.923 -0.484 25485 17374 1 14 . 1 1 61 61 ILE C C 61 179.033 179.033 177.111 1.922 25485 17375 1 14 . 1 1 61 61 ILE CA C 61 64.838 64.838 63.776 1.062 25485 17376 1 14 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.133 -1.234 25485 17377 1 14 . 1 1 61 61 ILE H H 61 7.246 7.246 7.148 0.098 25485 17378 1 14 . 1 1 62 62 MET N N 62 119.986 119.986 116.282 3.704 25485 17379 1 14 . 1 1 62 62 MET HA H 62 3.444 3.444 4.288 -0.844 25485 17380 1 14 . 1 1 62 62 MET C C 62 176.185 176.185 177.885 -1.700 25485 17381 1 14 . 1 1 62 62 MET CA C 62 59.014 59.014 58.100 0.914 25485 17382 1 14 . 1 1 62 62 MET CB C 62 31.250 31.250 32.883 -1.633 25485 17383 1 14 . 1 1 62 62 MET H H 62 7.835 7.835 7.179 0.655 25485 17384 1 14 . 1 1 63 63 GLN N N 63 116.163 116.163 115.451 0.712 25485 17385 1 14 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.328 -0.050 25485 17386 1 14 . 1 1 63 63 GLN C C 63 176.727 176.727 176.242 0.485 25485 17387 1 14 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.877 -0.739 25485 17388 1 14 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.426 -0.360 25485 17389 1 14 . 1 1 63 63 GLN H H 63 7.454 7.454 7.764 -0.310 25485 17390 1 14 . 1 1 64 64 LYS N N 64 121.430 121.430 121.120 0.310 25485 17391 1 14 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.521 0.022 25485 17392 1 14 . 1 1 64 64 LYS C C 64 174.724 174.724 174.960 -0.236 25485 17393 1 14 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.021 1.496 25485 17394 1 14 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.466 -0.869 25485 17395 1 14 . 1 1 64 64 LYS H H 64 7.483 7.483 7.432 0.051 25485 17396 1 14 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.473 -2.037 25485 17397 1 14 . 1 1 65 65 PRO C C 65 176.158 176.158 176.171 -0.013 25485 17398 1 14 . 1 1 65 65 PRO CA C 65 62.888 62.888 62.998 -0.110 25485 17399 1 14 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.374 -0.541 25485 17400 1 14 . 1 1 66 66 ARG N N 66 112.697 112.697 122.005 -9.308 25485 17401 1 14 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.681 -0.273 25485 17402 1 14 . 1 1 66 66 ARG C C 66 174.478 174.478 174.173 0.305 25485 17403 1 14 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.461 -1.825 25485 17404 1 14 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.571 3.102 25485 17405 1 14 . 1 1 66 66 ARG H H 66 8.146 8.146 8.714 -0.568 25485 17406 1 14 . 1 1 67 67 CYS N N 67 121.740 121.740 117.551 4.189 25485 17407 1 14 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.632 -0.192 25485 17408 1 14 . 1 1 67 67 CYS C C 67 175.659 175.659 174.338 1.321 25485 17409 1 14 . 1 1 67 67 CYS CA C 67 59.195 59.195 58.110 1.085 25485 17410 1 14 . 1 1 67 67 CYS CB C 67 30.206 30.206 32.144 -1.938 25485 17411 1 14 . 1 1 67 67 CYS H H 67 7.757 7.757 8.156 -0.399 25485 17412 1 14 . 1 1 68 68 GLY N N 68 116.217 116.217 110.387 5.830 25485 17413 1 14 . 1 1 68 68 GLY C C 68 172.210 172.210 173.104 -0.894 25485 17414 1 14 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.772 1.787 25485 17415 1 14 . 1 1 68 68 GLY H H 68 9.704 9.704 9.220 0.484 25485 17416 1 14 . 1 1 69 69 VAL N N 69 126.372 126.372 118.421 7.951 25485 17417 1 14 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.194 -0.363 25485 17418 1 14 . 1 1 69 69 VAL C C 69 173.538 173.538 174.051 -0.513 25485 17419 1 14 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.337 3.031 25485 17420 1 14 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.816 -0.293 25485 17421 1 14 . 1 1 69 69 VAL H H 69 9.113 9.113 7.328 1.785 25485 17422 1 14 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.204 0.746 25485 17423 1 14 . 1 1 70 70 PRO C C 70 175.019 175.019 176.035 -1.016 25485 17424 1 14 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.451 0.897 25485 17425 1 14 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.651 -0.293 25485 17426 1 14 . 1 1 71 71 ASP N N 71 118.986 118.986 117.382 1.604 25485 17427 1 14 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.382 0.051 25485 17428 1 14 . 1 1 71 71 ASP C C 71 175.166 175.166 175.284 -0.118 25485 17429 1 14 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.046 2.322 25485 17430 1 14 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.669 -1.806 25485 17431 1 14 . 1 1 71 71 ASP H H 71 8.054 8.054 7.740 0.314 25485 17432 1 14 . 1 1 72 72 VAL N N 72 112.953 112.953 116.869 -3.916 25485 17433 1 14 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.261 0.035 25485 17434 1 14 . 1 1 72 72 VAL C C 72 174.330 174.330 173.889 0.441 25485 17435 1 14 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.991 -1.346 25485 17436 1 14 . 1 1 72 72 VAL CB C 72 33.872 33.872 34.406 -0.534 25485 17437 1 14 . 1 1 72 72 VAL H H 72 6.430 6.430 7.046 -0.616 25485 17438 1 14 . 1 1 73 73 ALA N N 73 125.869 125.869 127.277 -1.408 25485 17439 1 14 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.587 -0.282 25485 17440 1 14 . 1 1 73 73 ALA C C 73 177.382 177.382 176.288 1.094 25485 17441 1 14 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.427 0.622 25485 17442 1 14 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.823 -0.872 25485 17443 1 14 . 1 1 73 73 ALA H H 73 8.177 8.177 7.848 0.329 25485 17444 1 14 . 1 1 74 74 GLU N N 74 120.724 120.724 118.929 1.795 25485 17445 1 14 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.636 -0.533 25485 17446 1 14 . 1 1 74 74 GLU C C 74 176.246 176.246 174.675 1.571 25485 17447 1 14 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.312 0.480 25485 17448 1 14 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.882 -2.097 25485 17449 1 14 . 1 1 74 74 GLU H H 74 8.381 8.381 8.808 -0.427 25485 17450 1 14 . 1 1 75 75 TYR N N 75 121.473 121.473 121.394 0.079 25485 17451 1 14 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.161 0.284 25485 17452 1 14 . 1 1 75 75 TYR C C 75 175.633 175.633 174.691 0.942 25485 17453 1 14 . 1 1 75 75 TYR CA C 75 58.327 58.327 59.794 -1.467 25485 17454 1 14 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.567 -0.154 25485 17455 1 14 . 1 1 75 75 TYR H H 75 8.065 8.065 8.683 -0.618 25485 17456 1 14 . 1 1 76 76 SER N N 76 117.860 117.860 115.911 1.949 25485 17457 1 14 . 1 1 76 76 SER HA H 76 3.886 3.886 4.299 -0.413 25485 17458 1 14 . 1 1 76 76 SER C C 76 173.859 173.859 174.552 -0.693 25485 17459 1 14 . 1 1 76 76 SER CA C 76 58.250 58.250 58.677 -0.427 25485 17460 1 14 . 1 1 76 76 SER CB C 76 64.117 64.117 63.285 0.832 25485 17461 1 14 . 1 1 76 76 SER H H 76 7.748 7.748 8.498 -0.750 25485 17462 1 14 . 1 1 77 77 LEU N N 77 123.789 123.789 118.371 5.418 25485 17463 1 14 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.334 0.812 25485 17464 1 14 . 1 1 77 77 LEU C C 77 176.451 176.451 175.845 0.606 25485 17465 1 14 . 1 1 77 77 LEU CA C 77 55.464 55.464 56.358 -0.894 25485 17466 1 14 . 1 1 77 77 LEU CB C 77 41.957 41.957 40.210 1.747 25485 17467 1 14 . 1 1 77 77 LEU H H 77 7.979 7.979 8.133 -0.154 25485 17468 1 14 . 1 1 78 78 PHE N N 78 119.275 119.275 113.661 5.614 25485 17469 1 14 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.188 0.688 25485 17470 1 14 . 1 1 78 78 PHE C C 78 173.844 173.844 173.618 0.226 25485 17471 1 14 . 1 1 78 78 PHE CA C 78 55.372 55.372 56.955 -1.583 25485 17472 1 14 . 1 1 78 78 PHE CB C 78 39.164 39.164 36.281 2.883 25485 17473 1 14 . 1 1 78 78 PHE H H 78 7.827 7.827 7.975 -0.148 25485 17474 1 14 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.207 0.149 25485 17475 1 14 . 1 1 79 79 PRO C C 79 176.433 176.433 176.411 0.022 25485 17476 1 14 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.055 1.795 25485 17477 1 14 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.476 -0.784 25485 17478 1 14 . 1 1 80 80 ASN N N 80 118.057 118.057 119.529 -1.472 25485 17479 1 14 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.649 -0.002 25485 17480 1 14 . 1 1 80 80 ASN C C 80 174.305 174.305 174.909 -0.604 25485 17481 1 14 . 1 1 80 80 ASN CA C 80 52.860 52.860 53.213 -0.353 25485 17482 1 14 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.397 1.186 25485 17483 1 14 . 1 1 80 80 ASN H H 80 8.068 8.068 8.445 -0.377 25485 17484 1 14 . 1 1 81 81 SER HA H 81 4.565 4.565 4.235 0.330 25485 17485 1 14 . 1 1 81 81 SER CA C 81 56.800 56.800 57.823 -1.023 25485 17486 1 14 . 1 1 81 81 SER CB C 81 63.128 63.128 63.639 -0.511 25485 17487 1 14 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.310 0.151 25485 17488 1 14 . 1 1 82 82 PRO C C 82 174.589 174.589 176.680 -2.091 25485 17489 1 14 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.866 -1.220 25485 17490 1 14 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.058 -0.804 25485 17491 1 14 . 1 1 83 83 LYS N N 83 114.578 114.578 119.027 -4.449 25485 17492 1 14 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.472 -0.319 25485 17493 1 14 . 1 1 83 83 LYS C C 83 175.308 175.308 176.744 -1.436 25485 17494 1 14 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.598 -1.191 25485 17495 1 14 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.631 0.787 25485 17496 1 14 . 1 1 83 83 LYS H H 83 7.356 7.356 7.496 -0.140 25485 17497 1 14 . 1 1 84 84 TRP N N 84 122.455 122.455 121.253 1.202 25485 17498 1 14 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.533 -0.513 25485 17499 1 14 . 1 1 84 84 TRP C C 84 177.636 177.636 177.830 -0.194 25485 17500 1 14 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.229 -0.758 25485 17501 1 14 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.906 0.412 25485 17502 1 14 . 1 1 84 84 TRP H H 84 8.050 8.050 8.427 -0.377 25485 17503 1 14 . 1 1 85 85 THR N N 85 113.501 113.501 115.887 -2.386 25485 17504 1 14 . 1 1 85 85 THR HA H 85 4.573 4.573 4.413 0.160 25485 17505 1 14 . 1 1 85 85 THR C C 85 174.757 174.757 174.849 -0.092 25485 17506 1 14 . 1 1 85 85 THR CA C 85 62.130 62.130 62.173 -0.043 25485 17507 1 14 . 1 1 85 85 THR CB C 85 69.107 69.107 69.540 -0.433 25485 17508 1 14 . 1 1 85 85 THR H H 85 8.861 8.861 8.756 0.105 25485 17509 1 14 . 1 1 86 86 SER N N 86 117.270 117.270 118.144 -0.874 25485 17510 1 14 . 1 1 86 86 SER HA H 86 4.741 4.741 4.617 0.124 25485 17511 1 14 . 1 1 86 86 SER C C 86 173.457 173.457 174.373 -0.916 25485 17512 1 14 . 1 1 86 86 SER CA C 86 56.739 56.739 57.996 -1.257 25485 17513 1 14 . 1 1 86 86 SER CB C 86 64.717 64.717 64.238 0.479 25485 17514 1 14 . 1 1 86 86 SER H H 86 7.743 7.743 8.050 -0.307 25485 17515 1 14 . 1 1 87 87 LYS N N 87 120.329 120.329 120.419 -0.090 25485 17516 1 14 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.158 0.071 25485 17517 1 14 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.495 0.097 25485 17518 1 14 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.476 -0.353 25485 17519 1 14 . 1 1 87 87 LYS H H 87 8.285 8.285 8.529 -0.244 25485 17520 1 14 . 1 1 88 88 VAL N N 88 117.531 117.531 116.292 1.239 25485 17521 1 14 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.434 0.221 25485 17522 1 14 . 1 1 88 88 VAL C C 88 174.868 174.868 174.102 0.766 25485 17523 1 14 . 1 1 88 88 VAL CA C 88 60.095 60.095 59.506 0.589 25485 17524 1 14 . 1 1 88 88 VAL CB C 88 33.695 33.695 34.136 -0.441 25485 17525 1 14 . 1 1 88 88 VAL H H 88 7.428 7.428 7.257 0.171 25485 17526 1 14 . 1 1 89 89 VAL N N 89 131.452 131.452 126.580 4.872 25485 17527 1 14 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.050 0.109 25485 17528 1 14 . 1 1 89 89 VAL C C 89 175.758 175.758 175.088 0.670 25485 17529 1 14 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.087 0.634 25485 17530 1 14 . 1 1 89 89 VAL CB C 89 34.173 34.173 33.813 0.360 25485 17531 1 14 . 1 1 89 89 VAL H H 89 8.603 8.603 8.102 0.501 25485 17532 1 14 . 1 1 90 90 THR N N 90 118.206 118.206 116.626 1.580 25485 17533 1 14 . 1 1 90 90 THR HA H 90 5.649 5.649 5.390 0.259 25485 17534 1 14 . 1 1 90 90 THR C C 90 174.579 174.579 173.612 0.967 25485 17535 1 14 . 1 1 90 90 THR CA C 90 58.959 58.959 59.151 -0.192 25485 17536 1 14 . 1 1 90 90 THR CB C 90 72.288 72.288 72.328 -0.040 25485 17537 1 14 . 1 1 90 90 THR H H 90 9.021 9.021 8.164 0.857 25485 17538 1 14 . 1 1 91 91 TYR N N 91 118.117 118.117 115.471 2.646 25485 17539 1 14 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.657 0.041 25485 17540 1 14 . 1 1 91 91 TYR C C 91 171.233 171.233 172.870 -1.637 25485 17541 1 14 . 1 1 91 91 TYR CA C 91 55.432 55.432 56.033 -0.601 25485 17542 1 14 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.228 1.032 25485 17543 1 14 . 1 1 91 91 TYR H H 91 8.555 8.555 8.201 0.354 25485 17544 1 14 . 1 1 92 92 ARG N N 92 120.252 120.252 119.986 0.266 25485 17545 1 14 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.614 0.083 25485 17546 1 14 . 1 1 92 92 ARG C C 92 173.932 173.932 174.516 -0.584 25485 17547 1 14 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.652 0.189 25485 17548 1 14 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.658 0.028 25485 17549 1 14 . 1 1 92 92 ARG H H 92 8.520 8.520 9.100 -0.580 25485 17550 1 14 . 1 1 93 93 ILE N N 93 128.305 128.305 127.710 0.595 25485 17551 1 14 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.424 0.208 25485 17552 1 14 . 1 1 93 93 ILE C C 93 175.468 175.468 176.392 -0.924 25485 17553 1 14 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.000 1.228 25485 17554 1 14 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.590 0.635 25485 17555 1 14 . 1 1 93 93 ILE H H 93 8.886 8.886 8.812 0.075 25485 17556 1 14 . 1 1 94 94 VAL N N 94 126.647 126.647 128.297 -1.650 25485 17557 1 14 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.151 -0.155 25485 17558 1 14 . 1 1 94 94 VAL C C 94 175.670 175.670 176.543 -0.873 25485 17559 1 14 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.430 -0.016 25485 17560 1 14 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.395 0.624 25485 17561 1 14 . 1 1 94 94 VAL H H 94 9.517 9.517 8.884 0.633 25485 17562 1 14 . 1 1 95 95 SER N N 95 113.398 113.398 112.629 0.769 25485 17563 1 14 . 1 1 95 95 SER HA H 95 4.701 4.701 4.760 -0.059 25485 17564 1 14 . 1 1 95 95 SER C C 95 170.684 170.684 172.703 -2.019 25485 17565 1 14 . 1 1 95 95 SER CA C 95 56.945 56.945 57.587 -0.642 25485 17566 1 14 . 1 1 95 95 SER CB C 95 65.276 65.276 65.418 -0.142 25485 17567 1 14 . 1 1 95 95 SER H H 95 7.463 7.463 7.649 -0.186 25485 17568 1 14 . 1 1 96 96 TYR N N 96 116.512 116.512 119.154 -2.642 25485 17569 1 14 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.649 -0.385 25485 17570 1 14 . 1 1 96 96 TYR C C 96 174.856 174.856 174.200 0.656 25485 17571 1 14 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.414 2.223 25485 17572 1 14 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.560 1.603 25485 17573 1 14 . 1 1 96 96 TYR H H 96 8.240 8.240 8.269 -0.029 25485 17574 1 14 . 1 1 97 97 THR CA C 97 57.798 57.798 60.079 -2.281 25485 17575 1 14 . 1 1 97 97 THR CB C 97 67.420 67.420 69.414 -1.994 25485 17576 1 14 . 1 1 98 98 ARG N N 98 128.156 128.156 124.848 3.308 25485 17577 1 14 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.073 0.252 25485 17578 1 14 . 1 1 98 98 ARG C C 98 177.625 177.625 176.363 1.262 25485 17579 1 14 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.397 -1.183 25485 17580 1 14 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.963 -0.483 25485 17581 1 14 . 1 1 98 98 ARG H H 98 8.914 8.914 8.500 0.414 25485 17582 1 14 . 1 1 99 99 ASP N N 99 120.592 120.592 117.525 3.067 25485 17583 1 14 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.590 -0.209 25485 17584 1 14 . 1 1 99 99 ASP C C 99 175.679 175.679 175.414 0.265 25485 17585 1 14 . 1 1 99 99 ASP CA C 99 56.436 56.436 55.109 1.327 25485 17586 1 14 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.636 0.734 25485 17587 1 14 . 1 1 99 99 ASP H H 99 8.708 8.708 7.974 0.734 25485 17588 1 14 . 1 1 100 100 LEU N N 100 116.829 116.829 118.984 -2.155 25485 17589 1 14 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.748 0.208 25485 17590 1 14 . 1 1 100 100 LEU C C 100 173.335 173.335 173.991 -0.656 25485 17591 1 14 . 1 1 100 100 LEU CA C 100 51.037 51.037 52.052 -1.015 25485 17592 1 14 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.529 1.738 25485 17593 1 14 . 1 1 100 100 LEU H H 100 6.916 6.916 7.370 -0.454 25485 17594 1 14 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.204 -0.029 25485 17595 1 14 . 1 1 102 102 HIS C C 102 177.649 177.649 177.619 0.030 25485 17596 1 14 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.241 -0.568 25485 17597 1 14 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.114 -1.680 25485 17598 1 14 . 1 1 103 103 ILE N N 103 115.170 115.170 118.071 -2.901 25485 17599 1 14 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.884 0.289 25485 17600 1 14 . 1 1 103 103 ILE C C 103 177.214 177.214 177.147 0.067 25485 17601 1 14 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.218 -1.053 25485 17602 1 14 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.930 -0.165 25485 17603 1 14 . 1 1 103 103 ILE H H 103 8.234 8.234 8.173 0.061 25485 17604 1 14 . 1 1 104 104 THR N N 104 119.374 119.374 117.421 1.953 25485 17605 1 14 . 1 1 104 104 THR HA H 104 4.045 4.045 4.019 0.026 25485 17606 1 14 . 1 1 104 104 THR C C 104 175.612 175.612 176.473 -0.861 25485 17607 1 14 . 1 1 104 104 THR CA C 104 66.568 66.568 67.173 -0.605 25485 17608 1 14 . 1 1 104 104 THR CB C 104 68.077 68.077 68.478 -0.401 25485 17609 1 14 . 1 1 104 104 THR H H 104 6.947 6.947 7.786 -0.839 25485 17610 1 14 . 1 1 105 105 VAL N N 105 123.263 123.263 120.940 2.323 25485 17611 1 14 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.152 0.286 25485 17612 1 14 . 1 1 105 105 VAL C C 105 177.322 177.322 177.383 -0.061 25485 17613 1 14 . 1 1 105 105 VAL CA C 105 67.947 67.947 66.257 1.690 25485 17614 1 14 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.147 0.122 25485 17615 1 14 . 1 1 105 105 VAL H H 105 7.407 7.407 8.043 -0.636 25485 17616 1 14 . 1 1 106 106 ASP N N 106 119.972 119.972 119.656 0.316 25485 17617 1 14 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.482 -0.160 25485 17618 1 14 . 1 1 106 106 ASP C C 106 179.747 179.747 178.545 1.202 25485 17619 1 14 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.387 0.848 25485 17620 1 14 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.907 -0.545 25485 17621 1 14 . 1 1 106 106 ASP H H 106 8.627 8.627 7.916 0.711 25485 17622 1 14 . 1 1 107 107 ARG N N 107 121.033 121.033 119.313 1.720 25485 17623 1 14 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.135 0.043 25485 17624 1 14 . 1 1 107 107 ARG C C 107 179.485 179.485 178.524 0.961 25485 17625 1 14 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.637 0.943 25485 17626 1 14 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.390 0.818 25485 17627 1 14 . 1 1 107 107 ARG H H 107 8.356 8.356 7.946 0.410 25485 17628 1 14 . 1 1 108 108 LEU N N 108 121.463 121.463 120.548 0.915 25485 17629 1 14 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.182 0.123 25485 17630 1 14 . 1 1 108 108 LEU C C 108 178.852 178.852 178.969 -0.117 25485 17631 1 14 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.374 0.508 25485 17632 1 14 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.328 -0.013 25485 17633 1 14 . 1 1 108 108 LEU H H 108 8.790 8.790 7.749 1.041 25485 17634 1 14 . 1 1 109 109 VAL N N 109 120.233 120.233 116.730 3.503 25485 17635 1 14 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.658 -0.258 25485 17636 1 14 . 1 1 109 109 VAL C C 109 177.019 177.019 177.502 -0.483 25485 17637 1 14 . 1 1 109 109 VAL CA C 109 68.046 68.046 67.169 0.877 25485 17638 1 14 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.471 -0.282 25485 17639 1 14 . 1 1 109 109 VAL H H 109 8.787 8.787 8.043 0.744 25485 17640 1 14 . 1 1 110 110 SER N N 110 112.862 112.862 115.364 -2.502 25485 17641 1 14 . 1 1 110 110 SER HA H 110 4.300 4.300 3.871 0.429 25485 17642 1 14 . 1 1 110 110 SER C C 110 176.770 176.770 176.655 0.115 25485 17643 1 14 . 1 1 110 110 SER CA C 110 61.744 61.744 61.237 0.507 25485 17644 1 14 . 1 1 110 110 SER CB C 110 62.742 62.742 62.724 0.018 25485 17645 1 14 . 1 1 110 110 SER H H 110 7.605 7.605 7.841 -0.236 25485 17646 1 14 . 1 1 111 111 LYS N N 111 122.319 122.319 121.664 0.655 25485 17647 1 14 . 1 1 111 111 LYS HA H 111 4.061 4.061 3.996 0.065 25485 17648 1 14 . 1 1 111 111 LYS C C 111 178.309 178.309 178.161 0.148 25485 17649 1 14 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.208 0.606 25485 17650 1 14 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.435 0.074 25485 17651 1 14 . 1 1 111 111 LYS H H 111 8.156 8.156 7.735 0.421 25485 17652 1 14 . 1 1 112 112 ALA N N 112 124.147 124.147 120.437 3.710 25485 17653 1 14 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.231 -0.132 25485 17654 1 14 . 1 1 112 112 ALA C C 112 179.445 179.445 178.672 0.773 25485 17655 1 14 . 1 1 112 112 ALA CA C 112 55.226 55.226 53.878 1.348 25485 17656 1 14 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.276 0.698 25485 17657 1 14 . 1 1 112 112 ALA H H 112 8.278 8.278 7.363 0.915 25485 17658 1 14 . 1 1 113 113 LEU N N 113 116.195 116.195 120.452 -4.257 25485 17659 1 14 . 1 1 113 113 LEU HA H 113 3.751 3.751 3.983 -0.232 25485 17660 1 14 . 1 1 113 113 LEU C C 113 179.537 179.537 177.549 1.988 25485 17661 1 14 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.848 -0.104 25485 17662 1 14 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.841 -1.286 25485 17663 1 14 . 1 1 113 113 LEU H H 113 8.021 8.021 8.471 -0.450 25485 17664 1 14 . 1 1 114 114 ASN N N 114 116.570 116.570 117.047 -0.477 25485 17665 1 14 . 1 1 114 114 ASN HA H 114 4.546 4.546 3.933 0.613 25485 17666 1 14 . 1 1 114 114 ASN C C 114 177.136 177.136 177.160 -0.024 25485 17667 1 14 . 1 1 114 114 ASN CA C 114 55.764 55.764 55.976 -0.212 25485 17668 1 14 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.348 0.275 25485 17669 1 14 . 1 1 114 114 ASN H H 114 8.212 8.212 7.949 0.263 25485 17670 1 14 . 1 1 115 115 MET N N 115 122.055 122.055 119.559 2.496 25485 17671 1 14 . 1 1 115 115 MET HA H 115 4.010 4.010 3.948 0.062 25485 17672 1 14 . 1 1 115 115 MET C C 115 177.681 177.681 177.842 -0.161 25485 17673 1 14 . 1 1 115 115 MET CA C 115 59.445 59.445 58.977 0.468 25485 17674 1 14 . 1 1 115 115 MET CB C 115 31.616 31.616 32.096 -0.480 25485 17675 1 14 . 1 1 115 115 MET H H 115 7.937 7.937 7.656 0.281 25485 17676 1 14 . 1 1 116 116 TRP N N 116 117.115 117.115 118.729 -1.614 25485 17677 1 14 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.219 0.299 25485 17678 1 14 . 1 1 116 116 TRP C C 116 179.054 179.054 179.320 -0.266 25485 17679 1 14 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.039 0.471 25485 17680 1 14 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.232 1.641 25485 17681 1 14 . 1 1 116 116 TRP H H 116 6.783 6.783 7.282 -0.499 25485 17682 1 14 . 1 1 117 117 GLY N N 117 104.511 104.511 106.348 -1.837 25485 17683 1 14 . 1 1 117 117 GLY C C 117 175.035 175.035 176.156 -1.121 25485 17684 1 14 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.762 0.235 25485 17685 1 14 . 1 1 117 117 GLY H H 117 9.302 9.302 7.642 1.660 25485 17686 1 14 . 1 1 118 118 LYS N N 118 118.580 118.580 119.672 -1.092 25485 17687 1 14 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.104 0.103 25485 17688 1 14 . 1 1 118 118 LYS C C 118 177.235 177.235 177.272 -0.037 25485 17689 1 14 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.784 0.107 25485 17690 1 14 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.061 -0.156 25485 17691 1 14 . 1 1 118 118 LYS H H 118 7.940 7.940 7.984 -0.044 25485 17692 1 14 . 1 1 119 119 GLU N N 119 113.749 113.749 116.914 -3.165 25485 17693 1 14 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.489 0.349 25485 17694 1 14 . 1 1 119 119 GLU C C 119 178.024 178.024 175.526 2.498 25485 17695 1 14 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.849 -0.574 25485 17696 1 14 . 1 1 119 119 GLU CB C 119 30.686 30.686 30.101 0.585 25485 17697 1 14 . 1 1 119 119 GLU H H 119 7.763 7.763 7.539 0.224 25485 17698 1 14 . 1 1 120 120 ILE N N 120 111.144 111.144 112.879 -1.735 25485 17699 1 14 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.720 0.651 25485 17700 1 14 . 1 1 120 120 ILE C C 120 174.033 174.033 173.534 0.499 25485 17701 1 14 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.524 0.930 25485 17702 1 14 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.544 2.385 25485 17703 1 14 . 1 1 120 120 ILE H H 120 7.518 7.518 7.625 -0.107 25485 17704 1 14 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.397 0.265 25485 17705 1 14 . 1 1 121 121 PRO C C 121 174.784 174.784 177.022 -2.238 25485 17706 1 14 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.630 -1.615 25485 17707 1 14 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.765 -2.380 25485 17708 1 14 . 1 1 122 122 LEU N N 122 121.531 121.531 119.321 2.210 25485 17709 1 14 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.247 0.092 25485 17710 1 14 . 1 1 122 122 LEU C C 122 173.977 173.977 176.369 -2.392 25485 17711 1 14 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.685 -1.127 25485 17712 1 14 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.860 2.539 25485 17713 1 14 . 1 1 122 122 LEU H H 122 6.847 6.847 7.602 -0.755 25485 17714 1 14 . 1 1 123 123 HIS N N 123 121.054 121.054 115.162 5.892 25485 17715 1 14 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.787 -0.180 25485 17716 1 14 . 1 1 123 123 HIS C C 123 172.820 172.820 173.059 -0.239 25485 17717 1 14 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.454 -0.945 25485 17718 1 14 . 1 1 123 123 HIS CB C 123 33.110 33.110 33.066 0.044 25485 17719 1 14 . 1 1 123 123 HIS H H 123 7.760 7.760 8.270 -0.510 25485 17720 1 14 . 1 1 124 124 PHE N N 124 120.465 120.465 121.839 -1.374 25485 17721 1 14 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.291 0.543 25485 17722 1 14 . 1 1 124 124 PHE C C 124 175.677 175.677 174.970 0.707 25485 17723 1 14 . 1 1 124 124 PHE CA C 124 56.292 56.292 57.029 -0.737 25485 17724 1 14 . 1 1 124 124 PHE CB C 124 41.822 41.822 42.828 -1.006 25485 17725 1 14 . 1 1 124 124 PHE H H 124 8.306 8.306 8.472 -0.166 25485 17726 1 14 . 1 1 125 125 ARG N N 125 124.008 124.008 123.312 0.696 25485 17727 1 14 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.815 -0.104 25485 17728 1 14 . 1 1 125 125 ARG C C 125 172.901 172.901 175.291 -2.390 25485 17729 1 14 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.807 -0.533 25485 17730 1 14 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.231 -0.409 25485 17731 1 14 . 1 1 125 125 ARG H H 125 8.426 8.426 8.665 -0.239 25485 17732 1 14 . 1 1 126 126 LYS N N 126 130.004 130.004 124.320 5.684 25485 17733 1 14 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.263 -0.880 25485 17734 1 14 . 1 1 126 126 LYS C C 126 176.126 176.126 175.538 0.588 25485 17735 1 14 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.477 0.704 25485 17736 1 14 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.790 -0.763 25485 17737 1 14 . 1 1 126 126 LYS H H 126 8.481 8.481 8.570 -0.089 25485 17738 1 14 . 1 1 127 127 VAL N N 127 125.288 125.288 120.770 4.518 25485 17739 1 14 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.212 0.293 25485 17740 1 14 . 1 1 127 127 VAL C C 127 175.565 175.565 174.927 0.638 25485 17741 1 14 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.530 -1.581 25485 17742 1 14 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.020 2.342 25485 17743 1 14 . 1 1 127 127 VAL H H 127 8.721 8.721 8.065 0.656 25485 17744 1 14 . 1 1 128 128 VAL N N 128 117.467 117.467 118.722 -1.255 25485 17745 1 14 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.116 0.213 25485 17746 1 14 . 1 1 128 128 VAL C C 128 174.622 174.622 174.690 -0.068 25485 17747 1 14 . 1 1 128 128 VAL CA C 128 62.118 62.118 60.482 1.636 25485 17748 1 14 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.939 0.571 25485 17749 1 14 . 1 1 128 128 VAL H H 128 8.406 8.406 7.990 0.416 25485 17750 1 14 . 1 1 129 129 TRP N N 129 119.986 119.986 121.862 -1.876 25485 17751 1 14 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.857 -0.141 25485 17752 1 14 . 1 1 129 129 TRP C C 129 174.536 174.536 176.447 -1.911 25485 17753 1 14 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.875 -0.958 25485 17754 1 14 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.512 2.502 25485 17755 1 14 . 1 1 129 129 TRP H H 129 7.435 7.435 7.283 0.152 25485 17756 1 14 . 1 1 130 130 GLY N N 130 109.900 109.900 112.893 -2.993 25485 17757 1 14 . 1 1 130 130 GLY C C 130 173.187 173.187 173.682 -0.495 25485 17758 1 14 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.436 0.044 25485 17759 1 14 . 1 1 130 130 GLY H H 130 8.006 8.006 8.403 -0.397 25485 17760 1 14 . 1 1 131 131 THR N N 131 116.142 116.142 115.707 0.435 25485 17761 1 14 . 1 1 131 131 THR HA H 131 4.162 4.162 4.502 -0.340 25485 17762 1 14 . 1 1 131 131 THR C C 131 172.766 172.766 173.386 -0.620 25485 17763 1 14 . 1 1 131 131 THR CA C 131 63.212 63.212 60.999 2.213 25485 17764 1 14 . 1 1 131 131 THR CB C 131 69.308 69.308 70.063 -0.755 25485 17765 1 14 . 1 1 131 131 THR H H 131 8.233 8.233 8.152 0.081 25485 17766 1 14 . 1 1 132 132 ALA N N 132 129.807 129.807 124.142 5.665 25485 17767 1 14 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.576 -0.060 25485 17768 1 14 . 1 1 132 132 ALA C C 132 175.358 175.358 176.268 -0.910 25485 17769 1 14 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.720 -1.354 25485 17770 1 14 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.278 1.520 25485 17771 1 14 . 1 1 132 132 ALA H H 132 7.962 7.962 8.514 -0.552 25485 17772 1 14 . 1 1 133 133 ASP N N 133 122.896 122.896 119.853 3.043 25485 17773 1 14 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.581 -0.160 25485 17774 1 14 . 1 1 133 133 ASP C C 133 177.314 177.314 177.012 0.302 25485 17775 1 14 . 1 1 133 133 ASP CA C 133 57.919 57.919 57.301 0.618 25485 17776 1 14 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.740 -1.269 25485 17777 1 14 . 1 1 133 133 ASP H H 133 8.251 8.251 8.542 -0.291 25485 17778 1 14 . 1 1 134 134 ILE N N 134 125.472 125.472 121.412 4.060 25485 17779 1 14 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.423 -0.280 25485 17780 1 14 . 1 1 134 134 ILE C C 134 174.201 174.201 175.044 -0.843 25485 17781 1 14 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.599 -0.328 25485 17782 1 14 . 1 1 134 134 ILE CB C 134 38.710 38.710 38.660 0.050 25485 17783 1 14 . 1 1 134 134 ILE H H 134 8.802 8.802 8.206 0.596 25485 17784 1 14 . 1 1 135 135 MET N N 135 127.265 127.265 126.969 0.296 25485 17785 1 14 . 1 1 135 135 MET HA H 135 5.192 5.192 5.461 -0.269 25485 17786 1 14 . 1 1 135 135 MET C C 135 176.206 176.206 175.624 0.582 25485 17787 1 14 . 1 1 135 135 MET CA C 135 53.626 53.626 52.222 1.404 25485 17788 1 14 . 1 1 135 135 MET CB C 135 32.639 32.639 33.860 -1.221 25485 17789 1 14 . 1 1 135 135 MET H H 135 7.418 7.418 8.400 -0.982 25485 17790 1 14 . 1 1 136 136 ILE N N 136 125.440 125.440 124.366 1.074 25485 17791 1 14 . 1 1 136 136 ILE HA H 136 5.589 5.589 5.012 0.577 25485 17792 1 14 . 1 1 136 136 ILE C C 136 175.190 175.190 175.939 -0.749 25485 17793 1 14 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.749 1.359 25485 17794 1 14 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.905 4.035 25485 17795 1 14 . 1 1 136 136 ILE H H 136 9.124 9.124 8.945 0.179 25485 17796 1 14 . 1 1 137 137 GLY N N 137 112.211 112.211 114.755 -2.544 25485 17797 1 14 . 1 1 137 137 GLY C C 137 170.855 170.855 171.654 -0.799 25485 17798 1 14 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.867 1.538 25485 17799 1 14 . 1 1 137 137 GLY H H 137 8.594 8.594 8.139 0.455 25485 17800 1 14 . 1 1 138 138 PHE N N 138 119.463 119.463 119.062 0.401 25485 17801 1 14 . 1 1 138 138 PHE HA H 138 5.496 5.496 4.957 0.539 25485 17802 1 14 . 1 1 138 138 PHE C C 138 175.186 175.186 175.621 -0.435 25485 17803 1 14 . 1 1 138 138 PHE CA C 138 55.995 55.995 56.999 -1.004 25485 17804 1 14 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.008 0.434 25485 17805 1 14 . 1 1 138 138 PHE H H 138 7.857 7.857 8.522 -0.665 25485 17806 1 14 . 1 1 139 139 ALA N N 139 123.914 123.914 125.939 -2.025 25485 17807 1 14 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.566 0.165 25485 17808 1 14 . 1 1 139 139 ALA C C 139 174.613 174.613 174.899 -0.286 25485 17809 1 14 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.241 -1.206 25485 17810 1 14 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.986 1.486 25485 17811 1 14 . 1 1 139 139 ALA H H 139 8.955 8.955 8.637 0.318 25485 17812 1 14 . 1 1 140 140 ARG N N 140 118.339 118.339 118.572 -0.233 25485 17813 1 14 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.772 0.334 25485 17814 1 14 . 1 1 140 140 ARG C C 140 176.201 176.201 176.622 -0.421 25485 17815 1 14 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.283 -0.117 25485 17816 1 14 . 1 1 140 140 ARG CB C 140 33.469 33.469 33.324 0.145 25485 17817 1 14 . 1 1 140 140 ARG H H 140 8.546 8.546 8.632 -0.086 25485 17818 1 14 . 1 1 141 141 GLY N N 141 108.916 108.916 109.412 -0.496 25485 17819 1 14 . 1 1 141 141 GLY C C 141 175.595 175.595 175.353 0.242 25485 17820 1 14 . 1 1 141 141 GLY CA C 141 46.290 46.290 46.940 -0.650 25485 17821 1 14 . 1 1 141 141 GLY H H 141 8.989 8.989 8.378 0.611 25485 17822 1 14 . 1 1 142 142 ALA N N 142 121.448 121.448 126.562 -5.114 25485 17823 1 14 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.228 0.180 25485 17824 1 14 . 1 1 142 142 ALA C C 142 177.027 177.027 177.508 -0.481 25485 17825 1 14 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.346 0.931 25485 17826 1 14 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.317 -0.353 25485 17827 1 14 . 1 1 142 142 ALA H H 142 8.642 8.642 8.013 0.629 25485 17828 1 14 . 1 1 143 143 HIS N N 143 120.356 120.356 116.637 3.719 25485 17829 1 14 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.366 0.791 25485 17830 1 14 . 1 1 143 143 HIS C C 143 174.303 174.303 176.195 -1.892 25485 17831 1 14 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.643 -1.190 25485 17832 1 14 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.730 -1.939 25485 17833 1 14 . 1 1 143 143 HIS H H 143 8.990 8.990 7.834 1.156 25485 17834 1 14 . 1 1 144 144 GLY N N 144 112.517 112.517 107.065 5.452 25485 17835 1 14 . 1 1 144 144 GLY C C 144 173.758 173.758 173.192 0.566 25485 17836 1 14 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.607 1.488 25485 17837 1 14 . 1 1 144 144 GLY H H 144 5.175 5.175 7.765 -2.590 25485 17838 1 14 . 1 1 145 145 ASP N N 145 117.762 117.762 118.117 -0.355 25485 17839 1 14 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.604 0.094 25485 17840 1 14 . 1 1 145 145 ASP C C 145 175.851 175.851 174.510 1.341 25485 17841 1 14 . 1 1 145 145 ASP CA C 145 51.959 51.959 53.270 -1.311 25485 17842 1 14 . 1 1 145 145 ASP CB C 145 41.799 41.799 40.756 1.043 25485 17843 1 14 . 1 1 145 145 ASP H H 145 7.096 7.096 7.595 -0.499 25485 17844 1 14 . 1 1 146 146 SER N N 146 125.540 125.540 115.744 9.796 25485 17845 1 14 . 1 1 146 146 SER HA H 146 4.204 4.204 4.430 -0.226 25485 17846 1 14 . 1 1 146 146 SER C C 146 172.319 172.319 174.139 -1.820 25485 17847 1 14 . 1 1 146 146 SER CA C 146 58.862 58.862 58.564 0.298 25485 17848 1 14 . 1 1 146 146 SER CB C 146 62.933 62.933 63.767 -0.835 25485 17849 1 14 . 1 1 146 146 SER H H 146 8.261 8.261 8.314 -0.053 25485 17850 1 14 . 1 1 147 147 TYR N N 147 120.757 120.757 119.472 1.285 25485 17851 1 14 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.267 0.555 25485 17852 1 14 . 1 1 147 147 TYR C C 147 170.372 170.372 173.742 -3.370 25485 17853 1 14 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.553 -4.285 25485 17854 1 14 . 1 1 147 147 TYR CB C 147 38.296 38.296 37.655 0.641 25485 17855 1 14 . 1 1 147 147 TYR H H 147 7.450 7.450 8.407 -0.957 25485 17856 1 14 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.316 0.556 25485 17857 1 14 . 1 1 148 148 PRO C C 148 179.009 179.009 177.571 1.438 25485 17858 1 14 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.076 1.299 25485 17859 1 14 . 1 1 148 148 PRO CB C 148 30.909 30.909 31.989 -1.080 25485 17860 1 14 . 1 1 149 149 PHE N N 149 120.514 120.514 117.979 2.535 25485 17861 1 14 . 1 1 149 149 PHE C C 149 176.813 176.813 175.756 1.057 25485 17862 1 14 . 1 1 149 149 PHE CA C 149 58.453 58.453 58.461 -0.008 25485 17863 1 14 . 1 1 149 149 PHE CB C 149 38.573 38.573 37.827 0.746 25485 17864 1 14 . 1 1 149 149 PHE H H 149 8.024 8.024 7.486 0.538 25485 17865 1 14 . 1 1 150 150 ASP N N 150 115.555 115.555 117.673 -2.118 25485 17866 1 14 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.438 0.401 25485 17867 1 14 . 1 1 150 150 ASP C C 150 177.007 177.007 176.278 0.729 25485 17868 1 14 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.864 -0.993 25485 17869 1 14 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.711 2.225 25485 17870 1 14 . 1 1 150 150 ASP H H 150 7.511 7.511 8.412 -0.901 25485 17871 1 14 . 1 1 151 151 GLY N N 151 110.650 110.650 108.676 1.974 25485 17872 1 14 . 1 1 151 151 GLY C C 151 170.281 170.281 171.892 -1.611 25485 17873 1 14 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.644 -0.246 25485 17874 1 14 . 1 1 151 151 GLY H H 151 9.080 9.080 8.482 0.598 25485 17875 1 14 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.123 -0.067 25485 17876 1 14 . 1 1 152 152 PRO C C 152 178.300 178.300 176.792 1.508 25485 17877 1 14 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.107 0.743 25485 17878 1 14 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.916 -0.656 25485 17879 1 14 . 1 1 153 153 GLY N N 153 118.783 118.783 113.341 5.442 25485 17880 1 14 . 1 1 153 153 GLY C C 153 174.098 174.098 173.686 0.412 25485 17881 1 14 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.483 -0.877 25485 17882 1 14 . 1 1 153 153 GLY H H 153 11.431 11.431 8.067 3.364 25485 17883 1 14 . 1 1 154 154 ASN N N 154 120.679 120.679 123.053 -2.374 25485 17884 1 14 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.361 -0.117 25485 17885 1 14 . 1 1 154 154 ASN C C 154 174.636 174.636 175.009 -0.373 25485 17886 1 14 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.567 2.101 25485 17887 1 14 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.478 -1.507 25485 17888 1 14 . 1 1 154 154 ASN H H 154 9.247 9.247 8.542 0.705 25485 17889 1 14 . 1 1 155 155 THR N N 155 118.252 118.252 112.157 6.095 25485 17890 1 14 . 1 1 155 155 THR HA H 155 5.577 5.577 4.257 1.320 25485 17891 1 14 . 1 1 155 155 THR C C 155 176.596 176.596 172.998 3.598 25485 17892 1 14 . 1 1 155 155 THR CA C 155 61.731 61.731 63.307 -1.576 25485 17893 1 14 . 1 1 155 155 THR CB C 155 71.325 71.325 68.499 2.826 25485 17894 1 14 . 1 1 155 155 THR H H 155 9.501 9.501 8.473 1.028 25485 17895 1 14 . 1 1 156 156 LEU N N 156 122.598 122.598 125.288 -2.690 25485 17896 1 14 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.550 0.321 25485 17897 1 14 . 1 1 156 156 LEU C C 156 175.655 175.655 175.861 -0.206 25485 17898 1 14 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.058 -0.520 25485 17899 1 14 . 1 1 156 156 LEU CB C 156 44.511 44.511 43.154 1.357 25485 17900 1 14 . 1 1 156 156 LEU H H 156 8.492 8.492 8.379 0.113 25485 17901 1 14 . 1 1 157 157 ALA N N 157 115.389 115.389 115.706 -0.317 25485 17902 1 14 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.511 0.524 25485 17903 1 14 . 1 1 157 157 ALA C C 157 175.739 175.739 175.048 0.691 25485 17904 1 14 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.606 -0.667 25485 17905 1 14 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.748 1.706 25485 17906 1 14 . 1 1 157 157 ALA H H 157 7.567 7.567 7.706 -0.139 25485 17907 1 14 . 1 1 158 158 HIS N N 158 111.900 111.900 118.499 -6.599 25485 17908 1 14 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.746 -0.141 25485 17909 1 14 . 1 1 158 158 HIS C C 158 170.186 170.186 172.348 -2.162 25485 17910 1 14 . 1 1 158 158 HIS CA C 158 56.075 56.075 53.963 2.112 25485 17911 1 14 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.300 -1.114 25485 17912 1 14 . 1 1 158 158 HIS H H 158 8.757 8.757 7.928 0.829 25485 17913 1 14 . 1 1 159 159 ALA N N 159 118.286 118.286 126.146 -7.860 25485 17914 1 14 . 1 1 159 159 ALA HA H 159 4.654 4.654 3.872 0.782 25485 17915 1 14 . 1 1 159 159 ALA C C 159 174.036 174.036 175.514 -1.478 25485 17916 1 14 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.429 0.704 25485 17917 1 14 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.365 2.672 25485 17918 1 14 . 1 1 159 159 ALA H H 159 6.110 6.110 8.141 -2.031 25485 17919 1 14 . 1 1 160 160 PHE N N 160 117.937 117.937 119.301 -1.364 25485 17920 1 14 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.653 -0.150 25485 17921 1 14 . 1 1 160 160 PHE C C 160 174.455 174.455 175.067 -0.612 25485 17922 1 14 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.418 1.395 25485 17923 1 14 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.404 0.790 25485 17924 1 14 . 1 1 160 160 PHE H H 160 7.912 7.912 8.143 -0.231 25485 17925 1 14 . 1 1 161 161 ALA N N 161 123.531 123.531 122.912 0.619 25485 17926 1 14 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.591 -0.100 25485 17927 1 14 . 1 1 161 161 ALA C C 161 175.503 175.503 175.870 -0.367 25485 17928 1 14 . 1 1 161 161 ALA CA C 161 50.633 50.633 48.867 1.766 25485 17929 1 14 . 1 1 161 161 ALA CB C 161 16.556 16.556 18.948 -2.392 25485 17930 1 14 . 1 1 161 161 ALA H H 161 8.107 8.107 8.322 -0.215 25485 17931 1 14 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.153 -0.243 25485 17932 1 14 . 1 1 162 162 PRO C C 162 173.465 173.465 175.332 -1.867 25485 17933 1 14 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.209 2.048 25485 17934 1 14 . 1 1 162 162 PRO CB C 162 31.242 31.242 28.968 2.273 25485 17935 1 14 . 1 1 163 163 GLY N N 163 107.206 107.206 109.839 -2.633 25485 17936 1 14 . 1 1 163 163 GLY C C 163 172.092 172.092 172.437 -0.345 25485 17937 1 14 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.311 -0.318 25485 17938 1 14 . 1 1 163 163 GLY H H 163 5.997 5.997 7.800 -1.803 25485 17939 1 14 . 1 1 165 165 GLY N N 165 103.110 103.110 107.762 -4.652 25485 17940 1 14 . 1 1 165 165 GLY C C 165 177.158 177.158 175.680 1.478 25485 17941 1 14 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.939 -1.696 25485 17942 1 14 . 1 1 165 165 GLY H H 165 9.145 9.145 8.395 0.750 25485 17943 1 14 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.225 -0.046 25485 17944 1 14 . 1 1 166 166 LEU C C 166 176.437 176.437 177.462 -1.025 25485 17945 1 14 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.070 0.130 25485 17946 1 14 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.320 -0.486 25485 17947 1 14 . 1 1 167 167 GLY N N 167 103.318 103.318 104.322 -1.004 25485 17948 1 14 . 1 1 167 167 GLY C C 167 174.803 174.803 173.641 1.162 25485 17949 1 14 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.958 2.275 25485 17950 1 14 . 1 1 167 167 GLY H H 167 7.768 7.768 7.430 0.338 25485 17951 1 14 . 1 1 168 168 GLY N N 168 121.051 121.051 109.046 12.005 25485 17952 1 14 . 1 1 168 168 GLY C C 168 172.122 172.122 174.281 -2.159 25485 17953 1 14 . 1 1 168 168 GLY CA C 168 46.602 46.602 44.898 1.704 25485 17954 1 14 . 1 1 168 168 GLY H H 168 7.698 7.698 8.531 -0.833 25485 17955 1 14 . 1 1 169 169 ASP N N 169 123.641 123.641 120.661 2.980 25485 17956 1 14 . 1 1 169 169 ASP C C 169 173.942 173.942 173.620 0.322 25485 17957 1 14 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.914 1.928 25485 17958 1 14 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.507 -2.637 25485 17959 1 14 . 1 1 169 169 ASP H H 169 8.595 8.595 8.033 0.562 25485 17960 1 14 . 1 1 170 170 ALA N N 170 119.366 119.366 119.659 -0.293 25485 17961 1 14 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.243 0.487 25485 17962 1 14 . 1 1 170 170 ALA C C 170 174.593 174.593 174.725 -0.132 25485 17963 1 14 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.895 0.229 25485 17964 1 14 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.501 0.834 25485 17965 1 14 . 1 1 170 170 ALA H H 170 8.324 8.324 8.359 -0.035 25485 17966 1 14 . 1 1 171 171 HIS N N 171 120.239 120.239 120.676 -0.437 25485 17967 1 14 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.087 0.661 25485 17968 1 14 . 1 1 171 171 HIS C C 171 172.949 172.949 173.613 -0.664 25485 17969 1 14 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.183 -2.459 25485 17970 1 14 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.570 1.971 25485 17971 1 14 . 1 1 171 171 HIS H H 171 8.499 8.499 7.497 1.002 25485 17972 1 14 . 1 1 172 172 PHE N N 172 121.125 121.125 120.605 0.520 25485 17973 1 14 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.510 0.018 25485 17974 1 14 . 1 1 172 172 PHE C C 172 173.875 173.875 174.127 -0.252 25485 17975 1 14 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.618 0.302 25485 17976 1 14 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.045 0.858 25485 17977 1 14 . 1 1 172 172 PHE H H 172 8.445 8.445 8.251 0.194 25485 17978 1 14 . 1 1 173 173 ASP N N 173 124.014 124.014 122.785 1.229 25485 17979 1 14 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.887 -0.973 25485 17980 1 14 . 1 1 173 173 ASP C C 173 178.613 178.613 177.610 1.003 25485 17981 1 14 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.725 1.073 25485 17982 1 14 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.140 -0.397 25485 17983 1 14 . 1 1 173 173 ASP H H 173 7.927 7.927 8.633 -0.706 25485 17984 1 14 . 1 1 174 174 GLU N N 174 132.469 132.469 126.982 5.487 25485 17985 1 14 . 1 1 174 174 GLU C C 174 176.442 176.442 176.998 -0.556 25485 17986 1 14 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.831 -1.647 25485 17987 1 14 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.258 1.027 25485 17988 1 14 . 1 1 174 174 GLU H H 174 9.528 9.528 8.634 0.894 25485 17989 1 14 . 1 1 175 175 ASP N N 175 117.394 117.394 118.689 -1.295 25485 17990 1 14 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.646 0.147 25485 17991 1 14 . 1 1 175 175 ASP C C 175 176.645 176.645 177.048 -0.403 25485 17992 1 14 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.935 -0.004 25485 17993 1 14 . 1 1 175 175 ASP CB C 175 40.141 40.141 40.942 -0.801 25485 17994 1 14 . 1 1 175 175 ASP H H 175 8.768 8.768 8.659 0.109 25485 17995 1 14 . 1 1 176 176 GLU N N 176 116.493 116.493 118.643 -2.150 25485 17996 1 14 . 1 1 176 176 GLU C C 176 175.038 175.038 176.008 -0.970 25485 17997 1 14 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.916 -2.251 25485 17998 1 14 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.650 -4.427 25485 17999 1 14 . 1 1 176 176 GLU H H 176 7.159 7.159 8.326 -1.167 25485 18000 1 14 . 1 1 177 177 ARG N N 177 122.186 122.186 118.694 3.492 25485 18001 1 14 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.468 0.221 25485 18002 1 14 . 1 1 177 177 ARG C C 177 174.482 174.482 174.324 0.158 25485 18003 1 14 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.781 -1.094 25485 18004 1 14 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.404 -1.320 25485 18005 1 14 . 1 1 177 177 ARG H H 177 7.560 7.560 8.164 -0.604 25485 18006 1 14 . 1 1 178 178 TRP N N 178 129.179 129.179 124.220 4.959 25485 18007 1 14 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.346 -0.246 25485 18008 1 14 . 1 1 178 178 TRP C C 178 176.298 176.298 176.327 -0.029 25485 18009 1 14 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.079 0.734 25485 18010 1 14 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.235 -1.038 25485 18011 1 14 . 1 1 178 178 TRP H H 178 8.807 8.807 8.617 0.190 25485 18012 1 14 . 1 1 179 179 THR N N 179 112.792 112.792 113.600 -0.808 25485 18013 1 14 . 1 1 179 179 THR HA H 179 4.985 4.985 4.732 0.253 25485 18014 1 14 . 1 1 179 179 THR C C 179 172.765 172.765 172.319 0.446 25485 18015 1 14 . 1 1 179 179 THR CA C 179 59.106 59.106 61.205 -2.099 25485 18016 1 14 . 1 1 179 179 THR CB C 179 71.786 71.786 70.041 1.745 25485 18017 1 14 . 1 1 179 179 THR H H 179 8.974 8.974 8.733 0.241 25485 18018 1 14 . 1 1 180 180 ASP N N 180 122.074 122.074 124.792 -2.718 25485 18019 1 14 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.022 -0.559 25485 18020 1 14 . 1 1 180 180 ASP C C 180 176.366 176.366 178.493 -2.127 25485 18021 1 14 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.057 -2.014 25485 18022 1 14 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.157 -0.429 25485 18023 1 14 . 1 1 180 180 ASP H H 180 8.485 8.485 8.896 -0.411 25485 18024 1 14 . 1 1 181 181 GLY N N 181 110.123 110.123 108.837 1.286 25485 18025 1 14 . 1 1 181 181 GLY C C 181 174.325 174.325 175.382 -1.057 25485 18026 1 14 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.524 1.137 25485 18027 1 14 . 1 1 181 181 GLY H H 181 8.569 8.569 8.610 -0.041 25485 18028 1 14 . 1 1 182 182 SER N N 182 115.562 115.562 115.190 0.372 25485 18029 1 14 . 1 1 182 182 SER HA H 182 4.519 4.519 4.513 0.006 25485 18030 1 14 . 1 1 182 182 SER C C 182 173.783 173.783 174.508 -0.725 25485 18031 1 14 . 1 1 182 182 SER CA C 182 57.965 57.965 57.740 0.225 25485 18032 1 14 . 1 1 182 182 SER CB C 182 64.166 64.166 64.042 0.124 25485 18033 1 14 . 1 1 182 182 SER H H 182 8.160 8.160 7.684 0.476 25485 18034 1 14 . 1 1 183 183 SER N N 183 117.153 117.153 114.877 2.276 25485 18035 1 14 . 1 1 183 183 SER HA H 183 4.275 4.275 4.388 -0.113 25485 18036 1 14 . 1 1 183 183 SER C C 183 173.333 173.333 175.030 -1.697 25485 18037 1 14 . 1 1 183 183 SER CA C 183 59.902 59.902 59.260 0.642 25485 18038 1 14 . 1 1 183 183 SER CB C 183 64.941 64.941 62.685 2.256 25485 18039 1 14 . 1 1 183 183 SER H H 183 7.796 7.796 7.788 0.008 25485 18040 1 14 . 1 1 184 184 LEU N N 184 122.351 122.351 118.442 3.909 25485 18041 1 14 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.507 -0.115 25485 18042 1 14 . 1 1 184 184 LEU C C 184 176.250 176.250 176.722 -0.472 25485 18043 1 14 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.916 -0.341 25485 18044 1 14 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.512 -0.431 25485 18045 1 14 . 1 1 184 184 LEU H H 184 8.092 8.092 7.884 0.208 25485 18046 1 14 . 1 1 185 185 GLY N N 185 108.871 108.871 106.786 2.085 25485 18047 1 14 . 1 1 185 185 GLY C C 185 172.375 172.375 173.686 -1.311 25485 18048 1 14 . 1 1 185 185 GLY CA C 185 44.380 44.380 43.725 0.655 25485 18049 1 14 . 1 1 185 185 GLY H H 185 7.960 7.960 7.453 0.507 25485 18050 1 14 . 1 1 186 186 ILE N N 186 123.096 123.096 121.756 1.340 25485 18051 1 14 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.236 -0.395 25485 18052 1 14 . 1 1 186 186 ILE C C 186 175.350 175.350 176.291 -0.941 25485 18053 1 14 . 1 1 186 186 ILE CA C 186 58.401 58.401 58.848 -0.447 25485 18054 1 14 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.150 0.306 25485 18055 1 14 . 1 1 186 186 ILE H H 186 8.893 8.893 8.191 0.702 25485 18056 1 14 . 1 1 187 187 ASN N N 187 127.167 127.167 127.004 0.163 25485 18057 1 14 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.964 -0.611 25485 18058 1 14 . 1 1 187 187 ASN C C 187 175.849 175.849 177.086 -1.237 25485 18059 1 14 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.719 0.995 25485 18060 1 14 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.553 0.577 25485 18061 1 14 . 1 1 187 187 ASN H H 187 8.580 8.580 8.297 0.283 25485 18062 1 14 . 1 1 188 188 PHE N N 188 129.985 129.985 126.508 3.477 25485 18063 1 14 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.406 0.167 25485 18064 1 14 . 1 1 188 188 PHE C C 188 175.578 175.578 177.653 -2.075 25485 18065 1 14 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.281 -0.553 25485 18066 1 14 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.567 -0.135 25485 18067 1 14 . 1 1 188 188 PHE H H 188 9.361 9.361 8.498 0.863 25485 18068 1 14 . 1 1 189 189 LEU N N 189 119.113 119.113 119.039 0.074 25485 18069 1 14 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.167 -0.366 25485 18070 1 14 . 1 1 189 189 LEU C C 189 179.601 179.601 178.870 0.731 25485 18071 1 14 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.634 -0.125 25485 18072 1 14 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.199 -1.322 25485 18073 1 14 . 1 1 189 189 LEU H H 189 8.562 8.562 8.403 0.159 25485 18074 1 14 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.926 -0.009 25485 18075 1 14 . 1 1 190 190 TYR C C 190 177.621 177.621 177.977 -0.356 25485 18076 1 14 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.834 -0.026 25485 18077 1 14 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.162 2.607 25485 18078 1 14 . 1 1 191 191 ALA N N 191 120.352 120.352 121.359 -1.007 25485 18079 1 14 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.111 0.204 25485 18080 1 14 . 1 1 191 191 ALA C C 191 180.252 180.252 178.964 1.288 25485 18081 1 14 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.334 0.848 25485 18082 1 14 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.562 0.580 25485 18083 1 14 . 1 1 191 191 ALA H H 191 7.993 7.993 9.000 -1.007 25485 18084 1 14 . 1 1 192 192 ALA N N 192 121.409 121.409 121.406 0.003 25485 18085 1 14 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.073 -0.016 25485 18086 1 14 . 1 1 192 192 ALA C C 192 178.575 178.575 179.537 -0.962 25485 18087 1 14 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.565 -0.380 25485 18088 1 14 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.237 -2.039 25485 18089 1 14 . 1 1 192 192 ALA H H 192 9.297 9.297 8.545 0.752 25485 18090 1 14 . 1 1 193 193 THR N N 193 116.996 116.996 113.865 3.131 25485 18091 1 14 . 1 1 193 193 THR HA H 193 3.833 3.833 4.047 -0.214 25485 18092 1 14 . 1 1 193 193 THR CA C 193 69.138 69.138 67.137 2.001 25485 18093 1 14 . 1 1 193 193 THR CB C 193 67.365 67.365 68.041 -0.676 25485 18094 1 14 . 1 1 193 193 THR H H 193 8.226 8.226 7.724 0.502 25485 18095 1 14 . 1 1 194 194 HIS N N 194 120.296 120.296 121.949 -1.653 25485 18096 1 14 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.261 -0.025 25485 18097 1 14 . 1 1 194 194 HIS C C 194 175.962 175.962 176.616 -0.654 25485 18098 1 14 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.208 1.539 25485 18099 1 14 . 1 1 194 194 HIS CB C 194 27.919 27.919 30.040 -2.121 25485 18100 1 14 . 1 1 194 194 HIS H H 194 7.782 7.782 7.528 0.254 25485 18101 1 14 . 1 1 195 195 ALA N N 195 121.290 121.290 122.491 -1.201 25485 18102 1 14 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.900 0.256 25485 18103 1 14 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.822 1.142 25485 18104 1 14 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.602 0.108 25485 18105 1 14 . 1 1 195 195 ALA H H 195 8.690 8.690 8.438 0.252 25485 18106 1 14 . 1 1 196 196 LEU N N 196 114.899 114.899 117.788 -2.889 25485 18107 1 14 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.135 0.035 25485 18108 1 14 . 1 1 196 196 LEU C C 196 177.946 177.946 179.934 -1.988 25485 18109 1 14 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.381 -1.153 25485 18110 1 14 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.137 -1.361 25485 18111 1 14 . 1 1 196 196 LEU H H 196 8.715 8.715 8.903 -0.188 25485 18112 1 14 . 1 1 197 197 GLY N N 197 107.901 107.901 105.763 2.138 25485 18113 1 14 . 1 1 197 197 GLY C C 197 178.641 178.641 175.240 3.401 25485 18114 1 14 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.690 0.877 25485 18115 1 14 . 1 1 197 197 GLY H H 197 7.546 7.546 8.344 -0.798 25485 18116 1 14 . 1 1 198 198 HIS N N 198 122.017 122.017 119.411 2.606 25485 18117 1 14 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.533 0.324 25485 18118 1 14 . 1 1 198 198 HIS C C 198 179.874 179.874 178.206 1.668 25485 18119 1 14 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.502 1.020 25485 18120 1 14 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.304 -1.758 25485 18121 1 14 . 1 1 198 198 HIS H H 198 7.196 7.196 7.341 -0.145 25485 18122 1 14 . 1 1 199 199 SER N N 199 118.486 118.486 114.864 3.622 25485 18123 1 14 . 1 1 199 199 SER HA H 199 4.490 4.490 4.511 -0.021 25485 18124 1 14 . 1 1 199 199 SER C C 199 174.493 174.493 175.400 -0.907 25485 18125 1 14 . 1 1 199 199 SER CA C 199 58.173 58.173 60.900 -2.727 25485 18126 1 14 . 1 1 199 199 SER CB C 199 63.589 63.589 62.943 0.646 25485 18127 1 14 . 1 1 199 199 SER H H 199 7.884 7.884 7.741 0.143 25485 18128 1 14 . 1 1 200 200 LEU N N 200 114.686 114.686 116.339 -1.653 25485 18129 1 14 . 1 1 200 200 LEU C C 200 177.720 177.720 177.098 0.622 25485 18130 1 14 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.291 0.546 25485 18131 1 14 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.968 0.390 25485 18132 1 14 . 1 1 200 200 LEU H H 200 7.108 7.108 7.105 0.003 25485 18133 1 14 . 1 1 201 201 GLY N N 201 108.363 108.363 107.138 1.225 25485 18134 1 14 . 1 1 201 201 GLY C C 201 174.008 174.008 175.057 -1.049 25485 18135 1 14 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.502 -1.088 25485 18136 1 14 . 1 1 201 201 GLY H H 201 8.195 8.195 7.878 0.317 25485 18137 1 14 . 1 1 202 202 MET N N 202 119.635 119.635 120.943 -1.308 25485 18138 1 14 . 1 1 202 202 MET HA H 202 4.473 4.473 4.326 0.147 25485 18139 1 14 . 1 1 202 202 MET C C 202 176.593 176.593 176.044 0.549 25485 18140 1 14 . 1 1 202 202 MET CA C 202 54.500 54.500 56.741 -2.241 25485 18141 1 14 . 1 1 202 202 MET CB C 202 32.161 32.161 32.672 -0.511 25485 18142 1 14 . 1 1 202 202 MET H H 202 8.182 8.182 7.295 0.886 25485 18143 1 14 . 1 1 203 203 GLY N N 203 109.749 109.749 111.103 -1.354 25485 18144 1 14 . 1 1 203 203 GLY C C 203 174.042 174.042 173.693 0.349 25485 18145 1 14 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.684 -0.680 25485 18146 1 14 . 1 1 203 203 GLY H H 203 8.405 8.405 8.453 -0.048 25485 18147 1 14 . 1 1 204 204 HIS N N 204 115.732 115.732 118.625 -2.893 25485 18148 1 14 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.472 0.928 25485 18149 1 14 . 1 1 204 204 HIS C C 204 174.430 174.430 174.860 -0.430 25485 18150 1 14 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.254 -1.440 25485 18151 1 14 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.469 -0.643 25485 18152 1 14 . 1 1 204 204 HIS H H 204 8.364 8.364 8.428 -0.064 25485 18153 1 14 . 1 1 205 205 SER N N 205 115.484 115.484 113.230 2.254 25485 18154 1 14 . 1 1 205 205 SER HA H 205 4.766 4.766 4.754 0.012 25485 18155 1 14 . 1 1 205 205 SER C C 205 173.611 173.611 174.713 -1.102 25485 18156 1 14 . 1 1 205 205 SER CA C 205 54.729 54.729 57.307 -2.578 25485 18157 1 14 . 1 1 205 205 SER CB C 205 65.855 65.855 66.031 -0.176 25485 18158 1 14 . 1 1 205 205 SER H H 205 7.231 7.231 8.245 -1.014 25485 18159 1 14 . 1 1 206 206 SER N N 206 119.263 119.263 118.167 1.096 25485 18160 1 14 . 1 1 206 206 SER HA H 206 3.701 3.701 4.892 -1.191 25485 18161 1 14 . 1 1 206 206 SER C C 206 173.635 173.635 174.398 -0.763 25485 18162 1 14 . 1 1 206 206 SER CA C 206 63.846 63.846 59.481 4.365 25485 18163 1 14 . 1 1 206 206 SER CB C 206 63.764 63.764 63.740 0.024 25485 18164 1 14 . 1 1 206 206 SER H H 206 8.289 8.289 8.952 -0.663 25485 18165 1 14 . 1 1 207 207 ASP N N 207 126.646 126.646 123.488 3.158 25485 18166 1 14 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.757 0.172 25485 18167 1 14 . 1 1 207 207 ASP C C 207 174.614 174.614 175.811 -1.197 25485 18168 1 14 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.937 -1.665 25485 18169 1 14 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.014 -0.727 25485 18170 1 14 . 1 1 207 207 ASP H H 207 8.541 8.541 8.218 0.323 25485 18171 1 14 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.578 0.209 25485 18172 1 14 . 1 1 208 208 PRO C C 208 177.467 177.467 175.370 2.097 25485 18173 1 14 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.664 -0.828 25485 18174 1 14 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.879 -0.282 25485 18175 1 14 . 1 1 209 209 ASN N N 209 116.020 116.020 112.845 3.175 25485 18176 1 14 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.663 -0.022 25485 18177 1 14 . 1 1 209 209 ASN C C 209 174.695 174.695 173.800 0.895 25485 18178 1 14 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.119 2.101 25485 18179 1 14 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.151 0.959 25485 18180 1 14 . 1 1 209 209 ASN H H 209 8.350 8.350 7.897 0.453 25485 18181 1 14 . 1 1 210 210 ALA N N 210 124.892 124.892 122.760 2.132 25485 18182 1 14 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.488 -0.393 25485 18183 1 14 . 1 1 210 210 ALA C C 210 179.495 179.495 178.437 1.058 25485 18184 1 14 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.933 1.121 25485 18185 1 14 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.729 -1.530 25485 18186 1 14 . 1 1 210 210 ALA H H 210 8.193 8.193 7.160 1.034 25485 18187 1 14 . 1 1 211 211 VAL N N 211 130.402 130.402 121.971 8.431 25485 18188 1 14 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.798 0.465 25485 18189 1 14 . 1 1 211 211 VAL C C 211 179.408 179.408 176.264 3.144 25485 18190 1 14 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.941 0.111 25485 18191 1 14 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.156 -1.173 25485 18192 1 14 . 1 1 211 211 VAL H H 211 11.592 11.592 8.838 2.754 25485 18193 1 14 . 1 1 212 212 MET N N 212 113.285 113.285 114.790 -1.505 25485 18194 1 14 . 1 1 212 212 MET C C 212 176.996 176.996 175.241 1.755 25485 18195 1 14 . 1 1 212 212 MET CA C 212 53.614 53.614 54.402 -0.788 25485 18196 1 14 . 1 1 212 212 MET CB C 212 26.975 26.975 31.355 -4.380 25485 18197 1 14 . 1 1 212 212 MET H H 212 7.724 7.724 7.506 0.218 25485 18198 1 14 . 1 1 213 213 TYR N N 213 129.919 129.919 124.864 5.055 25485 18199 1 14 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.355 1.341 25485 18200 1 14 . 1 1 213 213 TYR C C 213 178.411 178.411 175.616 2.795 25485 18201 1 14 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.098 0.033 25485 18202 1 14 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.508 0.659 25485 18203 1 14 . 1 1 213 213 TYR H H 213 7.902 7.902 7.292 0.610 25485 18204 1 14 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.202 -0.727 25485 18205 1 14 . 1 1 214 214 PRO C C 214 177.694 177.694 177.067 0.627 25485 18206 1 14 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.268 1.760 25485 18207 1 14 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.636 1.187 25485 18208 1 14 . 1 1 215 215 THR N N 215 104.450 104.450 112.867 -8.417 25485 18209 1 14 . 1 1 215 215 THR HA H 215 4.444 4.444 4.196 0.248 25485 18210 1 14 . 1 1 215 215 THR C C 215 173.429 173.429 173.976 -0.547 25485 18211 1 14 . 1 1 215 215 THR CA C 215 60.528 60.528 62.498 -1.970 25485 18212 1 14 . 1 1 215 215 THR CB C 215 69.614 69.614 68.618 0.996 25485 18213 1 14 . 1 1 215 215 THR H H 215 6.407 6.407 7.293 -0.886 25485 18214 1 14 . 1 1 216 216 TYR N N 216 124.618 124.618 120.788 3.830 25485 18215 1 14 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.190 0.042 25485 18216 1 14 . 1 1 216 216 TYR C C 216 175.669 175.669 175.410 0.259 25485 18217 1 14 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.178 -0.591 25485 18218 1 14 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.667 2.224 25485 18219 1 14 . 1 1 216 216 TYR H H 216 8.331 8.331 7.329 1.002 25485 18220 1 14 . 1 1 217 217 GLY N N 217 116.089 116.089 113.436 2.653 25485 18221 1 14 . 1 1 217 217 GLY C C 217 173.560 173.560 174.348 -0.788 25485 18222 1 14 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.630 -0.312 25485 18223 1 14 . 1 1 217 217 GLY H H 217 7.695 7.695 8.505 -0.810 25485 18224 1 14 . 1 1 218 218 ASN N N 218 120.167 120.167 123.867 -3.700 25485 18225 1 14 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.613 0.053 25485 18226 1 14 . 1 1 218 218 ASN C C 218 175.343 175.343 176.380 -1.037 25485 18227 1 14 . 1 1 218 218 ASN CA C 218 53.615 53.615 55.114 -1.499 25485 18228 1 14 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.833 -0.287 25485 18229 1 14 . 1 1 218 218 ASN H H 218 8.237 8.237 8.252 -0.015 25485 18230 1 14 . 1 1 219 219 GLY N N 219 109.322 109.322 108.750 0.572 25485 18231 1 14 . 1 1 219 219 GLY C C 219 172.842 172.842 172.772 0.070 25485 18232 1 14 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.550 0.168 25485 18233 1 14 . 1 1 219 219 GLY H H 219 8.027 8.027 8.348 -0.321 25485 18234 1 14 . 1 1 220 220 ASP N N 220 123.006 123.006 121.061 1.945 25485 18235 1 14 . 1 1 220 220 ASP H H 220 8.273 8.273 8.347 -0.074 25485 18236 1 14 . 1 1 221 221 PRO C C 221 177.138 177.138 177.213 -0.075 25485 18237 1 14 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.522 -5.459 25485 18238 1 14 . 1 1 221 221 PRO CB C 221 31.696 31.696 33.014 -1.318 25485 18239 1 14 . 1 1 222 222 GLN N N 222 116.718 116.718 121.476 -4.758 25485 18240 1 14 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.072 0.264 25485 18241 1 14 . 1 1 222 222 GLN C C 222 176.321 176.321 176.253 0.068 25485 18242 1 14 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.305 -1.162 25485 18243 1 14 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.595 0.902 25485 18244 1 14 . 1 1 222 222 GLN H H 222 8.240 8.240 8.849 -0.609 25485 18245 1 14 . 1 1 223 223 ASN N N 223 118.368 118.368 116.587 1.781 25485 18246 1 14 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.757 0.159 25485 18247 1 14 . 1 1 223 223 ASN C C 223 173.271 173.271 174.025 -0.754 25485 18248 1 14 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.327 -0.731 25485 18249 1 14 . 1 1 223 223 ASN CB C 223 39.215 39.215 40.376 -1.161 25485 18250 1 14 . 1 1 223 223 ASN H H 223 7.946 7.946 8.112 -0.166 25485 18251 1 14 . 1 1 224 224 PHE N N 224 118.429 118.429 118.588 -0.159 25485 18252 1 14 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.191 0.260 25485 18253 1 14 . 1 1 224 224 PHE C C 224 172.897 172.897 173.580 -0.683 25485 18254 1 14 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.258 0.151 25485 18255 1 14 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.340 1.361 25485 18256 1 14 . 1 1 224 224 PHE H H 224 6.992 6.992 7.829 -0.837 25485 18257 1 14 . 1 1 225 225 LYS N N 225 121.714 121.714 125.802 -4.088 25485 18258 1 14 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.781 0.649 25485 18259 1 14 . 1 1 225 225 LYS C C 225 174.664 174.664 174.728 -0.064 25485 18260 1 14 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.435 -0.123 25485 18261 1 14 . 1 1 225 225 LYS CB C 225 34.727 34.727 35.260 -0.533 25485 18262 1 14 . 1 1 225 225 LYS H H 225 7.709 7.709 8.176 -0.467 25485 18263 1 14 . 1 1 226 226 LEU N N 226 119.026 119.026 120.782 -1.756 25485 18264 1 14 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.049 0.091 25485 18265 1 14 . 1 1 226 226 LEU C C 226 177.495 177.495 177.156 0.339 25485 18266 1 14 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.186 0.413 25485 18267 1 14 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.782 -0.501 25485 18268 1 14 . 1 1 226 226 LEU H H 226 8.015 8.015 8.134 -0.119 25485 18269 1 14 . 1 1 227 227 SER N N 227 120.320 120.320 117.022 3.298 25485 18270 1 14 . 1 1 227 227 SER HA H 227 4.600 4.600 4.582 0.018 25485 18271 1 14 . 1 1 227 227 SER C C 227 175.492 175.492 175.388 0.104 25485 18272 1 14 . 1 1 227 227 SER CA C 227 57.239 57.239 57.083 0.156 25485 18273 1 14 . 1 1 227 227 SER CB C 227 66.278 66.278 65.220 1.058 25485 18274 1 14 . 1 1 227 227 SER H H 227 9.654 9.654 8.175 1.479 25485 18275 1 14 . 1 1 228 228 GLN N N 228 127.511 127.511 125.346 2.165 25485 18276 1 14 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.976 0.718 25485 18277 1 14 . 1 1 228 228 GLN H H 228 8.248 8.248 8.974 -0.726 25485 18278 1 14 . 1 1 229 229 ASP N N 229 124.358 124.358 118.363 5.995 25485 18279 1 14 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.326 0.048 25485 18280 1 14 . 1 1 229 229 ASP C C 229 178.793 178.793 178.285 0.508 25485 18281 1 14 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.904 0.238 25485 18282 1 14 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.340 2.902 25485 18283 1 14 . 1 1 229 229 ASP H H 229 8.138 8.138 8.651 -0.513 25485 18284 1 14 . 1 1 230 230 ASP N N 230 119.694 119.694 120.231 -0.537 25485 18285 1 14 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.510 -0.088 25485 18286 1 14 . 1 1 230 230 ASP C C 230 177.736 177.736 178.035 -0.299 25485 18287 1 14 . 1 1 230 230 ASP CA C 230 57.922 57.922 56.670 1.252 25485 18288 1 14 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.998 2.239 25485 18289 1 14 . 1 1 230 230 ASP H H 230 7.393 7.393 7.580 -0.187 25485 18290 1 14 . 1 1 231 231 ILE N N 231 120.364 120.364 120.309 0.055 25485 18291 1 14 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.781 -0.116 25485 18292 1 14 . 1 1 231 231 ILE C C 231 177.631 177.631 177.999 -0.368 25485 18293 1 14 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.181 0.318 25485 18294 1 14 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.093 0.420 25485 18295 1 14 . 1 1 231 231 ILE H H 231 8.115 8.115 7.994 0.121 25485 18296 1 14 . 1 1 232 232 LYS N N 232 119.156 119.156 120.190 -1.034 25485 18297 1 14 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.032 0.082 25485 18298 1 14 . 1 1 232 232 LYS C C 232 180.574 180.574 179.082 1.492 25485 18299 1 14 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.868 -0.308 25485 18300 1 14 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.620 0.177 25485 18301 1 14 . 1 1 232 232 LYS H H 232 8.607 8.607 8.401 0.206 25485 18302 1 14 . 1 1 233 233 GLY N N 233 106.425 106.425 107.985 -1.560 25485 18303 1 14 . 1 1 233 233 GLY C C 233 176.098 176.098 175.861 0.237 25485 18304 1 14 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.765 0.872 25485 18305 1 14 . 1 1 233 233 GLY H H 233 8.075 8.075 7.670 0.405 25485 18306 1 14 . 1 1 234 234 ILE N N 234 125.119 125.119 121.803 3.316 25485 18307 1 14 . 1 1 234 234 ILE C C 234 178.231 178.231 177.194 1.037 25485 18308 1 14 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.291 -1.698 25485 18309 1 14 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.078 -0.532 25485 18310 1 14 . 1 1 234 234 ILE H H 234 8.539 8.539 7.442 1.097 25485 18311 1 14 . 1 1 235 235 GLN N N 235 122.877 122.877 119.550 3.327 25485 18312 1 14 . 1 1 235 235 GLN HA H 235 4.357 4.357 3.992 0.365 25485 18313 1 14 . 1 1 235 235 GLN C C 235 180.105 180.105 178.505 1.600 25485 18314 1 14 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.627 -1.740 25485 18315 1 14 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.604 -1.067 25485 18316 1 14 . 1 1 235 235 GLN H H 235 8.296 8.296 8.456 -0.160 25485 18317 1 14 . 1 1 236 236 LYS N N 236 123.678 123.678 119.261 4.417 25485 18318 1 14 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.253 -0.171 25485 18319 1 14 . 1 1 236 236 LYS C C 236 178.169 178.169 178.032 0.137 25485 18320 1 14 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.929 0.447 25485 18321 1 14 . 1 1 236 236 LYS CB C 236 31.978 31.978 32.094 -0.116 25485 18322 1 14 . 1 1 236 236 LYS H H 236 8.024 8.024 7.791 0.233 25485 18323 1 14 . 1 1 237 237 LEU N N 237 116.873 116.873 120.024 -3.151 25485 18324 1 14 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.219 -0.232 25485 18325 1 14 . 1 1 237 237 LEU C C 237 177.893 177.893 177.503 0.390 25485 18326 1 14 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.364 1.075 25485 18327 1 14 . 1 1 237 237 LEU CB C 237 43.613 43.613 41.704 1.909 25485 18328 1 14 . 1 1 237 237 LEU H H 237 6.888 6.888 7.253 -0.365 25485 18329 1 14 . 1 1 238 238 TYR N N 238 112.237 112.237 116.040 -3.803 25485 18330 1 14 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.398 0.253 25485 18331 1 14 . 1 1 238 238 TYR C C 238 176.082 176.082 177.176 -1.094 25485 18332 1 14 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.075 -0.439 25485 18333 1 14 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.918 1.480 25485 18334 1 14 . 1 1 238 238 TYR H H 238 7.445 7.445 8.584 -1.139 25485 18335 1 14 . 1 1 239 239 GLY N N 239 110.906 110.906 105.537 5.369 25485 18336 1 14 . 1 1 239 239 GLY C C 239 171.269 171.269 172.975 -1.706 25485 18337 1 14 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.128 -1.242 25485 18338 1 14 . 1 1 239 239 GLY H H 239 8.443 8.443 8.074 0.369 25485 18339 1 14 . 1 1 240 240 LYS N N 240 114.281 114.281 122.448 -8.167 25485 18340 1 14 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.645 0.093 25485 18341 1 14 . 1 1 240 240 LYS C C 240 177.527 177.527 176.114 1.413 25485 18342 1 14 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.367 -0.409 25485 18343 1 14 . 1 1 240 240 LYS CB C 240 34.275 34.275 34.847 -0.572 25485 18344 1 14 . 1 1 240 240 LYS H H 240 7.873 7.873 8.452 -0.579 25485 18345 1 14 . 1 1 241 241 ARG N N 241 123.758 123.758 119.824 3.934 25485 18346 1 14 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.538 -0.541 25485 18347 1 14 . 1 1 241 241 ARG C C 241 176.026 176.026 175.822 0.204 25485 18348 1 14 . 1 1 241 241 ARG CA C 241 57.492 57.492 55.620 1.872 25485 18349 1 14 . 1 1 241 241 ARG CB C 241 30.371 30.371 31.243 -0.872 25485 18350 1 14 . 1 1 241 241 ARG H H 241 7.742 7.742 8.400 -0.658 25485 18351 1 14 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.599 -0.259 25485 18352 1 14 . 1 1 246 246 LYS C C 246 175.403 175.403 175.003 0.400 25485 18353 1 14 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.456 1.053 25485 18354 1 14 . 1 1 246 246 LYS CB C 246 32.858 32.858 33.617 -0.758 25485 18355 1 15 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.538 -0.231 25485 18356 1 15 . 1 1 2 2 GLN C C 2 176.492 176.492 176.092 0.400 25485 18357 1 15 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.001 0.749 25485 18358 1 15 . 1 1 2 2 GLN CB C 2 28.654 28.654 29.455 -0.801 25485 18359 1 15 . 1 1 3 3 GLU N N 3 121.668 121.668 120.407 1.261 25485 18360 1 15 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.418 -0.629 25485 18361 1 15 . 1 1 3 3 GLU C C 3 176.278 176.278 177.496 -1.218 25485 18362 1 15 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.216 -0.157 25485 18363 1 15 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.842 -0.151 25485 18364 1 15 . 1 1 3 3 GLU H H 3 8.331 8.331 8.598 -0.267 25485 18365 1 15 . 1 1 4 4 ALA N N 4 124.493 124.493 123.777 0.716 25485 18366 1 15 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.261 0.249 25485 18367 1 15 . 1 1 4 4 ALA C C 4 178.428 178.428 180.123 -1.695 25485 18368 1 15 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.487 0.190 25485 18369 1 15 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.124 0.585 25485 18370 1 15 . 1 1 4 4 ALA H H 4 8.131 8.131 8.373 -0.242 25485 18371 1 15 . 1 1 5 5 GLY N N 5 108.204 108.204 108.122 0.082 25485 18372 1 15 . 1 1 5 5 GLY C C 5 174.858 174.858 175.469 -0.611 25485 18373 1 15 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.150 1.511 25485 18374 1 15 . 1 1 5 5 GLY H H 5 8.279 8.279 8.613 -0.334 25485 18375 1 15 . 1 1 6 6 GLY N N 6 108.820 108.820 108.109 0.711 25485 18376 1 15 . 1 1 6 6 GLY C C 6 174.189 174.189 173.642 0.547 25485 18377 1 15 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.365 0.048 25485 18378 1 15 . 1 1 6 6 GLY H H 6 8.246 8.246 7.765 0.481 25485 18379 1 15 . 1 1 7 7 MET N N 7 119.938 119.938 120.899 -0.961 25485 18380 1 15 . 1 1 7 7 MET HA H 7 4.659 4.659 4.591 0.068 25485 18381 1 15 . 1 1 7 7 MET C C 7 176.191 176.191 176.103 0.088 25485 18382 1 15 . 1 1 7 7 MET CA C 7 54.799 54.799 55.874 -1.075 25485 18383 1 15 . 1 1 7 7 MET CB C 7 33.046 33.046 34.171 -1.125 25485 18384 1 15 . 1 1 7 7 MET H H 7 8.005 8.005 7.783 0.222 25485 18385 1 15 . 1 1 8 8 SER N N 8 118.919 118.919 115.984 2.935 25485 18386 1 15 . 1 1 8 8 SER HA H 8 4.239 4.239 4.803 -0.564 25485 18387 1 15 . 1 1 8 8 SER C C 8 174.949 174.949 175.770 -0.821 25485 18388 1 15 . 1 1 8 8 SER CA C 8 58.160 58.160 56.962 1.198 25485 18389 1 15 . 1 1 8 8 SER CB C 8 65.440 65.440 65.053 0.387 25485 18390 1 15 . 1 1 8 8 SER H H 8 8.731 8.731 8.331 0.400 25485 18391 1 15 . 1 1 9 9 GLU N N 9 122.442 122.442 123.144 -0.702 25485 18392 1 15 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.149 0.172 25485 18393 1 15 . 1 1 9 9 GLU C C 9 178.604 178.604 178.415 0.189 25485 18394 1 15 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.026 0.441 25485 18395 1 15 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.349 -0.173 25485 18396 1 15 . 1 1 9 9 GLU H H 9 8.901 8.901 9.038 -0.137 25485 18397 1 15 . 1 1 10 10 LEU N N 10 120.568 120.568 121.971 -1.403 25485 18398 1 15 . 1 1 10 10 LEU C C 10 179.307 179.307 178.749 0.558 25485 18399 1 15 . 1 1 10 10 LEU CA C 10 57.480 57.480 57.494 -0.014 25485 18400 1 15 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.883 -0.308 25485 18401 1 15 . 1 1 10 10 LEU H H 10 8.020 8.020 8.065 -0.045 25485 18402 1 15 . 1 1 11 11 GLN N N 11 119.930 119.930 118.897 1.033 25485 18403 1 15 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.083 0.051 25485 18404 1 15 . 1 1 11 11 GLN C C 11 178.330 178.330 178.291 0.039 25485 18405 1 15 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.902 -0.084 25485 18406 1 15 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.451 -0.587 25485 18407 1 15 . 1 1 11 11 GLN H H 11 7.811 7.811 7.667 0.144 25485 18408 1 15 . 1 1 12 12 TRP N N 12 121.031 121.031 121.976 -0.945 25485 18409 1 15 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.469 -0.055 25485 18410 1 15 . 1 1 12 12 TRP C C 12 178.874 178.874 178.273 0.601 25485 18411 1 15 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.685 -0.179 25485 18412 1 15 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.403 -0.016 25485 18413 1 15 . 1 1 12 12 TRP H H 12 8.205 8.205 7.686 0.519 25485 18414 1 15 . 1 1 13 13 GLU N N 13 121.877 121.877 119.039 2.838 25485 18415 1 15 . 1 1 13 13 GLU C C 13 179.425 179.425 179.258 0.167 25485 18416 1 15 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.798 0.239 25485 18417 1 15 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.696 -0.774 25485 18418 1 15 . 1 1 13 13 GLU H H 13 8.434 8.434 8.455 -0.021 25485 18419 1 15 . 1 1 14 14 GLN N N 14 120.449 120.449 118.461 1.988 25485 18420 1 15 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.918 0.320 25485 18421 1 15 . 1 1 14 14 GLN C C 14 179.210 179.210 178.236 0.974 25485 18422 1 15 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.579 0.303 25485 18423 1 15 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.563 -0.813 25485 18424 1 15 . 1 1 14 14 GLN H H 14 8.124 8.124 8.318 -0.194 25485 18425 1 15 . 1 1 15 15 ALA N N 15 123.114 123.114 121.706 1.408 25485 18426 1 15 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.127 0.263 25485 18427 1 15 . 1 1 15 15 ALA C C 15 179.352 179.352 179.184 0.168 25485 18428 1 15 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.934 -0.969 25485 18429 1 15 . 1 1 15 15 ALA CB C 15 18.663 18.663 18.098 0.566 25485 18430 1 15 . 1 1 15 15 ALA H H 15 8.344 8.344 7.792 0.552 25485 18431 1 15 . 1 1 16 16 GLN N N 16 117.718 117.718 117.671 0.047 25485 18432 1 15 . 1 1 16 16 GLN HA H 16 3.782 3.782 4.005 -0.223 25485 18433 1 15 . 1 1 16 16 GLN C C 16 177.719 177.719 178.135 -0.416 25485 18434 1 15 . 1 1 16 16 GLN CA C 16 60.281 60.281 59.256 1.025 25485 18435 1 15 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.469 0.067 25485 18436 1 15 . 1 1 16 16 GLN H H 16 8.500 8.500 8.046 0.454 25485 18437 1 15 . 1 1 17 17 ASP N N 17 120.040 120.040 119.910 0.130 25485 18438 1 15 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.359 0.177 25485 18439 1 15 . 1 1 17 17 ASP C C 17 177.630 177.630 178.612 -0.982 25485 18440 1 15 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.553 0.252 25485 18441 1 15 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.691 1.173 25485 18442 1 15 . 1 1 17 17 ASP H H 17 7.871 7.871 7.441 0.430 25485 18443 1 15 . 1 1 18 18 TYR N N 18 122.465 122.465 119.394 3.071 25485 18444 1 15 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.098 0.092 25485 18445 1 15 . 1 1 18 18 TYR C C 18 178.439 178.439 177.993 0.446 25485 18446 1 15 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.996 0.850 25485 18447 1 15 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.398 1.542 25485 18448 1 15 . 1 1 18 18 TYR H H 18 8.244 8.244 8.210 0.034 25485 18449 1 15 . 1 1 19 19 LEU N N 19 117.635 117.635 118.977 -1.342 25485 18450 1 15 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.425 -0.293 25485 18451 1 15 . 1 1 19 19 LEU C C 19 180.940 180.940 178.801 2.139 25485 18452 1 15 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.935 0.570 25485 18453 1 15 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.877 -1.279 25485 18454 1 15 . 1 1 19 19 LEU H H 19 8.713 8.713 8.093 0.620 25485 18455 1 15 . 1 1 20 20 LYS N N 20 124.594 124.594 120.094 4.500 25485 18456 1 15 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.021 0.063 25485 18457 1 15 . 1 1 20 20 LYS C C 20 178.387 178.387 179.039 -0.652 25485 18458 1 15 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.192 0.613 25485 18459 1 15 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.253 0.203 25485 18460 1 15 . 1 1 20 20 LYS H H 20 8.815 8.815 7.622 1.193 25485 18461 1 15 . 1 1 21 21 ARG N N 21 117.535 117.535 117.990 -0.455 25485 18462 1 15 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.127 -0.408 25485 18463 1 15 . 1 1 21 21 ARG C C 21 178.498 178.498 178.550 -0.052 25485 18464 1 15 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.401 0.843 25485 18465 1 15 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.372 0.069 25485 18466 1 15 . 1 1 21 21 ARG H H 21 7.810 7.810 7.632 0.178 25485 18467 1 15 . 1 1 22 22 PHE N N 22 112.113 112.113 118.013 -5.900 25485 18468 1 15 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.481 0.430 25485 18469 1 15 . 1 1 22 22 PHE C C 22 174.875 174.875 175.156 -0.281 25485 18470 1 15 . 1 1 22 22 PHE CA C 22 57.475 57.475 59.066 -1.591 25485 18471 1 15 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.418 -0.249 25485 18472 1 15 . 1 1 22 22 PHE H H 22 8.010 8.010 7.532 0.478 25485 18473 1 15 . 1 1 23 23 TYR N N 23 116.187 116.187 119.209 -3.022 25485 18474 1 15 . 1 1 23 23 TYR C C 23 173.455 173.455 174.731 -1.276 25485 18475 1 15 . 1 1 23 23 TYR CA C 23 58.427 58.427 57.305 1.122 25485 18476 1 15 . 1 1 23 23 TYR CB C 23 39.529 39.529 38.372 1.157 25485 18477 1 15 . 1 1 23 23 TYR H H 23 7.680 7.680 7.495 0.185 25485 18478 1 15 . 1 1 24 24 LEU N N 24 115.570 115.570 116.528 -0.958 25485 18479 1 15 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.978 0.172 25485 18480 1 15 . 1 1 24 24 LEU C C 24 176.661 176.661 175.131 1.530 25485 18481 1 15 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.412 0.740 25485 18482 1 15 . 1 1 24 24 LEU CB C 24 36.863 36.863 40.951 -4.088 25485 18483 1 15 . 1 1 24 24 LEU H H 24 7.238 7.238 7.427 -0.189 25485 18484 1 15 . 1 1 25 25 TYR N N 25 119.901 119.901 122.898 -2.997 25485 18485 1 15 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.718 -0.359 25485 18486 1 15 . 1 1 25 25 TYR C C 25 173.784 173.784 174.604 -0.820 25485 18487 1 15 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.744 0.503 25485 18488 1 15 . 1 1 25 25 TYR CB C 25 39.079 39.079 38.775 0.304 25485 18489 1 15 . 1 1 25 25 TYR H H 25 7.845 7.845 8.438 -0.593 25485 18490 1 15 . 1 1 26 26 ASP N N 26 129.338 129.338 125.255 4.083 25485 18491 1 15 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.050 -0.599 25485 18492 1 15 . 1 1 26 26 ASP C C 26 175.282 175.282 176.342 -1.060 25485 18493 1 15 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.562 -1.129 25485 18494 1 15 . 1 1 26 26 ASP CB C 26 41.249 41.249 43.310 -2.061 25485 18495 1 15 . 1 1 26 26 ASP H H 26 8.108 8.108 8.361 -0.253 25485 18496 1 15 . 1 1 27 27 SER C C 27 175.204 175.204 176.107 -0.903 25485 18497 1 15 . 1 1 27 27 SER CA C 27 59.424 59.424 60.088 -0.664 25485 18498 1 15 . 1 1 27 27 SER CB C 27 63.535 63.535 63.794 -0.259 25485 18499 1 15 . 1 1 28 28 GLU N N 28 122.058 122.058 122.168 -0.110 25485 18500 1 15 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.156 0.169 25485 18501 1 15 . 1 1 28 28 GLU C C 28 177.073 177.073 177.383 -0.310 25485 18502 1 15 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.425 -1.213 25485 18503 1 15 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.473 0.097 25485 18504 1 15 . 1 1 28 28 GLU H H 28 8.255 8.255 8.748 -0.493 25485 18505 1 15 . 1 1 29 29 THR N N 29 114.161 114.161 112.770 1.391 25485 18506 1 15 . 1 1 29 29 THR HA H 29 4.260 4.260 4.293 -0.033 25485 18507 1 15 . 1 1 29 29 THR C C 29 174.591 174.591 173.375 1.216 25485 18508 1 15 . 1 1 29 29 THR CA C 29 61.976 61.976 62.733 -0.757 25485 18509 1 15 . 1 1 29 29 THR CB C 29 69.385 69.385 69.006 0.379 25485 18510 1 15 . 1 1 29 29 THR H H 29 7.498 7.498 7.644 -0.146 25485 18511 1 15 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.248 -0.030 25485 18512 1 15 . 1 1 30 30 LYS H H 30 8.218 8.218 7.659 0.559 25485 18513 1 15 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.686 -0.262 25485 18514 1 15 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.871 -1.738 25485 18515 1 15 . 1 1 32 32 ALA N N 32 126.484 126.484 123.113 3.371 25485 18516 1 15 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.265 0.031 25485 18517 1 15 . 1 1 32 32 ALA C C 32 178.012 178.012 178.635 -0.623 25485 18518 1 15 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.412 -0.652 25485 18519 1 15 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.137 -0.367 25485 18520 1 15 . 1 1 32 32 ALA H H 32 8.411 8.411 8.701 -0.290 25485 18521 1 15 . 1 1 33 33 ASN N N 33 116.885 116.885 116.881 0.004 25485 18522 1 15 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.528 0.170 25485 18523 1 15 . 1 1 33 33 ASN C C 33 176.240 176.240 176.499 -0.259 25485 18524 1 15 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.835 -1.648 25485 18525 1 15 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.794 -0.208 25485 18526 1 15 . 1 1 33 33 ASN H H 33 8.309 8.309 8.235 0.074 25485 18527 1 15 . 1 1 34 34 SER N N 34 116.836 116.836 115.156 1.680 25485 18528 1 15 . 1 1 34 34 SER HA H 34 4.544 4.544 4.229 0.315 25485 18529 1 15 . 1 1 34 34 SER C C 34 175.253 175.253 176.077 -0.824 25485 18530 1 15 . 1 1 34 34 SER CA C 34 59.583 59.583 60.956 -1.373 25485 18531 1 15 . 1 1 34 34 SER CB C 34 63.919 63.919 62.366 1.553 25485 18532 1 15 . 1 1 34 34 SER H H 34 8.115 8.115 8.318 -0.203 25485 18533 1 15 . 1 1 35 35 LEU N N 35 125.355 125.355 123.506 1.849 25485 18534 1 15 . 1 1 35 35 LEU HA H 35 3.576 3.576 3.975 -0.399 25485 18535 1 15 . 1 1 35 35 LEU C C 35 177.973 177.973 178.054 -0.081 25485 18536 1 15 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.332 0.165 25485 18537 1 15 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.670 -0.978 25485 18538 1 15 . 1 1 35 35 LEU H H 35 8.312 8.312 7.526 0.786 25485 18539 1 15 . 1 1 36 36 GLU N N 36 119.201 119.201 119.643 -0.442 25485 18540 1 15 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.902 0.012 25485 18541 1 15 . 1 1 36 36 GLU C C 36 178.141 178.141 178.527 -0.386 25485 18542 1 15 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.860 -0.201 25485 18543 1 15 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.268 0.045 25485 18544 1 15 . 1 1 36 36 GLU H H 36 8.225 8.225 7.891 0.334 25485 18545 1 15 . 1 1 37 37 ALA N N 37 120.746 120.746 121.116 -0.370 25485 18546 1 15 . 1 1 37 37 ALA HA H 37 4.079 4.079 3.918 0.161 25485 18547 1 15 . 1 1 37 37 ALA C C 37 181.485 181.485 179.353 2.132 25485 18548 1 15 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.235 0.224 25485 18549 1 15 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.334 -0.167 25485 18550 1 15 . 1 1 37 37 ALA H H 37 7.917 7.917 7.604 0.313 25485 18551 1 15 . 1 1 38 38 LYS N N 38 119.326 119.326 120.292 -0.966 25485 18552 1 15 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.018 0.313 25485 18553 1 15 . 1 1 38 38 LYS C C 38 177.946 177.946 178.849 -0.903 25485 18554 1 15 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.518 -0.814 25485 18555 1 15 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.202 -0.402 25485 18556 1 15 . 1 1 38 38 LYS H H 38 8.216 8.216 7.964 0.252 25485 18557 1 15 . 1 1 39 39 LEU N N 39 122.736 122.736 119.212 3.524 25485 18558 1 15 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.953 -0.012 25485 18559 1 15 . 1 1 39 39 LEU C C 39 178.819 178.819 178.625 0.194 25485 18560 1 15 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.161 -0.080 25485 18561 1 15 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.293 -0.665 25485 18562 1 15 . 1 1 39 39 LEU H H 39 8.666 8.666 8.568 0.098 25485 18563 1 15 . 1 1 40 40 LYS N N 40 118.411 118.411 120.715 -2.304 25485 18564 1 15 . 1 1 40 40 LYS HA H 40 4.638 4.638 4.228 0.410 25485 18565 1 15 . 1 1 40 40 LYS C C 40 179.329 179.329 179.126 0.203 25485 18566 1 15 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.835 0.298 25485 18567 1 15 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.367 -0.582 25485 18568 1 15 . 1 1 40 40 LYS H H 40 8.227 8.227 7.947 0.280 25485 18569 1 15 . 1 1 41 41 GLU N N 41 121.329 121.329 118.512 2.817 25485 18570 1 15 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.142 -0.049 25485 18571 1 15 . 1 1 41 41 GLU C C 41 178.989 178.989 179.083 -0.094 25485 18572 1 15 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.970 0.790 25485 18573 1 15 . 1 1 41 41 GLU CB C 41 29.836 29.836 29.315 0.521 25485 18574 1 15 . 1 1 41 41 GLU H H 41 7.718 7.718 7.749 -0.031 25485 18575 1 15 . 1 1 42 42 MET N N 42 123.817 123.817 121.332 2.485 25485 18576 1 15 . 1 1 42 42 MET HA H 42 4.107 4.107 4.282 -0.175 25485 18577 1 15 . 1 1 42 42 MET C C 42 177.719 177.719 178.265 -0.546 25485 18578 1 15 . 1 1 42 42 MET CA C 42 59.912 59.912 58.656 1.256 25485 18579 1 15 . 1 1 42 42 MET CB C 42 30.506 30.506 32.600 -2.094 25485 18580 1 15 . 1 1 42 42 MET H H 42 7.657 7.657 7.870 -0.213 25485 18581 1 15 . 1 1 43 43 GLN N N 43 119.998 119.998 118.780 1.218 25485 18582 1 15 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.913 -0.108 25485 18583 1 15 . 1 1 43 43 GLN C C 43 177.604 177.604 178.830 -1.226 25485 18584 1 15 . 1 1 43 43 GLN CA C 43 59.965 59.965 59.676 0.289 25485 18585 1 15 . 1 1 43 43 GLN CB C 43 26.555 26.555 28.531 -1.976 25485 18586 1 15 . 1 1 43 43 GLN H H 43 8.910 8.910 8.646 0.264 25485 18587 1 15 . 1 1 44 44 LYS N N 44 119.165 119.165 118.360 0.805 25485 18588 1 15 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.220 -0.165 25485 18589 1 15 . 1 1 44 44 LYS C C 44 179.991 179.991 178.746 1.245 25485 18590 1 15 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.157 1.404 25485 18591 1 15 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.285 0.013 25485 18592 1 15 . 1 1 44 44 LYS H H 44 8.507 8.507 7.693 0.814 25485 18593 1 15 . 1 1 45 45 PHE N N 45 123.602 123.602 120.250 3.352 25485 18594 1 15 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.305 -0.404 25485 18595 1 15 . 1 1 45 45 PHE C C 45 177.606 177.606 176.374 1.232 25485 18596 1 15 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.429 2.605 25485 18597 1 15 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.130 0.736 25485 18598 1 15 . 1 1 45 45 PHE H H 45 8.445 8.445 7.563 0.882 25485 18599 1 15 . 1 1 46 46 PHE N N 46 112.715 112.715 115.368 -2.653 25485 18600 1 15 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.523 0.074 25485 18601 1 15 . 1 1 46 46 PHE C C 46 175.285 175.285 177.072 -1.787 25485 18602 1 15 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.845 0.830 25485 18603 1 15 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.218 -0.759 25485 18604 1 15 . 1 1 46 46 PHE H H 46 8.272 8.272 8.133 0.139 25485 18605 1 15 . 1 1 47 47 GLY N N 47 110.438 110.438 107.009 3.429 25485 18606 1 15 . 1 1 47 47 GLY C C 47 174.935 174.935 174.440 0.495 25485 18607 1 15 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.221 1.790 25485 18608 1 15 . 1 1 47 47 GLY H H 47 7.926 7.926 8.016 -0.090 25485 18609 1 15 . 1 1 48 48 LEU N N 48 121.830 121.830 119.386 2.444 25485 18610 1 15 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.680 0.244 25485 18611 1 15 . 1 1 48 48 LEU C C 48 174.009 174.009 175.914 -1.905 25485 18612 1 15 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.572 -1.738 25485 18613 1 15 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.804 0.659 25485 18614 1 15 . 1 1 48 48 LEU H H 48 8.762 8.762 7.614 1.148 25485 18615 1 15 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.383 -0.145 25485 18616 1 15 . 1 1 49 49 PRO C C 49 176.874 176.874 176.773 0.101 25485 18617 1 15 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.845 -0.327 25485 18618 1 15 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.841 -0.762 25485 18619 1 15 . 1 1 50 50 ILE N N 50 126.859 126.859 117.040 9.819 25485 18620 1 15 . 1 1 50 50 ILE HA H 50 4.101 4.101 3.988 0.113 25485 18621 1 15 . 1 1 50 50 ILE C C 50 176.540 176.540 175.569 0.971 25485 18622 1 15 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.119 -1.163 25485 18623 1 15 . 1 1 50 50 ILE CB C 50 36.393 36.393 36.937 -0.544 25485 18624 1 15 . 1 1 50 50 ILE H H 50 8.548 8.548 7.730 0.818 25485 18625 1 15 . 1 1 51 51 THR N N 51 116.443 116.443 122.762 -6.319 25485 18626 1 15 . 1 1 51 51 THR HA H 51 4.584 4.584 4.477 0.107 25485 18627 1 15 . 1 1 51 51 THR C C 51 176.672 176.672 175.383 1.289 25485 18628 1 15 . 1 1 51 51 THR CA C 51 60.979 60.979 60.022 0.958 25485 18629 1 15 . 1 1 51 51 THR CB C 51 71.505 71.505 70.183 1.322 25485 18630 1 15 . 1 1 51 51 THR H H 51 8.001 8.001 7.731 0.270 25485 18631 1 15 . 1 1 52 52 GLY N N 52 112.719 112.719 112.930 -0.211 25485 18632 1 15 . 1 1 52 52 GLY C C 52 170.609 170.609 173.478 -2.869 25485 18633 1 15 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.892 0.854 25485 18634 1 15 . 1 1 52 52 GLY H H 52 9.499 9.499 9.196 0.303 25485 18635 1 15 . 1 1 53 53 MET N N 53 116.621 116.621 117.768 -1.147 25485 18636 1 15 . 1 1 53 53 MET HA H 53 4.023 4.023 4.646 -0.623 25485 18637 1 15 . 1 1 53 53 MET C C 53 174.695 174.695 174.566 0.129 25485 18638 1 15 . 1 1 53 53 MET CA C 53 53.460 53.460 54.337 -0.876 25485 18639 1 15 . 1 1 53 53 MET CB C 53 35.408 35.408 36.021 -0.613 25485 18640 1 15 . 1 1 53 53 MET H H 53 7.993 7.993 7.399 0.594 25485 18641 1 15 . 1 1 54 54 LEU N N 54 122.679 122.679 123.049 -0.370 25485 18642 1 15 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.410 -0.659 25485 18643 1 15 . 1 1 54 54 LEU C C 54 174.784 174.784 174.587 0.197 25485 18644 1 15 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.538 -0.237 25485 18645 1 15 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.377 -0.367 25485 18646 1 15 . 1 1 54 54 LEU H H 54 7.940 7.940 8.389 -0.449 25485 18647 1 15 . 1 1 55 55 ASN N N 55 115.797 115.797 119.432 -3.635 25485 18648 1 15 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.511 0.238 25485 18649 1 15 . 1 1 55 55 ASN C C 55 175.459 175.459 174.778 0.681 25485 18650 1 15 . 1 1 55 55 ASN CA C 55 51.843 51.843 52.861 -1.018 25485 18651 1 15 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.646 1.711 25485 18652 1 15 . 1 1 55 55 ASN H H 55 6.543 6.543 8.171 -1.628 25485 18653 1 15 . 1 1 56 56 SER N N 56 121.507 121.507 117.530 3.977 25485 18654 1 15 . 1 1 56 56 SER HA H 56 4.638 4.638 4.424 0.214 25485 18655 1 15 . 1 1 56 56 SER C C 56 175.727 175.727 175.899 -0.172 25485 18656 1 15 . 1 1 56 56 SER CA C 56 57.932 57.932 59.240 -1.308 25485 18657 1 15 . 1 1 56 56 SER CB C 56 63.786 63.786 63.423 0.363 25485 18658 1 15 . 1 1 56 56 SER H H 56 8.213 8.213 8.126 0.087 25485 18659 1 15 . 1 1 57 57 ARG N N 57 122.951 122.951 120.213 2.738 25485 18660 1 15 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.250 -0.049 25485 18661 1 15 . 1 1 57 57 ARG C C 57 178.560 178.560 177.912 0.648 25485 18662 1 15 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.569 -0.137 25485 18663 1 15 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.578 -0.474 25485 18664 1 15 . 1 1 57 57 ARG H H 57 7.895 7.895 8.562 -0.667 25485 18665 1 15 . 1 1 58 58 VAL N N 58 118.778 118.778 120.824 -2.046 25485 18666 1 15 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.537 -0.206 25485 18667 1 15 . 1 1 58 58 VAL C C 58 177.370 177.370 177.555 -0.185 25485 18668 1 15 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.247 0.135 25485 18669 1 15 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.432 0.777 25485 18670 1 15 . 1 1 58 58 VAL H H 58 7.583 7.583 7.841 -0.258 25485 18671 1 15 . 1 1 59 59 ILE N N 59 119.159 119.159 117.913 1.246 25485 18672 1 15 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.718 -0.305 25485 18673 1 15 . 1 1 59 59 ILE C C 59 177.067 177.067 177.568 -0.501 25485 18674 1 15 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.311 0.322 25485 18675 1 15 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.830 -0.134 25485 18676 1 15 . 1 1 59 59 ILE H H 59 7.323 7.323 7.816 -0.493 25485 18677 1 15 . 1 1 60 60 GLU N N 60 119.367 119.367 121.524 -2.157 25485 18678 1 15 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.996 -0.258 25485 18679 1 15 . 1 1 60 60 GLU C C 60 179.978 179.978 178.758 1.220 25485 18680 1 15 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.646 -0.388 25485 18681 1 15 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.337 0.051 25485 18682 1 15 . 1 1 60 60 GLU H H 60 7.879 7.879 7.508 0.371 25485 18683 1 15 . 1 1 61 61 ILE N N 61 118.816 118.816 115.686 3.130 25485 18684 1 15 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.911 -0.472 25485 18685 1 15 . 1 1 61 61 ILE C C 61 179.033 179.033 176.634 2.399 25485 18686 1 15 . 1 1 61 61 ILE CA C 61 64.838 64.838 63.724 1.114 25485 18687 1 15 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.816 -0.917 25485 18688 1 15 . 1 1 61 61 ILE H H 61 7.246 7.246 7.512 -0.266 25485 18689 1 15 . 1 1 62 62 MET N N 62 119.986 119.986 115.881 4.105 25485 18690 1 15 . 1 1 62 62 MET HA H 62 3.444 3.444 4.207 -0.763 25485 18691 1 15 . 1 1 62 62 MET C C 62 176.185 176.185 177.232 -1.047 25485 18692 1 15 . 1 1 62 62 MET CA C 62 59.014 59.014 56.968 2.046 25485 18693 1 15 . 1 1 62 62 MET CB C 62 31.250 31.250 32.544 -1.294 25485 18694 1 15 . 1 1 62 62 MET H H 62 7.835 7.835 7.480 0.355 25485 18695 1 15 . 1 1 63 63 GLN N N 63 116.163 116.163 115.835 0.328 25485 18696 1 15 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.151 0.127 25485 18697 1 15 . 1 1 63 63 GLN C C 63 176.727 176.727 176.472 0.255 25485 18698 1 15 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.213 -0.075 25485 18699 1 15 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.570 -0.504 25485 18700 1 15 . 1 1 63 63 GLN H H 63 7.454 7.454 7.274 0.180 25485 18701 1 15 . 1 1 64 64 LYS N N 64 121.430 121.430 121.456 -0.026 25485 18702 1 15 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.482 0.061 25485 18703 1 15 . 1 1 64 64 LYS C C 64 174.724 174.724 174.965 -0.241 25485 18704 1 15 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.394 1.123 25485 18705 1 15 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.776 -1.179 25485 18706 1 15 . 1 1 64 64 LYS H H 64 7.483 7.483 7.779 -0.296 25485 18707 1 15 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.555 -2.119 25485 18708 1 15 . 1 1 65 65 PRO C C 65 176.158 176.158 176.071 0.087 25485 18709 1 15 . 1 1 65 65 PRO CA C 65 62.888 62.888 62.941 -0.052 25485 18710 1 15 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.483 -0.650 25485 18711 1 15 . 1 1 66 66 ARG N N 66 112.697 112.697 120.313 -7.616 25485 18712 1 15 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.493 -0.085 25485 18713 1 15 . 1 1 66 66 ARG C C 66 174.478 174.478 174.194 0.284 25485 18714 1 15 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.118 -1.482 25485 18715 1 15 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.165 3.508 25485 18716 1 15 . 1 1 66 66 ARG H H 66 8.146 8.146 8.674 -0.528 25485 18717 1 15 . 1 1 67 67 CYS N N 67 121.740 121.740 118.715 3.025 25485 18718 1 15 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.865 -0.425 25485 18719 1 15 . 1 1 67 67 CYS C C 67 175.659 175.659 175.907 -0.248 25485 18720 1 15 . 1 1 67 67 CYS CA C 67 59.195 59.195 56.642 2.554 25485 18721 1 15 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.775 -1.569 25485 18722 1 15 . 1 1 67 67 CYS H H 67 7.757 7.757 7.982 -0.225 25485 18723 1 15 . 1 1 68 68 GLY N N 68 116.217 116.217 112.008 4.209 25485 18724 1 15 . 1 1 68 68 GLY C C 68 172.210 172.210 174.412 -2.202 25485 18725 1 15 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.287 1.272 25485 18726 1 15 . 1 1 68 68 GLY H H 68 9.704 9.704 9.291 0.413 25485 18727 1 15 . 1 1 69 69 VAL N N 69 126.372 126.372 121.171 5.201 25485 18728 1 15 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.453 -0.622 25485 18729 1 15 . 1 1 69 69 VAL C C 69 173.538 173.538 174.429 -0.891 25485 18730 1 15 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.850 2.518 25485 18731 1 15 . 1 1 69 69 VAL CB C 69 32.523 32.523 34.141 -1.618 25485 18732 1 15 . 1 1 69 69 VAL H H 69 9.113 9.113 7.622 1.491 25485 18733 1 15 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.749 0.201 25485 18734 1 15 . 1 1 70 70 PRO C C 70 175.019 175.019 176.031 -1.012 25485 18735 1 15 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.624 0.724 25485 18736 1 15 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.180 0.178 25485 18737 1 15 . 1 1 71 71 ASP N N 71 118.986 118.986 119.751 -0.765 25485 18738 1 15 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.211 0.222 25485 18739 1 15 . 1 1 71 71 ASP C C 71 175.166 175.166 176.288 -1.122 25485 18740 1 15 . 1 1 71 71 ASP CA C 71 55.368 55.368 56.244 -0.876 25485 18741 1 15 . 1 1 71 71 ASP CB C 71 39.864 39.864 40.999 -1.135 25485 18742 1 15 . 1 1 71 71 ASP H H 71 8.054 8.054 8.544 -0.490 25485 18743 1 15 . 1 1 72 72 VAL N N 72 112.953 112.953 115.138 -2.185 25485 18744 1 15 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.174 0.122 25485 18745 1 15 . 1 1 72 72 VAL C C 72 174.330 174.330 173.954 0.376 25485 18746 1 15 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.813 -1.168 25485 18747 1 15 . 1 1 72 72 VAL CB C 72 33.872 33.872 32.382 1.490 25485 18748 1 15 . 1 1 72 72 VAL H H 72 6.430 6.430 6.928 -0.498 25485 18749 1 15 . 1 1 73 73 ALA N N 73 125.869 125.869 128.142 -2.273 25485 18750 1 15 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.540 -0.235 25485 18751 1 15 . 1 1 73 73 ALA C C 73 177.382 177.382 175.996 1.386 25485 18752 1 15 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.626 0.423 25485 18753 1 15 . 1 1 73 73 ALA CB C 73 19.951 19.951 21.165 -1.214 25485 18754 1 15 . 1 1 73 73 ALA H H 73 8.177 8.177 8.099 0.078 25485 18755 1 15 . 1 1 74 74 GLU N N 74 120.724 120.724 118.563 2.161 25485 18756 1 15 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.351 -0.248 25485 18757 1 15 . 1 1 74 74 GLU C C 74 176.246 176.246 174.096 2.150 25485 18758 1 15 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.710 0.082 25485 18759 1 15 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.160 -1.375 25485 18760 1 15 . 1 1 74 74 GLU H H 74 8.381 8.381 8.363 0.018 25485 18761 1 15 . 1 1 75 75 TYR N N 75 121.473 121.473 121.885 -0.412 25485 18762 1 15 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.603 -0.158 25485 18763 1 15 . 1 1 75 75 TYR C C 75 175.633 175.633 174.714 0.919 25485 18764 1 15 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.289 0.037 25485 18765 1 15 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.865 -0.452 25485 18766 1 15 . 1 1 75 75 TYR H H 75 8.065 8.065 8.584 -0.519 25485 18767 1 15 . 1 1 76 76 SER N N 76 117.860 117.860 116.301 1.559 25485 18768 1 15 . 1 1 76 76 SER HA H 76 3.886 3.886 4.282 -0.396 25485 18769 1 15 . 1 1 76 76 SER C C 76 173.859 173.859 173.590 0.269 25485 18770 1 15 . 1 1 76 76 SER CA C 76 58.250 58.250 59.039 -0.789 25485 18771 1 15 . 1 1 76 76 SER CB C 76 64.117 64.117 63.995 0.122 25485 18772 1 15 . 1 1 76 76 SER H H 76 7.748 7.748 8.479 -0.731 25485 18773 1 15 . 1 1 77 77 LEU N N 77 123.789 123.789 120.808 2.981 25485 18774 1 15 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.637 -0.491 25485 18775 1 15 . 1 1 77 77 LEU C C 77 176.451 176.451 176.757 -0.306 25485 18776 1 15 . 1 1 77 77 LEU CA C 77 55.464 55.464 54.286 1.178 25485 18777 1 15 . 1 1 77 77 LEU CB C 77 41.957 41.957 42.120 -0.163 25485 18778 1 15 . 1 1 77 77 LEU H H 77 7.979 7.979 8.474 -0.495 25485 18779 1 15 . 1 1 78 78 PHE N N 78 119.275 119.275 120.611 -1.336 25485 18780 1 15 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.258 0.618 25485 18781 1 15 . 1 1 78 78 PHE C C 78 173.844 173.844 174.345 -0.501 25485 18782 1 15 . 1 1 78 78 PHE CA C 78 55.372 55.372 60.402 -5.030 25485 18783 1 15 . 1 1 78 78 PHE CB C 78 39.164 39.164 37.275 1.889 25485 18784 1 15 . 1 1 78 78 PHE H H 78 7.827 7.827 8.504 -0.677 25485 18785 1 15 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.438 -0.082 25485 18786 1 15 . 1 1 79 79 PRO C C 79 176.433 176.433 175.575 0.858 25485 18787 1 15 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.856 0.994 25485 18788 1 15 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.068 -0.376 25485 18789 1 15 . 1 1 80 80 ASN N N 80 118.057 118.057 122.284 -4.227 25485 18790 1 15 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.650 -0.003 25485 18791 1 15 . 1 1 80 80 ASN C C 80 174.305 174.305 174.677 -0.372 25485 18792 1 15 . 1 1 80 80 ASN CA C 80 52.860 52.860 53.066 -0.207 25485 18793 1 15 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.409 1.174 25485 18794 1 15 . 1 1 80 80 ASN H H 80 8.068 8.068 8.436 -0.368 25485 18795 1 15 . 1 1 81 81 SER HA H 81 4.565 4.565 4.230 0.335 25485 18796 1 15 . 1 1 81 81 SER CA C 81 56.800 56.800 58.655 -1.855 25485 18797 1 15 . 1 1 81 81 SER CB C 81 63.128 63.128 61.877 1.251 25485 18798 1 15 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.302 0.159 25485 18799 1 15 . 1 1 82 82 PRO C C 82 174.589 174.589 176.523 -1.934 25485 18800 1 15 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.447 -0.801 25485 18801 1 15 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.086 -0.831 25485 18802 1 15 . 1 1 83 83 LYS N N 83 114.578 114.578 118.991 -4.413 25485 18803 1 15 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.317 -0.164 25485 18804 1 15 . 1 1 83 83 LYS C C 83 175.308 175.308 176.382 -1.074 25485 18805 1 15 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.625 -1.218 25485 18806 1 15 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.431 0.987 25485 18807 1 15 . 1 1 83 83 LYS H H 83 7.356 7.356 7.470 -0.114 25485 18808 1 15 . 1 1 84 84 TRP N N 84 122.455 122.455 120.448 2.007 25485 18809 1 15 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.685 -0.665 25485 18810 1 15 . 1 1 84 84 TRP C C 84 177.636 177.636 178.102 -0.466 25485 18811 1 15 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.233 -0.762 25485 18812 1 15 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.867 0.451 25485 18813 1 15 . 1 1 84 84 TRP H H 84 8.050 8.050 8.440 -0.390 25485 18814 1 15 . 1 1 85 85 THR N N 85 113.501 113.501 117.031 -3.530 25485 18815 1 15 . 1 1 85 85 THR HA H 85 4.573 4.573 4.392 0.181 25485 18816 1 15 . 1 1 85 85 THR C C 85 174.757 174.757 174.894 -0.137 25485 18817 1 15 . 1 1 85 85 THR CA C 85 62.130 62.130 61.267 0.863 25485 18818 1 15 . 1 1 85 85 THR CB C 85 69.107 69.107 69.069 0.038 25485 18819 1 15 . 1 1 85 85 THR H H 85 8.861 8.861 8.430 0.431 25485 18820 1 15 . 1 1 86 86 SER N N 86 117.270 117.270 118.015 -0.745 25485 18821 1 15 . 1 1 86 86 SER HA H 86 4.741 4.741 4.639 0.102 25485 18822 1 15 . 1 1 86 86 SER C C 86 173.457 173.457 175.235 -1.778 25485 18823 1 15 . 1 1 86 86 SER CA C 86 56.739 56.739 58.699 -1.960 25485 18824 1 15 . 1 1 86 86 SER CB C 86 64.717 64.717 64.495 0.222 25485 18825 1 15 . 1 1 86 86 SER H H 86 7.743 7.743 8.359 -0.616 25485 18826 1 15 . 1 1 87 87 LYS N N 87 120.329 120.329 119.674 0.655 25485 18827 1 15 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.384 -0.155 25485 18828 1 15 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.141 0.451 25485 18829 1 15 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.652 -0.529 25485 18830 1 15 . 1 1 87 87 LYS H H 87 8.285 8.285 8.399 -0.114 25485 18831 1 15 . 1 1 88 88 VAL N N 88 117.531 117.531 119.145 -1.614 25485 18832 1 15 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.843 -0.188 25485 18833 1 15 . 1 1 88 88 VAL C C 88 174.868 174.868 173.724 1.144 25485 18834 1 15 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.296 -0.201 25485 18835 1 15 . 1 1 88 88 VAL CB C 88 33.695 33.695 34.539 -0.844 25485 18836 1 15 . 1 1 88 88 VAL H H 88 7.428 7.428 7.350 0.078 25485 18837 1 15 . 1 1 89 89 VAL N N 89 131.452 131.452 124.568 6.884 25485 18838 1 15 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.143 0.016 25485 18839 1 15 . 1 1 89 89 VAL C C 89 175.758 175.758 174.873 0.885 25485 18840 1 15 . 1 1 89 89 VAL CA C 89 60.721 60.721 59.841 0.880 25485 18841 1 15 . 1 1 89 89 VAL CB C 89 34.173 34.173 32.992 1.181 25485 18842 1 15 . 1 1 89 89 VAL H H 89 8.603 8.603 9.034 -0.431 25485 18843 1 15 . 1 1 90 90 THR N N 90 118.206 118.206 115.700 2.506 25485 18844 1 15 . 1 1 90 90 THR HA H 90 5.649 5.649 5.122 0.527 25485 18845 1 15 . 1 1 90 90 THR C C 90 174.579 174.579 173.565 1.014 25485 18846 1 15 . 1 1 90 90 THR CA C 90 58.959 58.959 59.396 -0.437 25485 18847 1 15 . 1 1 90 90 THR CB C 90 72.288 72.288 72.808 -0.520 25485 18848 1 15 . 1 1 90 90 THR H H 90 9.021 9.021 8.016 1.005 25485 18849 1 15 . 1 1 91 91 TYR N N 91 118.117 118.117 115.360 2.757 25485 18850 1 15 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.521 0.177 25485 18851 1 15 . 1 1 91 91 TYR C C 91 171.233 171.233 172.736 -1.503 25485 18852 1 15 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.884 -0.452 25485 18853 1 15 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.033 1.227 25485 18854 1 15 . 1 1 91 91 TYR H H 91 8.555 8.555 7.977 0.578 25485 18855 1 15 . 1 1 92 92 ARG N N 92 120.252 120.252 120.246 0.006 25485 18856 1 15 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.609 0.088 25485 18857 1 15 . 1 1 92 92 ARG C C 92 173.932 173.932 174.736 -0.804 25485 18858 1 15 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.733 0.108 25485 18859 1 15 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.644 0.042 25485 18860 1 15 . 1 1 92 92 ARG H H 92 8.520 8.520 9.015 -0.495 25485 18861 1 15 . 1 1 93 93 ILE N N 93 128.305 128.305 127.754 0.551 25485 18862 1 15 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.235 0.397 25485 18863 1 15 . 1 1 93 93 ILE C C 93 175.468 175.468 176.510 -1.042 25485 18864 1 15 . 1 1 93 93 ILE CA C 93 61.228 61.228 62.681 -1.453 25485 18865 1 15 . 1 1 93 93 ILE CB C 93 37.225 37.225 37.800 -0.575 25485 18866 1 15 . 1 1 93 93 ILE H H 93 8.886 8.886 8.878 0.008 25485 18867 1 15 . 1 1 94 94 VAL N N 94 126.647 126.647 128.272 -1.625 25485 18868 1 15 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.039 -0.043 25485 18869 1 15 . 1 1 94 94 VAL C C 94 175.670 175.670 176.368 -0.698 25485 18870 1 15 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.634 -1.220 25485 18871 1 15 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.530 0.489 25485 18872 1 15 . 1 1 94 94 VAL H H 94 9.517 9.517 8.310 1.207 25485 18873 1 15 . 1 1 95 95 SER N N 95 113.398 113.398 111.233 2.165 25485 18874 1 15 . 1 1 95 95 SER HA H 95 4.701 4.701 4.651 0.050 25485 18875 1 15 . 1 1 95 95 SER C C 95 170.684 170.684 172.532 -1.848 25485 18876 1 15 . 1 1 95 95 SER CA C 95 56.945 56.945 57.500 -0.555 25485 18877 1 15 . 1 1 95 95 SER CB C 95 65.276 65.276 64.828 0.448 25485 18878 1 15 . 1 1 95 95 SER H H 95 7.463 7.463 7.614 -0.151 25485 18879 1 15 . 1 1 96 96 TYR N N 96 116.512 116.512 118.286 -1.774 25485 18880 1 15 . 1 1 96 96 TYR HA H 96 4.264 4.264 5.107 -0.843 25485 18881 1 15 . 1 1 96 96 TYR C C 96 174.856 174.856 173.959 0.897 25485 18882 1 15 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.148 2.489 25485 18883 1 15 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.350 0.813 25485 18884 1 15 . 1 1 96 96 TYR H H 96 8.240 8.240 8.100 0.140 25485 18885 1 15 . 1 1 97 97 THR CA C 97 57.798 57.798 59.308 -1.510 25485 18886 1 15 . 1 1 97 97 THR CB C 97 67.420 67.420 69.883 -2.463 25485 18887 1 15 . 1 1 98 98 ARG N N 98 128.156 128.156 126.550 1.606 25485 18888 1 15 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.062 0.263 25485 18889 1 15 . 1 1 98 98 ARG C C 98 177.625 177.625 176.860 0.765 25485 18890 1 15 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.141 -0.927 25485 18891 1 15 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.284 0.196 25485 18892 1 15 . 1 1 98 98 ARG H H 98 8.914 8.914 8.694 0.220 25485 18893 1 15 . 1 1 99 99 ASP N N 99 120.592 120.592 119.556 1.036 25485 18894 1 15 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.473 -0.092 25485 18895 1 15 . 1 1 99 99 ASP C C 99 175.679 175.679 175.970 -0.291 25485 18896 1 15 . 1 1 99 99 ASP CA C 99 56.436 56.436 56.720 -0.284 25485 18897 1 15 . 1 1 99 99 ASP CB C 99 42.370 42.370 42.124 0.246 25485 18898 1 15 . 1 1 99 99 ASP H H 99 8.708 8.708 7.685 1.023 25485 18899 1 15 . 1 1 100 100 LEU N N 100 116.829 116.829 117.151 -0.322 25485 18900 1 15 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.711 0.245 25485 18901 1 15 . 1 1 100 100 LEU C C 100 173.335 173.335 173.867 -0.532 25485 18902 1 15 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.932 -0.895 25485 18903 1 15 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.582 1.685 25485 18904 1 15 . 1 1 100 100 LEU H H 100 6.916 6.916 7.748 -0.832 25485 18905 1 15 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.048 0.127 25485 18906 1 15 . 1 1 102 102 HIS C C 102 177.649 177.649 177.364 0.285 25485 18907 1 15 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.023 -0.350 25485 18908 1 15 . 1 1 102 102 HIS CB C 102 28.434 28.434 29.870 -1.436 25485 18909 1 15 . 1 1 103 103 ILE N N 103 115.170 115.170 117.775 -2.605 25485 18910 1 15 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.774 0.399 25485 18911 1 15 . 1 1 103 103 ILE C C 103 177.214 177.214 177.081 0.133 25485 18912 1 15 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.222 -1.057 25485 18913 1 15 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.863 -0.098 25485 18914 1 15 . 1 1 103 103 ILE H H 103 8.234 8.234 8.065 0.169 25485 18915 1 15 . 1 1 104 104 THR N N 104 119.374 119.374 116.993 2.381 25485 18916 1 15 . 1 1 104 104 THR HA H 104 4.045 4.045 3.997 0.048 25485 18917 1 15 . 1 1 104 104 THR C C 104 175.612 175.612 176.269 -0.657 25485 18918 1 15 . 1 1 104 104 THR CA C 104 66.568 66.568 66.989 -0.421 25485 18919 1 15 . 1 1 104 104 THR CB C 104 68.077 68.077 68.491 -0.414 25485 18920 1 15 . 1 1 104 104 THR H H 104 6.947 6.947 7.597 -0.650 25485 18921 1 15 . 1 1 105 105 VAL N N 105 123.263 123.263 121.100 2.163 25485 18922 1 15 . 1 1 105 105 VAL HA H 105 3.438 3.438 2.947 0.491 25485 18923 1 15 . 1 1 105 105 VAL C C 105 177.322 177.322 176.722 0.600 25485 18924 1 15 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.516 0.431 25485 18925 1 15 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.411 -0.142 25485 18926 1 15 . 1 1 105 105 VAL H H 105 7.407 7.407 8.156 -0.749 25485 18927 1 15 . 1 1 106 106 ASP N N 106 119.972 119.972 119.511 0.461 25485 18928 1 15 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.341 -0.019 25485 18929 1 15 . 1 1 106 106 ASP C C 106 179.747 179.747 178.317 1.430 25485 18930 1 15 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.629 0.606 25485 18931 1 15 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.982 -0.620 25485 18932 1 15 . 1 1 106 106 ASP H H 106 8.627 8.627 7.878 0.749 25485 18933 1 15 . 1 1 107 107 ARG N N 107 121.033 121.033 119.128 1.905 25485 18934 1 15 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.117 0.061 25485 18935 1 15 . 1 1 107 107 ARG C C 107 179.485 179.485 178.607 0.878 25485 18936 1 15 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.661 0.919 25485 18937 1 15 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.419 0.789 25485 18938 1 15 . 1 1 107 107 ARG H H 107 8.356 8.356 7.840 0.516 25485 18939 1 15 . 1 1 108 108 LEU N N 108 121.463 121.463 120.700 0.763 25485 18940 1 15 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.218 0.087 25485 18941 1 15 . 1 1 108 108 LEU C C 108 178.852 178.852 179.041 -0.189 25485 18942 1 15 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.552 0.330 25485 18943 1 15 . 1 1 108 108 LEU CB C 108 41.315 41.315 40.930 0.385 25485 18944 1 15 . 1 1 108 108 LEU H H 108 8.790 8.790 7.808 0.982 25485 18945 1 15 . 1 1 109 109 VAL N N 109 120.233 120.233 117.715 2.518 25485 18946 1 15 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.710 -0.310 25485 18947 1 15 . 1 1 109 109 VAL C C 109 177.019 177.019 177.785 -0.766 25485 18948 1 15 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.437 1.609 25485 18949 1 15 . 1 1 109 109 VAL CB C 109 31.189 31.189 30.510 0.679 25485 18950 1 15 . 1 1 109 109 VAL H H 109 8.787 8.787 7.960 0.827 25485 18951 1 15 . 1 1 110 110 SER N N 110 112.862 112.862 115.894 -3.032 25485 18952 1 15 . 1 1 110 110 SER HA H 110 4.300 4.300 4.088 0.212 25485 18953 1 15 . 1 1 110 110 SER C C 110 176.770 176.770 176.794 -0.024 25485 18954 1 15 . 1 1 110 110 SER CA C 110 61.744 61.744 61.602 0.142 25485 18955 1 15 . 1 1 110 110 SER CB C 110 62.742 62.742 62.702 0.040 25485 18956 1 15 . 1 1 110 110 SER H H 110 7.605 7.605 7.824 -0.219 25485 18957 1 15 . 1 1 111 111 LYS N N 111 122.319 122.319 122.074 0.245 25485 18958 1 15 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.105 -0.044 25485 18959 1 15 . 1 1 111 111 LYS C C 111 178.309 178.309 178.781 -0.472 25485 18960 1 15 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.347 0.467 25485 18961 1 15 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.592 -0.083 25485 18962 1 15 . 1 1 111 111 LYS H H 111 8.156 8.156 7.944 0.212 25485 18963 1 15 . 1 1 112 112 ALA N N 112 124.147 124.147 121.256 2.891 25485 18964 1 15 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.440 -0.341 25485 18965 1 15 . 1 1 112 112 ALA C C 112 179.445 179.445 179.129 0.316 25485 18966 1 15 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.526 0.700 25485 18967 1 15 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.035 0.939 25485 18968 1 15 . 1 1 112 112 ALA H H 112 8.278 8.278 7.779 0.499 25485 18969 1 15 . 1 1 113 113 LEU N N 113 116.195 116.195 120.568 -4.373 25485 18970 1 15 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.112 -0.361 25485 18971 1 15 . 1 1 113 113 LEU C C 113 179.537 179.537 177.957 1.580 25485 18972 1 15 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.001 -0.257 25485 18973 1 15 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.969 -1.414 25485 18974 1 15 . 1 1 113 113 LEU H H 113 8.021 8.021 8.567 -0.546 25485 18975 1 15 . 1 1 114 114 ASN N N 114 116.570 116.570 117.753 -1.183 25485 18976 1 15 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.533 0.013 25485 18977 1 15 . 1 1 114 114 ASN C C 114 177.136 177.136 177.563 -0.427 25485 18978 1 15 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.491 -0.727 25485 18979 1 15 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.489 0.134 25485 18980 1 15 . 1 1 114 114 ASN H H 114 8.212 8.212 8.409 -0.197 25485 18981 1 15 . 1 1 115 115 MET N N 115 122.055 122.055 119.020 3.035 25485 18982 1 15 . 1 1 115 115 MET HA H 115 4.010 4.010 4.027 -0.017 25485 18983 1 15 . 1 1 115 115 MET C C 115 177.681 177.681 178.012 -0.331 25485 18984 1 15 . 1 1 115 115 MET CA C 115 59.445 59.445 59.014 0.431 25485 18985 1 15 . 1 1 115 115 MET CB C 115 31.616 31.616 32.271 -0.655 25485 18986 1 15 . 1 1 115 115 MET H H 115 7.937 7.937 7.636 0.301 25485 18987 1 15 . 1 1 116 116 TRP N N 116 117.115 117.115 118.329 -1.214 25485 18988 1 15 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.331 0.187 25485 18989 1 15 . 1 1 116 116 TRP C C 116 179.054 179.054 179.175 -0.121 25485 18990 1 15 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.011 0.500 25485 18991 1 15 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.668 1.205 25485 18992 1 15 . 1 1 116 116 TRP H H 116 6.783 6.783 7.530 -0.747 25485 18993 1 15 . 1 1 117 117 GLY N N 117 104.511 104.511 106.427 -1.916 25485 18994 1 15 . 1 1 117 117 GLY C C 117 175.035 175.035 176.130 -1.095 25485 18995 1 15 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.477 0.520 25485 18996 1 15 . 1 1 117 117 GLY H H 117 9.302 9.302 8.253 1.049 25485 18997 1 15 . 1 1 118 118 LYS N N 118 118.580 118.580 120.001 -1.421 25485 18998 1 15 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.000 0.207 25485 18999 1 15 . 1 1 118 118 LYS C C 118 177.235 177.235 177.535 -0.300 25485 19000 1 15 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.798 0.093 25485 19001 1 15 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.959 -0.054 25485 19002 1 15 . 1 1 118 118 LYS H H 118 7.940 7.940 7.833 0.107 25485 19003 1 15 . 1 1 119 119 GLU N N 119 113.749 113.749 116.225 -2.476 25485 19004 1 15 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.360 0.478 25485 19005 1 15 . 1 1 119 119 GLU C C 119 178.024 178.024 175.781 2.243 25485 19006 1 15 . 1 1 119 119 GLU CA C 119 55.275 55.275 56.292 -1.017 25485 19007 1 15 . 1 1 119 119 GLU CB C 119 30.686 30.686 30.578 0.108 25485 19008 1 15 . 1 1 119 119 GLU H H 119 7.763 7.763 7.624 0.139 25485 19009 1 15 . 1 1 120 120 ILE N N 120 111.144 111.144 113.703 -2.559 25485 19010 1 15 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.648 0.723 25485 19011 1 15 . 1 1 120 120 ILE C C 120 174.033 174.033 173.379 0.654 25485 19012 1 15 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.279 1.175 25485 19013 1 15 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.332 2.597 25485 19014 1 15 . 1 1 120 120 ILE H H 120 7.518 7.518 7.456 0.062 25485 19015 1 15 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.319 0.343 25485 19016 1 15 . 1 1 121 121 PRO C C 121 174.784 174.784 176.837 -2.053 25485 19017 1 15 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.354 -1.339 25485 19018 1 15 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.518 -2.134 25485 19019 1 15 . 1 1 122 122 LEU N N 122 121.531 121.531 119.355 2.176 25485 19020 1 15 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.244 0.095 25485 19021 1 15 . 1 1 122 122 LEU C C 122 173.977 173.977 176.787 -2.810 25485 19022 1 15 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.363 -0.805 25485 19023 1 15 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.575 2.824 25485 19024 1 15 . 1 1 122 122 LEU H H 122 6.847 6.847 7.503 -0.656 25485 19025 1 15 . 1 1 123 123 HIS N N 123 121.054 121.054 117.215 3.839 25485 19026 1 15 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.680 -0.073 25485 19027 1 15 . 1 1 123 123 HIS C C 123 172.820 172.820 173.618 -0.798 25485 19028 1 15 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.222 -0.713 25485 19029 1 15 . 1 1 123 123 HIS CB C 123 33.110 33.110 31.897 1.213 25485 19030 1 15 . 1 1 123 123 HIS H H 123 7.760 7.760 8.463 -0.703 25485 19031 1 15 . 1 1 124 124 PHE N N 124 120.465 120.465 124.261 -3.796 25485 19032 1 15 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.458 0.376 25485 19033 1 15 . 1 1 124 124 PHE C C 124 175.677 175.677 175.843 -0.166 25485 19034 1 15 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.337 0.955 25485 19035 1 15 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.107 0.715 25485 19036 1 15 . 1 1 124 124 PHE H H 124 8.306 8.306 8.650 -0.344 25485 19037 1 15 . 1 1 125 125 ARG N N 125 124.008 124.008 123.730 0.278 25485 19038 1 15 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.757 -0.046 25485 19039 1 15 . 1 1 125 125 ARG C C 125 172.901 172.901 175.276 -2.375 25485 19040 1 15 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.876 -0.602 25485 19041 1 15 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.210 -0.388 25485 19042 1 15 . 1 1 125 125 ARG H H 125 8.426 8.426 8.513 -0.087 25485 19043 1 15 . 1 1 126 126 LYS N N 126 130.004 130.004 123.853 6.151 25485 19044 1 15 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.166 -0.783 25485 19045 1 15 . 1 1 126 126 LYS C C 126 176.126 176.126 175.651 0.475 25485 19046 1 15 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.742 0.439 25485 19047 1 15 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.552 -0.525 25485 19048 1 15 . 1 1 126 126 LYS H H 126 8.481 8.481 8.568 -0.087 25485 19049 1 15 . 1 1 127 127 VAL N N 127 125.288 125.288 120.538 4.750 25485 19050 1 15 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.165 0.340 25485 19051 1 15 . 1 1 127 127 VAL C C 127 175.565 175.565 175.099 0.466 25485 19052 1 15 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.484 -1.535 25485 19053 1 15 . 1 1 127 127 VAL CB C 127 34.362 34.362 31.972 2.390 25485 19054 1 15 . 1 1 127 127 VAL H H 127 8.721 8.721 8.202 0.519 25485 19055 1 15 . 1 1 128 128 VAL N N 128 117.467 117.467 120.573 -3.106 25485 19056 1 15 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.012 0.317 25485 19057 1 15 . 1 1 128 128 VAL C C 128 174.622 174.622 174.732 -0.110 25485 19058 1 15 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.780 0.338 25485 19059 1 15 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.811 0.699 25485 19060 1 15 . 1 1 128 128 VAL H H 128 8.406 8.406 8.055 0.351 25485 19061 1 15 . 1 1 129 129 TRP N N 129 119.986 119.986 121.196 -1.210 25485 19062 1 15 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.829 -0.113 25485 19063 1 15 . 1 1 129 129 TRP C C 129 174.536 174.536 176.244 -1.708 25485 19064 1 15 . 1 1 129 129 TRP CA C 129 55.917 55.917 57.109 -1.192 25485 19065 1 15 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.458 2.556 25485 19066 1 15 . 1 1 129 129 TRP H H 129 7.435 7.435 7.278 0.157 25485 19067 1 15 . 1 1 130 130 GLY N N 130 109.900 109.900 113.641 -3.741 25485 19068 1 15 . 1 1 130 130 GLY C C 130 173.187 173.187 174.043 -0.856 25485 19069 1 15 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.471 0.009 25485 19070 1 15 . 1 1 130 130 GLY H H 130 8.006 8.006 8.361 -0.355 25485 19071 1 15 . 1 1 131 131 THR N N 131 116.142 116.142 114.897 1.245 25485 19072 1 15 . 1 1 131 131 THR HA H 131 4.162 4.162 4.456 -0.294 25485 19073 1 15 . 1 1 131 131 THR C C 131 172.766 172.766 173.728 -0.962 25485 19074 1 15 . 1 1 131 131 THR CA C 131 63.212 63.212 61.129 2.083 25485 19075 1 15 . 1 1 131 131 THR CB C 131 69.308 69.308 69.931 -0.623 25485 19076 1 15 . 1 1 131 131 THR H H 131 8.233 8.233 8.119 0.114 25485 19077 1 15 . 1 1 132 132 ALA N N 132 129.807 129.807 123.990 5.817 25485 19078 1 15 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.544 -0.028 25485 19079 1 15 . 1 1 132 132 ALA C C 132 175.358 175.358 176.291 -0.933 25485 19080 1 15 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.742 -1.376 25485 19081 1 15 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.223 1.575 25485 19082 1 15 . 1 1 132 132 ALA H H 132 7.962 7.962 8.465 -0.503 25485 19083 1 15 . 1 1 133 133 ASP N N 133 122.896 122.896 120.177 2.719 25485 19084 1 15 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.656 -0.235 25485 19085 1 15 . 1 1 133 133 ASP C C 133 177.314 177.314 176.852 0.462 25485 19086 1 15 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.790 1.129 25485 19087 1 15 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.947 -1.476 25485 19088 1 15 . 1 1 133 133 ASP H H 133 8.251 8.251 8.330 -0.079 25485 19089 1 15 . 1 1 134 134 ILE N N 134 125.472 125.472 120.552 4.920 25485 19090 1 15 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.527 -0.384 25485 19091 1 15 . 1 1 134 134 ILE C C 134 174.201 174.201 174.939 -0.738 25485 19092 1 15 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.473 -0.202 25485 19093 1 15 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.168 -0.458 25485 19094 1 15 . 1 1 134 134 ILE H H 134 8.802 8.802 8.145 0.657 25485 19095 1 15 . 1 1 135 135 MET N N 135 127.265 127.265 126.153 1.112 25485 19096 1 15 . 1 1 135 135 MET HA H 135 5.192 5.192 5.409 -0.217 25485 19097 1 15 . 1 1 135 135 MET C C 135 176.206 176.206 175.669 0.537 25485 19098 1 15 . 1 1 135 135 MET CA C 135 53.626 53.626 52.153 1.473 25485 19099 1 15 . 1 1 135 135 MET CB C 135 32.639 32.639 33.877 -1.238 25485 19100 1 15 . 1 1 135 135 MET H H 135 7.418 7.418 8.957 -1.539 25485 19101 1 15 . 1 1 136 136 ILE N N 136 125.440 125.440 124.284 1.156 25485 19102 1 15 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.805 0.784 25485 19103 1 15 . 1 1 136 136 ILE C C 136 175.190 175.190 175.453 -0.263 25485 19104 1 15 . 1 1 136 136 ILE CA C 136 60.108 60.108 59.077 1.031 25485 19105 1 15 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.349 4.591 25485 19106 1 15 . 1 1 136 136 ILE H H 136 9.124 9.124 8.628 0.496 25485 19107 1 15 . 1 1 137 137 GLY N N 137 112.211 112.211 112.884 -0.673 25485 19108 1 15 . 1 1 137 137 GLY C C 137 170.855 170.855 171.758 -0.903 25485 19109 1 15 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.895 1.510 25485 19110 1 15 . 1 1 137 137 GLY H H 137 8.594 8.594 7.841 0.753 25485 19111 1 15 . 1 1 138 138 PHE N N 138 119.463 119.463 118.597 0.866 25485 19112 1 15 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.170 0.326 25485 19113 1 15 . 1 1 138 138 PHE C C 138 175.186 175.186 175.462 -0.276 25485 19114 1 15 . 1 1 138 138 PHE CA C 138 55.995 55.995 56.697 -0.702 25485 19115 1 15 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.306 0.137 25485 19116 1 15 . 1 1 138 138 PHE H H 138 7.857 7.857 8.572 -0.715 25485 19117 1 15 . 1 1 139 139 ALA N N 139 123.914 123.914 124.331 -0.417 25485 19118 1 15 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.669 0.062 25485 19119 1 15 . 1 1 139 139 ALA C C 139 174.613 174.613 175.291 -0.678 25485 19120 1 15 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.226 -1.191 25485 19121 1 15 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.881 1.591 25485 19122 1 15 . 1 1 139 139 ALA H H 139 8.955 8.955 8.416 0.539 25485 19123 1 15 . 1 1 140 140 ARG N N 140 118.339 118.339 120.238 -1.899 25485 19124 1 15 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.816 0.290 25485 19125 1 15 . 1 1 140 140 ARG C C 140 176.201 176.201 178.245 -2.044 25485 19126 1 15 . 1 1 140 140 ARG CA C 140 54.166 54.166 55.275 -1.109 25485 19127 1 15 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.341 1.128 25485 19128 1 15 . 1 1 140 140 ARG H H 140 8.546 8.546 8.490 0.056 25485 19129 1 15 . 1 1 141 141 GLY N N 141 108.916 108.916 108.582 0.334 25485 19130 1 15 . 1 1 141 141 GLY C C 141 175.595 175.595 175.022 0.573 25485 19131 1 15 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.264 -0.974 25485 19132 1 15 . 1 1 141 141 GLY H H 141 8.989 8.989 9.346 -0.357 25485 19133 1 15 . 1 1 142 142 ALA N N 142 121.448 121.448 121.219 0.229 25485 19134 1 15 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.383 0.025 25485 19135 1 15 . 1 1 142 142 ALA C C 142 177.027 177.027 177.579 -0.552 25485 19136 1 15 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.250 1.027 25485 19137 1 15 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.133 -0.169 25485 19138 1 15 . 1 1 142 142 ALA H H 142 8.642 8.642 8.154 0.488 25485 19139 1 15 . 1 1 143 143 HIS N N 143 120.356 120.356 114.785 5.571 25485 19140 1 15 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.518 0.639 25485 19141 1 15 . 1 1 143 143 HIS C C 143 174.303 174.303 176.087 -1.784 25485 19142 1 15 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.472 -0.019 25485 19143 1 15 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.466 -1.675 25485 19144 1 15 . 1 1 143 143 HIS H H 143 8.990 8.990 7.975 1.015 25485 19145 1 15 . 1 1 144 144 GLY N N 144 112.517 112.517 108.279 4.238 25485 19146 1 15 . 1 1 144 144 GLY C C 144 173.758 173.758 173.187 0.571 25485 19147 1 15 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.872 1.223 25485 19148 1 15 . 1 1 144 144 GLY H H 144 5.175 5.175 7.766 -2.591 25485 19149 1 15 . 1 1 145 145 ASP N N 145 117.762 117.762 118.054 -0.292 25485 19150 1 15 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.738 -0.040 25485 19151 1 15 . 1 1 145 145 ASP C C 145 175.851 175.851 175.369 0.482 25485 19152 1 15 . 1 1 145 145 ASP CA C 145 51.959 51.959 53.090 -1.131 25485 19153 1 15 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.191 -0.392 25485 19154 1 15 . 1 1 145 145 ASP H H 145 7.096 7.096 7.483 -0.387 25485 19155 1 15 . 1 1 146 146 SER N N 146 125.540 125.540 115.991 9.549 25485 19156 1 15 . 1 1 146 146 SER HA H 146 4.204 4.204 4.383 -0.179 25485 19157 1 15 . 1 1 146 146 SER C C 146 172.319 172.319 174.343 -2.024 25485 19158 1 15 . 1 1 146 146 SER CA C 146 58.862 58.862 59.178 -0.317 25485 19159 1 15 . 1 1 146 146 SER CB C 146 62.933 62.933 63.945 -1.012 25485 19160 1 15 . 1 1 146 146 SER H H 146 8.261 8.261 8.581 -0.320 25485 19161 1 15 . 1 1 147 147 TYR N N 147 120.757 120.757 118.962 1.795 25485 19162 1 15 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.291 0.531 25485 19163 1 15 . 1 1 147 147 TYR C C 147 170.372 170.372 173.630 -3.258 25485 19164 1 15 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.253 -3.985 25485 19165 1 15 . 1 1 147 147 TYR CB C 147 38.296 38.296 38.289 0.007 25485 19166 1 15 . 1 1 147 147 TYR H H 147 7.450 7.450 8.376 -0.926 25485 19167 1 15 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.259 0.613 25485 19168 1 15 . 1 1 148 148 PRO C C 148 179.009 179.009 176.232 2.777 25485 19169 1 15 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.153 1.222 25485 19170 1 15 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.023 -1.113 25485 19171 1 15 . 1 1 149 149 PHE N N 149 120.514 120.514 118.290 2.224 25485 19172 1 15 . 1 1 149 149 PHE C C 149 176.813 176.813 175.963 0.850 25485 19173 1 15 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.541 -1.087 25485 19174 1 15 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.578 -0.005 25485 19175 1 15 . 1 1 149 149 PHE H H 149 8.024 8.024 7.565 0.459 25485 19176 1 15 . 1 1 150 150 ASP N N 150 115.555 115.555 116.624 -1.069 25485 19177 1 15 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.301 0.538 25485 19178 1 15 . 1 1 150 150 ASP C C 150 177.007 177.007 176.402 0.605 25485 19179 1 15 . 1 1 150 150 ASP CA C 150 53.871 53.871 55.112 -1.241 25485 19180 1 15 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.649 2.287 25485 19181 1 15 . 1 1 150 150 ASP H H 150 7.511 7.511 7.817 -0.306 25485 19182 1 15 . 1 1 151 151 GLY N N 151 110.650 110.650 110.285 0.365 25485 19183 1 15 . 1 1 151 151 GLY C C 151 170.281 170.281 172.453 -2.172 25485 19184 1 15 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.761 -0.363 25485 19185 1 15 . 1 1 151 151 GLY H H 151 9.080 9.080 8.026 1.054 25485 19186 1 15 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.497 -0.441 25485 19187 1 15 . 1 1 152 152 PRO C C 152 178.300 178.300 176.815 1.485 25485 19188 1 15 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.046 0.804 25485 19189 1 15 . 1 1 152 152 PRO CB C 152 31.260 31.260 32.170 -0.910 25485 19190 1 15 . 1 1 153 153 GLY N N 153 118.783 118.783 113.614 5.169 25485 19191 1 15 . 1 1 153 153 GLY C C 153 174.098 174.098 173.110 0.988 25485 19192 1 15 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.412 -0.806 25485 19193 1 15 . 1 1 153 153 GLY H H 153 11.431 11.431 8.898 2.533 25485 19194 1 15 . 1 1 154 154 ASN N N 154 120.679 120.679 120.743 -0.064 25485 19195 1 15 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.439 -0.195 25485 19196 1 15 . 1 1 154 154 ASN C C 154 174.636 174.636 175.104 -0.468 25485 19197 1 15 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.473 2.195 25485 19198 1 15 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.110 -1.139 25485 19199 1 15 . 1 1 154 154 ASN H H 154 9.247 9.247 8.445 0.802 25485 19200 1 15 . 1 1 155 155 THR N N 155 118.252 118.252 111.374 6.878 25485 19201 1 15 . 1 1 155 155 THR HA H 155 5.577 5.577 4.292 1.285 25485 19202 1 15 . 1 1 155 155 THR C C 155 176.596 176.596 173.038 3.558 25485 19203 1 15 . 1 1 155 155 THR CA C 155 61.731 61.731 62.693 -0.962 25485 19204 1 15 . 1 1 155 155 THR CB C 155 71.325 71.325 69.227 2.098 25485 19205 1 15 . 1 1 155 155 THR H H 155 9.501 9.501 8.623 0.878 25485 19206 1 15 . 1 1 156 156 LEU N N 156 122.598 122.598 122.163 0.435 25485 19207 1 15 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.610 0.261 25485 19208 1 15 . 1 1 156 156 LEU C C 156 175.655 175.655 175.839 -0.184 25485 19209 1 15 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.549 -1.011 25485 19210 1 15 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.928 1.583 25485 19211 1 15 . 1 1 156 156 LEU H H 156 8.492 8.492 8.387 0.105 25485 19212 1 15 . 1 1 157 157 ALA N N 157 115.389 115.389 115.804 -0.415 25485 19213 1 15 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.558 0.477 25485 19214 1 15 . 1 1 157 157 ALA C C 157 175.739 175.739 175.174 0.565 25485 19215 1 15 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.591 -0.652 25485 19216 1 15 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.921 1.533 25485 19217 1 15 . 1 1 157 157 ALA H H 157 7.567 7.567 7.950 -0.383 25485 19218 1 15 . 1 1 158 158 HIS N N 158 111.900 111.900 118.490 -6.590 25485 19219 1 15 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.955 -0.350 25485 19220 1 15 . 1 1 158 158 HIS C C 158 170.186 170.186 172.408 -2.222 25485 19221 1 15 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.031 2.044 25485 19222 1 15 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.025 -0.839 25485 19223 1 15 . 1 1 158 158 HIS H H 158 8.757 8.757 7.786 0.971 25485 19224 1 15 . 1 1 159 159 ALA N N 159 118.286 118.286 127.324 -9.038 25485 19225 1 15 . 1 1 159 159 ALA HA H 159 4.654 4.654 3.968 0.686 25485 19226 1 15 . 1 1 159 159 ALA C C 159 174.036 174.036 175.225 -1.189 25485 19227 1 15 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.513 0.620 25485 19228 1 15 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.763 2.274 25485 19229 1 15 . 1 1 159 159 ALA H H 159 6.110 6.110 8.140 -2.030 25485 19230 1 15 . 1 1 160 160 PHE N N 160 117.937 117.937 119.598 -1.661 25485 19231 1 15 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.760 -0.257 25485 19232 1 15 . 1 1 160 160 PHE C C 160 174.455 174.455 174.317 0.138 25485 19233 1 15 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.205 1.608 25485 19234 1 15 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.629 0.565 25485 19235 1 15 . 1 1 160 160 PHE H H 160 7.912 7.912 7.636 0.276 25485 19236 1 15 . 1 1 161 161 ALA N N 161 123.531 123.531 121.813 1.718 25485 19237 1 15 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.592 -0.101 25485 19238 1 15 . 1 1 161 161 ALA C C 161 175.503 175.503 175.780 -0.277 25485 19239 1 15 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.114 1.519 25485 19240 1 15 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.336 -2.780 25485 19241 1 15 . 1 1 161 161 ALA H H 161 8.107 8.107 8.465 -0.358 25485 19242 1 15 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.034 -1.124 25485 19243 1 15 . 1 1 162 162 PRO C C 162 173.465 173.465 175.774 -2.309 25485 19244 1 15 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.543 1.714 25485 19245 1 15 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.509 1.733 25485 19246 1 15 . 1 1 163 163 GLY N N 163 107.206 107.206 109.468 -2.262 25485 19247 1 15 . 1 1 163 163 GLY C C 163 172.092 172.092 173.544 -1.452 25485 19248 1 15 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.324 -0.331 25485 19249 1 15 . 1 1 163 163 GLY H H 163 5.997 5.997 7.783 -1.786 25485 19250 1 15 . 1 1 165 165 GLY N N 165 103.110 103.110 108.081 -4.971 25485 19251 1 15 . 1 1 165 165 GLY C C 165 177.158 177.158 174.704 2.454 25485 19252 1 15 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.088 -0.845 25485 19253 1 15 . 1 1 165 165 GLY H H 165 9.145 9.145 7.973 1.172 25485 19254 1 15 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.204 -0.025 25485 19255 1 15 . 1 1 166 166 LEU C C 166 176.437 176.437 177.485 -1.048 25485 19256 1 15 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.060 0.140 25485 19257 1 15 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.316 -0.482 25485 19258 1 15 . 1 1 167 167 GLY N N 167 103.318 103.318 104.283 -0.965 25485 19259 1 15 . 1 1 167 167 GLY C C 167 174.803 174.803 174.387 0.416 25485 19260 1 15 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.745 2.488 25485 19261 1 15 . 1 1 167 167 GLY H H 167 7.768 7.768 7.409 0.359 25485 19262 1 15 . 1 1 168 168 GLY N N 168 121.051 121.051 106.693 14.358 25485 19263 1 15 . 1 1 168 168 GLY C C 168 172.122 172.122 173.693 -1.571 25485 19264 1 15 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.175 1.427 25485 19265 1 15 . 1 1 168 168 GLY H H 168 7.698 7.698 8.035 -0.337 25485 19266 1 15 . 1 1 169 169 ASP N N 169 123.641 123.641 119.774 3.867 25485 19267 1 15 . 1 1 169 169 ASP C C 169 173.942 173.942 173.614 0.328 25485 19268 1 15 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.064 2.778 25485 19269 1 15 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.953 -3.083 25485 19270 1 15 . 1 1 169 169 ASP H H 169 8.595 8.595 7.522 1.073 25485 19271 1 15 . 1 1 170 170 ALA N N 170 119.366 119.366 120.743 -1.377 25485 19272 1 15 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.364 0.366 25485 19273 1 15 . 1 1 170 170 ALA C C 170 174.593 174.593 175.146 -0.553 25485 19274 1 15 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.728 0.396 25485 19275 1 15 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.093 1.242 25485 19276 1 15 . 1 1 170 170 ALA H H 170 8.324 8.324 8.368 -0.044 25485 19277 1 15 . 1 1 171 171 HIS N N 171 120.239 120.239 121.017 -0.778 25485 19278 1 15 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.268 0.480 25485 19279 1 15 . 1 1 171 171 HIS C C 171 172.949 172.949 173.894 -0.945 25485 19280 1 15 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.070 -2.346 25485 19281 1 15 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.783 1.758 25485 19282 1 15 . 1 1 171 171 HIS H H 171 8.499 8.499 7.688 0.811 25485 19283 1 15 . 1 1 172 172 PHE N N 172 121.125 121.125 121.062 0.063 25485 19284 1 15 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.559 -0.031 25485 19285 1 15 . 1 1 172 172 PHE C C 172 173.875 173.875 174.040 -0.165 25485 19286 1 15 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.707 0.213 25485 19287 1 15 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.041 0.862 25485 19288 1 15 . 1 1 172 172 PHE H H 172 8.445 8.445 8.244 0.201 25485 19289 1 15 . 1 1 173 173 ASP N N 173 124.014 124.014 123.322 0.692 25485 19290 1 15 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.943 -1.029 25485 19291 1 15 . 1 1 173 173 ASP C C 173 178.613 178.613 177.876 0.737 25485 19292 1 15 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.898 0.900 25485 19293 1 15 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.465 -0.722 25485 19294 1 15 . 1 1 173 173 ASP H H 173 7.927 7.927 8.821 -0.894 25485 19295 1 15 . 1 1 174 174 GLU N N 174 132.469 132.469 126.389 6.080 25485 19296 1 15 . 1 1 174 174 GLU C C 174 176.442 176.442 177.157 -0.715 25485 19297 1 15 . 1 1 174 174 GLU CA C 174 57.184 57.184 59.028 -1.843 25485 19298 1 15 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.756 0.529 25485 19299 1 15 . 1 1 174 174 GLU H H 174 9.528 9.528 8.718 0.810 25485 19300 1 15 . 1 1 175 175 ASP N N 175 117.394 117.394 117.411 -0.017 25485 19301 1 15 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.727 0.066 25485 19302 1 15 . 1 1 175 175 ASP C C 175 176.645 176.645 177.053 -0.408 25485 19303 1 15 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.604 0.327 25485 19304 1 15 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.174 -1.033 25485 19305 1 15 . 1 1 175 175 ASP H H 175 8.768 8.768 8.716 0.052 25485 19306 1 15 . 1 1 176 176 GLU N N 176 116.493 116.493 120.131 -3.638 25485 19307 1 15 . 1 1 176 176 GLU C C 176 175.038 175.038 176.183 -1.145 25485 19308 1 15 . 1 1 176 176 GLU CA C 176 53.665 53.665 54.725 -1.060 25485 19309 1 15 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.486 -4.263 25485 19310 1 15 . 1 1 176 176 GLU H H 176 7.159 7.159 8.126 -0.967 25485 19311 1 15 . 1 1 177 177 ARG N N 177 122.186 122.186 120.036 2.150 25485 19312 1 15 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.452 0.237 25485 19313 1 15 . 1 1 177 177 ARG C C 177 174.482 174.482 175.051 -0.569 25485 19314 1 15 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.316 -1.629 25485 19315 1 15 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.803 -1.719 25485 19316 1 15 . 1 1 177 177 ARG H H 177 7.560 7.560 8.276 -0.716 25485 19317 1 15 . 1 1 178 178 TRP N N 178 129.179 129.179 125.130 4.049 25485 19318 1 15 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.220 -0.120 25485 19319 1 15 . 1 1 178 178 TRP C C 178 176.298 176.298 176.836 -0.538 25485 19320 1 15 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.659 0.154 25485 19321 1 15 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.176 0.021 25485 19322 1 15 . 1 1 178 178 TRP H H 178 8.807 8.807 8.316 0.491 25485 19323 1 15 . 1 1 179 179 THR N N 179 112.792 112.792 116.925 -4.133 25485 19324 1 15 . 1 1 179 179 THR HA H 179 4.985 4.985 4.600 0.385 25485 19325 1 15 . 1 1 179 179 THR C C 179 172.765 172.765 172.351 0.414 25485 19326 1 15 . 1 1 179 179 THR CA C 179 59.106 59.106 61.843 -2.737 25485 19327 1 15 . 1 1 179 179 THR CB C 179 71.786 71.786 71.235 0.551 25485 19328 1 15 . 1 1 179 179 THR H H 179 8.974 8.974 8.420 0.554 25485 19329 1 15 . 1 1 180 180 ASP N N 180 122.074 122.074 123.501 -1.427 25485 19330 1 15 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.302 -0.839 25485 19331 1 15 . 1 1 180 180 ASP C C 180 176.366 176.366 178.694 -2.328 25485 19332 1 15 . 1 1 180 180 ASP CA C 180 53.043 53.043 53.780 -0.737 25485 19333 1 15 . 1 1 180 180 ASP CB C 180 41.728 41.728 41.775 -0.047 25485 19334 1 15 . 1 1 180 180 ASP H H 180 8.485 8.485 8.543 -0.058 25485 19335 1 15 . 1 1 181 181 GLY N N 181 110.123 110.123 107.724 2.399 25485 19336 1 15 . 1 1 181 181 GLY C C 181 174.325 174.325 175.838 -1.513 25485 19337 1 15 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.608 1.053 25485 19338 1 15 . 1 1 181 181 GLY H H 181 8.569 8.569 8.504 0.065 25485 19339 1 15 . 1 1 182 182 SER N N 182 115.562 115.562 114.586 0.976 25485 19340 1 15 . 1 1 182 182 SER HA H 182 4.519 4.519 4.643 -0.124 25485 19341 1 15 . 1 1 182 182 SER C C 182 173.783 173.783 174.011 -0.228 25485 19342 1 15 . 1 1 182 182 SER CA C 182 57.965 57.965 59.401 -1.436 25485 19343 1 15 . 1 1 182 182 SER CB C 182 64.166 64.166 63.777 0.389 25485 19344 1 15 . 1 1 182 182 SER H H 182 8.160 8.160 8.310 -0.150 25485 19345 1 15 . 1 1 183 183 SER N N 183 117.153 117.153 113.687 3.466 25485 19346 1 15 . 1 1 183 183 SER HA H 183 4.275 4.275 4.537 -0.262 25485 19347 1 15 . 1 1 183 183 SER C C 183 173.333 173.333 172.540 0.793 25485 19348 1 15 . 1 1 183 183 SER CA C 183 59.902 59.902 58.184 1.718 25485 19349 1 15 . 1 1 183 183 SER CB C 183 64.941 64.941 63.960 0.981 25485 19350 1 15 . 1 1 183 183 SER H H 183 7.796 7.796 7.504 0.292 25485 19351 1 15 . 1 1 184 184 LEU N N 184 122.351 122.351 119.346 3.005 25485 19352 1 15 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.831 -0.439 25485 19353 1 15 . 1 1 184 184 LEU C C 184 176.250 176.250 176.785 -0.535 25485 19354 1 15 . 1 1 184 184 LEU CA C 184 55.575 55.575 54.303 1.272 25485 19355 1 15 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.859 -0.778 25485 19356 1 15 . 1 1 184 184 LEU H H 184 8.092 8.092 8.273 -0.181 25485 19357 1 15 . 1 1 185 185 GLY N N 185 108.871 108.871 109.462 -0.591 25485 19358 1 15 . 1 1 185 185 GLY C C 185 172.375 172.375 175.046 -2.671 25485 19359 1 15 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.626 -0.246 25485 19360 1 15 . 1 1 185 185 GLY H H 185 7.960 7.960 7.482 0.478 25485 19361 1 15 . 1 1 186 186 ILE N N 186 123.096 123.096 120.480 2.616 25485 19362 1 15 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.051 -0.210 25485 19363 1 15 . 1 1 186 186 ILE C C 186 175.350 175.350 176.444 -1.094 25485 19364 1 15 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.339 -0.938 25485 19365 1 15 . 1 1 186 186 ILE CB C 186 35.456 35.456 34.970 0.486 25485 19366 1 15 . 1 1 186 186 ILE H H 186 8.893 8.893 8.474 0.419 25485 19367 1 15 . 1 1 187 187 ASN N N 187 127.167 127.167 127.622 -0.455 25485 19368 1 15 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.942 -0.589 25485 19369 1 15 . 1 1 187 187 ASN C C 187 175.849 175.849 176.728 -0.879 25485 19370 1 15 . 1 1 187 187 ASN CA C 187 55.714 55.714 53.568 2.146 25485 19371 1 15 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.195 0.935 25485 19372 1 15 . 1 1 187 187 ASN H H 187 8.580 8.580 8.361 0.219 25485 19373 1 15 . 1 1 188 188 PHE N N 188 129.985 129.985 127.129 2.856 25485 19374 1 15 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.362 0.211 25485 19375 1 15 . 1 1 188 188 PHE C C 188 175.578 175.578 177.640 -2.062 25485 19376 1 15 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.264 -0.536 25485 19377 1 15 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.626 -0.194 25485 19378 1 15 . 1 1 188 188 PHE H H 188 9.361 9.361 8.507 0.854 25485 19379 1 15 . 1 1 189 189 LEU N N 189 119.113 119.113 118.693 0.420 25485 19380 1 15 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.021 -0.220 25485 19381 1 15 . 1 1 189 189 LEU C C 189 179.601 179.601 178.130 1.471 25485 19382 1 15 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.007 0.502 25485 19383 1 15 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.071 -1.194 25485 19384 1 15 . 1 1 189 189 LEU H H 189 8.562 8.562 8.156 0.406 25485 19385 1 15 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.603 0.314 25485 19386 1 15 . 1 1 190 190 TYR C C 190 177.621 177.621 177.035 0.586 25485 19387 1 15 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.947 -0.139 25485 19388 1 15 . 1 1 190 190 TYR CB C 190 39.769 39.769 38.113 1.656 25485 19389 1 15 . 1 1 191 191 ALA N N 191 120.352 120.352 120.912 -0.560 25485 19390 1 15 . 1 1 191 191 ALA HA H 191 4.315 4.315 3.887 0.428 25485 19391 1 15 . 1 1 191 191 ALA C C 191 180.252 180.252 178.673 1.579 25485 19392 1 15 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.517 0.665 25485 19393 1 15 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.403 0.739 25485 19394 1 15 . 1 1 191 191 ALA H H 191 7.993 7.993 8.831 -0.838 25485 19395 1 15 . 1 1 192 192 ALA N N 192 121.409 121.409 121.460 -0.051 25485 19396 1 15 . 1 1 192 192 ALA HA H 192 4.057 4.057 3.947 0.110 25485 19397 1 15 . 1 1 192 192 ALA C C 192 178.575 178.575 179.532 -0.957 25485 19398 1 15 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.395 -0.210 25485 19399 1 15 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.022 -1.824 25485 19400 1 15 . 1 1 192 192 ALA H H 192 9.297 9.297 8.356 0.941 25485 19401 1 15 . 1 1 193 193 THR N N 193 116.996 116.996 114.995 2.001 25485 19402 1 15 . 1 1 193 193 THR HA H 193 3.833 3.833 4.034 -0.201 25485 19403 1 15 . 1 1 193 193 THR CA C 193 69.138 69.138 67.385 1.753 25485 19404 1 15 . 1 1 193 193 THR CB C 193 67.365 67.365 68.389 -1.024 25485 19405 1 15 . 1 1 193 193 THR H H 193 8.226 8.226 7.427 0.799 25485 19406 1 15 . 1 1 194 194 HIS N N 194 120.296 120.296 122.186 -1.890 25485 19407 1 15 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.320 -0.084 25485 19408 1 15 . 1 1 194 194 HIS C C 194 175.962 175.962 176.597 -0.635 25485 19409 1 15 . 1 1 194 194 HIS CA C 194 59.747 59.747 59.088 0.659 25485 19410 1 15 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.888 -1.969 25485 19411 1 15 . 1 1 194 194 HIS H H 194 7.782 7.782 7.469 0.313 25485 19412 1 15 . 1 1 195 195 ALA N N 195 121.290 121.290 122.160 -0.870 25485 19413 1 15 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.993 0.163 25485 19414 1 15 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.650 1.314 25485 19415 1 15 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.671 0.039 25485 19416 1 15 . 1 1 195 195 ALA H H 195 8.690 8.690 8.220 0.470 25485 19417 1 15 . 1 1 196 196 LEU N N 196 114.899 114.899 118.610 -3.711 25485 19418 1 15 . 1 1 196 196 LEU HA H 196 4.170 4.170 3.962 0.208 25485 19419 1 15 . 1 1 196 196 LEU C C 196 177.946 177.946 179.791 -1.845 25485 19420 1 15 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.580 -1.352 25485 19421 1 15 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.962 -1.186 25485 19422 1 15 . 1 1 196 196 LEU H H 196 8.715 8.715 8.812 -0.097 25485 19423 1 15 . 1 1 197 197 GLY N N 197 107.901 107.901 105.791 2.110 25485 19424 1 15 . 1 1 197 197 GLY C C 197 178.641 178.641 175.237 3.404 25485 19425 1 15 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.944 0.623 25485 19426 1 15 . 1 1 197 197 GLY H H 197 7.546 7.546 8.038 -0.492 25485 19427 1 15 . 1 1 198 198 HIS N N 198 122.017 122.017 119.248 2.769 25485 19428 1 15 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.380 0.477 25485 19429 1 15 . 1 1 198 198 HIS C C 198 179.874 179.874 178.477 1.397 25485 19430 1 15 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.905 0.617 25485 19431 1 15 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.279 -1.733 25485 19432 1 15 . 1 1 198 198 HIS H H 198 7.196 7.196 7.155 0.041 25485 19433 1 15 . 1 1 199 199 SER N N 199 118.486 118.486 114.864 3.622 25485 19434 1 15 . 1 1 199 199 SER HA H 199 4.490 4.490 4.626 -0.136 25485 19435 1 15 . 1 1 199 199 SER C C 199 174.493 174.493 175.800 -1.307 25485 19436 1 15 . 1 1 199 199 SER CA C 199 58.173 58.173 59.986 -1.813 25485 19437 1 15 . 1 1 199 199 SER CB C 199 63.589 63.589 63.112 0.477 25485 19438 1 15 . 1 1 199 199 SER H H 199 7.884 7.884 7.746 0.138 25485 19439 1 15 . 1 1 200 200 LEU N N 200 114.686 114.686 118.329 -3.643 25485 19440 1 15 . 1 1 200 200 LEU C C 200 177.720 177.720 177.422 0.298 25485 19441 1 15 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.715 0.123 25485 19442 1 15 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.656 0.701 25485 19443 1 15 . 1 1 200 200 LEU H H 200 7.108 7.108 7.099 0.009 25485 19444 1 15 . 1 1 201 201 GLY N N 201 108.363 108.363 106.674 1.689 25485 19445 1 15 . 1 1 201 201 GLY C C 201 174.008 174.008 174.795 -0.787 25485 19446 1 15 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.663 -1.249 25485 19447 1 15 . 1 1 201 201 GLY H H 201 8.195 8.195 7.567 0.628 25485 19448 1 15 . 1 1 202 202 MET N N 202 119.635 119.635 121.515 -1.880 25485 19449 1 15 . 1 1 202 202 MET HA H 202 4.473 4.473 4.398 0.075 25485 19450 1 15 . 1 1 202 202 MET C C 202 176.593 176.593 175.171 1.422 25485 19451 1 15 . 1 1 202 202 MET CA C 202 54.500 54.500 55.507 -1.006 25485 19452 1 15 . 1 1 202 202 MET CB C 202 32.161 32.161 33.510 -1.349 25485 19453 1 15 . 1 1 202 202 MET H H 202 8.182 8.182 7.227 0.955 25485 19454 1 15 . 1 1 203 203 GLY N N 203 109.749 109.749 112.792 -3.043 25485 19455 1 15 . 1 1 203 203 GLY C C 203 174.042 174.042 173.420 0.622 25485 19456 1 15 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.453 -0.449 25485 19457 1 15 . 1 1 203 203 GLY H H 203 8.405 8.405 8.440 -0.035 25485 19458 1 15 . 1 1 204 204 HIS N N 204 115.732 115.732 118.053 -2.321 25485 19459 1 15 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.475 0.925 25485 19460 1 15 . 1 1 204 204 HIS C C 204 174.430 174.430 174.717 -0.287 25485 19461 1 15 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.579 -1.765 25485 19462 1 15 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.502 -0.676 25485 19463 1 15 . 1 1 204 204 HIS H H 204 8.364 8.364 8.550 -0.186 25485 19464 1 15 . 1 1 205 205 SER N N 205 115.484 115.484 114.540 0.944 25485 19465 1 15 . 1 1 205 205 SER HA H 205 4.766 4.766 4.588 0.178 25485 19466 1 15 . 1 1 205 205 SER C C 205 173.611 173.611 175.019 -1.408 25485 19467 1 15 . 1 1 205 205 SER CA C 205 54.729 54.729 57.069 -2.340 25485 19468 1 15 . 1 1 205 205 SER CB C 205 65.855 65.855 64.997 0.858 25485 19469 1 15 . 1 1 205 205 SER H H 205 7.231 7.231 8.454 -1.223 25485 19470 1 15 . 1 1 206 206 SER N N 206 119.263 119.263 120.249 -0.986 25485 19471 1 15 . 1 1 206 206 SER HA H 206 3.701 3.701 4.990 -1.289 25485 19472 1 15 . 1 1 206 206 SER C C 206 173.635 173.635 174.895 -1.260 25485 19473 1 15 . 1 1 206 206 SER CA C 206 63.846 63.846 58.546 5.300 25485 19474 1 15 . 1 1 206 206 SER CB C 206 63.764 63.764 63.711 0.053 25485 19475 1 15 . 1 1 206 206 SER H H 206 8.289 8.289 8.770 -0.481 25485 19476 1 15 . 1 1 207 207 ASP N N 207 126.646 126.646 123.464 3.182 25485 19477 1 15 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.663 0.266 25485 19478 1 15 . 1 1 207 207 ASP C C 207 174.614 174.614 175.358 -0.744 25485 19479 1 15 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.559 -1.288 25485 19480 1 15 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.332 -1.044 25485 19481 1 15 . 1 1 207 207 ASP H H 207 8.541 8.541 7.883 0.658 25485 19482 1 15 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.824 -0.037 25485 19483 1 15 . 1 1 208 208 PRO C C 208 177.467 177.467 175.725 1.742 25485 19484 1 15 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.964 -1.127 25485 19485 1 15 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.835 -0.238 25485 19486 1 15 . 1 1 209 209 ASN N N 209 116.020 116.020 113.187 2.833 25485 19487 1 15 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.685 -0.044 25485 19488 1 15 . 1 1 209 209 ASN C C 209 174.695 174.695 173.683 1.012 25485 19489 1 15 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.436 1.784 25485 19490 1 15 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.563 0.547 25485 19491 1 15 . 1 1 209 209 ASN H H 209 8.350 8.350 7.946 0.404 25485 19492 1 15 . 1 1 210 210 ALA N N 210 124.892 124.892 122.406 2.486 25485 19493 1 15 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.437 -0.342 25485 19494 1 15 . 1 1 210 210 ALA C C 210 179.495 179.495 177.950 1.545 25485 19495 1 15 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.974 1.080 25485 19496 1 15 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.952 -1.753 25485 19497 1 15 . 1 1 210 210 ALA H H 210 8.193 8.193 7.037 1.156 25485 19498 1 15 . 1 1 211 211 VAL N N 211 130.402 130.402 123.470 6.932 25485 19499 1 15 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.875 0.388 25485 19500 1 15 . 1 1 211 211 VAL C C 211 179.408 179.408 176.634 2.774 25485 19501 1 15 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.608 -0.556 25485 19502 1 15 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.442 -1.459 25485 19503 1 15 . 1 1 211 211 VAL H H 211 11.592 11.592 8.271 3.321 25485 19504 1 15 . 1 1 212 212 MET N N 212 113.285 113.285 115.675 -2.390 25485 19505 1 15 . 1 1 212 212 MET C C 212 176.996 176.996 175.753 1.243 25485 19506 1 15 . 1 1 212 212 MET CA C 212 53.614 53.614 53.193 0.421 25485 19507 1 15 . 1 1 212 212 MET CB C 212 26.975 26.975 30.672 -3.697 25485 19508 1 15 . 1 1 212 212 MET H H 212 7.724 7.724 7.899 -0.175 25485 19509 1 15 . 1 1 213 213 TYR N N 213 129.919 129.919 124.981 4.938 25485 19510 1 15 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.481 1.215 25485 19511 1 15 . 1 1 213 213 TYR C C 213 178.411 178.411 175.553 2.858 25485 19512 1 15 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.236 -0.105 25485 19513 1 15 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.548 0.619 25485 19514 1 15 . 1 1 213 213 TYR H H 213 7.902 7.902 7.407 0.495 25485 19515 1 15 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.388 -0.913 25485 19516 1 15 . 1 1 214 214 PRO C C 214 177.694 177.694 177.005 0.689 25485 19517 1 15 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.027 2.001 25485 19518 1 15 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.840 0.983 25485 19519 1 15 . 1 1 215 215 THR N N 215 104.450 104.450 111.088 -6.638 25485 19520 1 15 . 1 1 215 215 THR HA H 215 4.444 4.444 4.302 0.142 25485 19521 1 15 . 1 1 215 215 THR C C 215 173.429 173.429 173.562 -0.133 25485 19522 1 15 . 1 1 215 215 THR CA C 215 60.528 60.528 60.129 0.399 25485 19523 1 15 . 1 1 215 215 THR CB C 215 69.614 69.614 67.549 2.065 25485 19524 1 15 . 1 1 215 215 THR H H 215 6.407 6.407 7.621 -1.214 25485 19525 1 15 . 1 1 216 216 TYR N N 216 124.618 124.618 124.459 0.159 25485 19526 1 15 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.334 -0.102 25485 19527 1 15 . 1 1 216 216 TYR C C 216 175.669 175.669 175.637 0.032 25485 19528 1 15 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.405 -0.818 25485 19529 1 15 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.404 2.487 25485 19530 1 15 . 1 1 216 216 TYR H H 216 8.331 8.331 7.755 0.576 25485 19531 1 15 . 1 1 217 217 GLY N N 217 116.089 116.089 116.368 -0.279 25485 19532 1 15 . 1 1 217 217 GLY C C 217 173.560 173.560 174.841 -1.281 25485 19533 1 15 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.620 0.698 25485 19534 1 15 . 1 1 217 217 GLY H H 217 7.695 7.695 8.821 -1.126 25485 19535 1 15 . 1 1 218 218 ASN N N 218 120.167 120.167 119.407 0.760 25485 19536 1 15 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.503 0.163 25485 19537 1 15 . 1 1 218 218 ASN C C 218 175.343 175.343 176.499 -1.156 25485 19538 1 15 . 1 1 218 218 ASN CA C 218 53.615 53.615 54.957 -1.342 25485 19539 1 15 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.754 -0.208 25485 19540 1 15 . 1 1 218 218 ASN H H 218 8.237 8.237 8.330 -0.093 25485 19541 1 15 . 1 1 219 219 GLY N N 219 109.322 109.322 105.463 3.859 25485 19542 1 15 . 1 1 219 219 GLY C C 219 172.842 172.842 172.157 0.685 25485 19543 1 15 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.839 -0.121 25485 19544 1 15 . 1 1 219 219 GLY H H 219 8.027 8.027 7.628 0.399 25485 19545 1 15 . 1 1 220 220 ASP N N 220 123.006 123.006 121.839 1.167 25485 19546 1 15 . 1 1 220 220 ASP H H 220 8.273 8.273 8.286 -0.013 25485 19547 1 15 . 1 1 221 221 PRO C C 221 177.138 177.138 176.666 0.472 25485 19548 1 15 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.825 -5.762 25485 19549 1 15 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.333 -0.637 25485 19550 1 15 . 1 1 222 222 GLN N N 222 116.718 116.718 122.830 -6.112 25485 19551 1 15 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.261 0.075 25485 19552 1 15 . 1 1 222 222 GLN C C 222 176.321 176.321 176.843 -0.522 25485 19553 1 15 . 1 1 222 222 GLN CA C 222 57.143 57.143 57.721 -0.577 25485 19554 1 15 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.332 0.165 25485 19555 1 15 . 1 1 222 222 GLN H H 222 8.240 8.240 8.797 -0.557 25485 19556 1 15 . 1 1 223 223 ASN N N 223 118.368 118.368 115.009 3.359 25485 19557 1 15 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.832 0.084 25485 19558 1 15 . 1 1 223 223 ASN C C 223 173.271 173.271 174.587 -1.316 25485 19559 1 15 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.034 -0.438 25485 19560 1 15 . 1 1 223 223 ASN CB C 223 39.215 39.215 40.283 -1.068 25485 19561 1 15 . 1 1 223 223 ASN H H 223 7.946 7.946 8.362 -0.416 25485 19562 1 15 . 1 1 224 224 PHE N N 224 118.429 118.429 119.390 -0.961 25485 19563 1 15 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.396 0.055 25485 19564 1 15 . 1 1 224 224 PHE C C 224 172.897 172.897 173.157 -0.260 25485 19565 1 15 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.475 -0.066 25485 19566 1 15 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.085 0.616 25485 19567 1 15 . 1 1 224 224 PHE H H 224 6.992 6.992 7.775 -0.783 25485 19568 1 15 . 1 1 225 225 LYS N N 225 121.714 121.714 125.805 -4.091 25485 19569 1 15 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.842 0.588 25485 19570 1 15 . 1 1 225 225 LYS C C 225 174.664 174.664 174.882 -0.218 25485 19571 1 15 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.362 -0.050 25485 19572 1 15 . 1 1 225 225 LYS CB C 225 34.727 34.727 35.024 -0.297 25485 19573 1 15 . 1 1 225 225 LYS H H 225 7.709 7.709 7.933 -0.224 25485 19574 1 15 . 1 1 226 226 LEU N N 226 119.026 119.026 121.559 -2.533 25485 19575 1 15 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.998 0.142 25485 19576 1 15 . 1 1 226 226 LEU C C 226 177.495 177.495 176.552 0.943 25485 19577 1 15 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.013 0.586 25485 19578 1 15 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.493 -1.212 25485 19579 1 15 . 1 1 226 226 LEU H H 226 8.015 8.015 8.100 -0.085 25485 19580 1 15 . 1 1 227 227 SER N N 227 120.320 120.320 115.241 5.079 25485 19581 1 15 . 1 1 227 227 SER HA H 227 4.600 4.600 4.484 0.116 25485 19582 1 15 . 1 1 227 227 SER C C 227 175.492 175.492 175.580 -0.088 25485 19583 1 15 . 1 1 227 227 SER CA C 227 57.239 57.239 56.893 0.346 25485 19584 1 15 . 1 1 227 227 SER CB C 227 66.278 66.278 65.272 1.006 25485 19585 1 15 . 1 1 227 227 SER H H 227 9.654 9.654 8.058 1.596 25485 19586 1 15 . 1 1 228 228 GLN N N 228 127.511 127.511 124.324 3.187 25485 19587 1 15 . 1 1 228 228 GLN HA H 228 4.694 4.694 4.033 0.661 25485 19588 1 15 . 1 1 228 228 GLN H H 228 8.248 8.248 8.714 -0.466 25485 19589 1 15 . 1 1 229 229 ASP N N 229 124.358 124.358 120.293 4.065 25485 19590 1 15 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.425 -0.051 25485 19591 1 15 . 1 1 229 229 ASP C C 229 178.793 178.793 177.989 0.804 25485 19592 1 15 . 1 1 229 229 ASP CA C 229 58.142 58.142 56.431 1.711 25485 19593 1 15 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.477 2.765 25485 19594 1 15 . 1 1 229 229 ASP H H 229 8.138 8.138 8.195 -0.057 25485 19595 1 15 . 1 1 230 230 ASP N N 230 119.694 119.694 120.159 -0.465 25485 19596 1 15 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.505 -0.083 25485 19597 1 15 . 1 1 230 230 ASP C C 230 177.736 177.736 178.461 -0.725 25485 19598 1 15 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.408 0.513 25485 19599 1 15 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.904 2.332 25485 19600 1 15 . 1 1 230 230 ASP H H 230 7.393 7.393 7.861 -0.468 25485 19601 1 15 . 1 1 231 231 ILE N N 231 120.364 120.364 119.548 0.816 25485 19602 1 15 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.910 -0.245 25485 19603 1 15 . 1 1 231 231 ILE C C 231 177.631 177.631 177.683 -0.052 25485 19604 1 15 . 1 1 231 231 ILE CA C 231 65.499 65.499 62.489 3.010 25485 19605 1 15 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.163 1.350 25485 19606 1 15 . 1 1 231 231 ILE H H 231 8.115 8.115 7.687 0.428 25485 19607 1 15 . 1 1 232 232 LYS N N 232 119.156 119.156 120.836 -1.680 25485 19608 1 15 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.068 0.046 25485 19609 1 15 . 1 1 232 232 LYS C C 232 180.574 180.574 179.288 1.286 25485 19610 1 15 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.888 -0.328 25485 19611 1 15 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.673 0.124 25485 19612 1 15 . 1 1 232 232 LYS H H 232 8.607 8.607 8.470 0.137 25485 19613 1 15 . 1 1 233 233 GLY N N 233 106.425 106.425 107.839 -1.414 25485 19614 1 15 . 1 1 233 233 GLY C C 233 176.098 176.098 175.838 0.260 25485 19615 1 15 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.673 0.964 25485 19616 1 15 . 1 1 233 233 GLY H H 233 8.075 8.075 7.661 0.414 25485 19617 1 15 . 1 1 234 234 ILE N N 234 125.119 125.119 121.764 3.355 25485 19618 1 15 . 1 1 234 234 ILE C C 234 178.231 178.231 177.231 1.000 25485 19619 1 15 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.338 -1.745 25485 19620 1 15 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.123 -0.577 25485 19621 1 15 . 1 1 234 234 ILE H H 234 8.539 8.539 7.482 1.057 25485 19622 1 15 . 1 1 235 235 GLN N N 235 122.877 122.877 119.368 3.509 25485 19623 1 15 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.027 0.330 25485 19624 1 15 . 1 1 235 235 GLN C C 235 180.105 180.105 178.436 1.669 25485 19625 1 15 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.386 -1.498 25485 19626 1 15 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.619 -1.083 25485 19627 1 15 . 1 1 235 235 GLN H H 235 8.296 8.296 8.622 -0.326 25485 19628 1 15 . 1 1 236 236 LYS N N 236 123.678 123.678 118.474 5.204 25485 19629 1 15 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.253 -0.171 25485 19630 1 15 . 1 1 236 236 LYS C C 236 178.169 178.169 177.711 0.458 25485 19631 1 15 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.527 0.849 25485 19632 1 15 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.908 0.070 25485 19633 1 15 . 1 1 236 236 LYS H H 236 8.024 8.024 7.644 0.380 25485 19634 1 15 . 1 1 237 237 LEU N N 237 116.873 116.873 119.674 -2.801 25485 19635 1 15 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.244 -0.257 25485 19636 1 15 . 1 1 237 237 LEU C C 237 177.893 177.893 178.251 -0.358 25485 19637 1 15 . 1 1 237 237 LEU CA C 237 57.439 57.439 57.050 0.389 25485 19638 1 15 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.737 0.876 25485 19639 1 15 . 1 1 237 237 LEU H H 237 6.888 6.888 7.442 -0.554 25485 19640 1 15 . 1 1 238 238 TYR N N 238 112.237 112.237 117.258 -5.021 25485 19641 1 15 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.478 0.173 25485 19642 1 15 . 1 1 238 238 TYR C C 238 176.082 176.082 176.935 -0.853 25485 19643 1 15 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.233 -0.597 25485 19644 1 15 . 1 1 238 238 TYR CB C 238 41.398 41.398 40.116 1.282 25485 19645 1 15 . 1 1 238 238 TYR H H 238 7.445 7.445 8.689 -1.244 25485 19646 1 15 . 1 1 239 239 GLY N N 239 110.906 110.906 105.456 5.450 25485 19647 1 15 . 1 1 239 239 GLY C C 239 171.269 171.269 172.593 -1.324 25485 19648 1 15 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.198 -1.312 25485 19649 1 15 . 1 1 239 239 GLY H H 239 8.443 8.443 8.047 0.396 25485 19650 1 15 . 1 1 240 240 LYS N N 240 114.281 114.281 121.615 -7.334 25485 19651 1 15 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.532 0.206 25485 19652 1 15 . 1 1 240 240 LYS C C 240 177.527 177.527 176.899 0.628 25485 19653 1 15 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.558 -0.600 25485 19654 1 15 . 1 1 240 240 LYS CB C 240 34.275 34.275 34.073 0.202 25485 19655 1 15 . 1 1 240 240 LYS H H 240 7.873 7.873 8.305 -0.432 25485 19656 1 15 . 1 1 241 241 ARG N N 241 123.758 123.758 121.972 1.786 25485 19657 1 15 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.143 -0.146 25485 19658 1 15 . 1 1 241 241 ARG C C 241 176.026 176.026 175.983 0.043 25485 19659 1 15 . 1 1 241 241 ARG CA C 241 57.492 57.492 57.551 -0.059 25485 19660 1 15 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.184 0.187 25485 19661 1 15 . 1 1 241 241 ARG H H 241 7.742 7.742 8.486 -0.744 25485 19662 1 15 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.463 -0.123 25485 19663 1 15 . 1 1 246 246 LYS C C 246 175.403 175.403 173.608 1.795 25485 19664 1 15 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.353 0.156 25485 19665 1 15 . 1 1 246 246 LYS CB C 246 32.858 32.858 34.568 -1.710 25485 19666 1 16 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.326 -0.019 25485 19667 1 16 . 1 1 2 2 GLN C C 2 176.492 176.492 176.986 -0.494 25485 19668 1 16 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.337 0.412 25485 19669 1 16 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.183 0.471 25485 19670 1 16 . 1 1 3 3 GLU N N 3 121.668 121.668 123.050 -1.382 25485 19671 1 16 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.068 -0.279 25485 19672 1 16 . 1 1 3 3 GLU C C 3 176.278 176.278 178.347 -2.069 25485 19673 1 16 . 1 1 3 3 GLU CA C 3 57.059 57.059 59.184 -2.125 25485 19674 1 16 . 1 1 3 3 GLU CB C 3 29.691 29.691 28.832 0.859 25485 19675 1 16 . 1 1 3 3 GLU H H 3 8.331 8.331 8.980 -0.649 25485 19676 1 16 . 1 1 4 4 ALA N N 4 124.493 124.493 121.656 2.837 25485 19677 1 16 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.079 0.431 25485 19678 1 16 . 1 1 4 4 ALA C C 4 178.428 178.428 179.716 -1.288 25485 19679 1 16 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.280 0.397 25485 19680 1 16 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.068 0.641 25485 19681 1 16 . 1 1 4 4 ALA H H 4 8.131 8.131 8.371 -0.240 25485 19682 1 16 . 1 1 5 5 GLY N N 5 108.204 108.204 108.359 -0.155 25485 19683 1 16 . 1 1 5 5 GLY C C 5 174.858 174.858 175.392 -0.534 25485 19684 1 16 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.467 1.194 25485 19685 1 16 . 1 1 5 5 GLY H H 5 8.279 8.279 8.256 0.023 25485 19686 1 16 . 1 1 6 6 GLY N N 6 108.820 108.820 107.746 1.074 25485 19687 1 16 . 1 1 6 6 GLY C C 6 174.189 174.189 174.248 -0.059 25485 19688 1 16 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.136 0.277 25485 19689 1 16 . 1 1 6 6 GLY H H 6 8.246 8.246 7.690 0.556 25485 19690 1 16 . 1 1 7 7 MET N N 7 119.938 119.938 119.961 -0.023 25485 19691 1 16 . 1 1 7 7 MET HA H 7 4.659 4.659 4.423 0.236 25485 19692 1 16 . 1 1 7 7 MET C C 7 176.191 176.191 176.523 -0.332 25485 19693 1 16 . 1 1 7 7 MET CA C 7 54.799 54.799 55.330 -0.531 25485 19694 1 16 . 1 1 7 7 MET CB C 7 33.046 33.046 32.828 0.218 25485 19695 1 16 . 1 1 7 7 MET H H 7 8.005 8.005 7.431 0.574 25485 19696 1 16 . 1 1 8 8 SER N N 8 118.919 118.919 116.889 2.030 25485 19697 1 16 . 1 1 8 8 SER HA H 8 4.239 4.239 4.399 -0.160 25485 19698 1 16 . 1 1 8 8 SER C C 8 174.949 174.949 175.481 -0.532 25485 19699 1 16 . 1 1 8 8 SER CA C 8 58.160 58.160 58.510 -0.350 25485 19700 1 16 . 1 1 8 8 SER CB C 8 65.440 65.440 64.030 1.410 25485 19701 1 16 . 1 1 8 8 SER H H 8 8.731 8.731 8.301 0.430 25485 19702 1 16 . 1 1 9 9 GLU N N 9 122.442 122.442 121.821 0.621 25485 19703 1 16 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.127 0.194 25485 19704 1 16 . 1 1 9 9 GLU C C 9 178.604 178.604 178.731 -0.127 25485 19705 1 16 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.614 -0.146 25485 19706 1 16 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.438 -0.262 25485 19707 1 16 . 1 1 9 9 GLU H H 9 8.901 8.901 8.889 0.012 25485 19708 1 16 . 1 1 10 10 LEU N N 10 120.568 120.568 116.136 4.432 25485 19709 1 16 . 1 1 10 10 LEU C C 10 179.307 179.307 178.850 0.457 25485 19710 1 16 . 1 1 10 10 LEU CA C 10 57.480 57.480 57.992 -0.512 25485 19711 1 16 . 1 1 10 10 LEU CB C 10 41.575 41.575 40.968 0.607 25485 19712 1 16 . 1 1 10 10 LEU H H 10 8.020 8.020 7.905 0.115 25485 19713 1 16 . 1 1 11 11 GLN N N 11 119.930 119.930 119.127 0.803 25485 19714 1 16 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.013 0.121 25485 19715 1 16 . 1 1 11 11 GLN C C 11 178.330 178.330 178.199 0.131 25485 19716 1 16 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.877 -0.059 25485 19717 1 16 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.250 -0.386 25485 19718 1 16 . 1 1 11 11 GLN H H 11 7.811 7.811 7.719 0.092 25485 19719 1 16 . 1 1 12 12 TRP N N 12 121.031 121.031 120.077 0.954 25485 19720 1 16 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.394 0.020 25485 19721 1 16 . 1 1 12 12 TRP C C 12 178.874 178.874 178.119 0.755 25485 19722 1 16 . 1 1 12 12 TRP CA C 12 60.507 60.507 59.583 0.924 25485 19723 1 16 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.717 -0.330 25485 19724 1 16 . 1 1 12 12 TRP H H 12 8.205 8.205 7.620 0.585 25485 19725 1 16 . 1 1 13 13 GLU N N 13 121.877 121.877 120.485 1.392 25485 19726 1 16 . 1 1 13 13 GLU C C 13 179.425 179.425 178.703 0.722 25485 19727 1 16 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.881 0.156 25485 19728 1 16 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.588 -0.666 25485 19729 1 16 . 1 1 13 13 GLU H H 13 8.434 8.434 8.422 0.012 25485 19730 1 16 . 1 1 14 14 GLN N N 14 120.449 120.449 118.057 2.392 25485 19731 1 16 . 1 1 14 14 GLN HA H 14 4.238 4.238 4.073 0.165 25485 19732 1 16 . 1 1 14 14 GLN C C 14 179.210 179.210 178.207 1.003 25485 19733 1 16 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.899 -0.017 25485 19734 1 16 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.241 -0.491 25485 19735 1 16 . 1 1 14 14 GLN H H 14 8.124 8.124 7.938 0.186 25485 19736 1 16 . 1 1 15 15 ALA N N 15 123.114 123.114 120.806 2.308 25485 19737 1 16 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.700 0.690 25485 19738 1 16 . 1 1 15 15 ALA C C 15 179.352 179.352 179.425 -0.073 25485 19739 1 16 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.494 -0.529 25485 19740 1 16 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.609 1.054 25485 19741 1 16 . 1 1 15 15 ALA H H 15 8.344 8.344 7.536 0.808 25485 19742 1 16 . 1 1 16 16 GLN N N 16 117.718 117.718 117.681 0.037 25485 19743 1 16 . 1 1 16 16 GLN HA H 16 3.782 3.782 4.003 -0.221 25485 19744 1 16 . 1 1 16 16 GLN C C 16 177.719 177.719 178.105 -0.386 25485 19745 1 16 . 1 1 16 16 GLN CA C 16 60.281 60.281 59.067 1.214 25485 19746 1 16 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.542 -0.006 25485 19747 1 16 . 1 1 16 16 GLN H H 16 8.500 8.500 7.854 0.646 25485 19748 1 16 . 1 1 17 17 ASP N N 17 120.040 120.040 120.413 -0.373 25485 19749 1 16 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.422 0.114 25485 19750 1 16 . 1 1 17 17 ASP C C 17 177.630 177.630 178.967 -1.337 25485 19751 1 16 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.628 0.177 25485 19752 1 16 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.845 1.019 25485 19753 1 16 . 1 1 17 17 ASP H H 17 7.871 7.871 8.007 -0.136 25485 19754 1 16 . 1 1 18 18 TYR N N 18 122.465 122.465 119.180 3.285 25485 19755 1 16 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.194 -0.004 25485 19756 1 16 . 1 1 18 18 TYR C C 18 178.439 178.439 177.805 0.634 25485 19757 1 16 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.810 1.036 25485 19758 1 16 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.566 1.374 25485 19759 1 16 . 1 1 18 18 TYR H H 18 8.244 8.244 8.508 -0.264 25485 19760 1 16 . 1 1 19 19 LEU N N 19 117.635 117.635 119.389 -1.754 25485 19761 1 16 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.165 -0.033 25485 19762 1 16 . 1 1 19 19 LEU C C 19 180.940 180.940 178.418 2.522 25485 19763 1 16 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.557 0.948 25485 19764 1 16 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.135 -0.537 25485 19765 1 16 . 1 1 19 19 LEU H H 19 8.713 8.713 7.974 0.739 25485 19766 1 16 . 1 1 20 20 LYS N N 20 124.594 124.594 119.941 4.653 25485 19767 1 16 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.196 -0.112 25485 19768 1 16 . 1 1 20 20 LYS C C 20 178.387 178.387 178.706 -0.319 25485 19769 1 16 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.783 0.022 25485 19770 1 16 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.380 0.076 25485 19771 1 16 . 1 1 20 20 LYS H H 20 8.815 8.815 8.415 0.400 25485 19772 1 16 . 1 1 21 21 ARG N N 21 117.535 117.535 116.349 1.186 25485 19773 1 16 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.142 -0.423 25485 19774 1 16 . 1 1 21 21 ARG C C 21 178.498 178.498 178.947 -0.449 25485 19775 1 16 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.307 0.937 25485 19776 1 16 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.433 0.008 25485 19777 1 16 . 1 1 21 21 ARG H H 21 7.810 7.810 7.410 0.400 25485 19778 1 16 . 1 1 22 22 PHE N N 22 112.113 112.113 123.528 -11.415 25485 19779 1 16 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.260 0.651 25485 19780 1 16 . 1 1 22 22 PHE C C 22 174.875 174.875 175.202 -0.327 25485 19781 1 16 . 1 1 22 22 PHE CA C 22 57.475 57.475 61.400 -3.925 25485 19782 1 16 . 1 1 22 22 PHE CB C 22 39.169 39.169 40.097 -0.928 25485 19783 1 16 . 1 1 22 22 PHE H H 22 8.010 8.010 7.830 0.180 25485 19784 1 16 . 1 1 23 23 TYR N N 23 116.187 116.187 115.205 0.982 25485 19785 1 16 . 1 1 23 23 TYR C C 23 173.455 173.455 174.874 -1.419 25485 19786 1 16 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.472 2.955 25485 19787 1 16 . 1 1 23 23 TYR CB C 23 39.529 39.529 37.288 2.241 25485 19788 1 16 . 1 1 23 23 TYR H H 23 7.680 7.680 7.996 -0.316 25485 19789 1 16 . 1 1 24 24 LEU N N 24 115.570 115.570 117.482 -1.912 25485 19790 1 16 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.000 0.150 25485 19791 1 16 . 1 1 24 24 LEU C C 24 176.661 176.661 175.920 0.741 25485 19792 1 16 . 1 1 24 24 LEU CA C 24 56.152 56.152 54.561 1.591 25485 19793 1 16 . 1 1 24 24 LEU CB C 24 36.863 36.863 40.812 -3.949 25485 19794 1 16 . 1 1 24 24 LEU H H 24 7.238 7.238 7.322 -0.084 25485 19795 1 16 . 1 1 25 25 TYR N N 25 119.901 119.901 123.648 -3.747 25485 19796 1 16 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.363 -0.004 25485 19797 1 16 . 1 1 25 25 TYR C C 25 173.784 173.784 175.020 -1.236 25485 19798 1 16 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.368 0.879 25485 19799 1 16 . 1 1 25 25 TYR CB C 25 39.079 39.079 37.321 1.758 25485 19800 1 16 . 1 1 25 25 TYR H H 25 7.845 7.845 8.477 -0.632 25485 19801 1 16 . 1 1 26 26 ASP N N 26 129.338 129.338 126.729 2.609 25485 19802 1 16 . 1 1 26 26 ASP HA H 26 4.451 4.451 4.935 -0.484 25485 19803 1 16 . 1 1 26 26 ASP C C 26 175.282 175.282 176.176 -0.894 25485 19804 1 16 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.234 -0.801 25485 19805 1 16 . 1 1 26 26 ASP CB C 26 41.249 41.249 43.599 -2.350 25485 19806 1 16 . 1 1 26 26 ASP H H 26 8.108 8.108 7.640 0.468 25485 19807 1 16 . 1 1 27 27 SER C C 27 175.204 175.204 176.204 -1.000 25485 19808 1 16 . 1 1 27 27 SER CA C 27 59.424 59.424 59.478 -0.054 25485 19809 1 16 . 1 1 27 27 SER CB C 27 63.535 63.535 63.625 -0.090 25485 19810 1 16 . 1 1 28 28 GLU N N 28 122.058 122.058 123.490 -1.432 25485 19811 1 16 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.211 0.114 25485 19812 1 16 . 1 1 28 28 GLU C C 28 177.073 177.073 177.273 -0.200 25485 19813 1 16 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.830 -1.618 25485 19814 1 16 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.634 -0.064 25485 19815 1 16 . 1 1 28 28 GLU H H 28 8.255 8.255 8.556 -0.301 25485 19816 1 16 . 1 1 29 29 THR N N 29 114.161 114.161 113.363 0.798 25485 19817 1 16 . 1 1 29 29 THR HA H 29 4.260 4.260 4.361 -0.101 25485 19818 1 16 . 1 1 29 29 THR C C 29 174.591 174.591 174.468 0.123 25485 19819 1 16 . 1 1 29 29 THR CA C 29 61.976 61.976 62.499 -0.523 25485 19820 1 16 . 1 1 29 29 THR CB C 29 69.385 69.385 69.182 0.203 25485 19821 1 16 . 1 1 29 29 THR H H 29 7.498 7.498 7.807 -0.309 25485 19822 1 16 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.110 0.108 25485 19823 1 16 . 1 1 30 30 LYS H H 30 8.218 8.218 7.957 0.261 25485 19824 1 16 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.517 -0.093 25485 19825 1 16 . 1 1 31 31 ASN CB C 31 39.133 39.133 38.339 0.794 25485 19826 1 16 . 1 1 32 32 ALA N N 32 126.484 126.484 124.500 1.984 25485 19827 1 16 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.119 0.177 25485 19828 1 16 . 1 1 32 32 ALA C C 32 178.012 178.012 179.013 -1.001 25485 19829 1 16 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.713 -0.953 25485 19830 1 16 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.007 -0.237 25485 19831 1 16 . 1 1 32 32 ALA H H 32 8.411 8.411 8.655 -0.244 25485 19832 1 16 . 1 1 33 33 ASN N N 33 116.885 116.885 115.175 1.710 25485 19833 1 16 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.630 0.068 25485 19834 1 16 . 1 1 33 33 ASN C C 33 176.240 176.240 177.172 -0.932 25485 19835 1 16 . 1 1 33 33 ASN CA C 33 54.187 54.187 56.011 -1.823 25485 19836 1 16 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.311 0.274 25485 19837 1 16 . 1 1 33 33 ASN H H 33 8.309 8.309 8.589 -0.280 25485 19838 1 16 . 1 1 34 34 SER N N 34 116.836 116.836 114.837 1.999 25485 19839 1 16 . 1 1 34 34 SER HA H 34 4.544 4.544 4.462 0.082 25485 19840 1 16 . 1 1 34 34 SER C C 34 175.253 175.253 175.554 -0.301 25485 19841 1 16 . 1 1 34 34 SER CA C 34 59.583 59.583 60.029 -0.446 25485 19842 1 16 . 1 1 34 34 SER CB C 34 63.919 63.919 63.392 0.527 25485 19843 1 16 . 1 1 34 34 SER H H 34 8.115 8.115 7.492 0.623 25485 19844 1 16 . 1 1 35 35 LEU N N 35 125.355 125.355 124.067 1.288 25485 19845 1 16 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.065 -0.489 25485 19846 1 16 . 1 1 35 35 LEU C C 35 177.973 177.973 177.713 0.260 25485 19847 1 16 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.041 0.456 25485 19848 1 16 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.763 -1.071 25485 19849 1 16 . 1 1 35 35 LEU H H 35 8.312 8.312 7.994 0.318 25485 19850 1 16 . 1 1 36 36 GLU N N 36 119.201 119.201 119.019 0.182 25485 19851 1 16 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.951 -0.037 25485 19852 1 16 . 1 1 36 36 GLU C C 36 178.141 178.141 178.735 -0.594 25485 19853 1 16 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.399 0.260 25485 19854 1 16 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.607 0.706 25485 19855 1 16 . 1 1 36 36 GLU H H 36 8.225 8.225 7.947 0.278 25485 19856 1 16 . 1 1 37 37 ALA N N 37 120.746 120.746 123.002 -2.256 25485 19857 1 16 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.083 -0.004 25485 19858 1 16 . 1 1 37 37 ALA C C 37 181.485 181.485 179.716 1.769 25485 19859 1 16 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.860 0.599 25485 19860 1 16 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.172 -0.005 25485 19861 1 16 . 1 1 37 37 ALA H H 37 7.917 7.917 7.885 0.032 25485 19862 1 16 . 1 1 38 38 LYS N N 38 119.326 119.326 119.813 -0.487 25485 19863 1 16 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.045 0.286 25485 19864 1 16 . 1 1 38 38 LYS C C 38 177.946 177.946 178.814 -0.868 25485 19865 1 16 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.695 -0.991 25485 19866 1 16 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.311 -0.511 25485 19867 1 16 . 1 1 38 38 LYS H H 38 8.216 8.216 8.205 0.011 25485 19868 1 16 . 1 1 39 39 LEU N N 39 122.736 122.736 119.636 3.100 25485 19869 1 16 . 1 1 39 39 LEU HA H 39 3.941 3.941 4.009 -0.068 25485 19870 1 16 . 1 1 39 39 LEU C C 39 178.819 178.819 178.698 0.121 25485 19871 1 16 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.061 0.020 25485 19872 1 16 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.487 -0.859 25485 19873 1 16 . 1 1 39 39 LEU H H 39 8.666 8.666 8.526 0.140 25485 19874 1 16 . 1 1 40 40 LYS N N 40 118.411 118.411 118.559 -0.148 25485 19875 1 16 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.925 0.713 25485 19876 1 16 . 1 1 40 40 LYS C C 40 179.329 179.329 178.333 0.996 25485 19877 1 16 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.071 0.062 25485 19878 1 16 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.140 -0.355 25485 19879 1 16 . 1 1 40 40 LYS H H 40 8.227 8.227 7.565 0.662 25485 19880 1 16 . 1 1 41 41 GLU N N 41 121.329 121.329 118.238 3.091 25485 19881 1 16 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.110 -0.017 25485 19882 1 16 . 1 1 41 41 GLU C C 41 178.989 178.989 178.931 0.058 25485 19883 1 16 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.987 0.773 25485 19884 1 16 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.821 1.015 25485 19885 1 16 . 1 1 41 41 GLU H H 41 7.718 7.718 7.647 0.071 25485 19886 1 16 . 1 1 42 42 MET N N 42 123.817 123.817 119.733 4.084 25485 19887 1 16 . 1 1 42 42 MET HA H 42 4.107 4.107 4.310 -0.203 25485 19888 1 16 . 1 1 42 42 MET C C 42 177.719 177.719 178.415 -0.696 25485 19889 1 16 . 1 1 42 42 MET CA C 42 59.912 59.912 58.728 1.184 25485 19890 1 16 . 1 1 42 42 MET CB C 42 30.506 30.506 32.687 -2.181 25485 19891 1 16 . 1 1 42 42 MET H H 42 7.657 7.657 7.572 0.085 25485 19892 1 16 . 1 1 43 43 GLN N N 43 119.998 119.998 118.545 1.453 25485 19893 1 16 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.095 -0.289 25485 19894 1 16 . 1 1 43 43 GLN C C 43 177.604 177.604 178.904 -1.300 25485 19895 1 16 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.669 1.296 25485 19896 1 16 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.706 -1.151 25485 19897 1 16 . 1 1 43 43 GLN H H 43 8.910 8.910 7.940 0.970 25485 19898 1 16 . 1 1 44 44 LYS N N 44 119.165 119.165 119.004 0.161 25485 19899 1 16 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.225 -0.170 25485 19900 1 16 . 1 1 44 44 LYS C C 44 179.991 179.991 179.097 0.894 25485 19901 1 16 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.252 1.309 25485 19902 1 16 . 1 1 44 44 LYS CB C 44 32.298 32.298 31.982 0.316 25485 19903 1 16 . 1 1 44 44 LYS H H 44 8.507 8.507 7.559 0.948 25485 19904 1 16 . 1 1 45 45 PHE N N 45 123.602 123.602 120.554 3.048 25485 19905 1 16 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.267 -0.366 25485 19906 1 16 . 1 1 45 45 PHE C C 45 177.606 177.606 176.333 1.273 25485 19907 1 16 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.454 2.580 25485 19908 1 16 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.124 0.742 25485 19909 1 16 . 1 1 45 45 PHE H H 45 8.445 8.445 7.573 0.872 25485 19910 1 16 . 1 1 46 46 PHE N N 46 112.715 112.715 115.650 -2.935 25485 19911 1 16 . 1 1 46 46 PHE HA H 46 4.597 4.597 3.947 0.650 25485 19912 1 16 . 1 1 46 46 PHE C C 46 175.285 175.285 177.211 -1.926 25485 19913 1 16 . 1 1 46 46 PHE CA C 46 60.675 60.675 60.078 0.597 25485 19914 1 16 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.286 -0.827 25485 19915 1 16 . 1 1 46 46 PHE H H 46 8.272 8.272 8.092 0.180 25485 19916 1 16 . 1 1 47 47 GLY N N 47 110.438 110.438 107.272 3.166 25485 19917 1 16 . 1 1 47 47 GLY C C 47 174.935 174.935 174.251 0.684 25485 19918 1 16 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.214 1.797 25485 19919 1 16 . 1 1 47 47 GLY H H 47 7.926 7.926 8.394 -0.468 25485 19920 1 16 . 1 1 48 48 LEU N N 48 121.830 121.830 118.883 2.947 25485 19921 1 16 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.598 0.326 25485 19922 1 16 . 1 1 48 48 LEU C C 48 174.009 174.009 175.847 -1.838 25485 19923 1 16 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.427 -1.592 25485 19924 1 16 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.921 0.542 25485 19925 1 16 . 1 1 48 48 LEU H H 48 8.762 8.762 7.566 1.196 25485 19926 1 16 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.328 -0.090 25485 19927 1 16 . 1 1 49 49 PRO C C 49 176.874 176.874 176.962 -0.088 25485 19928 1 16 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.806 -0.288 25485 19929 1 16 . 1 1 49 49 PRO CB C 49 31.079 31.079 32.025 -0.946 25485 19930 1 16 . 1 1 50 50 ILE N N 50 126.859 126.859 117.043 9.816 25485 19931 1 16 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.084 0.017 25485 19932 1 16 . 1 1 50 50 ILE C C 50 176.540 176.540 175.422 1.118 25485 19933 1 16 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.852 -0.896 25485 19934 1 16 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.924 -1.531 25485 19935 1 16 . 1 1 50 50 ILE H H 50 8.548 8.548 7.858 0.690 25485 19936 1 16 . 1 1 51 51 THR N N 51 116.443 116.443 118.184 -1.741 25485 19937 1 16 . 1 1 51 51 THR HA H 51 4.584 4.584 4.521 0.063 25485 19938 1 16 . 1 1 51 51 THR C C 51 176.672 176.672 175.231 1.441 25485 19939 1 16 . 1 1 51 51 THR CA C 51 60.979 60.979 60.534 0.445 25485 19940 1 16 . 1 1 51 51 THR CB C 51 71.505 71.505 70.475 1.030 25485 19941 1 16 . 1 1 51 51 THR H H 51 8.001 8.001 8.091 -0.090 25485 19942 1 16 . 1 1 52 52 GLY N N 52 112.719 112.719 111.283 1.436 25485 19943 1 16 . 1 1 52 52 GLY C C 52 170.609 170.609 173.862 -3.253 25485 19944 1 16 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.681 1.065 25485 19945 1 16 . 1 1 52 52 GLY H H 52 9.499 9.499 8.710 0.789 25485 19946 1 16 . 1 1 53 53 MET N N 53 116.621 116.621 119.011 -2.390 25485 19947 1 16 . 1 1 53 53 MET HA H 53 4.023 4.023 4.772 -0.749 25485 19948 1 16 . 1 1 53 53 MET C C 53 174.695 174.695 174.180 0.515 25485 19949 1 16 . 1 1 53 53 MET CA C 53 53.460 53.460 54.747 -1.287 25485 19950 1 16 . 1 1 53 53 MET CB C 53 35.408 35.408 35.991 -0.583 25485 19951 1 16 . 1 1 53 53 MET H H 53 7.993 7.993 7.495 0.498 25485 19952 1 16 . 1 1 54 54 LEU N N 54 122.679 122.679 119.839 2.840 25485 19953 1 16 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.507 -0.756 25485 19954 1 16 . 1 1 54 54 LEU C C 54 174.784 174.784 174.655 0.129 25485 19955 1 16 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.113 0.188 25485 19956 1 16 . 1 1 54 54 LEU CB C 54 42.010 42.010 44.905 -2.895 25485 19957 1 16 . 1 1 54 54 LEU H H 54 7.940 7.940 8.316 -0.376 25485 19958 1 16 . 1 1 55 55 ASN N N 55 115.797 115.797 117.810 -2.013 25485 19959 1 16 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.614 0.135 25485 19960 1 16 . 1 1 55 55 ASN C C 55 175.459 175.459 174.696 0.763 25485 19961 1 16 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.813 -1.970 25485 19962 1 16 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.282 2.075 25485 19963 1 16 . 1 1 55 55 ASN H H 55 6.543 6.543 8.492 -1.949 25485 19964 1 16 . 1 1 56 56 SER N N 56 121.507 121.507 116.005 5.502 25485 19965 1 16 . 1 1 56 56 SER HA H 56 4.638 4.638 4.398 0.240 25485 19966 1 16 . 1 1 56 56 SER C C 56 175.727 175.727 175.595 0.132 25485 19967 1 16 . 1 1 56 56 SER CA C 56 57.932 57.932 60.020 -2.088 25485 19968 1 16 . 1 1 56 56 SER CB C 56 63.786 63.786 63.900 -0.114 25485 19969 1 16 . 1 1 56 56 SER H H 56 8.213 8.213 7.943 0.270 25485 19970 1 16 . 1 1 57 57 ARG N N 57 122.951 122.951 122.388 0.563 25485 19971 1 16 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.182 0.019 25485 19972 1 16 . 1 1 57 57 ARG C C 57 178.560 178.560 177.786 0.774 25485 19973 1 16 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.772 -0.340 25485 19974 1 16 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.810 -0.705 25485 19975 1 16 . 1 1 57 57 ARG H H 57 7.895 7.895 8.533 -0.638 25485 19976 1 16 . 1 1 58 58 VAL N N 58 118.778 118.778 118.421 0.357 25485 19977 1 16 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.530 -0.199 25485 19978 1 16 . 1 1 58 58 VAL C C 58 177.370 177.370 178.121 -0.751 25485 19979 1 16 . 1 1 58 58 VAL CA C 58 66.382 66.382 65.689 0.693 25485 19980 1 16 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.071 1.138 25485 19981 1 16 . 1 1 58 58 VAL H H 58 7.583 7.583 8.100 -0.517 25485 19982 1 16 . 1 1 59 59 ILE N N 59 119.159 119.159 116.792 2.367 25485 19983 1 16 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.507 -0.094 25485 19984 1 16 . 1 1 59 59 ILE C C 59 177.067 177.067 177.048 0.019 25485 19985 1 16 . 1 1 59 59 ILE CA C 59 63.633 63.633 64.053 -0.420 25485 19986 1 16 . 1 1 59 59 ILE CB C 59 36.696 36.696 37.852 -1.155 25485 19987 1 16 . 1 1 59 59 ILE H H 59 7.323 7.323 7.814 -0.491 25485 19988 1 16 . 1 1 60 60 GLU N N 60 119.367 119.367 119.756 -0.389 25485 19989 1 16 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.903 -0.165 25485 19990 1 16 . 1 1 60 60 GLU C C 60 179.978 179.978 178.951 1.027 25485 19991 1 16 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.638 -0.380 25485 19992 1 16 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.239 0.149 25485 19993 1 16 . 1 1 60 60 GLU H H 60 7.879 7.879 7.419 0.460 25485 19994 1 16 . 1 1 61 61 ILE N N 61 118.816 118.816 115.548 3.268 25485 19995 1 16 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.719 -0.280 25485 19996 1 16 . 1 1 61 61 ILE C C 61 179.033 179.033 177.126 1.907 25485 19997 1 16 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.811 0.027 25485 19998 1 16 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.521 -0.622 25485 19999 1 16 . 1 1 61 61 ILE H H 61 7.246 7.246 7.422 -0.176 25485 20000 1 16 . 1 1 62 62 MET N N 62 119.986 119.986 115.758 4.228 25485 20001 1 16 . 1 1 62 62 MET HA H 62 3.444 3.444 4.231 -0.787 25485 20002 1 16 . 1 1 62 62 MET C C 62 176.185 176.185 177.821 -1.636 25485 20003 1 16 . 1 1 62 62 MET CA C 62 59.014 59.014 57.260 1.754 25485 20004 1 16 . 1 1 62 62 MET CB C 62 31.250 31.250 31.802 -0.552 25485 20005 1 16 . 1 1 62 62 MET H H 62 7.835 7.835 7.114 0.721 25485 20006 1 16 . 1 1 63 63 GLN N N 63 116.163 116.163 115.535 0.628 25485 20007 1 16 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.297 -0.019 25485 20008 1 16 . 1 1 63 63 GLN C C 63 176.727 176.727 176.892 -0.165 25485 20009 1 16 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.440 -0.302 25485 20010 1 16 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.492 -0.426 25485 20011 1 16 . 1 1 63 63 GLN H H 63 7.454 7.454 7.418 0.036 25485 20012 1 16 . 1 1 64 64 LYS N N 64 121.430 121.430 121.846 -0.416 25485 20013 1 16 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.627 -0.084 25485 20014 1 16 . 1 1 64 64 LYS C C 64 174.724 174.724 174.394 0.330 25485 20015 1 16 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.054 1.463 25485 20016 1 16 . 1 1 64 64 LYS CB C 64 31.597 31.597 33.060 -1.463 25485 20017 1 16 . 1 1 64 64 LYS H H 64 7.483 7.483 7.988 -0.505 25485 20018 1 16 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.504 -2.068 25485 20019 1 16 . 1 1 65 65 PRO C C 65 176.158 176.158 176.545 -0.387 25485 20020 1 16 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.291 -0.403 25485 20021 1 16 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.433 -0.600 25485 20022 1 16 . 1 1 66 66 ARG N N 66 112.697 112.697 118.469 -5.772 25485 20023 1 16 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.909 -0.501 25485 20024 1 16 . 1 1 66 66 ARG C C 66 174.478 174.478 174.797 -0.319 25485 20025 1 16 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.558 -1.922 25485 20026 1 16 . 1 1 66 66 ARG CB C 66 34.673 34.673 30.728 3.945 25485 20027 1 16 . 1 1 66 66 ARG H H 66 8.146 8.146 8.713 -0.567 25485 20028 1 16 . 1 1 67 67 CYS N N 67 121.740 121.740 118.497 3.243 25485 20029 1 16 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.746 -0.306 25485 20030 1 16 . 1 1 67 67 CYS C C 67 175.659 175.659 175.744 -0.085 25485 20031 1 16 . 1 1 67 67 CYS CA C 67 59.195 59.195 58.135 1.060 25485 20032 1 16 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.781 -1.575 25485 20033 1 16 . 1 1 67 67 CYS H H 67 7.757 7.757 8.191 -0.434 25485 20034 1 16 . 1 1 68 68 GLY N N 68 116.217 116.217 112.321 3.896 25485 20035 1 16 . 1 1 68 68 GLY C C 68 172.210 172.210 173.415 -1.205 25485 20036 1 16 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.226 1.333 25485 20037 1 16 . 1 1 68 68 GLY H H 68 9.704 9.704 9.291 0.413 25485 20038 1 16 . 1 1 69 69 VAL N N 69 126.372 126.372 119.195 7.177 25485 20039 1 16 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.275 -0.444 25485 20040 1 16 . 1 1 69 69 VAL C C 69 173.538 173.538 173.643 -0.105 25485 20041 1 16 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.187 3.181 25485 20042 1 16 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.199 0.324 25485 20043 1 16 . 1 1 69 69 VAL H H 69 9.113 9.113 7.442 1.671 25485 20044 1 16 . 1 1 70 70 PRO HA H 70 4.950 4.950 3.864 1.086 25485 20045 1 16 . 1 1 70 70 PRO C C 70 175.019 175.019 175.953 -0.934 25485 20046 1 16 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.201 1.147 25485 20047 1 16 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.514 -0.156 25485 20048 1 16 . 1 1 71 71 ASP N N 71 118.986 118.986 120.364 -1.378 25485 20049 1 16 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.643 -0.210 25485 20050 1 16 . 1 1 71 71 ASP C C 71 175.166 175.166 175.385 -0.219 25485 20051 1 16 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.322 2.046 25485 20052 1 16 . 1 1 71 71 ASP CB C 71 39.864 39.864 40.784 -0.920 25485 20053 1 16 . 1 1 71 71 ASP H H 71 8.054 8.054 8.145 -0.091 25485 20054 1 16 . 1 1 72 72 VAL N N 72 112.953 112.953 115.909 -2.956 25485 20055 1 16 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.440 -0.144 25485 20056 1 16 . 1 1 72 72 VAL C C 72 174.330 174.330 174.644 -0.314 25485 20057 1 16 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.712 -1.067 25485 20058 1 16 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.142 0.730 25485 20059 1 16 . 1 1 72 72 VAL H H 72 6.430 6.430 7.403 -0.973 25485 20060 1 16 . 1 1 73 73 ALA N N 73 125.869 125.869 129.807 -3.938 25485 20061 1 16 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.568 -0.263 25485 20062 1 16 . 1 1 73 73 ALA C C 73 177.382 177.382 176.198 1.184 25485 20063 1 16 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.688 0.361 25485 20064 1 16 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.757 -0.806 25485 20065 1 16 . 1 1 73 73 ALA H H 73 8.177 8.177 8.162 0.015 25485 20066 1 16 . 1 1 74 74 GLU N N 74 120.724 120.724 119.266 1.458 25485 20067 1 16 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.415 -0.312 25485 20068 1 16 . 1 1 74 74 GLU C C 74 176.246 176.246 174.956 1.290 25485 20069 1 16 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.347 0.445 25485 20070 1 16 . 1 1 74 74 GLU CB C 74 29.785 29.785 32.926 -3.141 25485 20071 1 16 . 1 1 74 74 GLU H H 74 8.381 8.381 8.270 0.111 25485 20072 1 16 . 1 1 75 75 TYR N N 75 121.473 121.473 124.531 -3.058 25485 20073 1 16 . 1 1 75 75 TYR HA H 75 4.445 4.445 3.867 0.578 25485 20074 1 16 . 1 1 75 75 TYR C C 75 175.633 175.633 174.866 0.767 25485 20075 1 16 . 1 1 75 75 TYR CA C 75 58.327 58.327 59.084 -0.757 25485 20076 1 16 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.052 0.361 25485 20077 1 16 . 1 1 75 75 TYR H H 75 8.065 8.065 8.652 -0.587 25485 20078 1 16 . 1 1 76 76 SER N N 76 117.860 117.860 120.616 -2.756 25485 20079 1 16 . 1 1 76 76 SER HA H 76 3.886 3.886 4.701 -0.815 25485 20080 1 16 . 1 1 76 76 SER C C 76 173.859 173.859 174.022 -0.163 25485 20081 1 16 . 1 1 76 76 SER CA C 76 58.250 58.250 58.502 -0.251 25485 20082 1 16 . 1 1 76 76 SER CB C 76 64.117 64.117 64.885 -0.768 25485 20083 1 16 . 1 1 76 76 SER H H 76 7.748 7.748 8.290 -0.542 25485 20084 1 16 . 1 1 77 77 LEU N N 77 123.789 123.789 122.672 1.117 25485 20085 1 16 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.989 0.157 25485 20086 1 16 . 1 1 77 77 LEU C C 77 176.451 176.451 175.550 0.901 25485 20087 1 16 . 1 1 77 77 LEU CA C 77 55.464 55.464 56.435 -0.971 25485 20088 1 16 . 1 1 77 77 LEU CB C 77 41.957 41.957 41.681 0.276 25485 20089 1 16 . 1 1 77 77 LEU H H 77 7.979 7.979 8.698 -0.719 25485 20090 1 16 . 1 1 78 78 PHE N N 78 119.275 119.275 118.216 1.059 25485 20091 1 16 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.428 0.448 25485 20092 1 16 . 1 1 78 78 PHE C C 78 173.844 173.844 174.466 -0.622 25485 20093 1 16 . 1 1 78 78 PHE CA C 78 55.372 55.372 55.446 -0.074 25485 20094 1 16 . 1 1 78 78 PHE CB C 78 39.164 39.164 37.672 1.492 25485 20095 1 16 . 1 1 78 78 PHE H H 78 7.827 7.827 8.074 -0.247 25485 20096 1 16 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.087 0.269 25485 20097 1 16 . 1 1 79 79 PRO C C 79 176.433 176.433 175.063 1.370 25485 20098 1 16 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.189 1.661 25485 20099 1 16 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.412 -0.720 25485 20100 1 16 . 1 1 80 80 ASN N N 80 118.057 118.057 118.208 -0.151 25485 20101 1 16 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.376 0.271 25485 20102 1 16 . 1 1 80 80 ASN C C 80 174.305 174.305 175.230 -0.925 25485 20103 1 16 . 1 1 80 80 ASN CA C 80 52.860 52.860 52.764 0.096 25485 20104 1 16 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.602 0.981 25485 20105 1 16 . 1 1 80 80 ASN H H 80 8.068 8.068 8.174 -0.106 25485 20106 1 16 . 1 1 81 81 SER HA H 81 4.565 4.565 4.363 0.202 25485 20107 1 16 . 1 1 81 81 SER CA C 81 56.800 56.800 58.123 -1.323 25485 20108 1 16 . 1 1 81 81 SER CB C 81 63.128 63.128 63.743 -0.615 25485 20109 1 16 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.506 -0.045 25485 20110 1 16 . 1 1 82 82 PRO C C 82 174.589 174.589 176.431 -1.842 25485 20111 1 16 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.635 -0.988 25485 20112 1 16 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.356 -1.103 25485 20113 1 16 . 1 1 83 83 LYS N N 83 114.578 114.578 118.567 -3.989 25485 20114 1 16 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.801 -0.648 25485 20115 1 16 . 1 1 83 83 LYS C C 83 175.308 175.308 176.321 -1.013 25485 20116 1 16 . 1 1 83 83 LYS CA C 83 54.407 54.407 54.988 -0.581 25485 20117 1 16 . 1 1 83 83 LYS CB C 83 34.418 34.418 34.473 -0.055 25485 20118 1 16 . 1 1 83 83 LYS H H 83 7.356 7.356 7.625 -0.269 25485 20119 1 16 . 1 1 84 84 TRP N N 84 122.455 122.455 121.659 0.796 25485 20120 1 16 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.598 -0.578 25485 20121 1 16 . 1 1 84 84 TRP C C 84 177.636 177.636 176.994 0.642 25485 20122 1 16 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.295 -0.824 25485 20123 1 16 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.121 1.197 25485 20124 1 16 . 1 1 84 84 TRP H H 84 8.050 8.050 8.376 -0.326 25485 20125 1 16 . 1 1 85 85 THR N N 85 113.501 113.501 114.629 -1.128 25485 20126 1 16 . 1 1 85 85 THR HA H 85 4.573 4.573 4.424 0.149 25485 20127 1 16 . 1 1 85 85 THR C C 85 174.757 174.757 174.630 0.127 25485 20128 1 16 . 1 1 85 85 THR CA C 85 62.130 62.130 62.032 0.098 25485 20129 1 16 . 1 1 85 85 THR CB C 85 69.107 69.107 70.248 -1.141 25485 20130 1 16 . 1 1 85 85 THR H H 85 8.861 8.861 8.348 0.513 25485 20131 1 16 . 1 1 86 86 SER N N 86 117.270 117.270 118.127 -0.857 25485 20132 1 16 . 1 1 86 86 SER HA H 86 4.741 4.741 4.365 0.376 25485 20133 1 16 . 1 1 86 86 SER C C 86 173.457 173.457 175.103 -1.646 25485 20134 1 16 . 1 1 86 86 SER CA C 86 56.739 56.739 58.516 -1.777 25485 20135 1 16 . 1 1 86 86 SER CB C 86 64.717 64.717 64.243 0.474 25485 20136 1 16 . 1 1 86 86 SER H H 86 7.743 7.743 7.931 -0.188 25485 20137 1 16 . 1 1 87 87 LYS N N 87 120.329 120.329 119.509 0.820 25485 20138 1 16 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.314 -0.085 25485 20139 1 16 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.523 0.069 25485 20140 1 16 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.615 -0.492 25485 20141 1 16 . 1 1 87 87 LYS H H 87 8.285 8.285 8.380 -0.095 25485 20142 1 16 . 1 1 88 88 VAL N N 88 117.531 117.531 117.867 -0.336 25485 20143 1 16 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.897 -0.242 25485 20144 1 16 . 1 1 88 88 VAL C C 88 174.868 174.868 174.307 0.561 25485 20145 1 16 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.243 -0.148 25485 20146 1 16 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.484 -1.789 25485 20147 1 16 . 1 1 88 88 VAL H H 88 7.428 7.428 7.409 0.019 25485 20148 1 16 . 1 1 89 89 VAL N N 89 131.452 131.452 124.826 6.626 25485 20149 1 16 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.455 -0.296 25485 20150 1 16 . 1 1 89 89 VAL C C 89 175.758 175.758 175.174 0.584 25485 20151 1 16 . 1 1 89 89 VAL CA C 89 60.721 60.721 59.913 0.808 25485 20152 1 16 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.977 -0.805 25485 20153 1 16 . 1 1 89 89 VAL H H 89 8.603 8.603 8.922 -0.319 25485 20154 1 16 . 1 1 90 90 THR N N 90 118.206 118.206 115.792 2.414 25485 20155 1 16 . 1 1 90 90 THR HA H 90 5.649 5.649 5.462 0.187 25485 20156 1 16 . 1 1 90 90 THR C C 90 174.579 174.579 173.391 1.188 25485 20157 1 16 . 1 1 90 90 THR CA C 90 58.959 58.959 59.632 -0.673 25485 20158 1 16 . 1 1 90 90 THR CB C 90 72.288 72.288 72.152 0.136 25485 20159 1 16 . 1 1 90 90 THR H H 90 9.021 9.021 8.388 0.633 25485 20160 1 16 . 1 1 91 91 TYR N N 91 118.117 118.117 115.994 2.123 25485 20161 1 16 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.668 0.030 25485 20162 1 16 . 1 1 91 91 TYR C C 91 171.233 171.233 172.793 -1.560 25485 20163 1 16 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.932 -0.500 25485 20164 1 16 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.126 1.134 25485 20165 1 16 . 1 1 91 91 TYR H H 91 8.555 8.555 7.990 0.565 25485 20166 1 16 . 1 1 92 92 ARG N N 92 120.252 120.252 119.885 0.367 25485 20167 1 16 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.668 0.029 25485 20168 1 16 . 1 1 92 92 ARG C C 92 173.932 173.932 174.671 -0.739 25485 20169 1 16 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.404 0.437 25485 20170 1 16 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.838 -0.152 25485 20171 1 16 . 1 1 92 92 ARG H H 92 8.520 8.520 8.888 -0.368 25485 20172 1 16 . 1 1 93 93 ILE N N 93 128.305 128.305 126.208 2.097 25485 20173 1 16 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.359 0.273 25485 20174 1 16 . 1 1 93 93 ILE C C 93 175.468 175.468 176.597 -1.129 25485 20175 1 16 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.077 1.151 25485 20176 1 16 . 1 1 93 93 ILE CB C 93 37.225 37.225 37.146 0.079 25485 20177 1 16 . 1 1 93 93 ILE H H 93 8.886 8.886 8.713 0.173 25485 20178 1 16 . 1 1 94 94 VAL N N 94 126.647 126.647 128.055 -1.408 25485 20179 1 16 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.022 -0.026 25485 20180 1 16 . 1 1 94 94 VAL C C 94 175.670 175.670 176.367 -0.697 25485 20181 1 16 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.173 -0.759 25485 20182 1 16 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.424 0.595 25485 20183 1 16 . 1 1 94 94 VAL H H 94 9.517 9.517 8.439 1.078 25485 20184 1 16 . 1 1 95 95 SER N N 95 113.398 113.398 111.919 1.479 25485 20185 1 16 . 1 1 95 95 SER HA H 95 4.701 4.701 4.647 0.054 25485 20186 1 16 . 1 1 95 95 SER C C 95 170.684 170.684 172.561 -1.877 25485 20187 1 16 . 1 1 95 95 SER CA C 95 56.945 56.945 57.110 -0.165 25485 20188 1 16 . 1 1 95 95 SER CB C 95 65.276 65.276 64.536 0.740 25485 20189 1 16 . 1 1 95 95 SER H H 95 7.463 7.463 7.706 -0.243 25485 20190 1 16 . 1 1 96 96 TYR N N 96 116.512 116.512 119.336 -2.824 25485 20191 1 16 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.890 -0.626 25485 20192 1 16 . 1 1 96 96 TYR C C 96 174.856 174.856 174.384 0.472 25485 20193 1 16 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.579 2.058 25485 20194 1 16 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.002 1.161 25485 20195 1 16 . 1 1 96 96 TYR H H 96 8.240 8.240 8.147 0.093 25485 20196 1 16 . 1 1 97 97 THR CA C 97 57.798 57.798 61.239 -3.441 25485 20197 1 16 . 1 1 97 97 THR CB C 97 67.420 67.420 69.633 -2.213 25485 20198 1 16 . 1 1 98 98 ARG N N 98 128.156 128.156 124.758 3.398 25485 20199 1 16 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.177 0.148 25485 20200 1 16 . 1 1 98 98 ARG C C 98 177.625 177.625 176.097 1.528 25485 20201 1 16 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.505 -1.291 25485 20202 1 16 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.632 -0.152 25485 20203 1 16 . 1 1 98 98 ARG H H 98 8.914 8.914 8.773 0.141 25485 20204 1 16 . 1 1 99 99 ASP N N 99 120.592 120.592 117.654 2.938 25485 20205 1 16 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.672 -0.291 25485 20206 1 16 . 1 1 99 99 ASP C C 99 175.679 175.679 175.006 0.673 25485 20207 1 16 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.863 1.573 25485 20208 1 16 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.440 0.930 25485 20209 1 16 . 1 1 99 99 ASP H H 99 8.708 8.708 8.112 0.596 25485 20210 1 16 . 1 1 100 100 LEU N N 100 116.829 116.829 118.928 -2.099 25485 20211 1 16 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.645 0.311 25485 20212 1 16 . 1 1 100 100 LEU C C 100 173.335 173.335 174.090 -0.755 25485 20213 1 16 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.973 -0.936 25485 20214 1 16 . 1 1 100 100 LEU CB C 100 46.267 46.267 45.109 1.158 25485 20215 1 16 . 1 1 100 100 LEU H H 100 6.916 6.916 7.625 -0.709 25485 20216 1 16 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.135 0.040 25485 20217 1 16 . 1 1 102 102 HIS C C 102 177.649 177.649 177.349 0.300 25485 20218 1 16 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.413 -0.741 25485 20219 1 16 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.155 -1.721 25485 20220 1 16 . 1 1 103 103 ILE N N 103 115.170 115.170 118.317 -3.147 25485 20221 1 16 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.866 0.307 25485 20222 1 16 . 1 1 103 103 ILE C C 103 177.214 177.214 177.267 -0.053 25485 20223 1 16 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.695 -1.530 25485 20224 1 16 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.319 0.446 25485 20225 1 16 . 1 1 103 103 ILE H H 103 8.234 8.234 8.197 0.037 25485 20226 1 16 . 1 1 104 104 THR N N 104 119.374 119.374 117.356 2.018 25485 20227 1 16 . 1 1 104 104 THR HA H 104 4.045 4.045 4.079 -0.034 25485 20228 1 16 . 1 1 104 104 THR C C 104 175.612 175.612 176.704 -1.092 25485 20229 1 16 . 1 1 104 104 THR CA C 104 66.568 66.568 66.873 -0.305 25485 20230 1 16 . 1 1 104 104 THR CB C 104 68.077 68.077 68.770 -0.693 25485 20231 1 16 . 1 1 104 104 THR H H 104 6.947 6.947 7.694 -0.747 25485 20232 1 16 . 1 1 105 105 VAL N N 105 123.263 123.263 121.734 1.529 25485 20233 1 16 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.102 0.336 25485 20234 1 16 . 1 1 105 105 VAL C C 105 177.322 177.322 177.233 0.089 25485 20235 1 16 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.456 0.492 25485 20236 1 16 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.591 -0.322 25485 20237 1 16 . 1 1 105 105 VAL H H 105 7.407 7.407 8.235 -0.828 25485 20238 1 16 . 1 1 106 106 ASP N N 106 119.972 119.972 119.898 0.074 25485 20239 1 16 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.470 -0.148 25485 20240 1 16 . 1 1 106 106 ASP C C 106 179.747 179.747 178.281 1.466 25485 20241 1 16 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.306 0.929 25485 20242 1 16 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.906 -0.544 25485 20243 1 16 . 1 1 106 106 ASP H H 106 8.627 8.627 8.200 0.427 25485 20244 1 16 . 1 1 107 107 ARG N N 107 121.033 121.033 118.619 2.414 25485 20245 1 16 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.136 0.042 25485 20246 1 16 . 1 1 107 107 ARG C C 107 179.485 179.485 178.549 0.936 25485 20247 1 16 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.970 0.610 25485 20248 1 16 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.744 0.464 25485 20249 1 16 . 1 1 107 107 ARG H H 107 8.356 8.356 7.917 0.439 25485 20250 1 16 . 1 1 108 108 LEU N N 108 121.463 121.463 120.798 0.665 25485 20251 1 16 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.201 0.104 25485 20252 1 16 . 1 1 108 108 LEU C C 108 178.852 178.852 178.939 -0.087 25485 20253 1 16 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.456 0.426 25485 20254 1 16 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.429 -0.114 25485 20255 1 16 . 1 1 108 108 LEU H H 108 8.790 8.790 7.833 0.957 25485 20256 1 16 . 1 1 109 109 VAL N N 109 120.233 120.233 116.696 3.537 25485 20257 1 16 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.636 -0.236 25485 20258 1 16 . 1 1 109 109 VAL C C 109 177.019 177.019 177.502 -0.483 25485 20259 1 16 . 1 1 109 109 VAL CA C 109 68.046 68.046 67.067 0.979 25485 20260 1 16 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.422 -0.233 25485 20261 1 16 . 1 1 109 109 VAL H H 109 8.787 8.787 7.890 0.897 25485 20262 1 16 . 1 1 110 110 SER N N 110 112.862 112.862 115.560 -2.698 25485 20263 1 16 . 1 1 110 110 SER HA H 110 4.300 4.300 3.960 0.340 25485 20264 1 16 . 1 1 110 110 SER C C 110 176.770 176.770 176.719 0.051 25485 20265 1 16 . 1 1 110 110 SER CA C 110 61.744 61.744 61.503 0.241 25485 20266 1 16 . 1 1 110 110 SER CB C 110 62.742 62.742 62.784 -0.042 25485 20267 1 16 . 1 1 110 110 SER H H 110 7.605 7.605 7.794 -0.189 25485 20268 1 16 . 1 1 111 111 LYS N N 111 122.319 122.319 121.957 0.362 25485 20269 1 16 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.090 -0.029 25485 20270 1 16 . 1 1 111 111 LYS C C 111 178.309 178.309 178.590 -0.281 25485 20271 1 16 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.297 0.517 25485 20272 1 16 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.564 -0.055 25485 20273 1 16 . 1 1 111 111 LYS H H 111 8.156 8.156 7.978 0.178 25485 20274 1 16 . 1 1 112 112 ALA N N 112 124.147 124.147 120.914 3.233 25485 20275 1 16 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.393 -0.294 25485 20276 1 16 . 1 1 112 112 ALA C C 112 179.445 179.445 179.109 0.336 25485 20277 1 16 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.443 0.783 25485 20278 1 16 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.135 0.839 25485 20279 1 16 . 1 1 112 112 ALA H H 112 8.278 8.278 7.480 0.798 25485 20280 1 16 . 1 1 113 113 LEU N N 113 116.195 116.195 120.488 -4.293 25485 20281 1 16 . 1 1 113 113 LEU HA H 113 3.751 3.751 3.979 -0.228 25485 20282 1 16 . 1 1 113 113 LEU C C 113 179.537 179.537 177.904 1.633 25485 20283 1 16 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.764 -0.020 25485 20284 1 16 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.840 -1.285 25485 20285 1 16 . 1 1 113 113 LEU H H 113 8.021 8.021 8.394 -0.373 25485 20286 1 16 . 1 1 114 114 ASN N N 114 116.570 116.570 117.693 -1.123 25485 20287 1 16 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.688 -0.142 25485 20288 1 16 . 1 1 114 114 ASN C C 114 177.136 177.136 177.517 -0.381 25485 20289 1 16 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.553 -0.789 25485 20290 1 16 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.571 0.052 25485 20291 1 16 . 1 1 114 114 ASN H H 114 8.212 8.212 8.323 -0.112 25485 20292 1 16 . 1 1 115 115 MET N N 115 122.055 122.055 118.587 3.468 25485 20293 1 16 . 1 1 115 115 MET HA H 115 4.010 4.010 4.102 -0.092 25485 20294 1 16 . 1 1 115 115 MET C C 115 177.681 177.681 178.020 -0.339 25485 20295 1 16 . 1 1 115 115 MET CA C 115 59.445 59.445 59.436 0.009 25485 20296 1 16 . 1 1 115 115 MET CB C 115 31.616 31.616 32.269 -0.653 25485 20297 1 16 . 1 1 115 115 MET H H 115 7.937 7.937 7.687 0.250 25485 20298 1 16 . 1 1 116 116 TRP N N 116 117.115 117.115 117.569 -0.454 25485 20299 1 16 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.370 0.148 25485 20300 1 16 . 1 1 116 116 TRP C C 116 179.054 179.054 179.019 0.035 25485 20301 1 16 . 1 1 116 116 TRP CA C 116 59.511 59.511 58.541 0.970 25485 20302 1 16 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.425 1.448 25485 20303 1 16 . 1 1 116 116 TRP H H 116 6.783 6.783 7.253 -0.470 25485 20304 1 16 . 1 1 117 117 GLY N N 117 104.511 104.511 107.588 -3.077 25485 20305 1 16 . 1 1 117 117 GLY C C 117 175.035 175.035 176.152 -1.117 25485 20306 1 16 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.868 0.129 25485 20307 1 16 . 1 1 117 117 GLY H H 117 9.302 9.302 8.242 1.060 25485 20308 1 16 . 1 1 118 118 LYS N N 118 118.580 118.580 119.802 -1.222 25485 20309 1 16 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.131 0.076 25485 20310 1 16 . 1 1 118 118 LYS C C 118 177.235 177.235 177.611 -0.376 25485 20311 1 16 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.021 0.870 25485 20312 1 16 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.613 0.291 25485 20313 1 16 . 1 1 118 118 LYS H H 118 7.940 7.940 7.997 -0.057 25485 20314 1 16 . 1 1 119 119 GLU N N 119 113.749 113.749 117.190 -3.441 25485 20315 1 16 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.466 0.372 25485 20316 1 16 . 1 1 119 119 GLU C C 119 178.024 178.024 175.009 3.015 25485 20317 1 16 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.479 -0.204 25485 20318 1 16 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.781 0.905 25485 20319 1 16 . 1 1 119 119 GLU H H 119 7.763 7.763 7.575 0.188 25485 20320 1 16 . 1 1 120 120 ILE N N 120 111.144 111.144 112.755 -1.611 25485 20321 1 16 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.690 0.681 25485 20322 1 16 . 1 1 120 120 ILE C C 120 174.033 174.033 174.317 -0.284 25485 20323 1 16 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.636 0.818 25485 20324 1 16 . 1 1 120 120 ILE CB C 120 41.929 41.929 40.185 1.744 25485 20325 1 16 . 1 1 120 120 ILE H H 120 7.518 7.518 7.654 -0.136 25485 20326 1 16 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.468 0.194 25485 20327 1 16 . 1 1 121 121 PRO C C 121 174.784 174.784 176.309 -1.525 25485 20328 1 16 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.090 -1.075 25485 20329 1 16 . 1 1 121 121 PRO CB C 121 29.385 29.385 30.113 -0.728 25485 20330 1 16 . 1 1 122 122 LEU N N 122 121.531 121.531 119.099 2.432 25485 20331 1 16 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.477 -0.138 25485 20332 1 16 . 1 1 122 122 LEU C C 122 173.977 173.977 176.328 -2.351 25485 20333 1 16 . 1 1 122 122 LEU CA C 122 54.558 54.558 54.762 -0.204 25485 20334 1 16 . 1 1 122 122 LEU CB C 122 45.399 45.399 43.526 1.873 25485 20335 1 16 . 1 1 122 122 LEU H H 122 6.847 6.847 7.392 -0.545 25485 20336 1 16 . 1 1 123 123 HIS N N 123 121.054 121.054 115.890 5.164 25485 20337 1 16 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.524 0.083 25485 20338 1 16 . 1 1 123 123 HIS C C 123 172.820 172.820 173.136 -0.316 25485 20339 1 16 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.244 -0.735 25485 20340 1 16 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.942 0.168 25485 20341 1 16 . 1 1 123 123 HIS H H 123 7.760 7.760 8.352 -0.593 25485 20342 1 16 . 1 1 124 124 PHE N N 124 120.465 120.465 123.180 -2.715 25485 20343 1 16 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.648 0.186 25485 20344 1 16 . 1 1 124 124 PHE C C 124 175.677 175.677 175.611 0.066 25485 20345 1 16 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.764 0.528 25485 20346 1 16 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.352 0.470 25485 20347 1 16 . 1 1 124 124 PHE H H 124 8.306 8.306 8.375 -0.069 25485 20348 1 16 . 1 1 125 125 ARG N N 125 124.008 124.008 123.288 0.720 25485 20349 1 16 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.923 -0.212 25485 20350 1 16 . 1 1 125 125 ARG C C 125 172.901 172.901 175.645 -2.744 25485 20351 1 16 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.846 -0.572 25485 20352 1 16 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.242 -0.420 25485 20353 1 16 . 1 1 125 125 ARG H H 125 8.426 8.426 9.336 -0.910 25485 20354 1 16 . 1 1 126 126 LYS N N 126 130.004 130.004 125.318 4.686 25485 20355 1 16 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.263 -0.880 25485 20356 1 16 . 1 1 126 126 LYS C C 126 176.126 176.126 175.576 0.550 25485 20357 1 16 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.959 0.222 25485 20358 1 16 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.065 -0.038 25485 20359 1 16 . 1 1 126 126 LYS H H 126 8.481 8.481 8.595 -0.114 25485 20360 1 16 . 1 1 127 127 VAL N N 127 125.288 125.288 120.683 4.605 25485 20361 1 16 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.279 0.226 25485 20362 1 16 . 1 1 127 127 VAL C C 127 175.565 175.565 175.435 0.130 25485 20363 1 16 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.336 -1.387 25485 20364 1 16 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.920 1.442 25485 20365 1 16 . 1 1 127 127 VAL H H 127 8.721 8.721 7.944 0.777 25485 20366 1 16 . 1 1 128 128 VAL N N 128 117.467 117.467 119.829 -2.362 25485 20367 1 16 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.084 0.245 25485 20368 1 16 . 1 1 128 128 VAL C C 128 174.622 174.622 174.956 -0.334 25485 20369 1 16 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.372 0.746 25485 20370 1 16 . 1 1 128 128 VAL CB C 128 32.510 32.510 31.879 0.631 25485 20371 1 16 . 1 1 128 128 VAL H H 128 8.406 8.406 7.951 0.455 25485 20372 1 16 . 1 1 129 129 TRP N N 129 119.986 119.986 121.920 -1.934 25485 20373 1 16 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.907 -0.191 25485 20374 1 16 . 1 1 129 129 TRP C C 129 174.536 174.536 176.450 -1.914 25485 20375 1 16 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.920 -1.003 25485 20376 1 16 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.508 2.506 25485 20377 1 16 . 1 1 129 129 TRP H H 129 7.435 7.435 7.417 0.018 25485 20378 1 16 . 1 1 130 130 GLY N N 130 109.900 109.900 112.605 -2.705 25485 20379 1 16 . 1 1 130 130 GLY C C 130 173.187 173.187 173.932 -0.745 25485 20380 1 16 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.483 -0.003 25485 20381 1 16 . 1 1 130 130 GLY H H 130 8.006 8.006 8.426 -0.420 25485 20382 1 16 . 1 1 131 131 THR N N 131 116.142 116.142 115.651 0.491 25485 20383 1 16 . 1 1 131 131 THR HA H 131 4.162 4.162 4.495 -0.333 25485 20384 1 16 . 1 1 131 131 THR C C 131 172.766 172.766 173.191 -0.425 25485 20385 1 16 . 1 1 131 131 THR CA C 131 63.212 63.212 61.148 2.064 25485 20386 1 16 . 1 1 131 131 THR CB C 131 69.308 69.308 70.142 -0.834 25485 20387 1 16 . 1 1 131 131 THR H H 131 8.233 8.233 8.115 0.118 25485 20388 1 16 . 1 1 132 132 ALA N N 132 129.807 129.807 124.677 5.130 25485 20389 1 16 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.705 -0.189 25485 20390 1 16 . 1 1 132 132 ALA C C 132 175.358 175.358 176.499 -1.141 25485 20391 1 16 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.151 -0.784 25485 20392 1 16 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.305 1.493 25485 20393 1 16 . 1 1 132 132 ALA H H 132 7.962 7.962 8.530 -0.568 25485 20394 1 16 . 1 1 133 133 ASP N N 133 122.896 122.896 120.541 2.355 25485 20395 1 16 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.562 -0.141 25485 20396 1 16 . 1 1 133 133 ASP C C 133 177.314 177.314 176.976 0.338 25485 20397 1 16 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.421 1.498 25485 20398 1 16 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.277 -0.806 25485 20399 1 16 . 1 1 133 133 ASP H H 133 8.251 8.251 8.444 -0.193 25485 20400 1 16 . 1 1 134 134 ILE N N 134 125.472 125.472 121.281 4.191 25485 20401 1 16 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.310 -0.167 25485 20402 1 16 . 1 1 134 134 ILE C C 134 174.201 174.201 175.201 -1.000 25485 20403 1 16 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.429 -0.158 25485 20404 1 16 . 1 1 134 134 ILE CB C 134 38.710 38.710 38.462 0.248 25485 20405 1 16 . 1 1 134 134 ILE H H 134 8.802 8.802 8.061 0.741 25485 20406 1 16 . 1 1 135 135 MET N N 135 127.265 127.265 127.219 0.046 25485 20407 1 16 . 1 1 135 135 MET HA H 135 5.192 5.192 5.498 -0.306 25485 20408 1 16 . 1 1 135 135 MET C C 135 176.206 176.206 175.753 0.453 25485 20409 1 16 . 1 1 135 135 MET CA C 135 53.626 53.626 52.571 1.055 25485 20410 1 16 . 1 1 135 135 MET CB C 135 32.639 32.639 34.253 -1.614 25485 20411 1 16 . 1 1 135 135 MET H H 135 7.418 7.418 8.314 -0.896 25485 20412 1 16 . 1 1 136 136 ILE N N 136 125.440 125.440 123.287 2.153 25485 20413 1 16 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.983 0.606 25485 20414 1 16 . 1 1 136 136 ILE C C 136 175.190 175.190 176.122 -0.932 25485 20415 1 16 . 1 1 136 136 ILE CA C 136 60.108 60.108 59.072 1.036 25485 20416 1 16 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.574 4.366 25485 20417 1 16 . 1 1 136 136 ILE H H 136 9.124 9.124 8.627 0.497 25485 20418 1 16 . 1 1 137 137 GLY N N 137 112.211 112.211 114.183 -1.972 25485 20419 1 16 . 1 1 137 137 GLY C C 137 170.855 170.855 172.238 -1.383 25485 20420 1 16 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.913 1.492 25485 20421 1 16 . 1 1 137 137 GLY H H 137 8.594 8.594 8.178 0.416 25485 20422 1 16 . 1 1 138 138 PHE N N 138 119.463 119.463 118.442 1.021 25485 20423 1 16 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.577 -0.081 25485 20424 1 16 . 1 1 138 138 PHE C C 138 175.186 175.186 173.857 1.329 25485 20425 1 16 . 1 1 138 138 PHE CA C 138 55.995 55.995 54.424 1.571 25485 20426 1 16 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.082 0.360 25485 20427 1 16 . 1 1 138 138 PHE H H 138 7.857 7.857 8.248 -0.391 25485 20428 1 16 . 1 1 139 139 ALA N N 139 123.914 123.914 126.099 -2.185 25485 20429 1 16 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.617 0.114 25485 20430 1 16 . 1 1 139 139 ALA C C 139 174.613 174.613 175.702 -1.089 25485 20431 1 16 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.147 -1.112 25485 20432 1 16 . 1 1 139 139 ALA CB C 139 22.472 22.472 21.149 1.323 25485 20433 1 16 . 1 1 139 139 ALA H H 139 8.955 8.955 9.134 -0.179 25485 20434 1 16 . 1 1 140 140 ARG N N 140 118.339 118.339 120.207 -1.868 25485 20435 1 16 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.871 0.235 25485 20436 1 16 . 1 1 140 140 ARG C C 140 176.201 176.201 178.376 -2.175 25485 20437 1 16 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.937 -0.771 25485 20438 1 16 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.621 0.848 25485 20439 1 16 . 1 1 140 140 ARG H H 140 8.546 8.546 8.478 0.068 25485 20440 1 16 . 1 1 141 141 GLY N N 141 108.916 108.916 108.511 0.405 25485 20441 1 16 . 1 1 141 141 GLY C C 141 175.595 175.595 174.752 0.843 25485 20442 1 16 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.080 -0.790 25485 20443 1 16 . 1 1 141 141 GLY H H 141 8.989 8.989 9.283 -0.294 25485 20444 1 16 . 1 1 142 142 ALA N N 142 121.448 121.448 121.029 0.419 25485 20445 1 16 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.304 0.104 25485 20446 1 16 . 1 1 142 142 ALA C C 142 177.027 177.027 177.356 -0.329 25485 20447 1 16 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.287 0.990 25485 20448 1 16 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.106 -0.142 25485 20449 1 16 . 1 1 142 142 ALA H H 142 8.642 8.642 8.186 0.456 25485 20450 1 16 . 1 1 143 143 HIS N N 143 120.356 120.356 115.892 4.464 25485 20451 1 16 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.601 0.556 25485 20452 1 16 . 1 1 143 143 HIS C C 143 174.303 174.303 175.715 -1.412 25485 20453 1 16 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.681 -0.228 25485 20454 1 16 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.444 -1.653 25485 20455 1 16 . 1 1 143 143 HIS H H 143 8.990 8.990 8.394 0.596 25485 20456 1 16 . 1 1 144 144 GLY N N 144 112.517 112.517 107.250 5.267 25485 20457 1 16 . 1 1 144 144 GLY C C 144 173.758 173.758 173.289 0.469 25485 20458 1 16 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.769 1.326 25485 20459 1 16 . 1 1 144 144 GLY H H 144 5.175 5.175 7.789 -2.614 25485 20460 1 16 . 1 1 145 145 ASP N N 145 117.762 117.762 119.453 -1.691 25485 20461 1 16 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.872 -0.174 25485 20462 1 16 . 1 1 145 145 ASP C C 145 175.851 175.851 175.227 0.624 25485 20463 1 16 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.731 -0.772 25485 20464 1 16 . 1 1 145 145 ASP CB C 145 41.799 41.799 43.896 -2.097 25485 20465 1 16 . 1 1 145 145 ASP H H 145 7.096 7.096 7.477 -0.381 25485 20466 1 16 . 1 1 146 146 SER N N 146 125.540 125.540 116.113 9.427 25485 20467 1 16 . 1 1 146 146 SER HA H 146 4.204 4.204 4.447 -0.243 25485 20468 1 16 . 1 1 146 146 SER C C 146 172.319 172.319 174.109 -1.790 25485 20469 1 16 . 1 1 146 146 SER CA C 146 58.862 58.862 58.215 0.647 25485 20470 1 16 . 1 1 146 146 SER CB C 146 62.933 62.933 63.902 -0.969 25485 20471 1 16 . 1 1 146 146 SER H H 146 8.261 8.261 8.326 -0.065 25485 20472 1 16 . 1 1 147 147 TYR N N 147 120.757 120.757 118.101 2.656 25485 20473 1 16 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.223 0.599 25485 20474 1 16 . 1 1 147 147 TYR C C 147 170.372 170.372 173.889 -3.517 25485 20475 1 16 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.057 -3.789 25485 20476 1 16 . 1 1 147 147 TYR CB C 147 38.296 38.296 37.400 0.896 25485 20477 1 16 . 1 1 147 147 TYR H H 147 7.450 7.450 8.566 -1.116 25485 20478 1 16 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.122 0.750 25485 20479 1 16 . 1 1 148 148 PRO C C 148 179.009 179.009 175.962 3.047 25485 20480 1 16 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.139 1.236 25485 20481 1 16 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.192 -1.283 25485 20482 1 16 . 1 1 149 149 PHE N N 149 120.514 120.514 117.373 3.141 25485 20483 1 16 . 1 1 149 149 PHE C C 149 176.813 176.813 175.410 1.403 25485 20484 1 16 . 1 1 149 149 PHE CA C 149 58.453 58.453 57.954 0.499 25485 20485 1 16 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.275 0.298 25485 20486 1 16 . 1 1 149 149 PHE H H 149 8.024 8.024 7.127 0.897 25485 20487 1 16 . 1 1 150 150 ASP N N 150 115.555 115.555 115.458 0.097 25485 20488 1 16 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.439 0.400 25485 20489 1 16 . 1 1 150 150 ASP C C 150 177.007 177.007 176.577 0.430 25485 20490 1 16 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.336 -0.465 25485 20491 1 16 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.105 2.830 25485 20492 1 16 . 1 1 150 150 ASP H H 150 7.511 7.511 8.446 -0.935 25485 20493 1 16 . 1 1 151 151 GLY N N 151 110.650 110.650 108.648 2.002 25485 20494 1 16 . 1 1 151 151 GLY C C 151 170.281 170.281 172.927 -2.646 25485 20495 1 16 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.658 -0.260 25485 20496 1 16 . 1 1 151 151 GLY H H 151 9.080 9.080 8.606 0.474 25485 20497 1 16 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.141 -0.085 25485 20498 1 16 . 1 1 152 152 PRO C C 152 178.300 178.300 176.667 1.633 25485 20499 1 16 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.164 0.686 25485 20500 1 16 . 1 1 152 152 PRO CB C 152 31.260 31.260 32.158 -0.898 25485 20501 1 16 . 1 1 153 153 GLY N N 153 118.783 118.783 113.269 5.514 25485 20502 1 16 . 1 1 153 153 GLY C C 153 174.098 174.098 173.202 0.896 25485 20503 1 16 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.544 -0.938 25485 20504 1 16 . 1 1 153 153 GLY H H 153 11.431 11.431 8.542 2.889 25485 20505 1 16 . 1 1 154 154 ASN N N 154 120.679 120.679 122.453 -1.774 25485 20506 1 16 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.520 -0.276 25485 20507 1 16 . 1 1 154 154 ASN C C 154 174.636 174.636 175.566 -0.930 25485 20508 1 16 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.587 2.081 25485 20509 1 16 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.676 -1.706 25485 20510 1 16 . 1 1 154 154 ASN H H 154 9.247 9.247 8.498 0.749 25485 20511 1 16 . 1 1 155 155 THR N N 155 118.252 118.252 111.175 7.077 25485 20512 1 16 . 1 1 155 155 THR HA H 155 5.577 5.577 4.129 1.448 25485 20513 1 16 . 1 1 155 155 THR C C 155 176.596 176.596 173.093 3.503 25485 20514 1 16 . 1 1 155 155 THR CA C 155 61.731 61.731 62.515 -0.784 25485 20515 1 16 . 1 1 155 155 THR CB C 155 71.325 71.325 68.773 2.552 25485 20516 1 16 . 1 1 155 155 THR H H 155 9.501 9.501 8.524 0.977 25485 20517 1 16 . 1 1 156 156 LEU N N 156 122.598 122.598 125.018 -2.420 25485 20518 1 16 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.555 0.316 25485 20519 1 16 . 1 1 156 156 LEU C C 156 175.655 175.655 176.046 -0.391 25485 20520 1 16 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.329 -0.791 25485 20521 1 16 . 1 1 156 156 LEU CB C 156 44.511 44.511 43.036 1.475 25485 20522 1 16 . 1 1 156 156 LEU H H 156 8.492 8.492 8.433 0.059 25485 20523 1 16 . 1 1 157 157 ALA N N 157 115.389 115.389 115.514 -0.125 25485 20524 1 16 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.525 0.510 25485 20525 1 16 . 1 1 157 157 ALA C C 157 175.739 175.739 175.204 0.535 25485 20526 1 16 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.327 -0.388 25485 20527 1 16 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.990 1.464 25485 20528 1 16 . 1 1 157 157 ALA H H 157 7.567 7.567 7.836 -0.269 25485 20529 1 16 . 1 1 158 158 HIS N N 158 111.900 111.900 118.440 -6.540 25485 20530 1 16 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.814 -0.209 25485 20531 1 16 . 1 1 158 158 HIS C C 158 170.186 170.186 172.478 -2.292 25485 20532 1 16 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.075 2.000 25485 20533 1 16 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.717 -1.531 25485 20534 1 16 . 1 1 158 158 HIS H H 158 8.757 8.757 7.807 0.950 25485 20535 1 16 . 1 1 159 159 ALA N N 159 118.286 118.286 126.230 -7.944 25485 20536 1 16 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.128 0.526 25485 20537 1 16 . 1 1 159 159 ALA C C 159 174.036 174.036 175.574 -1.538 25485 20538 1 16 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.216 0.917 25485 20539 1 16 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.689 2.348 25485 20540 1 16 . 1 1 159 159 ALA H H 159 6.110 6.110 8.215 -2.105 25485 20541 1 16 . 1 1 160 160 PHE N N 160 117.937 117.937 118.536 -0.599 25485 20542 1 16 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.740 -0.237 25485 20543 1 16 . 1 1 160 160 PHE C C 160 174.455 174.455 175.069 -0.614 25485 20544 1 16 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.259 1.554 25485 20545 1 16 . 1 1 160 160 PHE CB C 160 42.194 42.194 42.017 0.177 25485 20546 1 16 . 1 1 160 160 PHE H H 160 7.912 7.912 7.973 -0.061 25485 20547 1 16 . 1 1 161 161 ALA N N 161 123.531 123.531 123.871 -0.340 25485 20548 1 16 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.654 -0.163 25485 20549 1 16 . 1 1 161 161 ALA C C 161 175.503 175.503 176.313 -0.810 25485 20550 1 16 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.612 1.021 25485 20551 1 16 . 1 1 161 161 ALA CB C 161 16.556 16.556 18.866 -2.310 25485 20552 1 16 . 1 1 161 161 ALA H H 161 8.107 8.107 8.537 -0.430 25485 20553 1 16 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.405 -1.495 25485 20554 1 16 . 1 1 162 162 PRO C C 162 173.465 173.465 175.961 -2.496 25485 20555 1 16 . 1 1 162 162 PRO CA C 162 64.257 64.257 63.243 1.014 25485 20556 1 16 . 1 1 162 162 PRO CB C 162 31.242 31.242 30.312 0.930 25485 20557 1 16 . 1 1 163 163 GLY N N 163 107.206 107.206 111.457 -4.251 25485 20558 1 16 . 1 1 163 163 GLY C C 163 172.092 172.092 173.035 -0.943 25485 20559 1 16 . 1 1 163 163 GLY CA C 163 43.993 43.993 45.173 -1.180 25485 20560 1 16 . 1 1 163 163 GLY H H 163 5.997 5.997 8.177 -2.180 25485 20561 1 16 . 1 1 165 165 GLY N N 165 103.110 103.110 108.886 -5.776 25485 20562 1 16 . 1 1 165 165 GLY C C 165 177.158 177.158 174.995 2.163 25485 20563 1 16 . 1 1 165 165 GLY CA C 165 44.243 44.243 46.855 -2.612 25485 20564 1 16 . 1 1 165 165 GLY H H 165 9.145 9.145 8.665 0.480 25485 20565 1 16 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.550 -0.371 25485 20566 1 16 . 1 1 166 166 LEU C C 166 176.437 176.437 177.410 -0.973 25485 20567 1 16 . 1 1 166 166 LEU CA C 166 56.200 56.200 54.991 1.209 25485 20568 1 16 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.299 -0.465 25485 20569 1 16 . 1 1 167 167 GLY N N 167 103.318 103.318 104.320 -1.002 25485 20570 1 16 . 1 1 167 167 GLY C C 167 174.803 174.803 174.120 0.683 25485 20571 1 16 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.475 2.758 25485 20572 1 16 . 1 1 167 167 GLY H H 167 7.768 7.768 7.660 0.108 25485 20573 1 16 . 1 1 168 168 GLY N N 168 121.051 121.051 109.418 11.633 25485 20574 1 16 . 1 1 168 168 GLY C C 168 172.122 172.122 174.653 -2.531 25485 20575 1 16 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.121 1.481 25485 20576 1 16 . 1 1 168 168 GLY H H 168 7.698 7.698 7.985 -0.287 25485 20577 1 16 . 1 1 169 169 ASP N N 169 123.641 123.641 122.320 1.321 25485 20578 1 16 . 1 1 169 169 ASP C C 169 173.942 173.942 174.328 -0.386 25485 20579 1 16 . 1 1 169 169 ASP CA C 169 55.842 55.842 54.588 1.254 25485 20580 1 16 . 1 1 169 169 ASP CB C 169 39.870 39.870 41.533 -1.663 25485 20581 1 16 . 1 1 169 169 ASP H H 169 8.595 8.595 7.789 0.806 25485 20582 1 16 . 1 1 170 170 ALA N N 170 119.366 119.366 122.623 -3.257 25485 20583 1 16 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.318 0.412 25485 20584 1 16 . 1 1 170 170 ALA C C 170 174.593 174.593 175.115 -0.522 25485 20585 1 16 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.699 0.425 25485 20586 1 16 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.311 1.024 25485 20587 1 16 . 1 1 170 170 ALA H H 170 8.324 8.324 8.398 -0.074 25485 20588 1 16 . 1 1 171 171 HIS N N 171 120.239 120.239 121.125 -0.886 25485 20589 1 16 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.541 0.207 25485 20590 1 16 . 1 1 171 171 HIS C C 171 172.949 172.949 173.945 -0.996 25485 20591 1 16 . 1 1 171 171 HIS CA C 171 50.724 50.724 52.851 -2.127 25485 20592 1 16 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.067 1.474 25485 20593 1 16 . 1 1 171 171 HIS H H 171 8.499 8.499 7.641 0.858 25485 20594 1 16 . 1 1 172 172 PHE N N 172 121.125 121.125 120.994 0.131 25485 20595 1 16 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.539 -0.011 25485 20596 1 16 . 1 1 172 172 PHE C C 172 173.875 173.875 174.112 -0.237 25485 20597 1 16 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.586 0.334 25485 20598 1 16 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.045 0.858 25485 20599 1 16 . 1 1 172 172 PHE H H 172 8.445 8.445 8.986 -0.541 25485 20600 1 16 . 1 1 173 173 ASP N N 173 124.014 124.014 122.879 1.135 25485 20601 1 16 . 1 1 173 173 ASP HA H 173 3.914 3.914 5.229 -1.315 25485 20602 1 16 . 1 1 173 173 ASP C C 173 178.613 178.613 178.014 0.599 25485 20603 1 16 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.349 1.448 25485 20604 1 16 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.193 -0.450 25485 20605 1 16 . 1 1 173 173 ASP H H 173 7.927 7.927 8.624 -0.697 25485 20606 1 16 . 1 1 174 174 GLU N N 174 132.469 132.469 127.173 5.296 25485 20607 1 16 . 1 1 174 174 GLU C C 174 176.442 176.442 177.247 -0.805 25485 20608 1 16 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.855 -1.671 25485 20609 1 16 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.337 0.948 25485 20610 1 16 . 1 1 174 174 GLU H H 174 9.528 9.528 8.632 0.896 25485 20611 1 16 . 1 1 175 175 ASP N N 175 117.394 117.394 119.147 -1.753 25485 20612 1 16 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.605 0.188 25485 20613 1 16 . 1 1 175 175 ASP C C 175 176.645 176.645 176.640 0.005 25485 20614 1 16 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.855 0.076 25485 20615 1 16 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.657 -1.516 25485 20616 1 16 . 1 1 175 175 ASP H H 175 8.768 8.768 8.528 0.240 25485 20617 1 16 . 1 1 176 176 GLU N N 176 116.493 116.493 118.379 -1.886 25485 20618 1 16 . 1 1 176 176 GLU C C 176 175.038 175.038 175.620 -0.582 25485 20619 1 16 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.439 -1.774 25485 20620 1 16 . 1 1 176 176 GLU CB C 176 26.223 26.223 31.009 -4.786 25485 20621 1 16 . 1 1 176 176 GLU H H 176 7.159 7.159 8.262 -1.103 25485 20622 1 16 . 1 1 177 177 ARG N N 177 122.186 122.186 119.033 3.153 25485 20623 1 16 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.342 0.347 25485 20624 1 16 . 1 1 177 177 ARG C C 177 174.482 174.482 174.217 0.265 25485 20625 1 16 . 1 1 177 177 ARG CA C 177 53.687 53.687 54.776 -1.089 25485 20626 1 16 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.528 -1.444 25485 20627 1 16 . 1 1 177 177 ARG H H 177 7.560 7.560 8.080 -0.520 25485 20628 1 16 . 1 1 178 178 TRP N N 178 129.179 129.179 124.073 5.106 25485 20629 1 16 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.366 -0.266 25485 20630 1 16 . 1 1 178 178 TRP C C 178 176.298 176.298 176.470 -0.172 25485 20631 1 16 . 1 1 178 178 TRP CA C 178 56.813 56.813 55.766 1.047 25485 20632 1 16 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.812 -0.615 25485 20633 1 16 . 1 1 178 178 TRP H H 178 8.807 8.807 8.423 0.384 25485 20634 1 16 . 1 1 179 179 THR N N 179 112.792 112.792 116.110 -3.318 25485 20635 1 16 . 1 1 179 179 THR HA H 179 4.985 4.985 4.599 0.386 25485 20636 1 16 . 1 1 179 179 THR C C 179 172.765 172.765 172.644 0.121 25485 20637 1 16 . 1 1 179 179 THR CA C 179 59.106 59.106 60.529 -1.423 25485 20638 1 16 . 1 1 179 179 THR CB C 179 71.786 71.786 70.184 1.602 25485 20639 1 16 . 1 1 179 179 THR H H 179 8.974 8.974 8.718 0.256 25485 20640 1 16 . 1 1 180 180 ASP N N 180 122.074 122.074 124.506 -2.432 25485 20641 1 16 . 1 1 180 180 ASP HA H 180 4.463 4.463 4.961 -0.498 25485 20642 1 16 . 1 1 180 180 ASP C C 180 176.366 176.366 178.172 -1.806 25485 20643 1 16 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.102 -2.059 25485 20644 1 16 . 1 1 180 180 ASP CB C 180 41.728 41.728 41.978 -0.250 25485 20645 1 16 . 1 1 180 180 ASP H H 180 8.485 8.485 8.756 -0.271 25485 20646 1 16 . 1 1 181 181 GLY N N 181 110.123 110.123 107.746 2.377 25485 20647 1 16 . 1 1 181 181 GLY C C 181 174.325 174.325 175.506 -1.181 25485 20648 1 16 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.369 1.292 25485 20649 1 16 . 1 1 181 181 GLY H H 181 8.569 8.569 8.582 -0.013 25485 20650 1 16 . 1 1 182 182 SER N N 182 115.562 115.562 114.935 0.627 25485 20651 1 16 . 1 1 182 182 SER HA H 182 4.519 4.519 4.514 0.005 25485 20652 1 16 . 1 1 182 182 SER C C 182 173.783 173.783 174.312 -0.529 25485 20653 1 16 . 1 1 182 182 SER CA C 182 57.965 57.965 58.116 -0.151 25485 20654 1 16 . 1 1 182 182 SER CB C 182 64.166 64.166 64.194 -0.028 25485 20655 1 16 . 1 1 182 182 SER H H 182 8.160 8.160 7.730 0.430 25485 20656 1 16 . 1 1 183 183 SER N N 183 117.153 117.153 115.225 1.928 25485 20657 1 16 . 1 1 183 183 SER HA H 183 4.275 4.275 4.331 -0.056 25485 20658 1 16 . 1 1 183 183 SER C C 183 173.333 173.333 174.006 -0.673 25485 20659 1 16 . 1 1 183 183 SER CA C 183 59.902 59.902 59.113 0.789 25485 20660 1 16 . 1 1 183 183 SER CB C 183 64.941 64.941 62.971 1.970 25485 20661 1 16 . 1 1 183 183 SER H H 183 7.796 7.796 7.504 0.292 25485 20662 1 16 . 1 1 184 184 LEU N N 184 122.351 122.351 120.610 1.741 25485 20663 1 16 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.536 -0.144 25485 20664 1 16 . 1 1 184 184 LEU C C 184 176.250 176.250 175.885 0.365 25485 20665 1 16 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.526 0.049 25485 20666 1 16 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.220 -1.139 25485 20667 1 16 . 1 1 184 184 LEU H H 184 8.092 8.092 8.291 -0.199 25485 20668 1 16 . 1 1 185 185 GLY N N 185 108.871 108.871 107.232 1.639 25485 20669 1 16 . 1 1 185 185 GLY C C 185 172.375 172.375 174.085 -1.710 25485 20670 1 16 . 1 1 185 185 GLY CA C 185 44.380 44.380 43.964 0.416 25485 20671 1 16 . 1 1 185 185 GLY H H 185 7.960 7.960 7.430 0.530 25485 20672 1 16 . 1 1 186 186 ILE N N 186 123.096 123.096 122.658 0.438 25485 20673 1 16 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.268 -0.426 25485 20674 1 16 . 1 1 186 186 ILE C C 186 175.350 175.350 175.941 -0.591 25485 20675 1 16 . 1 1 186 186 ILE CA C 186 58.401 58.401 58.855 -0.453 25485 20676 1 16 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.199 0.257 25485 20677 1 16 . 1 1 186 186 ILE H H 186 8.893 8.893 7.685 1.208 25485 20678 1 16 . 1 1 187 187 ASN N N 187 127.167 127.167 126.465 0.702 25485 20679 1 16 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.920 -0.567 25485 20680 1 16 . 1 1 187 187 ASN C C 187 175.849 175.849 176.992 -1.143 25485 20681 1 16 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.687 1.027 25485 20682 1 16 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.939 0.191 25485 20683 1 16 . 1 1 187 187 ASN H H 187 8.580 8.580 8.273 0.307 25485 20684 1 16 . 1 1 188 188 PHE N N 188 129.985 129.985 125.933 4.052 25485 20685 1 16 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.253 0.320 25485 20686 1 16 . 1 1 188 188 PHE C C 188 175.578 175.578 177.511 -1.933 25485 20687 1 16 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.625 -0.897 25485 20688 1 16 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.419 0.013 25485 20689 1 16 . 1 1 188 188 PHE H H 188 9.361 9.361 8.429 0.932 25485 20690 1 16 . 1 1 189 189 LEU N N 189 119.113 119.113 119.852 -0.739 25485 20691 1 16 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.043 -0.242 25485 20692 1 16 . 1 1 189 189 LEU C C 189 179.601 179.601 178.135 1.466 25485 20693 1 16 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.563 -0.054 25485 20694 1 16 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.645 -1.768 25485 20695 1 16 . 1 1 189 189 LEU H H 189 8.562 8.562 8.207 0.355 25485 20696 1 16 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.416 0.501 25485 20697 1 16 . 1 1 190 190 TYR C C 190 177.621 177.621 177.189 0.432 25485 20698 1 16 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.021 -0.213 25485 20699 1 16 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.986 1.783 25485 20700 1 16 . 1 1 191 191 ALA N N 191 120.352 120.352 120.814 -0.462 25485 20701 1 16 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.088 0.227 25485 20702 1 16 . 1 1 191 191 ALA C C 191 180.252 180.252 178.825 1.427 25485 20703 1 16 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.419 0.763 25485 20704 1 16 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.598 0.544 25485 20705 1 16 . 1 1 191 191 ALA H H 191 7.993 7.993 8.799 -0.806 25485 20706 1 16 . 1 1 192 192 ALA N N 192 121.409 121.409 121.791 -0.382 25485 20707 1 16 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.044 0.013 25485 20708 1 16 . 1 1 192 192 ALA C C 192 178.575 178.575 179.593 -1.018 25485 20709 1 16 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.465 -0.280 25485 20710 1 16 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.075 -1.877 25485 20711 1 16 . 1 1 192 192 ALA H H 192 9.297 9.297 8.178 1.119 25485 20712 1 16 . 1 1 193 193 THR N N 193 116.996 116.996 114.329 2.667 25485 20713 1 16 . 1 1 193 193 THR HA H 193 3.833 3.833 4.031 -0.198 25485 20714 1 16 . 1 1 193 193 THR CA C 193 69.138 69.138 67.224 1.914 25485 20715 1 16 . 1 1 193 193 THR CB C 193 67.365 67.365 68.389 -1.024 25485 20716 1 16 . 1 1 193 193 THR H H 193 8.226 8.226 7.585 0.641 25485 20717 1 16 . 1 1 194 194 HIS N N 194 120.296 120.296 121.797 -1.501 25485 20718 1 16 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.111 0.125 25485 20719 1 16 . 1 1 194 194 HIS C C 194 175.962 175.962 176.663 -0.701 25485 20720 1 16 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.270 1.477 25485 20721 1 16 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.880 -1.961 25485 20722 1 16 . 1 1 194 194 HIS H H 194 7.782 7.782 7.428 0.354 25485 20723 1 16 . 1 1 195 195 ALA N N 195 121.290 121.290 122.255 -0.965 25485 20724 1 16 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.983 0.172 25485 20725 1 16 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.897 1.067 25485 20726 1 16 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.624 0.086 25485 20727 1 16 . 1 1 195 195 ALA H H 195 8.690 8.690 8.407 0.283 25485 20728 1 16 . 1 1 196 196 LEU N N 196 114.899 114.899 118.439 -3.540 25485 20729 1 16 . 1 1 196 196 LEU HA H 196 4.170 4.170 3.997 0.173 25485 20730 1 16 . 1 1 196 196 LEU C C 196 177.946 177.946 179.422 -1.476 25485 20731 1 16 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.766 -1.538 25485 20732 1 16 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.027 -1.251 25485 20733 1 16 . 1 1 196 196 LEU H H 196 8.715 8.715 8.790 -0.075 25485 20734 1 16 . 1 1 197 197 GLY N N 197 107.901 107.901 104.789 3.112 25485 20735 1 16 . 1 1 197 197 GLY C C 197 178.641 178.641 175.295 3.346 25485 20736 1 16 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.876 0.691 25485 20737 1 16 . 1 1 197 197 GLY H H 197 7.546 7.546 7.942 -0.396 25485 20738 1 16 . 1 1 198 198 HIS N N 198 122.017 122.017 119.462 2.555 25485 20739 1 16 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.434 0.423 25485 20740 1 16 . 1 1 198 198 HIS C C 198 179.874 179.874 178.127 1.747 25485 20741 1 16 . 1 1 198 198 HIS CA C 198 58.522 58.522 58.621 -0.099 25485 20742 1 16 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.542 -1.996 25485 20743 1 16 . 1 1 198 198 HIS H H 198 7.196 7.196 7.235 -0.039 25485 20744 1 16 . 1 1 199 199 SER N N 199 118.486 118.486 115.672 2.814 25485 20745 1 16 . 1 1 199 199 SER HA H 199 4.490 4.490 4.629 -0.139 25485 20746 1 16 . 1 1 199 199 SER C C 199 174.493 174.493 175.629 -1.136 25485 20747 1 16 . 1 1 199 199 SER CA C 199 58.173 58.173 61.095 -2.922 25485 20748 1 16 . 1 1 199 199 SER CB C 199 63.589 63.589 62.678 0.911 25485 20749 1 16 . 1 1 199 199 SER H H 199 7.884 7.884 7.606 0.278 25485 20750 1 16 . 1 1 200 200 LEU N N 200 114.686 114.686 117.878 -3.192 25485 20751 1 16 . 1 1 200 200 LEU C C 200 177.720 177.720 177.150 0.570 25485 20752 1 16 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.157 0.680 25485 20753 1 16 . 1 1 200 200 LEU CB C 200 42.357 42.357 40.575 1.782 25485 20754 1 16 . 1 1 200 200 LEU H H 200 7.108 7.108 7.608 -0.500 25485 20755 1 16 . 1 1 201 201 GLY N N 201 108.363 108.363 106.697 1.666 25485 20756 1 16 . 1 1 201 201 GLY C C 201 174.008 174.008 174.939 -0.931 25485 20757 1 16 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.613 -1.199 25485 20758 1 16 . 1 1 201 201 GLY H H 201 8.195 8.195 7.578 0.617 25485 20759 1 16 . 1 1 202 202 MET N N 202 119.635 119.635 121.978 -2.343 25485 20760 1 16 . 1 1 202 202 MET HA H 202 4.473 4.473 4.404 0.069 25485 20761 1 16 . 1 1 202 202 MET C C 202 176.593 176.593 175.345 1.248 25485 20762 1 16 . 1 1 202 202 MET CA C 202 54.500 54.500 55.662 -1.162 25485 20763 1 16 . 1 1 202 202 MET CB C 202 32.161 32.161 33.497 -1.336 25485 20764 1 16 . 1 1 202 202 MET H H 202 8.182 8.182 7.248 0.934 25485 20765 1 16 . 1 1 203 203 GLY N N 203 109.749 109.749 111.534 -1.785 25485 20766 1 16 . 1 1 203 203 GLY C C 203 174.042 174.042 173.874 0.168 25485 20767 1 16 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.864 -0.860 25485 20768 1 16 . 1 1 203 203 GLY H H 203 8.405 8.405 8.320 0.085 25485 20769 1 16 . 1 1 204 204 HIS N N 204 115.732 115.732 120.316 -4.584 25485 20770 1 16 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.477 0.923 25485 20771 1 16 . 1 1 204 204 HIS C C 204 174.430 174.430 174.486 -0.056 25485 20772 1 16 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.799 -1.985 25485 20773 1 16 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.783 -0.957 25485 20774 1 16 . 1 1 204 204 HIS H H 204 8.364 8.364 8.455 -0.091 25485 20775 1 16 . 1 1 205 205 SER N N 205 115.484 115.484 113.965 1.519 25485 20776 1 16 . 1 1 205 205 SER HA H 205 4.766 4.766 4.790 -0.024 25485 20777 1 16 . 1 1 205 205 SER C C 205 173.611 173.611 174.668 -1.057 25485 20778 1 16 . 1 1 205 205 SER CA C 205 54.729 54.729 57.343 -2.614 25485 20779 1 16 . 1 1 205 205 SER CB C 205 65.855 65.855 65.660 0.195 25485 20780 1 16 . 1 1 205 205 SER H H 205 7.231 7.231 8.356 -1.125 25485 20781 1 16 . 1 1 206 206 SER N N 206 119.263 119.263 117.707 1.556 25485 20782 1 16 . 1 1 206 206 SER HA H 206 3.701 3.701 4.623 -0.922 25485 20783 1 16 . 1 1 206 206 SER C C 206 173.635 173.635 174.287 -0.652 25485 20784 1 16 . 1 1 206 206 SER CA C 206 63.846 63.846 59.076 4.770 25485 20785 1 16 . 1 1 206 206 SER CB C 206 63.764 63.764 63.901 -0.137 25485 20786 1 16 . 1 1 206 206 SER H H 206 8.289 8.289 8.881 -0.592 25485 20787 1 16 . 1 1 207 207 ASP N N 207 126.646 126.646 123.662 2.984 25485 20788 1 16 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.644 0.285 25485 20789 1 16 . 1 1 207 207 ASP C C 207 174.614 174.614 175.170 -0.556 25485 20790 1 16 . 1 1 207 207 ASP CA C 207 51.272 51.272 53.139 -1.867 25485 20791 1 16 . 1 1 207 207 ASP CB C 207 41.288 41.288 41.553 -0.266 25485 20792 1 16 . 1 1 207 207 ASP H H 207 8.541 8.541 8.207 0.334 25485 20793 1 16 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.855 -0.068 25485 20794 1 16 . 1 1 208 208 PRO C C 208 177.467 177.467 175.509 1.958 25485 20795 1 16 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.810 -0.974 25485 20796 1 16 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.192 -0.595 25485 20797 1 16 . 1 1 209 209 ASN N N 209 116.020 116.020 112.001 4.019 25485 20798 1 16 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.643 -0.002 25485 20799 1 16 . 1 1 209 209 ASN C C 209 174.695 174.695 173.604 1.091 25485 20800 1 16 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.101 2.119 25485 20801 1 16 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.124 0.986 25485 20802 1 16 . 1 1 209 209 ASN H H 209 8.350 8.350 7.660 0.690 25485 20803 1 16 . 1 1 210 210 ALA N N 210 124.892 124.892 121.054 3.838 25485 20804 1 16 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.293 -0.198 25485 20805 1 16 . 1 1 210 210 ALA C C 210 179.495 179.495 177.351 2.144 25485 20806 1 16 . 1 1 210 210 ALA CA C 210 52.054 52.054 51.001 1.053 25485 20807 1 16 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.458 -1.259 25485 20808 1 16 . 1 1 210 210 ALA H H 210 8.193 8.193 7.038 1.155 25485 20809 1 16 . 1 1 211 211 VAL N N 211 130.402 130.402 123.752 6.650 25485 20810 1 16 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.618 0.645 25485 20811 1 16 . 1 1 211 211 VAL C C 211 179.408 179.408 176.179 3.229 25485 20812 1 16 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.179 -0.127 25485 20813 1 16 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.254 -1.271 25485 20814 1 16 . 1 1 211 211 VAL H H 211 11.592 11.592 9.080 2.512 25485 20815 1 16 . 1 1 212 212 MET N N 212 113.285 113.285 115.939 -2.654 25485 20816 1 16 . 1 1 212 212 MET C C 212 176.996 176.996 175.056 1.940 25485 20817 1 16 . 1 1 212 212 MET CA C 212 53.614 53.614 54.180 -0.566 25485 20818 1 16 . 1 1 212 212 MET CB C 212 26.975 26.975 32.742 -5.766 25485 20819 1 16 . 1 1 212 212 MET H H 212 7.724 7.724 7.673 0.051 25485 20820 1 16 . 1 1 213 213 TYR N N 213 129.919 129.919 123.819 6.100 25485 20821 1 16 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.355 1.341 25485 20822 1 16 . 1 1 213 213 TYR C C 213 178.411 178.411 175.803 2.608 25485 20823 1 16 . 1 1 213 213 TYR CA C 213 57.131 57.131 56.591 0.540 25485 20824 1 16 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.204 0.963 25485 20825 1 16 . 1 1 213 213 TYR H H 213 7.902 7.902 7.258 0.644 25485 20826 1 16 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.548 -1.073 25485 20827 1 16 . 1 1 214 214 PRO C C 214 177.694 177.694 176.777 0.917 25485 20828 1 16 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.459 1.569 25485 20829 1 16 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.627 1.196 25485 20830 1 16 . 1 1 215 215 THR N N 215 104.450 104.450 108.310 -3.860 25485 20831 1 16 . 1 1 215 215 THR HA H 215 4.444 4.444 4.225 0.219 25485 20832 1 16 . 1 1 215 215 THR C C 215 173.429 173.429 174.448 -1.019 25485 20833 1 16 . 1 1 215 215 THR CA C 215 60.528 60.528 61.742 -1.214 25485 20834 1 16 . 1 1 215 215 THR CB C 215 69.614 69.614 68.836 0.778 25485 20835 1 16 . 1 1 215 215 THR H H 215 6.407 6.407 7.456 -1.049 25485 20836 1 16 . 1 1 216 216 TYR N N 216 124.618 124.618 120.314 4.304 25485 20837 1 16 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.345 -0.113 25485 20838 1 16 . 1 1 216 216 TYR C C 216 175.669 175.669 175.423 0.246 25485 20839 1 16 . 1 1 216 216 TYR CA C 216 58.587 58.587 59.480 -0.893 25485 20840 1 16 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.808 2.083 25485 20841 1 16 . 1 1 216 216 TYR H H 216 8.331 8.331 7.474 0.857 25485 20842 1 16 . 1 1 217 217 GLY N N 217 116.089 116.089 112.090 3.999 25485 20843 1 16 . 1 1 217 217 GLY C C 217 173.560 173.560 174.569 -1.009 25485 20844 1 16 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.556 -0.238 25485 20845 1 16 . 1 1 217 217 GLY H H 217 7.695 7.695 8.697 -1.002 25485 20846 1 16 . 1 1 218 218 ASN N N 218 120.167 120.167 123.970 -3.803 25485 20847 1 16 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.561 0.105 25485 20848 1 16 . 1 1 218 218 ASN C C 218 175.343 175.343 176.697 -1.354 25485 20849 1 16 . 1 1 218 218 ASN CA C 218 53.615 53.615 55.490 -1.875 25485 20850 1 16 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.669 -0.123 25485 20851 1 16 . 1 1 218 218 ASN H H 218 8.237 8.237 8.245 -0.008 25485 20852 1 16 . 1 1 219 219 GLY N N 219 109.322 109.322 108.572 0.750 25485 20853 1 16 . 1 1 219 219 GLY C C 219 172.842 172.842 173.077 -0.235 25485 20854 1 16 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.840 -0.122 25485 20855 1 16 . 1 1 219 219 GLY H H 219 8.027 8.027 8.322 -0.295 25485 20856 1 16 . 1 1 220 220 ASP N N 220 123.006 123.006 121.339 1.667 25485 20857 1 16 . 1 1 220 220 ASP H H 220 8.273 8.273 8.277 -0.004 25485 20858 1 16 . 1 1 221 221 PRO C C 221 177.138 177.138 176.895 0.243 25485 20859 1 16 . 1 1 221 221 PRO CA C 221 57.063 57.063 63.139 -6.076 25485 20860 1 16 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.654 -0.958 25485 20861 1 16 . 1 1 222 222 GLN N N 222 116.718 116.718 123.898 -7.180 25485 20862 1 16 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.259 0.077 25485 20863 1 16 . 1 1 222 222 GLN C C 222 176.321 176.321 176.885 -0.564 25485 20864 1 16 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.183 -1.040 25485 20865 1 16 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.865 0.632 25485 20866 1 16 . 1 1 222 222 GLN H H 222 8.240 8.240 8.943 -0.703 25485 20867 1 16 . 1 1 223 223 ASN N N 223 118.368 118.368 115.271 3.097 25485 20868 1 16 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.783 0.133 25485 20869 1 16 . 1 1 223 223 ASN C C 223 173.271 173.271 174.556 -1.285 25485 20870 1 16 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.094 -0.498 25485 20871 1 16 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.870 -0.655 25485 20872 1 16 . 1 1 223 223 ASN H H 223 7.946 7.946 8.296 -0.350 25485 20873 1 16 . 1 1 224 224 PHE N N 224 118.429 118.429 117.525 0.904 25485 20874 1 16 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.361 0.090 25485 20875 1 16 . 1 1 224 224 PHE C C 224 172.897 172.897 173.150 -0.253 25485 20876 1 16 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.877 0.532 25485 20877 1 16 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.269 0.432 25485 20878 1 16 . 1 1 224 224 PHE H H 224 6.992 6.992 7.783 -0.791 25485 20879 1 16 . 1 1 225 225 LYS N N 225 121.714 121.714 123.835 -2.121 25485 20880 1 16 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.922 0.508 25485 20881 1 16 . 1 1 225 225 LYS C C 225 174.664 174.664 174.706 -0.042 25485 20882 1 16 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.197 0.115 25485 20883 1 16 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.290 0.437 25485 20884 1 16 . 1 1 225 225 LYS H H 225 7.709 7.709 7.845 -0.136 25485 20885 1 16 . 1 1 226 226 LEU N N 226 119.026 119.026 121.008 -1.982 25485 20886 1 16 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.041 0.099 25485 20887 1 16 . 1 1 226 226 LEU C C 226 177.495 177.495 176.919 0.576 25485 20888 1 16 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.033 0.566 25485 20889 1 16 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.535 -1.254 25485 20890 1 16 . 1 1 226 226 LEU H H 226 8.015 8.015 8.079 -0.064 25485 20891 1 16 . 1 1 227 227 SER N N 227 120.320 120.320 114.967 5.353 25485 20892 1 16 . 1 1 227 227 SER HA H 227 4.600 4.600 4.539 0.061 25485 20893 1 16 . 1 1 227 227 SER C C 227 175.492 175.492 175.052 0.440 25485 20894 1 16 . 1 1 227 227 SER CA C 227 57.239 57.239 57.427 -0.188 25485 20895 1 16 . 1 1 227 227 SER CB C 227 66.278 66.278 64.787 1.491 25485 20896 1 16 . 1 1 227 227 SER H H 227 9.654 9.654 8.305 1.349 25485 20897 1 16 . 1 1 228 228 GLN N N 228 127.511 127.511 122.750 4.761 25485 20898 1 16 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.978 0.716 25485 20899 1 16 . 1 1 228 228 GLN H H 228 8.248 8.248 8.969 -0.721 25485 20900 1 16 . 1 1 229 229 ASP N N 229 124.358 124.358 118.189 6.169 25485 20901 1 16 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.284 0.090 25485 20902 1 16 . 1 1 229 229 ASP C C 229 178.793 178.793 177.457 1.336 25485 20903 1 16 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.149 0.993 25485 20904 1 16 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.590 2.651 25485 20905 1 16 . 1 1 229 229 ASP H H 229 8.138 8.138 8.539 -0.401 25485 20906 1 16 . 1 1 230 230 ASP N N 230 119.694 119.694 120.087 -0.393 25485 20907 1 16 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.469 -0.047 25485 20908 1 16 . 1 1 230 230 ASP C C 230 177.736 177.736 178.416 -0.680 25485 20909 1 16 . 1 1 230 230 ASP CA C 230 57.922 57.922 56.719 1.203 25485 20910 1 16 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.865 2.370 25485 20911 1 16 . 1 1 230 230 ASP H H 230 7.393 7.393 8.205 -0.812 25485 20912 1 16 . 1 1 231 231 ILE N N 231 120.364 120.364 119.938 0.426 25485 20913 1 16 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.763 -0.098 25485 20914 1 16 . 1 1 231 231 ILE C C 231 177.631 177.631 177.749 -0.118 25485 20915 1 16 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.010 0.490 25485 20916 1 16 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.110 0.403 25485 20917 1 16 . 1 1 231 231 ILE H H 231 8.115 8.115 7.765 0.350 25485 20918 1 16 . 1 1 232 232 LYS N N 232 119.156 119.156 120.636 -1.480 25485 20919 1 16 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.104 0.010 25485 20920 1 16 . 1 1 232 232 LYS C C 232 180.574 180.574 179.129 1.445 25485 20921 1 16 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.253 0.307 25485 20922 1 16 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.252 0.545 25485 20923 1 16 . 1 1 232 232 LYS H H 232 8.607 8.607 8.318 0.289 25485 20924 1 16 . 1 1 233 233 GLY N N 233 106.425 106.425 107.651 -1.226 25485 20925 1 16 . 1 1 233 233 GLY C C 233 176.098 176.098 175.884 0.214 25485 20926 1 16 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.717 0.920 25485 20927 1 16 . 1 1 233 233 GLY H H 233 8.075 8.075 7.612 0.463 25485 20928 1 16 . 1 1 234 234 ILE N N 234 125.119 125.119 121.714 3.405 25485 20929 1 16 . 1 1 234 234 ILE C C 234 178.231 178.231 177.348 0.883 25485 20930 1 16 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.390 -1.797 25485 20931 1 16 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.127 -0.580 25485 20932 1 16 . 1 1 234 234 ILE H H 234 8.539 8.539 7.453 1.086 25485 20933 1 16 . 1 1 235 235 GLN N N 235 122.877 122.877 119.516 3.361 25485 20934 1 16 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.081 0.276 25485 20935 1 16 . 1 1 235 235 GLN C C 235 180.105 180.105 178.422 1.683 25485 20936 1 16 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.488 -1.601 25485 20937 1 16 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.842 -1.305 25485 20938 1 16 . 1 1 235 235 GLN H H 235 8.296 8.296 8.679 -0.383 25485 20939 1 16 . 1 1 236 236 LYS N N 236 123.678 123.678 118.153 5.525 25485 20940 1 16 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.203 -0.121 25485 20941 1 16 . 1 1 236 236 LYS C C 236 178.169 178.169 177.718 0.451 25485 20942 1 16 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.578 0.798 25485 20943 1 16 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.907 0.071 25485 20944 1 16 . 1 1 236 236 LYS H H 236 8.024 8.024 7.744 0.280 25485 20945 1 16 . 1 1 237 237 LEU N N 237 116.873 116.873 119.097 -2.224 25485 20946 1 16 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.386 -0.399 25485 20947 1 16 . 1 1 237 237 LEU C C 237 177.893 177.893 177.765 0.128 25485 20948 1 16 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.509 0.930 25485 20949 1 16 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.838 0.775 25485 20950 1 16 . 1 1 237 237 LEU H H 237 6.888 6.888 7.365 -0.477 25485 20951 1 16 . 1 1 238 238 TYR N N 238 112.237 112.237 117.641 -5.404 25485 20952 1 16 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.499 0.152 25485 20953 1 16 . 1 1 238 238 TYR C C 238 176.082 176.082 176.889 -0.807 25485 20954 1 16 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.313 -0.677 25485 20955 1 16 . 1 1 238 238 TYR CB C 238 41.398 41.398 40.136 1.262 25485 20956 1 16 . 1 1 238 238 TYR H H 238 7.445 7.445 8.656 -1.211 25485 20957 1 16 . 1 1 239 239 GLY N N 239 110.906 110.906 106.065 4.841 25485 20958 1 16 . 1 1 239 239 GLY C C 239 171.269 171.269 172.660 -1.391 25485 20959 1 16 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.442 -1.556 25485 20960 1 16 . 1 1 239 239 GLY H H 239 8.443 8.443 8.049 0.394 25485 20961 1 16 . 1 1 240 240 LYS N N 240 114.281 114.281 122.405 -8.124 25485 20962 1 16 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.689 0.049 25485 20963 1 16 . 1 1 240 240 LYS C C 240 177.527 177.527 175.857 1.670 25485 20964 1 16 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.542 -0.584 25485 20965 1 16 . 1 1 240 240 LYS CB C 240 34.275 34.275 34.369 -0.094 25485 20966 1 16 . 1 1 240 240 LYS H H 240 7.873 7.873 8.380 -0.507 25485 20967 1 16 . 1 1 241 241 ARG N N 241 123.758 123.758 120.065 3.693 25485 20968 1 16 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.636 -0.639 25485 20969 1 16 . 1 1 241 241 ARG C C 241 176.026 176.026 174.817 1.209 25485 20970 1 16 . 1 1 241 241 ARG CA C 241 57.492 57.492 55.249 2.243 25485 20971 1 16 . 1 1 241 241 ARG CB C 241 30.371 30.371 31.604 -1.233 25485 20972 1 16 . 1 1 241 241 ARG H H 241 7.742 7.742 8.363 -0.621 25485 20973 1 16 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.334 0.006 25485 20974 1 16 . 1 1 246 246 LYS C C 246 175.403 175.403 176.057 -0.654 25485 20975 1 16 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.458 0.051 25485 20976 1 16 . 1 1 246 246 LYS CB C 246 32.858 32.858 32.949 -0.091 25485 20977 1 17 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.483 -0.176 25485 20978 1 17 . 1 1 2 2 GLN C C 2 176.492 176.492 175.834 0.658 25485 20979 1 17 . 1 1 2 2 GLN CA C 2 56.749 56.749 55.668 1.081 25485 20980 1 17 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.383 0.271 25485 20981 1 17 . 1 1 3 3 GLU N N 3 121.668 121.668 121.753 -0.085 25485 20982 1 17 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.353 -0.564 25485 20983 1 17 . 1 1 3 3 GLU C C 3 176.278 176.278 177.514 -1.236 25485 20984 1 17 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.301 -0.242 25485 20985 1 17 . 1 1 3 3 GLU CB C 3 29.691 29.691 30.200 -0.508 25485 20986 1 17 . 1 1 3 3 GLU H H 3 8.331 8.331 8.406 -0.075 25485 20987 1 17 . 1 1 4 4 ALA N N 4 124.493 124.493 122.502 1.991 25485 20988 1 17 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.172 0.338 25485 20989 1 17 . 1 1 4 4 ALA C C 4 178.428 178.428 179.911 -1.483 25485 20990 1 17 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.901 -0.225 25485 20991 1 17 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.110 0.599 25485 20992 1 17 . 1 1 4 4 ALA H H 4 8.131 8.131 8.534 -0.403 25485 20993 1 17 . 1 1 5 5 GLY N N 5 108.204 108.204 108.418 -0.214 25485 20994 1 17 . 1 1 5 5 GLY C C 5 174.858 174.858 175.511 -0.653 25485 20995 1 17 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.371 1.290 25485 20996 1 17 . 1 1 5 5 GLY H H 5 8.279 8.279 8.550 -0.271 25485 20997 1 17 . 1 1 6 6 GLY N N 6 108.820 108.820 108.021 0.799 25485 20998 1 17 . 1 1 6 6 GLY C C 6 174.189 174.189 173.622 0.567 25485 20999 1 17 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.142 0.272 25485 21000 1 17 . 1 1 6 6 GLY H H 6 8.246 8.246 7.713 0.533 25485 21001 1 17 . 1 1 7 7 MET N N 7 119.938 119.938 119.674 0.264 25485 21002 1 17 . 1 1 7 7 MET HA H 7 4.659 4.659 4.437 0.222 25485 21003 1 17 . 1 1 7 7 MET C C 7 176.191 176.191 175.603 0.588 25485 21004 1 17 . 1 1 7 7 MET CA C 7 54.799 54.799 55.698 -0.899 25485 21005 1 17 . 1 1 7 7 MET CB C 7 33.046 33.046 33.567 -0.521 25485 21006 1 17 . 1 1 7 7 MET H H 7 8.005 8.005 7.502 0.503 25485 21007 1 17 . 1 1 8 8 SER N N 8 118.919 118.919 117.175 1.744 25485 21008 1 17 . 1 1 8 8 SER HA H 8 4.239 4.239 4.711 -0.472 25485 21009 1 17 . 1 1 8 8 SER C C 8 174.949 174.949 175.394 -0.445 25485 21010 1 17 . 1 1 8 8 SER CA C 8 58.160 58.160 57.499 0.661 25485 21011 1 17 . 1 1 8 8 SER CB C 8 65.440 65.440 64.226 1.214 25485 21012 1 17 . 1 1 8 8 SER H H 8 8.731 8.731 8.236 0.495 25485 21013 1 17 . 1 1 9 9 GLU N N 9 122.442 122.442 121.442 1.000 25485 21014 1 17 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.155 0.166 25485 21015 1 17 . 1 1 9 9 GLU C C 9 178.604 178.604 179.057 -0.453 25485 21016 1 17 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.776 -0.309 25485 21017 1 17 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.324 -0.148 25485 21018 1 17 . 1 1 9 9 GLU H H 9 8.901 8.901 9.000 -0.099 25485 21019 1 17 . 1 1 10 10 LEU N N 10 120.568 120.568 119.382 1.186 25485 21020 1 17 . 1 1 10 10 LEU C C 10 179.307 179.307 179.262 0.045 25485 21021 1 17 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.236 -0.756 25485 21022 1 17 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.956 -0.381 25485 21023 1 17 . 1 1 10 10 LEU H H 10 8.020 8.020 8.167 -0.147 25485 21024 1 17 . 1 1 11 11 GLN N N 11 119.930 119.930 118.273 1.657 25485 21025 1 17 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.311 -0.177 25485 21026 1 17 . 1 1 11 11 GLN C C 11 178.330 178.330 178.638 -0.308 25485 21027 1 17 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.423 0.395 25485 21028 1 17 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.468 -0.604 25485 21029 1 17 . 1 1 11 11 GLN H H 11 7.811 7.811 7.670 0.141 25485 21030 1 17 . 1 1 12 12 TRP N N 12 121.031 121.031 121.104 -0.073 25485 21031 1 17 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.402 0.012 25485 21032 1 17 . 1 1 12 12 TRP C C 12 178.874 178.874 178.058 0.816 25485 21033 1 17 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.499 0.008 25485 21034 1 17 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.742 -0.355 25485 21035 1 17 . 1 1 12 12 TRP H H 12 8.205 8.205 7.930 0.275 25485 21036 1 17 . 1 1 13 13 GLU N N 13 121.877 121.877 119.066 2.811 25485 21037 1 17 . 1 1 13 13 GLU C C 13 179.425 179.425 178.897 0.528 25485 21038 1 17 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.670 0.367 25485 21039 1 17 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.388 -0.466 25485 21040 1 17 . 1 1 13 13 GLU H H 13 8.434 8.434 8.290 0.144 25485 21041 1 17 . 1 1 14 14 GLN N N 14 120.449 120.449 118.288 2.161 25485 21042 1 17 . 1 1 14 14 GLN HA H 14 4.238 4.238 4.037 0.201 25485 21043 1 17 . 1 1 14 14 GLN C C 14 179.210 179.210 177.990 1.220 25485 21044 1 17 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.521 0.361 25485 21045 1 17 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.536 -0.786 25485 21046 1 17 . 1 1 14 14 GLN H H 14 8.124 8.124 7.685 0.439 25485 21047 1 17 . 1 1 15 15 ALA N N 15 123.114 123.114 120.474 2.640 25485 21048 1 17 . 1 1 15 15 ALA HA H 15 4.390 4.390 4.017 0.373 25485 21049 1 17 . 1 1 15 15 ALA C C 15 179.352 179.352 179.213 0.139 25485 21050 1 17 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.115 -0.151 25485 21051 1 17 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.763 0.900 25485 21052 1 17 . 1 1 15 15 ALA H H 15 8.344 8.344 7.567 0.777 25485 21053 1 17 . 1 1 16 16 GLN N N 16 117.718 117.718 117.732 -0.014 25485 21054 1 17 . 1 1 16 16 GLN HA H 16 3.782 3.782 4.010 -0.228 25485 21055 1 17 . 1 1 16 16 GLN C C 16 177.719 177.719 178.052 -0.333 25485 21056 1 17 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.813 1.468 25485 21057 1 17 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.646 -0.110 25485 21058 1 17 . 1 1 16 16 GLN H H 16 8.500 8.500 7.546 0.954 25485 21059 1 17 . 1 1 17 17 ASP N N 17 120.040 120.040 120.283 -0.243 25485 21060 1 17 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.326 0.210 25485 21061 1 17 . 1 1 17 17 ASP C C 17 177.630 177.630 178.776 -1.146 25485 21062 1 17 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.171 0.634 25485 21063 1 17 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.399 1.465 25485 21064 1 17 . 1 1 17 17 ASP H H 17 7.871 7.871 7.581 0.290 25485 21065 1 17 . 1 1 18 18 TYR N N 18 122.465 122.465 119.986 2.479 25485 21066 1 17 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.297 -0.107 25485 21067 1 17 . 1 1 18 18 TYR C C 18 178.439 178.439 178.073 0.366 25485 21068 1 17 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.473 1.373 25485 21069 1 17 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.185 1.755 25485 21070 1 17 . 1 1 18 18 TYR H H 18 8.244 8.244 8.220 0.024 25485 21071 1 17 . 1 1 19 19 LEU N N 19 117.635 117.635 119.060 -1.425 25485 21072 1 17 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.973 0.159 25485 21073 1 17 . 1 1 19 19 LEU C C 19 180.940 180.940 178.740 2.200 25485 21074 1 17 . 1 1 19 19 LEU CA C 19 57.505 57.505 57.088 0.417 25485 21075 1 17 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.865 -1.267 25485 21076 1 17 . 1 1 19 19 LEU H H 19 8.713 8.713 7.643 1.070 25485 21077 1 17 . 1 1 20 20 LYS N N 20 124.594 124.594 117.044 7.550 25485 21078 1 17 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.264 -0.180 25485 21079 1 17 . 1 1 20 20 LYS C C 20 178.387 178.387 178.205 0.182 25485 21080 1 17 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.759 1.046 25485 21081 1 17 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.248 0.208 25485 21082 1 17 . 1 1 20 20 LYS H H 20 8.815 8.815 7.665 1.150 25485 21083 1 17 . 1 1 21 21 ARG N N 21 117.535 117.535 118.766 -1.231 25485 21084 1 17 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.116 -0.397 25485 21085 1 17 . 1 1 21 21 ARG C C 21 178.498 178.498 177.513 0.985 25485 21086 1 17 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.668 0.576 25485 21087 1 17 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.303 0.138 25485 21088 1 17 . 1 1 21 21 ARG H H 21 7.810 7.810 7.722 0.088 25485 21089 1 17 . 1 1 22 22 PHE N N 22 112.113 112.113 116.314 -4.201 25485 21090 1 17 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.176 0.735 25485 21091 1 17 . 1 1 22 22 PHE C C 22 174.875 174.875 175.653 -0.778 25485 21092 1 17 . 1 1 22 22 PHE CA C 22 57.475 57.475 60.681 -3.206 25485 21093 1 17 . 1 1 22 22 PHE CB C 22 39.169 39.169 38.578 0.591 25485 21094 1 17 . 1 1 22 22 PHE H H 22 8.010 8.010 7.904 0.106 25485 21095 1 17 . 1 1 23 23 TYR N N 23 116.187 116.187 116.111 0.076 25485 21096 1 17 . 1 1 23 23 TYR C C 23 173.455 173.455 176.065 -2.610 25485 21097 1 17 . 1 1 23 23 TYR CA C 23 58.427 58.427 60.319 -1.893 25485 21098 1 17 . 1 1 23 23 TYR CB C 23 39.529 39.529 40.761 -1.232 25485 21099 1 17 . 1 1 23 23 TYR H H 23 7.680 7.680 7.760 -0.080 25485 21100 1 17 . 1 1 24 24 LEU N N 24 115.570 115.570 114.309 1.261 25485 21101 1 17 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.759 -0.609 25485 21102 1 17 . 1 1 24 24 LEU C C 24 176.661 176.661 175.003 1.658 25485 21103 1 17 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.489 0.663 25485 21104 1 17 . 1 1 24 24 LEU CB C 24 36.863 36.863 45.098 -8.235 25485 21105 1 17 . 1 1 24 24 LEU H H 24 7.238 7.238 8.056 -0.818 25485 21106 1 17 . 1 1 25 25 TYR N N 25 119.901 119.901 119.422 0.479 25485 21107 1 17 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.727 -0.368 25485 21108 1 17 . 1 1 25 25 TYR C C 25 173.784 173.784 173.617 0.167 25485 21109 1 17 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.319 0.928 25485 21110 1 17 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.624 -0.545 25485 21111 1 17 . 1 1 25 25 TYR H H 25 7.845 7.845 8.121 -0.276 25485 21112 1 17 . 1 1 26 26 ASP N N 26 129.338 129.338 126.614 2.724 25485 21113 1 17 . 1 1 26 26 ASP HA H 26 4.451 4.451 4.995 -0.544 25485 21114 1 17 . 1 1 26 26 ASP C C 26 175.282 175.282 176.236 -0.954 25485 21115 1 17 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.738 -1.305 25485 21116 1 17 . 1 1 26 26 ASP CB C 26 41.249 41.249 40.907 0.342 25485 21117 1 17 . 1 1 26 26 ASP H H 26 8.108 8.108 8.563 -0.455 25485 21118 1 17 . 1 1 27 27 SER C C 27 175.204 175.204 176.140 -0.936 25485 21119 1 17 . 1 1 27 27 SER CA C 27 59.424 59.424 60.181 -0.757 25485 21120 1 17 . 1 1 27 27 SER CB C 27 63.535 63.535 63.814 -0.279 25485 21121 1 17 . 1 1 28 28 GLU N N 28 122.058 122.058 121.204 0.854 25485 21122 1 17 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.118 0.207 25485 21123 1 17 . 1 1 28 28 GLU C C 28 177.073 177.073 177.325 -0.252 25485 21124 1 17 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.265 -1.053 25485 21125 1 17 . 1 1 28 28 GLU CB C 28 29.570 29.570 28.853 0.717 25485 21126 1 17 . 1 1 28 28 GLU H H 28 8.255 8.255 8.891 -0.636 25485 21127 1 17 . 1 1 29 29 THR N N 29 114.161 114.161 111.969 2.192 25485 21128 1 17 . 1 1 29 29 THR HA H 29 4.260 4.260 4.212 0.048 25485 21129 1 17 . 1 1 29 29 THR C C 29 174.591 174.591 174.934 -0.343 25485 21130 1 17 . 1 1 29 29 THR CA C 29 61.976 61.976 63.508 -1.532 25485 21131 1 17 . 1 1 29 29 THR CB C 29 69.385 69.385 69.174 0.211 25485 21132 1 17 . 1 1 29 29 THR H H 29 7.498 7.498 7.366 0.132 25485 21133 1 17 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.054 0.164 25485 21134 1 17 . 1 1 30 30 LYS H H 30 8.218 8.218 7.770 0.448 25485 21135 1 17 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.707 -0.283 25485 21136 1 17 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.120 -0.987 25485 21137 1 17 . 1 1 32 32 ALA N N 32 126.484 126.484 123.508 2.976 25485 21138 1 17 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.238 0.058 25485 21139 1 17 . 1 1 32 32 ALA C C 32 178.012 178.012 178.182 -0.170 25485 21140 1 17 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.771 -1.011 25485 21141 1 17 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.023 -0.253 25485 21142 1 17 . 1 1 32 32 ALA H H 32 8.411 8.411 8.707 -0.296 25485 21143 1 17 . 1 1 33 33 ASN N N 33 116.885 116.885 115.204 1.681 25485 21144 1 17 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.583 0.115 25485 21145 1 17 . 1 1 33 33 ASN C C 33 176.240 176.240 177.482 -1.242 25485 21146 1 17 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.070 -0.883 25485 21147 1 17 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.972 -0.387 25485 21148 1 17 . 1 1 33 33 ASN H H 33 8.309 8.309 8.214 0.095 25485 21149 1 17 . 1 1 34 34 SER N N 34 116.836 116.836 116.375 0.461 25485 21150 1 17 . 1 1 34 34 SER HA H 34 4.544 4.544 4.220 0.325 25485 21151 1 17 . 1 1 34 34 SER C C 34 175.253 175.253 176.131 -0.878 25485 21152 1 17 . 1 1 34 34 SER CA C 34 59.583 59.583 60.487 -0.904 25485 21153 1 17 . 1 1 34 34 SER CB C 34 63.919 63.919 63.010 0.909 25485 21154 1 17 . 1 1 34 34 SER H H 34 8.115 8.115 7.968 0.147 25485 21155 1 17 . 1 1 35 35 LEU N N 35 125.355 125.355 123.121 2.234 25485 21156 1 17 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.107 -0.531 25485 21157 1 17 . 1 1 35 35 LEU C C 35 177.973 177.973 177.710 0.263 25485 21158 1 17 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.018 0.479 25485 21159 1 17 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.631 -0.939 25485 21160 1 17 . 1 1 35 35 LEU H H 35 8.312 8.312 7.631 0.681 25485 21161 1 17 . 1 1 36 36 GLU N N 36 119.201 119.201 118.757 0.444 25485 21162 1 17 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.894 0.020 25485 21163 1 17 . 1 1 36 36 GLU C C 36 178.141 178.141 178.841 -0.700 25485 21164 1 17 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.639 0.020 25485 21165 1 17 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.936 0.377 25485 21166 1 17 . 1 1 36 36 GLU H H 36 8.225 8.225 7.886 0.339 25485 21167 1 17 . 1 1 37 37 ALA N N 37 120.746 120.746 121.740 -0.994 25485 21168 1 17 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.104 -0.025 25485 21169 1 17 . 1 1 37 37 ALA C C 37 181.485 181.485 179.664 1.821 25485 21170 1 17 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.747 0.712 25485 21171 1 17 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.355 -0.188 25485 21172 1 17 . 1 1 37 37 ALA H H 37 7.917 7.917 7.780 0.137 25485 21173 1 17 . 1 1 38 38 LYS N N 38 119.326 119.326 119.657 -0.331 25485 21174 1 17 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.043 0.288 25485 21175 1 17 . 1 1 38 38 LYS C C 38 177.946 177.946 179.078 -1.132 25485 21176 1 17 . 1 1 38 38 LYS CA C 38 57.704 57.704 59.017 -1.313 25485 21177 1 17 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.300 -0.500 25485 21178 1 17 . 1 1 38 38 LYS H H 38 8.216 8.216 7.957 0.259 25485 21179 1 17 . 1 1 39 39 LEU N N 39 122.736 122.736 118.858 3.878 25485 21180 1 17 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.929 0.012 25485 21181 1 17 . 1 1 39 39 LEU C C 39 178.819 178.819 178.674 0.145 25485 21182 1 17 . 1 1 39 39 LEU CA C 39 58.081 58.081 57.868 0.213 25485 21183 1 17 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.353 -0.725 25485 21184 1 17 . 1 1 39 39 LEU H H 39 8.666 8.666 8.517 0.149 25485 21185 1 17 . 1 1 40 40 LYS N N 40 118.411 118.411 119.990 -1.579 25485 21186 1 17 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.897 0.741 25485 21187 1 17 . 1 1 40 40 LYS C C 40 179.329 179.329 178.602 0.727 25485 21188 1 17 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.947 0.186 25485 21189 1 17 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.403 -0.618 25485 21190 1 17 . 1 1 40 40 LYS H H 40 8.227 8.227 7.985 0.242 25485 21191 1 17 . 1 1 41 41 GLU N N 41 121.329 121.329 117.820 3.509 25485 21192 1 17 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.093 -0.000 25485 21193 1 17 . 1 1 41 41 GLU C C 41 178.989 178.989 178.991 -0.002 25485 21194 1 17 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.277 0.483 25485 21195 1 17 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.812 1.024 25485 21196 1 17 . 1 1 41 41 GLU H H 41 7.718 7.718 7.814 -0.096 25485 21197 1 17 . 1 1 42 42 MET N N 42 123.817 123.817 117.910 5.907 25485 21198 1 17 . 1 1 42 42 MET HA H 42 4.107 4.107 4.199 -0.092 25485 21199 1 17 . 1 1 42 42 MET C C 42 177.719 177.719 177.273 0.446 25485 21200 1 17 . 1 1 42 42 MET CA C 42 59.912 59.912 58.538 1.374 25485 21201 1 17 . 1 1 42 42 MET CB C 42 30.506 30.506 32.108 -1.602 25485 21202 1 17 . 1 1 42 42 MET H H 42 7.657 7.657 7.326 0.331 25485 21203 1 17 . 1 1 43 43 GLN N N 43 119.998 119.998 118.389 1.609 25485 21204 1 17 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.971 -0.166 25485 21205 1 17 . 1 1 43 43 GLN C C 43 177.604 177.604 178.796 -1.192 25485 21206 1 17 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.726 1.239 25485 21207 1 17 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.766 -1.211 25485 21208 1 17 . 1 1 43 43 GLN H H 43 8.910 8.910 7.656 1.254 25485 21209 1 17 . 1 1 44 44 LYS N N 44 119.165 119.165 119.521 -0.356 25485 21210 1 17 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.243 -0.188 25485 21211 1 17 . 1 1 44 44 LYS C C 44 179.991 179.991 179.230 0.761 25485 21212 1 17 . 1 1 44 44 LYS CA C 44 59.561 59.561 57.979 1.582 25485 21213 1 17 . 1 1 44 44 LYS CB C 44 32.298 32.298 31.832 0.466 25485 21214 1 17 . 1 1 44 44 LYS H H 44 8.507 8.507 7.561 0.946 25485 21215 1 17 . 1 1 45 45 PHE N N 45 123.602 123.602 120.347 3.255 25485 21216 1 17 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.345 -0.444 25485 21217 1 17 . 1 1 45 45 PHE C C 45 177.606 177.606 176.659 0.947 25485 21218 1 17 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.529 2.505 25485 21219 1 17 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.445 0.421 25485 21220 1 17 . 1 1 45 45 PHE H H 45 8.445 8.445 7.741 0.704 25485 21221 1 17 . 1 1 46 46 PHE N N 46 112.715 112.715 115.803 -3.088 25485 21222 1 17 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.465 0.132 25485 21223 1 17 . 1 1 46 46 PHE C C 46 175.285 175.285 176.704 -1.419 25485 21224 1 17 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.339 1.336 25485 21225 1 17 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.076 -0.617 25485 21226 1 17 . 1 1 46 46 PHE H H 46 8.272 8.272 8.523 -0.251 25485 21227 1 17 . 1 1 47 47 GLY N N 47 110.438 110.438 106.871 3.567 25485 21228 1 17 . 1 1 47 47 GLY C C 47 174.935 174.935 174.566 0.369 25485 21229 1 17 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.161 1.850 25485 21230 1 17 . 1 1 47 47 GLY H H 47 7.926 7.926 8.392 -0.466 25485 21231 1 17 . 1 1 48 48 LEU N N 48 121.830 121.830 119.356 2.474 25485 21232 1 17 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.718 0.206 25485 21233 1 17 . 1 1 48 48 LEU C C 48 174.009 174.009 176.189 -2.180 25485 21234 1 17 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.588 -1.753 25485 21235 1 17 . 1 1 48 48 LEU CB C 48 41.463 41.463 41.092 0.371 25485 21236 1 17 . 1 1 48 48 LEU H H 48 8.762 8.762 7.581 1.181 25485 21237 1 17 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.415 -0.177 25485 21238 1 17 . 1 1 49 49 PRO C C 49 176.874 176.874 176.750 0.124 25485 21239 1 17 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.686 -0.168 25485 21240 1 17 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.843 -0.764 25485 21241 1 17 . 1 1 50 50 ILE N N 50 126.859 126.859 117.825 9.034 25485 21242 1 17 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.054 0.047 25485 21243 1 17 . 1 1 50 50 ILE C C 50 176.540 176.540 175.920 0.620 25485 21244 1 17 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.898 -0.942 25485 21245 1 17 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.202 -0.809 25485 21246 1 17 . 1 1 50 50 ILE H H 50 8.548 8.548 7.828 0.720 25485 21247 1 17 . 1 1 51 51 THR N N 51 116.443 116.443 116.472 -0.029 25485 21248 1 17 . 1 1 51 51 THR HA H 51 4.584 4.584 4.472 0.112 25485 21249 1 17 . 1 1 51 51 THR C C 51 176.672 176.672 175.374 1.298 25485 21250 1 17 . 1 1 51 51 THR CA C 51 60.979 60.979 60.715 0.264 25485 21251 1 17 . 1 1 51 51 THR CB C 51 71.505 71.505 70.583 0.922 25485 21252 1 17 . 1 1 51 51 THR H H 51 8.001 8.001 7.744 0.257 25485 21253 1 17 . 1 1 52 52 GLY N N 52 112.719 112.719 110.026 2.693 25485 21254 1 17 . 1 1 52 52 GLY C C 52 170.609 170.609 174.433 -3.824 25485 21255 1 17 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.757 0.989 25485 21256 1 17 . 1 1 52 52 GLY H H 52 9.499 9.499 8.529 0.970 25485 21257 1 17 . 1 1 53 53 MET N N 53 116.621 116.621 118.993 -2.372 25485 21258 1 17 . 1 1 53 53 MET HA H 53 4.023 4.023 4.581 -0.558 25485 21259 1 17 . 1 1 53 53 MET C C 53 174.695 174.695 174.700 -0.005 25485 21260 1 17 . 1 1 53 53 MET CA C 53 53.460 53.460 54.988 -1.528 25485 21261 1 17 . 1 1 53 53 MET CB C 53 35.408 35.408 34.456 0.952 25485 21262 1 17 . 1 1 53 53 MET H H 53 7.993 7.993 7.533 0.460 25485 21263 1 17 . 1 1 54 54 LEU N N 54 122.679 122.679 122.279 0.400 25485 21264 1 17 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.388 -0.637 25485 21265 1 17 . 1 1 54 54 LEU C C 54 174.784 174.784 174.365 0.419 25485 21266 1 17 . 1 1 54 54 LEU CA C 54 55.301 55.301 56.153 -0.852 25485 21267 1 17 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.861 -0.851 25485 21268 1 17 . 1 1 54 54 LEU H H 54 7.940 7.940 8.334 -0.394 25485 21269 1 17 . 1 1 55 55 ASN N N 55 115.797 115.797 119.909 -4.112 25485 21270 1 17 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.746 0.003 25485 21271 1 17 . 1 1 55 55 ASN C C 55 175.459 175.459 174.738 0.721 25485 21272 1 17 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.684 -1.841 25485 21273 1 17 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.899 1.458 25485 21274 1 17 . 1 1 55 55 ASN H H 55 6.543 6.543 8.482 -1.939 25485 21275 1 17 . 1 1 56 56 SER N N 56 121.507 121.507 114.725 6.782 25485 21276 1 17 . 1 1 56 56 SER HA H 56 4.638 4.638 4.422 0.216 25485 21277 1 17 . 1 1 56 56 SER C C 56 175.727 175.727 176.021 -0.294 25485 21278 1 17 . 1 1 56 56 SER CA C 56 57.932 57.932 59.942 -2.010 25485 21279 1 17 . 1 1 56 56 SER CB C 56 63.786 63.786 63.700 0.086 25485 21280 1 17 . 1 1 56 56 SER H H 56 8.213 8.213 8.162 0.051 25485 21281 1 17 . 1 1 57 57 ARG N N 57 122.951 122.951 121.481 1.470 25485 21282 1 17 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.556 -0.355 25485 21283 1 17 . 1 1 57 57 ARG C C 57 178.560 178.560 178.651 -0.091 25485 21284 1 17 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.607 -0.175 25485 21285 1 17 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.622 -0.517 25485 21286 1 17 . 1 1 57 57 ARG H H 57 7.895 7.895 8.494 -0.599 25485 21287 1 17 . 1 1 58 58 VAL N N 58 118.778 118.778 120.341 -1.563 25485 21288 1 17 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.541 -0.210 25485 21289 1 17 . 1 1 58 58 VAL C C 58 177.370 177.370 177.693 -0.323 25485 21290 1 17 . 1 1 58 58 VAL CA C 58 66.382 66.382 67.142 -0.760 25485 21291 1 17 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.523 0.686 25485 21292 1 17 . 1 1 58 58 VAL H H 58 7.583 7.583 7.902 -0.319 25485 21293 1 17 . 1 1 59 59 ILE N N 59 119.159 119.159 118.350 0.809 25485 21294 1 17 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.641 -0.228 25485 21295 1 17 . 1 1 59 59 ILE C C 59 177.067 177.067 177.480 -0.413 25485 21296 1 17 . 1 1 59 59 ILE CA C 59 63.633 63.633 62.723 0.910 25485 21297 1 17 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.752 -0.056 25485 21298 1 17 . 1 1 59 59 ILE H H 59 7.323 7.323 8.035 -0.712 25485 21299 1 17 . 1 1 60 60 GLU N N 60 119.367 119.367 120.524 -1.157 25485 21300 1 17 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.943 -0.205 25485 21301 1 17 . 1 1 60 60 GLU C C 60 179.978 179.978 179.282 0.696 25485 21302 1 17 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.989 -0.731 25485 21303 1 17 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.622 -0.234 25485 21304 1 17 . 1 1 60 60 GLU H H 60 7.879 7.879 7.470 0.409 25485 21305 1 17 . 1 1 61 61 ILE N N 61 118.816 118.816 118.540 0.276 25485 21306 1 17 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.764 -0.325 25485 21307 1 17 . 1 1 61 61 ILE C C 61 179.033 179.033 177.241 1.792 25485 21308 1 17 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.647 0.190 25485 21309 1 17 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.076 -1.177 25485 21310 1 17 . 1 1 61 61 ILE H H 61 7.246 7.246 7.929 -0.683 25485 21311 1 17 . 1 1 62 62 MET N N 62 119.986 119.986 115.536 4.450 25485 21312 1 17 . 1 1 62 62 MET HA H 62 3.444 3.444 4.015 -0.571 25485 21313 1 17 . 1 1 62 62 MET C C 62 176.185 176.185 177.900 -1.715 25485 21314 1 17 . 1 1 62 62 MET CA C 62 59.014 59.014 57.947 1.067 25485 21315 1 17 . 1 1 62 62 MET CB C 62 31.250 31.250 32.470 -1.220 25485 21316 1 17 . 1 1 62 62 MET H H 62 7.835 7.835 7.264 0.571 25485 21317 1 17 . 1 1 63 63 GLN N N 63 116.163 116.163 115.922 0.241 25485 21318 1 17 . 1 1 63 63 GLN HA H 63 4.278 4.278 3.749 0.529 25485 21319 1 17 . 1 1 63 63 GLN C C 63 176.727 176.727 176.241 0.486 25485 21320 1 17 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.361 -0.223 25485 21321 1 17 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.292 -0.226 25485 21322 1 17 . 1 1 63 63 GLN H H 63 7.454 7.454 7.563 -0.109 25485 21323 1 17 . 1 1 64 64 LYS N N 64 121.430 121.430 121.718 -0.288 25485 21324 1 17 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.446 0.097 25485 21325 1 17 . 1 1 64 64 LYS C C 64 174.724 174.724 174.784 -0.060 25485 21326 1 17 . 1 1 64 64 LYS CA C 64 55.517 55.517 53.791 1.726 25485 21327 1 17 . 1 1 64 64 LYS CB C 64 31.597 31.597 33.040 -1.443 25485 21328 1 17 . 1 1 64 64 LYS H H 64 7.483 7.483 7.615 -0.132 25485 21329 1 17 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.343 -1.907 25485 21330 1 17 . 1 1 65 65 PRO C C 65 176.158 176.158 175.626 0.532 25485 21331 1 17 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.344 -0.456 25485 21332 1 17 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.484 -0.651 25485 21333 1 17 . 1 1 66 66 ARG N N 66 112.697 112.697 119.177 -6.480 25485 21334 1 17 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.669 -0.261 25485 21335 1 17 . 1 1 66 66 ARG C C 66 174.478 174.478 174.882 -0.404 25485 21336 1 17 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.055 -1.419 25485 21337 1 17 . 1 1 66 66 ARG CB C 66 34.673 34.673 30.823 3.850 25485 21338 1 17 . 1 1 66 66 ARG H H 66 8.146 8.146 8.602 -0.456 25485 21339 1 17 . 1 1 67 67 CYS N N 67 121.740 121.740 116.645 5.095 25485 21340 1 17 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.747 -0.307 25485 21341 1 17 . 1 1 67 67 CYS C C 67 175.659 175.659 174.267 1.392 25485 21342 1 17 . 1 1 67 67 CYS CA C 67 59.195 59.195 56.680 2.515 25485 21343 1 17 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.317 -1.111 25485 21344 1 17 . 1 1 67 67 CYS H H 67 7.757 7.757 7.484 0.273 25485 21345 1 17 . 1 1 68 68 GLY N N 68 116.217 116.217 110.228 5.989 25485 21346 1 17 . 1 1 68 68 GLY C C 68 172.210 172.210 173.768 -1.558 25485 21347 1 17 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.764 1.795 25485 21348 1 17 . 1 1 68 68 GLY H H 68 9.704 9.704 9.057 0.647 25485 21349 1 17 . 1 1 69 69 VAL N N 69 126.372 126.372 119.450 6.922 25485 21350 1 17 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.398 -0.567 25485 21351 1 17 . 1 1 69 69 VAL C C 69 173.538 173.538 174.262 -0.724 25485 21352 1 17 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.386 2.982 25485 21353 1 17 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.413 0.110 25485 21354 1 17 . 1 1 69 69 VAL H H 69 9.113 9.113 7.343 1.770 25485 21355 1 17 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.370 0.580 25485 21356 1 17 . 1 1 70 70 PRO C C 70 175.019 175.019 176.319 -1.300 25485 21357 1 17 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.629 0.719 25485 21358 1 17 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.643 -0.285 25485 21359 1 17 . 1 1 71 71 ASP N N 71 118.986 118.986 119.491 -0.505 25485 21360 1 17 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.826 -0.393 25485 21361 1 17 . 1 1 71 71 ASP C C 71 175.166 175.166 175.515 -0.349 25485 21362 1 17 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.270 2.098 25485 21363 1 17 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.699 -1.835 25485 21364 1 17 . 1 1 71 71 ASP H H 71 8.054 8.054 8.070 -0.016 25485 21365 1 17 . 1 1 72 72 VAL N N 72 112.953 112.953 117.236 -4.283 25485 21366 1 17 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.475 -0.179 25485 21367 1 17 . 1 1 72 72 VAL C C 72 174.330 174.330 174.364 -0.034 25485 21368 1 17 . 1 1 72 72 VAL CA C 72 59.645 59.645 59.967 -0.322 25485 21369 1 17 . 1 1 72 72 VAL CB C 72 33.872 33.872 34.354 -0.482 25485 21370 1 17 . 1 1 72 72 VAL H H 72 6.430 6.430 7.472 -1.042 25485 21371 1 17 . 1 1 73 73 ALA N N 73 125.869 125.869 128.725 -2.856 25485 21372 1 17 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.631 -0.326 25485 21373 1 17 . 1 1 73 73 ALA C C 73 177.382 177.382 176.289 1.093 25485 21374 1 17 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.393 0.656 25485 21375 1 17 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.954 -1.003 25485 21376 1 17 . 1 1 73 73 ALA H H 73 8.177 8.177 7.897 0.280 25485 21377 1 17 . 1 1 74 74 GLU N N 74 120.724 120.724 119.891 0.833 25485 21378 1 17 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.656 -0.553 25485 21379 1 17 . 1 1 74 74 GLU C C 74 176.246 176.246 174.378 1.868 25485 21380 1 17 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.643 0.149 25485 21381 1 17 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.386 -1.601 25485 21382 1 17 . 1 1 74 74 GLU H H 74 8.381 8.381 8.816 -0.435 25485 21383 1 17 . 1 1 75 75 TYR N N 75 121.473 121.473 121.223 0.250 25485 21384 1 17 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.513 -0.068 25485 21385 1 17 . 1 1 75 75 TYR C C 75 175.633 175.633 174.246 1.387 25485 21386 1 17 . 1 1 75 75 TYR CA C 75 58.327 58.327 57.500 0.827 25485 21387 1 17 . 1 1 75 75 TYR CB C 75 38.413 38.413 39.916 -1.503 25485 21388 1 17 . 1 1 75 75 TYR H H 75 8.065 8.065 8.236 -0.171 25485 21389 1 17 . 1 1 76 76 SER N N 76 117.860 117.860 121.612 -3.752 25485 21390 1 17 . 1 1 76 76 SER HA H 76 3.886 3.886 4.419 -0.533 25485 21391 1 17 . 1 1 76 76 SER C C 76 173.859 173.859 174.821 -0.962 25485 21392 1 17 . 1 1 76 76 SER CA C 76 58.250 58.250 59.235 -0.985 25485 21393 1 17 . 1 1 76 76 SER CB C 76 64.117 64.117 63.548 0.569 25485 21394 1 17 . 1 1 76 76 SER H H 76 7.748 7.748 8.466 -0.718 25485 21395 1 17 . 1 1 77 77 LEU N N 77 123.789 123.789 127.172 -3.383 25485 21396 1 17 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.888 0.258 25485 21397 1 17 . 1 1 77 77 LEU C C 77 176.451 176.451 176.693 -0.242 25485 21398 1 17 . 1 1 77 77 LEU CA C 77 55.464 55.464 57.620 -2.156 25485 21399 1 17 . 1 1 77 77 LEU CB C 77 41.957 41.957 42.334 -0.377 25485 21400 1 17 . 1 1 77 77 LEU H H 77 7.979 7.979 8.633 -0.654 25485 21401 1 17 . 1 1 78 78 PHE N N 78 119.275 119.275 112.059 7.216 25485 21402 1 17 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.459 0.417 25485 21403 1 17 . 1 1 78 78 PHE C C 78 173.844 173.844 174.150 -0.306 25485 21404 1 17 . 1 1 78 78 PHE CA C 78 55.372 55.372 57.021 -1.649 25485 21405 1 17 . 1 1 78 78 PHE CB C 78 39.164 39.164 37.215 1.948 25485 21406 1 17 . 1 1 78 78 PHE H H 78 7.827 7.827 7.793 0.034 25485 21407 1 17 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.621 -0.265 25485 21408 1 17 . 1 1 79 79 PRO C C 79 176.433 176.433 175.401 1.032 25485 21409 1 17 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.895 0.954 25485 21410 1 17 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.208 -0.516 25485 21411 1 17 . 1 1 80 80 ASN N N 80 118.057 118.057 118.521 -0.464 25485 21412 1 17 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.832 -0.185 25485 21413 1 17 . 1 1 80 80 ASN C C 80 174.305 174.305 174.728 -0.423 25485 21414 1 17 . 1 1 80 80 ASN CA C 80 52.860 52.860 52.621 0.239 25485 21415 1 17 . 1 1 80 80 ASN CB C 80 39.583 39.583 39.534 0.049 25485 21416 1 17 . 1 1 80 80 ASN H H 80 8.068 8.068 8.418 -0.350 25485 21417 1 17 . 1 1 81 81 SER HA H 81 4.565 4.565 4.247 0.318 25485 21418 1 17 . 1 1 81 81 SER CA C 81 56.800 56.800 58.467 -1.667 25485 21419 1 17 . 1 1 81 81 SER CB C 81 63.128 63.128 62.320 0.808 25485 21420 1 17 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.340 0.121 25485 21421 1 17 . 1 1 82 82 PRO C C 82 174.589 174.589 176.375 -1.786 25485 21422 1 17 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.354 -0.708 25485 21423 1 17 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.111 -0.857 25485 21424 1 17 . 1 1 83 83 LYS N N 83 114.578 114.578 117.027 -2.449 25485 21425 1 17 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.664 -0.511 25485 21426 1 17 . 1 1 83 83 LYS C C 83 175.308 175.308 175.853 -0.545 25485 21427 1 17 . 1 1 83 83 LYS CA C 83 54.407 54.407 53.843 0.564 25485 21428 1 17 . 1 1 83 83 LYS CB C 83 34.418 34.418 34.268 0.150 25485 21429 1 17 . 1 1 83 83 LYS H H 83 7.356 7.356 7.363 -0.007 25485 21430 1 17 . 1 1 84 84 TRP N N 84 122.455 122.455 119.541 2.914 25485 21431 1 17 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.686 -0.666 25485 21432 1 17 . 1 1 84 84 TRP C C 84 177.636 177.636 178.468 -0.832 25485 21433 1 17 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.290 -0.819 25485 21434 1 17 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.939 0.379 25485 21435 1 17 . 1 1 84 84 TRP H H 84 8.050 8.050 8.384 -0.334 25485 21436 1 17 . 1 1 85 85 THR N N 85 113.501 113.501 117.267 -3.766 25485 21437 1 17 . 1 1 85 85 THR HA H 85 4.573 4.573 4.505 0.068 25485 21438 1 17 . 1 1 85 85 THR C C 85 174.757 174.757 174.975 -0.218 25485 21439 1 17 . 1 1 85 85 THR CA C 85 62.130 62.130 61.612 0.518 25485 21440 1 17 . 1 1 85 85 THR CB C 85 69.107 69.107 68.998 0.109 25485 21441 1 17 . 1 1 85 85 THR H H 85 8.861 8.861 8.753 0.108 25485 21442 1 17 . 1 1 86 86 SER N N 86 117.270 117.270 118.276 -1.006 25485 21443 1 17 . 1 1 86 86 SER HA H 86 4.741 4.741 4.690 0.051 25485 21444 1 17 . 1 1 86 86 SER C C 86 173.457 173.457 174.205 -0.748 25485 21445 1 17 . 1 1 86 86 SER CA C 86 56.739 56.739 59.110 -2.371 25485 21446 1 17 . 1 1 86 86 SER CB C 86 64.717 64.717 64.459 0.258 25485 21447 1 17 . 1 1 86 86 SER H H 86 7.743 7.743 8.308 -0.565 25485 21448 1 17 . 1 1 87 87 LYS N N 87 120.329 120.329 120.220 0.109 25485 21449 1 17 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.392 -0.163 25485 21450 1 17 . 1 1 87 87 LYS CA C 87 57.592 57.592 56.935 0.657 25485 21451 1 17 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.855 -0.732 25485 21452 1 17 . 1 1 87 87 LYS H H 87 8.285 8.285 8.419 -0.134 25485 21453 1 17 . 1 1 88 88 VAL N N 88 117.531 117.531 117.735 -0.204 25485 21454 1 17 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.656 -0.001 25485 21455 1 17 . 1 1 88 88 VAL C C 88 174.868 174.868 173.959 0.909 25485 21456 1 17 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.675 -0.580 25485 21457 1 17 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.635 -1.940 25485 21458 1 17 . 1 1 88 88 VAL H H 88 7.428 7.428 7.337 0.091 25485 21459 1 17 . 1 1 89 89 VAL N N 89 131.452 131.452 128.512 2.940 25485 21460 1 17 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.134 0.025 25485 21461 1 17 . 1 1 89 89 VAL C C 89 175.758 175.758 174.410 1.348 25485 21462 1 17 . 1 1 89 89 VAL CA C 89 60.721 60.721 59.752 0.970 25485 21463 1 17 . 1 1 89 89 VAL CB C 89 34.173 34.173 33.141 1.032 25485 21464 1 17 . 1 1 89 89 VAL H H 89 8.603 8.603 9.312 -0.709 25485 21465 1 17 . 1 1 90 90 THR N N 90 118.206 118.206 117.525 0.681 25485 21466 1 17 . 1 1 90 90 THR HA H 90 5.649 5.649 5.094 0.555 25485 21467 1 17 . 1 1 90 90 THR C C 90 174.579 174.579 173.367 1.212 25485 21468 1 17 . 1 1 90 90 THR CA C 90 58.959 58.959 59.427 -0.468 25485 21469 1 17 . 1 1 90 90 THR CB C 90 72.288 72.288 71.894 0.394 25485 21470 1 17 . 1 1 90 90 THR H H 90 9.021 9.021 8.222 0.799 25485 21471 1 17 . 1 1 91 91 TYR N N 91 118.117 118.117 116.488 1.629 25485 21472 1 17 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.570 0.128 25485 21473 1 17 . 1 1 91 91 TYR C C 91 171.233 171.233 172.820 -1.587 25485 21474 1 17 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.721 -0.289 25485 21475 1 17 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.340 0.920 25485 21476 1 17 . 1 1 91 91 TYR H H 91 8.555 8.555 8.171 0.384 25485 21477 1 17 . 1 1 92 92 ARG N N 92 120.252 120.252 119.666 0.586 25485 21478 1 17 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.629 0.068 25485 21479 1 17 . 1 1 92 92 ARG C C 92 173.932 173.932 174.647 -0.715 25485 21480 1 17 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.763 0.078 25485 21481 1 17 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.734 -0.048 25485 21482 1 17 . 1 1 92 92 ARG H H 92 8.520 8.520 8.909 -0.389 25485 21483 1 17 . 1 1 93 93 ILE N N 93 128.305 128.305 126.549 1.756 25485 21484 1 17 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.366 0.266 25485 21485 1 17 . 1 1 93 93 ILE C C 93 175.468 175.468 176.486 -1.018 25485 21486 1 17 . 1 1 93 93 ILE CA C 93 61.228 61.228 62.277 -1.049 25485 21487 1 17 . 1 1 93 93 ILE CB C 93 37.225 37.225 38.053 -0.828 25485 21488 1 17 . 1 1 93 93 ILE H H 93 8.886 8.886 8.890 -0.004 25485 21489 1 17 . 1 1 94 94 VAL N N 94 126.647 126.647 128.205 -1.558 25485 21490 1 17 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.045 -0.049 25485 21491 1 17 . 1 1 94 94 VAL C C 94 175.670 175.670 176.324 -0.654 25485 21492 1 17 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.956 -0.542 25485 21493 1 17 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.467 0.553 25485 21494 1 17 . 1 1 94 94 VAL H H 94 9.517 9.517 8.247 1.270 25485 21495 1 17 . 1 1 95 95 SER N N 95 113.398 113.398 112.307 1.091 25485 21496 1 17 . 1 1 95 95 SER HA H 95 4.701 4.701 4.653 0.048 25485 21497 1 17 . 1 1 95 95 SER C C 95 170.684 170.684 172.664 -1.980 25485 21498 1 17 . 1 1 95 95 SER CA C 95 56.945 56.945 57.373 -0.428 25485 21499 1 17 . 1 1 95 95 SER CB C 95 65.276 65.276 64.280 0.996 25485 21500 1 17 . 1 1 95 95 SER H H 95 7.463 7.463 7.665 -0.202 25485 21501 1 17 . 1 1 96 96 TYR N N 96 116.512 116.512 119.795 -3.283 25485 21502 1 17 . 1 1 96 96 TYR HA H 96 4.264 4.264 5.010 -0.746 25485 21503 1 17 . 1 1 96 96 TYR C C 96 174.856 174.856 174.607 0.249 25485 21504 1 17 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.371 2.266 25485 21505 1 17 . 1 1 96 96 TYR CB C 96 41.163 41.163 40.138 1.025 25485 21506 1 17 . 1 1 96 96 TYR H H 96 8.240 8.240 8.230 0.010 25485 21507 1 17 . 1 1 97 97 THR CA C 97 57.798 57.798 61.182 -3.384 25485 21508 1 17 . 1 1 97 97 THR CB C 97 67.420 67.420 69.590 -2.170 25485 21509 1 17 . 1 1 98 98 ARG N N 98 128.156 128.156 124.764 3.392 25485 21510 1 17 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.194 0.131 25485 21511 1 17 . 1 1 98 98 ARG C C 98 177.625 177.625 176.500 1.125 25485 21512 1 17 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.441 -1.227 25485 21513 1 17 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.989 -0.509 25485 21514 1 17 . 1 1 98 98 ARG H H 98 8.914 8.914 8.694 0.220 25485 21515 1 17 . 1 1 99 99 ASP N N 99 120.592 120.592 117.247 3.345 25485 21516 1 17 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.646 -0.265 25485 21517 1 17 . 1 1 99 99 ASP C C 99 175.679 175.679 175.174 0.505 25485 21518 1 17 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.704 1.732 25485 21519 1 17 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.387 0.983 25485 21520 1 17 . 1 1 99 99 ASP H H 99 8.708 8.708 8.060 0.648 25485 21521 1 17 . 1 1 100 100 LEU N N 100 116.829 116.829 118.762 -1.933 25485 21522 1 17 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.679 0.277 25485 21523 1 17 . 1 1 100 100 LEU C C 100 173.335 173.335 174.165 -0.830 25485 21524 1 17 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.958 -0.921 25485 21525 1 17 . 1 1 100 100 LEU CB C 100 46.267 46.267 45.109 1.158 25485 21526 1 17 . 1 1 100 100 LEU H H 100 6.916 6.916 7.509 -0.593 25485 21527 1 17 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.102 0.073 25485 21528 1 17 . 1 1 102 102 HIS C C 102 177.649 177.649 177.462 0.187 25485 21529 1 17 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.121 -0.448 25485 21530 1 17 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.017 -1.583 25485 21531 1 17 . 1 1 103 103 ILE N N 103 115.170 115.170 118.133 -2.963 25485 21532 1 17 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.796 0.377 25485 21533 1 17 . 1 1 103 103 ILE C C 103 177.214 177.214 177.044 0.170 25485 21534 1 17 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.256 -1.091 25485 21535 1 17 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.944 -0.179 25485 21536 1 17 . 1 1 103 103 ILE H H 103 8.234 8.234 8.141 0.093 25485 21537 1 17 . 1 1 104 104 THR N N 104 119.374 119.374 117.436 1.938 25485 21538 1 17 . 1 1 104 104 THR HA H 104 4.045 4.045 3.967 0.078 25485 21539 1 17 . 1 1 104 104 THR C C 104 175.612 175.612 176.179 -0.567 25485 21540 1 17 . 1 1 104 104 THR CA C 104 66.568 66.568 66.860 -0.292 25485 21541 1 17 . 1 1 104 104 THR CB C 104 68.077 68.077 68.783 -0.706 25485 21542 1 17 . 1 1 104 104 THR H H 104 6.947 6.947 7.506 -0.559 25485 21543 1 17 . 1 1 105 105 VAL N N 105 123.263 123.263 120.578 2.685 25485 21544 1 17 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.119 0.319 25485 21545 1 17 . 1 1 105 105 VAL C C 105 177.322 177.322 177.078 0.244 25485 21546 1 17 . 1 1 105 105 VAL CA C 105 67.947 67.947 65.510 2.437 25485 21547 1 17 . 1 1 105 105 VAL CB C 105 31.269 31.269 30.730 0.539 25485 21548 1 17 . 1 1 105 105 VAL H H 105 7.407 7.407 8.121 -0.714 25485 21549 1 17 . 1 1 106 106 ASP N N 106 119.972 119.972 119.973 -0.001 25485 21550 1 17 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.382 -0.060 25485 21551 1 17 . 1 1 106 106 ASP C C 106 179.747 179.747 178.190 1.557 25485 21552 1 17 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.638 0.597 25485 21553 1 17 . 1 1 106 106 ASP CB C 106 40.362 40.362 41.054 -0.692 25485 21554 1 17 . 1 1 106 106 ASP H H 106 8.627 8.627 8.016 0.611 25485 21555 1 17 . 1 1 107 107 ARG N N 107 121.033 121.033 118.576 2.457 25485 21556 1 17 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.105 0.073 25485 21557 1 17 . 1 1 107 107 ARG C C 107 179.485 179.485 178.616 0.869 25485 21558 1 17 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.949 0.631 25485 21559 1 17 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.727 0.481 25485 21560 1 17 . 1 1 107 107 ARG H H 107 8.356 8.356 7.946 0.410 25485 21561 1 17 . 1 1 108 108 LEU N N 108 121.463 121.463 120.977 0.486 25485 21562 1 17 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.175 0.130 25485 21563 1 17 . 1 1 108 108 LEU C C 108 178.852 178.852 178.809 0.043 25485 21564 1 17 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.658 0.224 25485 21565 1 17 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.319 -0.004 25485 21566 1 17 . 1 1 108 108 LEU H H 108 8.790 8.790 7.861 0.929 25485 21567 1 17 . 1 1 109 109 VAL N N 109 120.233 120.233 117.344 2.889 25485 21568 1 17 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.696 -0.296 25485 21569 1 17 . 1 1 109 109 VAL C C 109 177.019 177.019 177.741 -0.722 25485 21570 1 17 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.390 1.656 25485 21571 1 17 . 1 1 109 109 VAL CB C 109 31.189 31.189 30.555 0.634 25485 21572 1 17 . 1 1 109 109 VAL H H 109 8.787 8.787 7.732 1.055 25485 21573 1 17 . 1 1 110 110 SER N N 110 112.862 112.862 116.040 -3.178 25485 21574 1 17 . 1 1 110 110 SER HA H 110 4.300 4.300 3.980 0.320 25485 21575 1 17 . 1 1 110 110 SER C C 110 176.770 176.770 176.696 0.074 25485 21576 1 17 . 1 1 110 110 SER CA C 110 61.744 61.744 61.453 0.291 25485 21577 1 17 . 1 1 110 110 SER CB C 110 62.742 62.742 62.621 0.121 25485 21578 1 17 . 1 1 110 110 SER H H 110 7.605 7.605 7.757 -0.152 25485 21579 1 17 . 1 1 111 111 LYS N N 111 122.319 122.319 121.957 0.362 25485 21580 1 17 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.012 0.049 25485 21581 1 17 . 1 1 111 111 LYS C C 111 178.309 178.309 178.330 -0.021 25485 21582 1 17 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.215 0.599 25485 21583 1 17 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.516 -0.007 25485 21584 1 17 . 1 1 111 111 LYS H H 111 8.156 8.156 7.864 0.292 25485 21585 1 17 . 1 1 112 112 ALA N N 112 124.147 124.147 120.992 3.155 25485 21586 1 17 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.259 -0.160 25485 21587 1 17 . 1 1 112 112 ALA C C 112 179.445 179.445 178.890 0.555 25485 21588 1 17 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.060 1.166 25485 21589 1 17 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.265 0.709 25485 21590 1 17 . 1 1 112 112 ALA H H 112 8.278 8.278 7.466 0.812 25485 21591 1 17 . 1 1 113 113 LEU N N 113 116.195 116.195 120.408 -4.213 25485 21592 1 17 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.124 -0.373 25485 21593 1 17 . 1 1 113 113 LEU C C 113 179.537 179.537 178.131 1.406 25485 21594 1 17 . 1 1 113 113 LEU CA C 113 57.744 57.744 58.142 -0.398 25485 21595 1 17 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.961 -1.406 25485 21596 1 17 . 1 1 113 113 LEU H H 113 8.021 8.021 8.543 -0.522 25485 21597 1 17 . 1 1 114 114 ASN N N 114 116.570 116.570 117.265 -0.695 25485 21598 1 17 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.470 0.076 25485 21599 1 17 . 1 1 114 114 ASN C C 114 177.136 177.136 177.026 0.110 25485 21600 1 17 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.351 -0.587 25485 21601 1 17 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.514 0.109 25485 21602 1 17 . 1 1 114 114 ASN H H 114 8.212 8.212 8.410 -0.198 25485 21603 1 17 . 1 1 115 115 MET N N 115 122.055 122.055 119.104 2.951 25485 21604 1 17 . 1 1 115 115 MET HA H 115 4.010 4.010 3.928 0.083 25485 21605 1 17 . 1 1 115 115 MET C C 115 177.681 177.681 177.553 0.128 25485 21606 1 17 . 1 1 115 115 MET CA C 115 59.445 59.445 59.023 0.422 25485 21607 1 17 . 1 1 115 115 MET CB C 115 31.616 31.616 32.233 -0.616 25485 21608 1 17 . 1 1 115 115 MET H H 115 7.937 7.937 7.720 0.217 25485 21609 1 17 . 1 1 116 116 TRP N N 116 117.115 117.115 117.735 -0.620 25485 21610 1 17 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.384 0.134 25485 21611 1 17 . 1 1 116 116 TRP C C 116 179.054 179.054 179.259 -0.205 25485 21612 1 17 . 1 1 116 116 TRP CA C 116 59.511 59.511 58.865 0.646 25485 21613 1 17 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.808 1.065 25485 21614 1 17 . 1 1 116 116 TRP H H 116 6.783 6.783 7.363 -0.580 25485 21615 1 17 . 1 1 117 117 GLY N N 117 104.511 104.511 107.483 -2.972 25485 21616 1 17 . 1 1 117 117 GLY C C 117 175.035 175.035 175.995 -0.960 25485 21617 1 17 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.603 0.394 25485 21618 1 17 . 1 1 117 117 GLY H H 117 9.302 9.302 8.136 1.166 25485 21619 1 17 . 1 1 118 118 LYS N N 118 118.580 118.580 119.731 -1.151 25485 21620 1 17 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.052 0.155 25485 21621 1 17 . 1 1 118 118 LYS C C 118 177.235 177.235 177.468 -0.233 25485 21622 1 17 . 1 1 118 118 LYS CA C 118 57.891 57.891 56.853 1.038 25485 21623 1 17 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.591 0.314 25485 21624 1 17 . 1 1 118 118 LYS H H 118 7.940 7.940 8.076 -0.136 25485 21625 1 17 . 1 1 119 119 GLU N N 119 113.749 113.749 116.884 -3.135 25485 21626 1 17 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.405 0.433 25485 21627 1 17 . 1 1 119 119 GLU C C 119 178.024 178.024 175.754 2.270 25485 21628 1 17 . 1 1 119 119 GLU CA C 119 55.275 55.275 56.099 -0.824 25485 21629 1 17 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.986 0.700 25485 21630 1 17 . 1 1 119 119 GLU H H 119 7.763 7.763 7.528 0.235 25485 21631 1 17 . 1 1 120 120 ILE N N 120 111.144 111.144 113.456 -2.312 25485 21632 1 17 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.637 0.734 25485 21633 1 17 . 1 1 120 120 ILE C C 120 174.033 174.033 173.360 0.673 25485 21634 1 17 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.507 0.947 25485 21635 1 17 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.510 2.419 25485 21636 1 17 . 1 1 120 120 ILE H H 120 7.518 7.518 7.548 -0.030 25485 21637 1 17 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.327 0.335 25485 21638 1 17 . 1 1 121 121 PRO C C 121 174.784 174.784 176.848 -2.064 25485 21639 1 17 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.424 -1.409 25485 21640 1 17 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.581 -2.196 25485 21641 1 17 . 1 1 122 122 LEU N N 122 121.531 121.531 118.481 3.050 25485 21642 1 17 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.314 0.025 25485 21643 1 17 . 1 1 122 122 LEU C C 122 173.977 173.977 176.425 -2.448 25485 21644 1 17 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.321 -0.763 25485 21645 1 17 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.671 2.728 25485 21646 1 17 . 1 1 122 122 LEU H H 122 6.847 6.847 7.483 -0.636 25485 21647 1 17 . 1 1 123 123 HIS N N 123 121.054 121.054 118.203 2.851 25485 21648 1 17 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.682 -0.075 25485 21649 1 17 . 1 1 123 123 HIS C C 123 172.820 172.820 173.585 -0.765 25485 21650 1 17 . 1 1 123 123 HIS CA C 123 54.509 54.509 54.845 -0.336 25485 21651 1 17 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.335 0.775 25485 21652 1 17 . 1 1 123 123 HIS H H 123 7.760 7.760 8.429 -0.669 25485 21653 1 17 . 1 1 124 124 PHE N N 124 120.465 120.465 124.125 -3.660 25485 21654 1 17 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.481 0.353 25485 21655 1 17 . 1 1 124 124 PHE C C 124 175.677 175.677 175.751 -0.074 25485 21656 1 17 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.338 0.954 25485 21657 1 17 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.410 0.412 25485 21658 1 17 . 1 1 124 124 PHE H H 124 8.306 8.306 8.743 -0.437 25485 21659 1 17 . 1 1 125 125 ARG N N 125 124.008 124.008 123.314 0.694 25485 21660 1 17 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.817 -0.106 25485 21661 1 17 . 1 1 125 125 ARG C C 125 172.901 172.901 175.080 -2.179 25485 21662 1 17 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.774 -0.500 25485 21663 1 17 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.553 -0.731 25485 21664 1 17 . 1 1 125 125 ARG H H 125 8.426 8.426 8.808 -0.382 25485 21665 1 17 . 1 1 126 126 LYS N N 126 130.004 130.004 125.266 4.738 25485 21666 1 17 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.221 -0.838 25485 21667 1 17 . 1 1 126 126 LYS C C 126 176.126 176.126 175.721 0.405 25485 21668 1 17 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.954 0.227 25485 21669 1 17 . 1 1 126 126 LYS CB C 126 33.027 33.027 32.989 0.038 25485 21670 1 17 . 1 1 126 126 LYS H H 126 8.481 8.481 8.529 -0.048 25485 21671 1 17 . 1 1 127 127 VAL N N 127 125.288 125.288 120.708 4.580 25485 21672 1 17 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.264 0.241 25485 21673 1 17 . 1 1 127 127 VAL C C 127 175.565 175.565 175.398 0.167 25485 21674 1 17 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.884 -1.935 25485 21675 1 17 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.891 1.471 25485 21676 1 17 . 1 1 127 127 VAL H H 127 8.721 8.721 7.900 0.821 25485 21677 1 17 . 1 1 128 128 VAL N N 128 117.467 117.467 122.119 -4.652 25485 21678 1 17 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.059 0.270 25485 21679 1 17 . 1 1 128 128 VAL C C 128 174.622 174.622 175.112 -0.490 25485 21680 1 17 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.470 0.648 25485 21681 1 17 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.101 0.409 25485 21682 1 17 . 1 1 128 128 VAL H H 128 8.406 8.406 8.205 0.201 25485 21683 1 17 . 1 1 129 129 TRP N N 129 119.986 119.986 122.095 -2.109 25485 21684 1 17 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.926 -0.210 25485 21685 1 17 . 1 1 129 129 TRP C C 129 174.536 174.536 176.543 -2.007 25485 21686 1 17 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.874 -0.957 25485 21687 1 17 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.622 2.392 25485 21688 1 17 . 1 1 129 129 TRP H H 129 7.435 7.435 7.339 0.096 25485 21689 1 17 . 1 1 130 130 GLY N N 130 109.900 109.900 113.820 -3.920 25485 21690 1 17 . 1 1 130 130 GLY C C 130 173.187 173.187 174.009 -0.822 25485 21691 1 17 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.500 -0.020 25485 21692 1 17 . 1 1 130 130 GLY H H 130 8.006 8.006 8.468 -0.462 25485 21693 1 17 . 1 1 131 131 THR N N 131 116.142 116.142 113.973 2.169 25485 21694 1 17 . 1 1 131 131 THR HA H 131 4.162 4.162 4.402 -0.240 25485 21695 1 17 . 1 1 131 131 THR C C 131 172.766 172.766 173.429 -0.663 25485 21696 1 17 . 1 1 131 131 THR CA C 131 63.212 63.212 60.933 2.279 25485 21697 1 17 . 1 1 131 131 THR CB C 131 69.308 69.308 70.260 -0.952 25485 21698 1 17 . 1 1 131 131 THR H H 131 8.233 8.233 8.094 0.139 25485 21699 1 17 . 1 1 132 132 ALA N N 132 129.807 129.807 124.626 5.181 25485 21700 1 17 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.484 0.032 25485 21701 1 17 . 1 1 132 132 ALA C C 132 175.358 175.358 175.992 -0.634 25485 21702 1 17 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.877 -1.511 25485 21703 1 17 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.648 1.150 25485 21704 1 17 . 1 1 132 132 ALA H H 132 7.962 7.962 8.414 -0.452 25485 21705 1 17 . 1 1 133 133 ASP N N 133 122.896 122.896 120.506 2.390 25485 21706 1 17 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.547 -0.126 25485 21707 1 17 . 1 1 133 133 ASP C C 133 177.314 177.314 177.074 0.240 25485 21708 1 17 . 1 1 133 133 ASP CA C 133 57.919 57.919 57.318 0.601 25485 21709 1 17 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.623 -1.152 25485 21710 1 17 . 1 1 133 133 ASP H H 133 8.251 8.251 8.243 0.008 25485 21711 1 17 . 1 1 134 134 ILE N N 134 125.472 125.472 119.918 5.554 25485 21712 1 17 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.512 -0.369 25485 21713 1 17 . 1 1 134 134 ILE C C 134 174.201 174.201 175.330 -1.129 25485 21714 1 17 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.679 -0.408 25485 21715 1 17 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.179 -0.469 25485 21716 1 17 . 1 1 134 134 ILE H H 134 8.802 8.802 8.279 0.523 25485 21717 1 17 . 1 1 135 135 MET N N 135 127.265 127.265 124.886 2.379 25485 21718 1 17 . 1 1 135 135 MET HA H 135 5.192 5.192 5.529 -0.337 25485 21719 1 17 . 1 1 135 135 MET C C 135 176.206 176.206 175.755 0.451 25485 21720 1 17 . 1 1 135 135 MET CA C 135 53.626 53.626 52.254 1.372 25485 21721 1 17 . 1 1 135 135 MET CB C 135 32.639 32.639 34.558 -1.919 25485 21722 1 17 . 1 1 135 135 MET H H 135 7.418 7.418 8.772 -1.354 25485 21723 1 17 . 1 1 136 136 ILE N N 136 125.440 125.440 123.487 1.953 25485 21724 1 17 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.931 0.658 25485 21725 1 17 . 1 1 136 136 ILE C C 136 175.190 175.190 175.856 -0.666 25485 21726 1 17 . 1 1 136 136 ILE CA C 136 60.108 60.108 59.143 0.965 25485 21727 1 17 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.665 4.275 25485 21728 1 17 . 1 1 136 136 ILE H H 136 9.124 9.124 9.097 0.027 25485 21729 1 17 . 1 1 137 137 GLY N N 137 112.211 112.211 114.366 -2.155 25485 21730 1 17 . 1 1 137 137 GLY C C 137 170.855 170.855 172.178 -1.323 25485 21731 1 17 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.231 1.174 25485 21732 1 17 . 1 1 137 137 GLY H H 137 8.594 8.594 8.141 0.453 25485 21733 1 17 . 1 1 138 138 PHE N N 138 119.463 119.463 118.664 0.799 25485 21734 1 17 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.555 -0.059 25485 21735 1 17 . 1 1 138 138 PHE C C 138 175.186 175.186 174.551 0.635 25485 21736 1 17 . 1 1 138 138 PHE CA C 138 55.995 55.995 53.810 2.185 25485 21737 1 17 . 1 1 138 138 PHE CB C 138 41.442 41.442 40.779 0.663 25485 21738 1 17 . 1 1 138 138 PHE H H 138 7.857 7.857 8.120 -0.263 25485 21739 1 17 . 1 1 139 139 ALA N N 139 123.914 123.914 125.482 -1.568 25485 21740 1 17 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.566 0.165 25485 21741 1 17 . 1 1 139 139 ALA C C 139 174.613 174.613 175.684 -1.071 25485 21742 1 17 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.469 -1.434 25485 21743 1 17 . 1 1 139 139 ALA CB C 139 22.472 22.472 21.085 1.387 25485 21744 1 17 . 1 1 139 139 ALA H H 139 8.955 8.955 9.137 -0.182 25485 21745 1 17 . 1 1 140 140 ARG N N 140 118.339 118.339 120.398 -2.059 25485 21746 1 17 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.837 0.269 25485 21747 1 17 . 1 1 140 140 ARG C C 140 176.201 176.201 178.100 -1.899 25485 21748 1 17 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.707 -0.541 25485 21749 1 17 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.642 0.827 25485 21750 1 17 . 1 1 140 140 ARG H H 140 8.546 8.546 8.515 0.031 25485 21751 1 17 . 1 1 141 141 GLY N N 141 108.916 108.916 109.129 -0.213 25485 21752 1 17 . 1 1 141 141 GLY C C 141 175.595 175.595 175.047 0.548 25485 21753 1 17 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.297 -1.007 25485 21754 1 17 . 1 1 141 141 GLY H H 141 8.989 8.989 9.131 -0.142 25485 21755 1 17 . 1 1 142 142 ALA N N 142 121.448 121.448 121.414 0.034 25485 21756 1 17 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.415 -0.007 25485 21757 1 17 . 1 1 142 142 ALA C C 142 177.027 177.027 177.509 -0.482 25485 21758 1 17 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.385 0.892 25485 21759 1 17 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.151 -0.187 25485 21760 1 17 . 1 1 142 142 ALA H H 142 8.642 8.642 8.233 0.409 25485 21761 1 17 . 1 1 143 143 HIS N N 143 120.356 120.356 114.733 5.623 25485 21762 1 17 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.507 0.650 25485 21763 1 17 . 1 1 143 143 HIS C C 143 174.303 174.303 176.120 -1.817 25485 21764 1 17 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.681 -0.228 25485 21765 1 17 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.514 -1.723 25485 21766 1 17 . 1 1 143 143 HIS H H 143 8.990 8.990 8.039 0.951 25485 21767 1 17 . 1 1 144 144 GLY N N 144 112.517 112.517 108.085 4.432 25485 21768 1 17 . 1 1 144 144 GLY C C 144 173.758 173.758 173.246 0.512 25485 21769 1 17 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.784 1.311 25485 21770 1 17 . 1 1 144 144 GLY H H 144 5.175 5.175 7.802 -2.627 25485 21771 1 17 . 1 1 145 145 ASP N N 145 117.762 117.762 118.975 -1.213 25485 21772 1 17 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.773 -0.075 25485 21773 1 17 . 1 1 145 145 ASP C C 145 175.851 175.851 174.999 0.852 25485 21774 1 17 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.755 -0.796 25485 21775 1 17 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.393 -0.594 25485 21776 1 17 . 1 1 145 145 ASP H H 145 7.096 7.096 7.540 -0.444 25485 21777 1 17 . 1 1 146 146 SER N N 146 125.540 125.540 114.064 11.476 25485 21778 1 17 . 1 1 146 146 SER HA H 146 4.204 4.204 4.377 -0.173 25485 21779 1 17 . 1 1 146 146 SER C C 146 172.319 172.319 173.789 -1.470 25485 21780 1 17 . 1 1 146 146 SER CA C 146 58.862 58.862 58.436 0.426 25485 21781 1 17 . 1 1 146 146 SER CB C 146 62.933 62.933 63.770 -0.838 25485 21782 1 17 . 1 1 146 146 SER H H 146 8.261 8.261 8.204 0.057 25485 21783 1 17 . 1 1 147 147 TYR N N 147 120.757 120.757 117.595 3.162 25485 21784 1 17 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.231 0.591 25485 21785 1 17 . 1 1 147 147 TYR C C 147 170.372 170.372 173.773 -3.401 25485 21786 1 17 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.370 -4.101 25485 21787 1 17 . 1 1 147 147 TYR CB C 147 38.296 38.296 37.788 0.508 25485 21788 1 17 . 1 1 147 147 TYR H H 147 7.450 7.450 8.496 -1.046 25485 21789 1 17 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.208 0.664 25485 21790 1 17 . 1 1 148 148 PRO C C 148 179.009 179.009 175.917 3.092 25485 21791 1 17 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.277 1.098 25485 21792 1 17 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.076 -1.167 25485 21793 1 17 . 1 1 149 149 PHE N N 149 120.514 120.514 118.906 1.608 25485 21794 1 17 . 1 1 149 149 PHE C C 149 176.813 176.813 175.815 0.998 25485 21795 1 17 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.061 -0.608 25485 21796 1 17 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.463 0.110 25485 21797 1 17 . 1 1 149 149 PHE H H 149 8.024 8.024 7.465 0.559 25485 21798 1 17 . 1 1 150 150 ASP N N 150 115.555 115.555 117.241 -1.686 25485 21799 1 17 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.360 0.479 25485 21800 1 17 . 1 1 150 150 ASP C C 150 177.007 177.007 175.858 1.149 25485 21801 1 17 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.734 -0.863 25485 21802 1 17 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.740 2.196 25485 21803 1 17 . 1 1 150 150 ASP H H 150 7.511 7.511 7.912 -0.401 25485 21804 1 17 . 1 1 151 151 GLY N N 151 110.650 110.650 109.273 1.377 25485 21805 1 17 . 1 1 151 151 GLY C C 151 170.281 170.281 172.368 -2.087 25485 21806 1 17 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.614 -0.216 25485 21807 1 17 . 1 1 151 151 GLY H H 151 9.080 9.080 8.366 0.714 25485 21808 1 17 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.182 -0.126 25485 21809 1 17 . 1 1 152 152 PRO C C 152 178.300 178.300 176.550 1.750 25485 21810 1 17 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.120 0.730 25485 21811 1 17 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.993 -0.733 25485 21812 1 17 . 1 1 153 153 GLY N N 153 118.783 118.783 113.119 5.664 25485 21813 1 17 . 1 1 153 153 GLY C C 153 174.098 174.098 173.126 0.972 25485 21814 1 17 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.482 -0.876 25485 21815 1 17 . 1 1 153 153 GLY H H 153 11.431 11.431 8.226 3.205 25485 21816 1 17 . 1 1 154 154 ASN N N 154 120.679 120.679 123.319 -2.640 25485 21817 1 17 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.412 -0.168 25485 21818 1 17 . 1 1 154 154 ASN C C 154 174.636 174.636 174.472 0.164 25485 21819 1 17 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.546 2.122 25485 21820 1 17 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.683 -1.712 25485 21821 1 17 . 1 1 154 154 ASN H H 154 9.247 9.247 8.516 0.731 25485 21822 1 17 . 1 1 155 155 THR N N 155 118.252 118.252 111.457 6.795 25485 21823 1 17 . 1 1 155 155 THR HA H 155 5.577 5.577 4.043 1.534 25485 21824 1 17 . 1 1 155 155 THR C C 155 176.596 176.596 173.220 3.376 25485 21825 1 17 . 1 1 155 155 THR CA C 155 61.731 61.731 63.231 -1.500 25485 21826 1 17 . 1 1 155 155 THR CB C 155 71.325 71.325 68.943 2.382 25485 21827 1 17 . 1 1 155 155 THR H H 155 9.501 9.501 8.418 1.083 25485 21828 1 17 . 1 1 156 156 LEU N N 156 122.598 122.598 121.404 1.194 25485 21829 1 17 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.551 0.320 25485 21830 1 17 . 1 1 156 156 LEU C C 156 175.655 175.655 175.920 -0.265 25485 21831 1 17 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.103 -0.565 25485 21832 1 17 . 1 1 156 156 LEU CB C 156 44.511 44.511 43.280 1.231 25485 21833 1 17 . 1 1 156 156 LEU H H 156 8.492 8.492 8.164 0.328 25485 21834 1 17 . 1 1 157 157 ALA N N 157 115.389 115.389 115.716 -0.327 25485 21835 1 17 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.512 0.523 25485 21836 1 17 . 1 1 157 157 ALA C C 157 175.739 175.739 175.111 0.628 25485 21837 1 17 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.550 -0.611 25485 21838 1 17 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.938 1.516 25485 21839 1 17 . 1 1 157 157 ALA H H 157 7.567 7.567 7.816 -0.249 25485 21840 1 17 . 1 1 158 158 HIS N N 158 111.900 111.900 118.358 -6.458 25485 21841 1 17 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.876 -0.271 25485 21842 1 17 . 1 1 158 158 HIS C C 158 170.186 170.186 172.407 -2.221 25485 21843 1 17 . 1 1 158 158 HIS CA C 158 56.075 56.075 53.976 2.099 25485 21844 1 17 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.556 -1.370 25485 21845 1 17 . 1 1 158 158 HIS H H 158 8.757 8.757 7.763 0.994 25485 21846 1 17 . 1 1 159 159 ALA N N 159 118.286 118.286 126.715 -8.429 25485 21847 1 17 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.039 0.615 25485 21848 1 17 . 1 1 159 159 ALA C C 159 174.036 174.036 175.163 -1.127 25485 21849 1 17 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.501 0.632 25485 21850 1 17 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.523 2.514 25485 21851 1 17 . 1 1 159 159 ALA H H 159 6.110 6.110 8.228 -2.118 25485 21852 1 17 . 1 1 160 160 PHE N N 160 117.937 117.937 119.669 -1.732 25485 21853 1 17 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.745 -0.242 25485 21854 1 17 . 1 1 160 160 PHE C C 160 174.455 174.455 174.889 -0.434 25485 21855 1 17 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.155 1.658 25485 21856 1 17 . 1 1 160 160 PHE CB C 160 42.194 42.194 40.867 1.327 25485 21857 1 17 . 1 1 160 160 PHE H H 160 7.912 7.912 7.754 0.158 25485 21858 1 17 . 1 1 161 161 ALA N N 161 123.531 123.531 121.662 1.869 25485 21859 1 17 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.711 -0.220 25485 21860 1 17 . 1 1 161 161 ALA C C 161 175.503 175.503 176.178 -0.675 25485 21861 1 17 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.175 1.458 25485 21862 1 17 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.226 -2.670 25485 21863 1 17 . 1 1 161 161 ALA H H 161 8.107 8.107 8.438 -0.331 25485 21864 1 17 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.458 -0.548 25485 21865 1 17 . 1 1 162 162 PRO C C 162 173.465 173.465 175.507 -2.042 25485 21866 1 17 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.363 1.894 25485 21867 1 17 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.214 2.028 25485 21868 1 17 . 1 1 163 163 GLY N N 163 107.206 107.206 109.177 -1.971 25485 21869 1 17 . 1 1 163 163 GLY C C 163 172.092 172.092 172.072 0.020 25485 21870 1 17 . 1 1 163 163 GLY CA C 163 43.993 43.993 45.087 -1.093 25485 21871 1 17 . 1 1 163 163 GLY H H 163 5.997 5.997 7.723 -1.726 25485 21872 1 17 . 1 1 165 165 GLY N N 165 103.110 103.110 109.624 -6.514 25485 21873 1 17 . 1 1 165 165 GLY C C 165 177.158 177.158 175.554 1.604 25485 21874 1 17 . 1 1 165 165 GLY CA C 165 44.243 44.243 46.629 -2.386 25485 21875 1 17 . 1 1 165 165 GLY H H 165 9.145 9.145 8.592 0.553 25485 21876 1 17 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.358 -0.179 25485 21877 1 17 . 1 1 166 166 LEU C C 166 176.437 176.437 177.496 -1.059 25485 21878 1 17 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.920 0.280 25485 21879 1 17 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.436 -0.602 25485 21880 1 17 . 1 1 167 167 GLY N N 167 103.318 103.318 103.951 -0.633 25485 21881 1 17 . 1 1 167 167 GLY C C 167 174.803 174.803 174.201 0.602 25485 21882 1 17 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.684 2.549 25485 21883 1 17 . 1 1 167 167 GLY H H 167 7.768 7.768 7.340 0.428 25485 21884 1 17 . 1 1 168 168 GLY N N 168 121.051 121.051 107.248 13.803 25485 21885 1 17 . 1 1 168 168 GLY C C 168 172.122 172.122 174.051 -1.929 25485 21886 1 17 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.300 1.302 25485 21887 1 17 . 1 1 168 168 GLY H H 168 7.698 7.698 8.089 -0.391 25485 21888 1 17 . 1 1 169 169 ASP N N 169 123.641 123.641 120.718 2.923 25485 21889 1 17 . 1 1 169 169 ASP C C 169 173.942 173.942 173.759 0.183 25485 21890 1 17 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.452 2.390 25485 21891 1 17 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.673 -2.803 25485 21892 1 17 . 1 1 169 169 ASP H H 169 8.595 8.595 7.912 0.683 25485 21893 1 17 . 1 1 170 170 ALA N N 170 119.366 119.366 120.679 -1.313 25485 21894 1 17 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.418 0.312 25485 21895 1 17 . 1 1 170 170 ALA C C 170 174.593 174.593 175.254 -0.661 25485 21896 1 17 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.824 0.300 25485 21897 1 17 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.169 1.166 25485 21898 1 17 . 1 1 170 170 ALA H H 170 8.324 8.324 8.547 -0.223 25485 21899 1 17 . 1 1 171 171 HIS N N 171 120.239 120.239 121.305 -1.066 25485 21900 1 17 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.485 0.263 25485 21901 1 17 . 1 1 171 171 HIS C C 171 172.949 172.949 173.946 -0.997 25485 21902 1 17 . 1 1 171 171 HIS CA C 171 50.724 50.724 52.975 -2.251 25485 21903 1 17 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.904 1.637 25485 21904 1 17 . 1 1 171 171 HIS H H 171 8.499 8.499 7.714 0.785 25485 21905 1 17 . 1 1 172 172 PHE N N 172 121.125 121.125 121.068 0.057 25485 21906 1 17 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.584 -0.056 25485 21907 1 17 . 1 1 172 172 PHE C C 172 173.875 173.875 174.041 -0.166 25485 21908 1 17 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.652 0.268 25485 21909 1 17 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.270 0.633 25485 21910 1 17 . 1 1 172 172 PHE H H 172 8.445 8.445 8.875 -0.430 25485 21911 1 17 . 1 1 173 173 ASP N N 173 124.014 124.014 122.870 1.144 25485 21912 1 17 . 1 1 173 173 ASP HA H 173 3.914 3.914 5.160 -1.246 25485 21913 1 17 . 1 1 173 173 ASP C C 173 178.613 178.613 177.990 0.623 25485 21914 1 17 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.588 1.210 25485 21915 1 17 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.257 -0.514 25485 21916 1 17 . 1 1 173 173 ASP H H 173 7.927 7.927 8.631 -0.704 25485 21917 1 17 . 1 1 174 174 GLU N N 174 132.469 132.469 127.217 5.252 25485 21918 1 17 . 1 1 174 174 GLU C C 174 176.442 176.442 177.185 -0.743 25485 21919 1 17 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.747 -1.563 25485 21920 1 17 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.301 0.984 25485 21921 1 17 . 1 1 174 174 GLU H H 174 9.528 9.528 8.687 0.841 25485 21922 1 17 . 1 1 175 175 ASP N N 175 117.394 117.394 119.007 -1.613 25485 21923 1 17 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.626 0.167 25485 21924 1 17 . 1 1 175 175 ASP C C 175 176.645 176.645 176.585 0.060 25485 21925 1 17 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.343 0.588 25485 21926 1 17 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.763 -1.621 25485 21927 1 17 . 1 1 175 175 ASP H H 175 8.768 8.768 8.654 0.114 25485 21928 1 17 . 1 1 176 176 GLU N N 176 116.493 116.493 118.656 -2.163 25485 21929 1 17 . 1 1 176 176 GLU C C 176 175.038 175.038 175.030 0.008 25485 21930 1 17 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.246 -1.581 25485 21931 1 17 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.480 -4.257 25485 21932 1 17 . 1 1 176 176 GLU H H 176 7.159 7.159 8.127 -0.968 25485 21933 1 17 . 1 1 177 177 ARG N N 177 122.186 122.186 120.310 1.876 25485 21934 1 17 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.269 0.420 25485 21935 1 17 . 1 1 177 177 ARG C C 177 174.482 174.482 174.300 0.182 25485 21936 1 17 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.218 -1.531 25485 21937 1 17 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.736 -1.652 25485 21938 1 17 . 1 1 177 177 ARG H H 177 7.560 7.560 8.105 -0.545 25485 21939 1 17 . 1 1 178 178 TRP N N 178 129.179 129.179 125.293 3.886 25485 21940 1 17 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.449 -0.349 25485 21941 1 17 . 1 1 178 178 TRP C C 178 176.298 176.298 176.257 0.041 25485 21942 1 17 . 1 1 178 178 TRP CA C 178 56.813 56.813 55.538 1.275 25485 21943 1 17 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.494 -0.297 25485 21944 1 17 . 1 1 178 178 TRP H H 178 8.807 8.807 8.465 0.342 25485 21945 1 17 . 1 1 179 179 THR N N 179 112.792 112.792 115.467 -2.675 25485 21946 1 17 . 1 1 179 179 THR HA H 179 4.985 4.985 4.583 0.402 25485 21947 1 17 . 1 1 179 179 THR C C 179 172.765 172.765 172.597 0.168 25485 21948 1 17 . 1 1 179 179 THR CA C 179 59.106 59.106 61.017 -1.911 25485 21949 1 17 . 1 1 179 179 THR CB C 179 71.786 71.786 70.575 1.211 25485 21950 1 17 . 1 1 179 179 THR H H 179 8.974 8.974 8.672 0.302 25485 21951 1 17 . 1 1 180 180 ASP N N 180 122.074 122.074 124.301 -2.227 25485 21952 1 17 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.168 -0.705 25485 21953 1 17 . 1 1 180 180 ASP C C 180 176.366 176.366 178.232 -1.866 25485 21954 1 17 . 1 1 180 180 ASP CA C 180 53.043 53.043 54.974 -1.931 25485 21955 1 17 . 1 1 180 180 ASP CB C 180 41.728 41.728 41.779 -0.051 25485 21956 1 17 . 1 1 180 180 ASP H H 180 8.485 8.485 8.767 -0.282 25485 21957 1 17 . 1 1 181 181 GLY N N 181 110.123 110.123 107.605 2.518 25485 21958 1 17 . 1 1 181 181 GLY C C 181 174.325 174.325 175.341 -1.016 25485 21959 1 17 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.443 1.218 25485 21960 1 17 . 1 1 181 181 GLY H H 181 8.569 8.569 8.601 -0.032 25485 21961 1 17 . 1 1 182 182 SER N N 182 115.562 115.562 115.185 0.377 25485 21962 1 17 . 1 1 182 182 SER HA H 182 4.519 4.519 4.539 -0.020 25485 21963 1 17 . 1 1 182 182 SER C C 182 173.783 173.783 173.865 -0.082 25485 21964 1 17 . 1 1 182 182 SER CA C 182 57.965 57.965 57.596 0.369 25485 21965 1 17 . 1 1 182 182 SER CB C 182 64.166 64.166 63.956 0.210 25485 21966 1 17 . 1 1 182 182 SER H H 182 8.160 8.160 7.828 0.332 25485 21967 1 17 . 1 1 183 183 SER N N 183 117.153 117.153 114.753 2.400 25485 21968 1 17 . 1 1 183 183 SER HA H 183 4.275 4.275 4.142 0.133 25485 21969 1 17 . 1 1 183 183 SER C C 183 173.333 173.333 174.568 -1.235 25485 21970 1 17 . 1 1 183 183 SER CA C 183 59.902 59.902 58.430 1.472 25485 21971 1 17 . 1 1 183 183 SER CB C 183 64.941 64.941 62.348 2.593 25485 21972 1 17 . 1 1 183 183 SER H H 183 7.796 7.796 7.473 0.323 25485 21973 1 17 . 1 1 184 184 LEU N N 184 122.351 122.351 121.900 0.451 25485 21974 1 17 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.375 0.017 25485 21975 1 17 . 1 1 184 184 LEU C C 184 176.250 176.250 177.137 -0.887 25485 21976 1 17 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.465 0.110 25485 21977 1 17 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.994 -0.913 25485 21978 1 17 . 1 1 184 184 LEU H H 184 8.092 8.092 8.112 -0.020 25485 21979 1 17 . 1 1 185 185 GLY N N 185 108.871 108.871 106.406 2.465 25485 21980 1 17 . 1 1 185 185 GLY C C 185 172.375 172.375 173.648 -1.273 25485 21981 1 17 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.576 -0.196 25485 21982 1 17 . 1 1 185 185 GLY H H 185 7.960 7.960 7.631 0.329 25485 21983 1 17 . 1 1 186 186 ILE N N 186 123.096 123.096 123.205 -0.109 25485 21984 1 17 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.130 -0.289 25485 21985 1 17 . 1 1 186 186 ILE C C 186 175.350 175.350 175.239 0.111 25485 21986 1 17 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.114 -0.713 25485 21987 1 17 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.172 0.284 25485 21988 1 17 . 1 1 186 186 ILE H H 186 8.893 8.893 7.656 1.237 25485 21989 1 17 . 1 1 187 187 ASN N N 187 127.167 127.167 126.246 0.921 25485 21990 1 17 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.925 -0.572 25485 21991 1 17 . 1 1 187 187 ASN C C 187 175.849 175.849 176.855 -1.006 25485 21992 1 17 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.299 1.415 25485 21993 1 17 . 1 1 187 187 ASN CB C 187 39.130 39.130 39.421 -0.291 25485 21994 1 17 . 1 1 187 187 ASN H H 187 8.580 8.580 8.042 0.538 25485 21995 1 17 . 1 1 188 188 PHE N N 188 129.985 129.985 127.510 2.475 25485 21996 1 17 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.247 0.326 25485 21997 1 17 . 1 1 188 188 PHE C C 188 175.578 175.578 177.367 -1.789 25485 21998 1 17 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.142 -0.414 25485 21999 1 17 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.459 -0.027 25485 22000 1 17 . 1 1 188 188 PHE H H 188 9.361 9.361 8.793 0.568 25485 22001 1 17 . 1 1 189 189 LEU N N 189 119.113 119.113 119.492 -0.379 25485 22002 1 17 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.171 -0.370 25485 22003 1 17 . 1 1 189 189 LEU C C 189 179.601 179.601 178.827 0.774 25485 22004 1 17 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.375 0.134 25485 22005 1 17 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.019 -1.142 25485 22006 1 17 . 1 1 189 189 LEU H H 189 8.562 8.562 8.040 0.522 25485 22007 1 17 . 1 1 190 190 TYR HA H 190 3.917 3.917 4.331 -0.414 25485 22008 1 17 . 1 1 190 190 TYR C C 190 177.621 177.621 177.901 -0.280 25485 22009 1 17 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.355 -0.547 25485 22010 1 17 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.522 2.247 25485 22011 1 17 . 1 1 191 191 ALA N N 191 120.352 120.352 121.146 -0.794 25485 22012 1 17 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.135 0.180 25485 22013 1 17 . 1 1 191 191 ALA C C 191 180.252 180.252 179.040 1.212 25485 22014 1 17 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.522 0.660 25485 22015 1 17 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.391 0.751 25485 22016 1 17 . 1 1 191 191 ALA H H 191 7.993 7.993 8.917 -0.924 25485 22017 1 17 . 1 1 192 192 ALA N N 192 121.409 121.409 121.811 -0.402 25485 22018 1 17 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.180 -0.123 25485 22019 1 17 . 1 1 192 192 ALA C C 192 178.575 178.575 179.812 -1.237 25485 22020 1 17 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.527 -0.342 25485 22021 1 17 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.141 -1.943 25485 22022 1 17 . 1 1 192 192 ALA H H 192 9.297 9.297 8.332 0.965 25485 22023 1 17 . 1 1 193 193 THR N N 193 116.996 116.996 115.698 1.298 25485 22024 1 17 . 1 1 193 193 THR HA H 193 3.833 3.833 4.115 -0.282 25485 22025 1 17 . 1 1 193 193 THR CA C 193 69.138 69.138 67.924 1.214 25485 22026 1 17 . 1 1 193 193 THR CB C 193 67.365 67.365 68.659 -1.294 25485 22027 1 17 . 1 1 193 193 THR H H 193 8.226 8.226 7.863 0.363 25485 22028 1 17 . 1 1 194 194 HIS N N 194 120.296 120.296 121.824 -1.528 25485 22029 1 17 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.302 -0.066 25485 22030 1 17 . 1 1 194 194 HIS C C 194 175.962 175.962 176.797 -0.835 25485 22031 1 17 . 1 1 194 194 HIS CA C 194 59.747 59.747 59.541 0.206 25485 22032 1 17 . 1 1 194 194 HIS CB C 194 27.919 27.919 30.006 -2.087 25485 22033 1 17 . 1 1 194 194 HIS H H 194 7.782 7.782 7.732 0.050 25485 22034 1 17 . 1 1 195 195 ALA N N 195 121.290 121.290 122.237 -0.947 25485 22035 1 17 . 1 1 195 195 ALA HA H 195 4.156 4.156 4.012 0.144 25485 22036 1 17 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.901 1.063 25485 22037 1 17 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.597 0.113 25485 22038 1 17 . 1 1 195 195 ALA H H 195 8.690 8.690 8.528 0.162 25485 22039 1 17 . 1 1 196 196 LEU N N 196 114.899 114.899 117.977 -3.078 25485 22040 1 17 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.040 0.130 25485 22041 1 17 . 1 1 196 196 LEU C C 196 177.946 177.946 179.329 -1.383 25485 22042 1 17 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.530 -1.302 25485 22043 1 17 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.131 -1.355 25485 22044 1 17 . 1 1 196 196 LEU H H 196 8.715 8.715 8.789 -0.074 25485 22045 1 17 . 1 1 197 197 GLY N N 197 107.901 107.901 104.350 3.551 25485 22046 1 17 . 1 1 197 197 GLY C C 197 178.641 178.641 175.540 3.101 25485 22047 1 17 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.594 0.973 25485 22048 1 17 . 1 1 197 197 GLY H H 197 7.546 7.546 8.041 -0.495 25485 22049 1 17 . 1 1 198 198 HIS N N 198 122.017 122.017 119.753 2.264 25485 22050 1 17 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.504 0.353 25485 22051 1 17 . 1 1 198 198 HIS C C 198 179.874 179.874 178.258 1.616 25485 22052 1 17 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.266 1.256 25485 22053 1 17 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.577 -2.031 25485 22054 1 17 . 1 1 198 198 HIS H H 198 7.196 7.196 7.560 -0.364 25485 22055 1 17 . 1 1 199 199 SER N N 199 118.486 118.486 114.583 3.903 25485 22056 1 17 . 1 1 199 199 SER HA H 199 4.490 4.490 4.605 -0.115 25485 22057 1 17 . 1 1 199 199 SER C C 199 174.493 174.493 175.644 -1.151 25485 22058 1 17 . 1 1 199 199 SER CA C 199 58.173 58.173 60.000 -1.827 25485 22059 1 17 . 1 1 199 199 SER CB C 199 63.589 63.589 63.298 0.291 25485 22060 1 17 . 1 1 199 199 SER H H 199 7.884 7.884 7.617 0.267 25485 22061 1 17 . 1 1 200 200 LEU N N 200 114.686 114.686 117.357 -2.671 25485 22062 1 17 . 1 1 200 200 LEU C C 200 177.720 177.720 177.225 0.495 25485 22063 1 17 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.584 0.253 25485 22064 1 17 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.911 0.446 25485 22065 1 17 . 1 1 200 200 LEU H H 200 7.108 7.108 7.051 0.057 25485 22066 1 17 . 1 1 201 201 GLY N N 201 108.363 108.363 106.243 2.120 25485 22067 1 17 . 1 1 201 201 GLY C C 201 174.008 174.008 174.473 -0.465 25485 22068 1 17 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.402 -0.988 25485 22069 1 17 . 1 1 201 201 GLY H H 201 8.195 8.195 7.475 0.720 25485 22070 1 17 . 1 1 202 202 MET N N 202 119.635 119.635 121.394 -1.759 25485 22071 1 17 . 1 1 202 202 MET HA H 202 4.473 4.473 4.574 -0.101 25485 22072 1 17 . 1 1 202 202 MET C C 202 176.593 176.593 175.339 1.254 25485 22073 1 17 . 1 1 202 202 MET CA C 202 54.500 54.500 54.903 -0.403 25485 22074 1 17 . 1 1 202 202 MET CB C 202 32.161 32.161 33.527 -1.366 25485 22075 1 17 . 1 1 202 202 MET H H 202 8.182 8.182 7.557 0.625 25485 22076 1 17 . 1 1 203 203 GLY N N 203 109.749 109.749 112.254 -2.505 25485 22077 1 17 . 1 1 203 203 GLY C C 203 174.042 174.042 173.852 0.190 25485 22078 1 17 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.830 -0.826 25485 22079 1 17 . 1 1 203 203 GLY H H 203 8.405 8.405 8.312 0.093 25485 22080 1 17 . 1 1 204 204 HIS N N 204 115.732 115.732 118.603 -2.871 25485 22081 1 17 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.534 0.866 25485 22082 1 17 . 1 1 204 204 HIS C C 204 174.430 174.430 174.602 -0.172 25485 22083 1 17 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.608 -1.794 25485 22084 1 17 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.367 -0.541 25485 22085 1 17 . 1 1 204 204 HIS H H 204 8.364 8.364 8.609 -0.245 25485 22086 1 17 . 1 1 205 205 SER N N 205 115.484 115.484 116.333 -0.849 25485 22087 1 17 . 1 1 205 205 SER HA H 205 4.766 4.766 4.736 0.030 25485 22088 1 17 . 1 1 205 205 SER C C 205 173.611 173.611 174.841 -1.230 25485 22089 1 17 . 1 1 205 205 SER CA C 205 54.729 54.729 57.139 -2.410 25485 22090 1 17 . 1 1 205 205 SER CB C 205 65.855 65.855 65.177 0.678 25485 22091 1 17 . 1 1 205 205 SER H H 205 7.231 7.231 8.480 -1.249 25485 22092 1 17 . 1 1 206 206 SER N N 206 119.263 119.263 118.095 1.168 25485 22093 1 17 . 1 1 206 206 SER HA H 206 3.701 3.701 4.692 -0.991 25485 22094 1 17 . 1 1 206 206 SER C C 206 173.635 173.635 174.467 -0.832 25485 22095 1 17 . 1 1 206 206 SER CA C 206 63.846 63.846 58.709 5.137 25485 22096 1 17 . 1 1 206 206 SER CB C 206 63.764 63.764 63.656 0.108 25485 22097 1 17 . 1 1 206 206 SER H H 206 8.289 8.289 8.868 -0.579 25485 22098 1 17 . 1 1 207 207 ASP N N 207 126.646 126.646 122.191 4.455 25485 22099 1 17 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.642 0.287 25485 22100 1 17 . 1 1 207 207 ASP C C 207 174.614 174.614 175.621 -1.007 25485 22101 1 17 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.498 -1.226 25485 22102 1 17 . 1 1 207 207 ASP CB C 207 41.288 41.288 41.989 -0.701 25485 22103 1 17 . 1 1 207 207 ASP H H 207 8.541 8.541 8.088 0.453 25485 22104 1 17 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.410 0.377 25485 22105 1 17 . 1 1 208 208 PRO C C 208 177.467 177.467 175.623 1.844 25485 22106 1 17 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.890 -1.054 25485 22107 1 17 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.705 -0.108 25485 22108 1 17 . 1 1 209 209 ASN N N 209 116.020 116.020 113.230 2.790 25485 22109 1 17 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.680 -0.039 25485 22110 1 17 . 1 1 209 209 ASN C C 209 174.695 174.695 174.182 0.513 25485 22111 1 17 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.172 2.048 25485 22112 1 17 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.365 0.745 25485 22113 1 17 . 1 1 209 209 ASN H H 209 8.350 8.350 7.780 0.570 25485 22114 1 17 . 1 1 210 210 ALA N N 210 124.892 124.892 121.866 3.026 25485 22115 1 17 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.416 -0.321 25485 22116 1 17 . 1 1 210 210 ALA C C 210 179.495 179.495 178.539 0.956 25485 22117 1 17 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.547 1.507 25485 22118 1 17 . 1 1 210 210 ALA CB C 210 19.199 19.199 21.264 -2.065 25485 22119 1 17 . 1 1 210 210 ALA H H 210 8.193 8.193 7.338 0.855 25485 22120 1 17 . 1 1 211 211 VAL N N 211 130.402 130.402 124.048 6.354 25485 22121 1 17 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.917 0.346 25485 22122 1 17 . 1 1 211 211 VAL C C 211 179.408 179.408 176.536 2.872 25485 22123 1 17 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.236 -0.184 25485 22124 1 17 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.288 -1.305 25485 22125 1 17 . 1 1 211 211 VAL H H 211 11.592 11.592 8.722 2.870 25485 22126 1 17 . 1 1 212 212 MET N N 212 113.285 113.285 115.029 -1.744 25485 22127 1 17 . 1 1 212 212 MET C C 212 176.996 176.996 175.325 1.671 25485 22128 1 17 . 1 1 212 212 MET CA C 212 53.614 53.614 54.095 -0.481 25485 22129 1 17 . 1 1 212 212 MET CB C 212 26.975 26.975 31.025 -4.050 25485 22130 1 17 . 1 1 212 212 MET H H 212 7.724 7.724 7.694 0.030 25485 22131 1 17 . 1 1 213 213 TYR N N 213 129.919 129.919 123.650 6.269 25485 22132 1 17 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.508 1.188 25485 22133 1 17 . 1 1 213 213 TYR C C 213 178.411 178.411 175.392 3.019 25485 22134 1 17 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.137 -0.006 25485 22135 1 17 . 1 1 213 213 TYR CB C 213 39.167 39.167 39.004 0.163 25485 22136 1 17 . 1 1 213 213 TYR H H 213 7.902 7.902 7.433 0.469 25485 22137 1 17 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.082 -0.607 25485 22138 1 17 . 1 1 214 214 PRO C C 214 177.694 177.694 176.451 1.243 25485 22139 1 17 . 1 1 214 214 PRO CA C 214 66.028 66.028 63.729 2.299 25485 22140 1 17 . 1 1 214 214 PRO CB C 214 32.823 32.823 32.028 0.795 25485 22141 1 17 . 1 1 215 215 THR N N 215 104.450 104.450 114.887 -10.437 25485 22142 1 17 . 1 1 215 215 THR HA H 215 4.444 4.444 4.148 0.296 25485 22143 1 17 . 1 1 215 215 THR C C 215 173.429 173.429 173.591 -0.162 25485 22144 1 17 . 1 1 215 215 THR CA C 215 60.528 60.528 61.463 -0.935 25485 22145 1 17 . 1 1 215 215 THR CB C 215 69.614 69.614 66.931 2.683 25485 22146 1 17 . 1 1 215 215 THR H H 215 6.407 6.407 7.345 -0.938 25485 22147 1 17 . 1 1 216 216 TYR N N 216 124.618 124.618 122.611 2.007 25485 22148 1 17 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.136 0.096 25485 22149 1 17 . 1 1 216 216 TYR C C 216 175.669 175.669 177.423 -1.754 25485 22150 1 17 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.783 -0.196 25485 22151 1 17 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.097 2.794 25485 22152 1 17 . 1 1 216 216 TYR H H 216 8.331 8.331 7.537 0.794 25485 22153 1 17 . 1 1 217 217 GLY N N 217 116.089 116.089 111.407 4.682 25485 22154 1 17 . 1 1 217 217 GLY C C 217 173.560 173.560 174.618 -1.058 25485 22155 1 17 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.027 0.291 25485 22156 1 17 . 1 1 217 217 GLY H H 217 7.695 7.695 8.663 -0.968 25485 22157 1 17 . 1 1 218 218 ASN N N 218 120.167 120.167 119.438 0.729 25485 22158 1 17 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.690 -0.024 25485 22159 1 17 . 1 1 218 218 ASN C C 218 175.343 175.343 176.886 -1.543 25485 22160 1 17 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.579 0.036 25485 22161 1 17 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.628 -0.082 25485 22162 1 17 . 1 1 218 218 ASN H H 218 8.237 8.237 8.365 -0.128 25485 22163 1 17 . 1 1 219 219 GLY N N 219 109.322 109.322 107.653 1.669 25485 22164 1 17 . 1 1 219 219 GLY C C 219 172.842 172.842 173.392 -0.550 25485 22165 1 17 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.999 -0.281 25485 22166 1 17 . 1 1 219 219 GLY H H 219 8.027 8.027 8.265 -0.238 25485 22167 1 17 . 1 1 220 220 ASP N N 220 123.006 123.006 121.158 1.848 25485 22168 1 17 . 1 1 220 220 ASP H H 220 8.273 8.273 8.280 -0.007 25485 22169 1 17 . 1 1 221 221 PRO C C 221 177.138 177.138 177.613 -0.475 25485 22170 1 17 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.584 -5.521 25485 22171 1 17 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.837 -1.141 25485 22172 1 17 . 1 1 222 222 GLN N N 222 116.718 116.718 118.549 -1.831 25485 22173 1 17 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.278 0.058 25485 22174 1 17 . 1 1 222 222 GLN C C 222 176.321 176.321 176.034 0.287 25485 22175 1 17 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.422 -1.279 25485 22176 1 17 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.907 0.590 25485 22177 1 17 . 1 1 222 222 GLN H H 222 8.240 8.240 8.810 -0.570 25485 22178 1 17 . 1 1 223 223 ASN N N 223 118.368 118.368 115.762 2.606 25485 22179 1 17 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.765 0.151 25485 22180 1 17 . 1 1 223 223 ASN C C 223 173.271 173.271 175.008 -1.737 25485 22181 1 17 . 1 1 223 223 ASN CA C 223 52.596 52.596 52.496 0.100 25485 22182 1 17 . 1 1 223 223 ASN CB C 223 39.215 39.215 38.085 1.130 25485 22183 1 17 . 1 1 223 223 ASN H H 223 7.946 7.946 8.120 -0.174 25485 22184 1 17 . 1 1 224 224 PHE N N 224 118.429 118.429 121.136 -2.707 25485 22185 1 17 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.299 0.152 25485 22186 1 17 . 1 1 224 224 PHE C C 224 172.897 172.897 174.634 -1.737 25485 22187 1 17 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.523 -0.114 25485 22188 1 17 . 1 1 224 224 PHE CB C 224 39.701 39.701 39.844 -0.143 25485 22189 1 17 . 1 1 224 224 PHE H H 224 6.992 6.992 7.710 -0.718 25485 22190 1 17 . 1 1 225 225 LYS N N 225 121.714 121.714 121.838 -0.124 25485 22191 1 17 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.834 0.596 25485 22192 1 17 . 1 1 225 225 LYS C C 225 174.664 174.664 174.683 -0.019 25485 22193 1 17 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.943 0.369 25485 22194 1 17 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.373 0.354 25485 22195 1 17 . 1 1 225 225 LYS H H 225 7.709 7.709 7.946 -0.237 25485 22196 1 17 . 1 1 226 226 LEU N N 226 119.026 119.026 120.981 -1.955 25485 22197 1 17 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.003 0.137 25485 22198 1 17 . 1 1 226 226 LEU C C 226 177.495 177.495 177.139 0.356 25485 22199 1 17 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.477 0.122 25485 22200 1 17 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.712 -0.431 25485 22201 1 17 . 1 1 226 226 LEU H H 226 8.015 8.015 8.130 -0.115 25485 22202 1 17 . 1 1 227 227 SER N N 227 120.320 120.320 116.458 3.862 25485 22203 1 17 . 1 1 227 227 SER HA H 227 4.600 4.600 4.489 0.112 25485 22204 1 17 . 1 1 227 227 SER C C 227 175.492 175.492 175.254 0.238 25485 22205 1 17 . 1 1 227 227 SER CA C 227 57.239 57.239 57.538 -0.299 25485 22206 1 17 . 1 1 227 227 SER CB C 227 66.278 66.278 64.877 1.401 25485 22207 1 17 . 1 1 227 227 SER H H 227 9.654 9.654 7.869 1.785 25485 22208 1 17 . 1 1 228 228 GLN N N 228 127.511 127.511 123.399 4.112 25485 22209 1 17 . 1 1 228 228 GLN HA H 228 4.694 4.694 4.003 0.691 25485 22210 1 17 . 1 1 228 228 GLN H H 228 8.248 8.248 9.011 -0.763 25485 22211 1 17 . 1 1 229 229 ASP N N 229 124.358 124.358 118.763 5.595 25485 22212 1 17 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.390 -0.016 25485 22213 1 17 . 1 1 229 229 ASP C C 229 178.793 178.793 178.276 0.517 25485 22214 1 17 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.726 0.416 25485 22215 1 17 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.562 2.680 25485 22216 1 17 . 1 1 229 229 ASP H H 229 8.138 8.138 8.506 -0.368 25485 22217 1 17 . 1 1 230 230 ASP N N 230 119.694 119.694 119.486 0.208 25485 22218 1 17 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.504 -0.082 25485 22219 1 17 . 1 1 230 230 ASP C C 230 177.736 177.736 178.343 -0.607 25485 22220 1 17 . 1 1 230 230 ASP CA C 230 57.922 57.922 58.113 -0.191 25485 22221 1 17 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.178 2.058 25485 22222 1 17 . 1 1 230 230 ASP H H 230 7.393 7.393 7.661 -0.268 25485 22223 1 17 . 1 1 231 231 ILE N N 231 120.364 120.364 119.923 0.441 25485 22224 1 17 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.753 -0.088 25485 22225 1 17 . 1 1 231 231 ILE C C 231 177.631 177.631 177.739 -0.108 25485 22226 1 17 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.499 0.000 25485 22227 1 17 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.026 0.487 25485 22228 1 17 . 1 1 231 231 ILE H H 231 8.115 8.115 7.963 0.152 25485 22229 1 17 . 1 1 232 232 LYS N N 232 119.156 119.156 120.501 -1.345 25485 22230 1 17 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.148 -0.034 25485 22231 1 17 . 1 1 232 232 LYS C C 232 180.574 180.574 179.191 1.383 25485 22232 1 17 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.470 0.090 25485 22233 1 17 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.758 0.039 25485 22234 1 17 . 1 1 232 232 LYS H H 232 8.607 8.607 8.582 0.025 25485 22235 1 17 . 1 1 233 233 GLY N N 233 106.425 106.425 108.185 -1.760 25485 22236 1 17 . 1 1 233 233 GLY C C 233 176.098 176.098 175.867 0.231 25485 22237 1 17 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.752 0.885 25485 22238 1 17 . 1 1 233 233 GLY H H 233 8.075 8.075 7.771 0.304 25485 22239 1 17 . 1 1 234 234 ILE N N 234 125.119 125.119 122.283 2.836 25485 22240 1 17 . 1 1 234 234 ILE C C 234 178.231 178.231 177.376 0.855 25485 22241 1 17 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.492 -1.899 25485 22242 1 17 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.363 -0.817 25485 22243 1 17 . 1 1 234 234 ILE H H 234 8.539 8.539 7.596 0.943 25485 22244 1 17 . 1 1 235 235 GLN N N 235 122.877 122.877 119.222 3.655 25485 22245 1 17 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.054 0.303 25485 22246 1 17 . 1 1 235 235 GLN C C 235 180.105 180.105 178.495 1.610 25485 22247 1 17 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.538 -1.651 25485 22248 1 17 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.779 -1.242 25485 22249 1 17 . 1 1 235 235 GLN H H 235 8.296 8.296 8.593 -0.297 25485 22250 1 17 . 1 1 236 236 LYS N N 236 123.678 123.678 118.900 4.778 25485 22251 1 17 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.283 -0.201 25485 22252 1 17 . 1 1 236 236 LYS C C 236 178.169 178.169 177.753 0.416 25485 22253 1 17 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.688 0.688 25485 22254 1 17 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.931 0.047 25485 22255 1 17 . 1 1 236 236 LYS H H 236 8.024 8.024 7.817 0.207 25485 22256 1 17 . 1 1 237 237 LEU N N 237 116.873 116.873 118.728 -1.855 25485 22257 1 17 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.318 -0.331 25485 22258 1 17 . 1 1 237 237 LEU C C 237 177.893 177.893 177.914 -0.021 25485 22259 1 17 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.591 0.848 25485 22260 1 17 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.777 0.836 25485 22261 1 17 . 1 1 237 237 LEU H H 237 6.888 6.888 7.299 -0.411 25485 22262 1 17 . 1 1 238 238 TYR N N 238 112.237 112.237 117.465 -5.228 25485 22263 1 17 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.474 0.177 25485 22264 1 17 . 1 1 238 238 TYR C C 238 176.082 176.082 177.053 -0.971 25485 22265 1 17 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.490 -0.855 25485 22266 1 17 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.993 1.405 25485 22267 1 17 . 1 1 238 238 TYR H H 238 7.445 7.445 8.822 -1.377 25485 22268 1 17 . 1 1 239 239 GLY N N 239 110.906 110.906 106.520 4.386 25485 22269 1 17 . 1 1 239 239 GLY C C 239 171.269 171.269 172.692 -1.423 25485 22270 1 17 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.148 -1.262 25485 22271 1 17 . 1 1 239 239 GLY H H 239 8.443 8.443 7.918 0.525 25485 22272 1 17 . 1 1 240 240 LYS N N 240 114.281 114.281 122.293 -8.012 25485 22273 1 17 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.482 0.256 25485 22274 1 17 . 1 1 240 240 LYS C C 240 177.527 177.527 176.037 1.490 25485 22275 1 17 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.650 -0.692 25485 22276 1 17 . 1 1 240 240 LYS CB C 240 34.275 34.275 34.004 0.271 25485 22277 1 17 . 1 1 240 240 LYS H H 240 7.873 7.873 8.350 -0.477 25485 22278 1 17 . 1 1 241 241 ARG N N 241 123.758 123.758 120.422 3.336 25485 22279 1 17 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.514 -0.517 25485 22280 1 17 . 1 1 241 241 ARG C C 241 176.026 176.026 175.826 0.200 25485 22281 1 17 . 1 1 241 241 ARG CA C 241 57.492 57.492 55.588 1.904 25485 22282 1 17 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.997 -0.625 25485 22283 1 17 . 1 1 241 241 ARG H H 241 7.742 7.742 8.299 -0.557 25485 22284 1 17 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.493 -0.153 25485 22285 1 17 . 1 1 246 246 LYS C C 246 175.403 175.403 176.459 -1.056 25485 22286 1 17 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.369 1.140 25485 22287 1 17 . 1 1 246 246 LYS CB C 246 32.858 32.858 32.209 0.649 25485 22288 1 18 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.214 0.093 25485 22289 1 18 . 1 1 2 2 GLN C C 2 176.492 176.492 176.469 0.023 25485 22290 1 18 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.651 0.098 25485 22291 1 18 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.965 -0.311 25485 22292 1 18 . 1 1 3 3 GLU N N 3 121.668 121.668 123.633 -1.965 25485 22293 1 18 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.324 -0.535 25485 22294 1 18 . 1 1 3 3 GLU C C 3 176.278 176.278 177.632 -1.354 25485 22295 1 18 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.553 -0.494 25485 22296 1 18 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.773 -0.082 25485 22297 1 18 . 1 1 3 3 GLU H H 3 8.331 8.331 8.695 -0.364 25485 22298 1 18 . 1 1 4 4 ALA N N 4 124.493 124.493 125.189 -0.696 25485 22299 1 18 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.205 0.305 25485 22300 1 18 . 1 1 4 4 ALA C C 4 178.428 178.428 180.220 -1.792 25485 22301 1 18 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.551 0.126 25485 22302 1 18 . 1 1 4 4 ALA CB C 4 18.709 18.709 17.836 0.873 25485 22303 1 18 . 1 1 4 4 ALA H H 4 8.131 8.131 8.754 -0.623 25485 22304 1 18 . 1 1 5 5 GLY N N 5 108.204 108.204 108.091 0.113 25485 22305 1 18 . 1 1 5 5 GLY C C 5 174.858 174.858 175.442 -0.584 25485 22306 1 18 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.177 1.484 25485 22307 1 18 . 1 1 5 5 GLY H H 5 8.279 8.279 8.591 -0.312 25485 22308 1 18 . 1 1 6 6 GLY N N 6 108.820 108.820 108.056 0.764 25485 22309 1 18 . 1 1 6 6 GLY C C 6 174.189 174.189 173.894 0.295 25485 22310 1 18 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.456 -0.043 25485 22311 1 18 . 1 1 6 6 GLY H H 6 8.246 8.246 7.773 0.473 25485 22312 1 18 . 1 1 7 7 MET N N 7 119.938 119.938 120.817 -0.879 25485 22313 1 18 . 1 1 7 7 MET HA H 7 4.659 4.659 4.439 0.220 25485 22314 1 18 . 1 1 7 7 MET C C 7 176.191 176.191 176.658 -0.467 25485 22315 1 18 . 1 1 7 7 MET CA C 7 54.799 54.799 56.102 -1.303 25485 22316 1 18 . 1 1 7 7 MET CB C 7 33.046 33.046 33.807 -0.761 25485 22317 1 18 . 1 1 7 7 MET H H 7 8.005 8.005 7.807 0.198 25485 22318 1 18 . 1 1 8 8 SER N N 8 118.919 118.919 115.400 3.519 25485 22319 1 18 . 1 1 8 8 SER HA H 8 4.239 4.239 4.768 -0.529 25485 22320 1 18 . 1 1 8 8 SER C C 8 174.949 174.949 175.209 -0.260 25485 22321 1 18 . 1 1 8 8 SER CA C 8 58.160 58.160 56.955 1.205 25485 22322 1 18 . 1 1 8 8 SER CB C 8 65.440 65.440 64.832 0.608 25485 22323 1 18 . 1 1 8 8 SER H H 8 8.731 8.731 8.159 0.572 25485 22324 1 18 . 1 1 9 9 GLU N N 9 122.442 122.442 122.233 0.209 25485 22325 1 18 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.113 0.208 25485 22326 1 18 . 1 1 9 9 GLU C C 9 178.604 178.604 178.773 -0.169 25485 22327 1 18 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.389 0.078 25485 22328 1 18 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.695 -0.519 25485 22329 1 18 . 1 1 9 9 GLU H H 9 8.901 8.901 8.883 0.018 25485 22330 1 18 . 1 1 10 10 LEU N N 10 120.568 120.568 118.948 1.620 25485 22331 1 18 . 1 1 10 10 LEU C C 10 179.307 179.307 179.169 0.138 25485 22332 1 18 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.204 -0.724 25485 22333 1 18 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.729 -0.154 25485 22334 1 18 . 1 1 10 10 LEU H H 10 8.020 8.020 8.099 -0.079 25485 22335 1 18 . 1 1 11 11 GLN N N 11 119.930 119.930 118.815 1.115 25485 22336 1 18 . 1 1 11 11 GLN HA H 11 4.134 4.134 3.971 0.163 25485 22337 1 18 . 1 1 11 11 GLN C C 11 178.330 178.330 178.442 -0.112 25485 22338 1 18 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.299 -0.481 25485 22339 1 18 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.346 -0.482 25485 22340 1 18 . 1 1 11 11 GLN H H 11 7.811 7.811 7.786 0.025 25485 22341 1 18 . 1 1 12 12 TRP N N 12 121.031 121.031 119.957 1.074 25485 22342 1 18 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.387 0.027 25485 22343 1 18 . 1 1 12 12 TRP C C 12 178.874 178.874 178.035 0.839 25485 22344 1 18 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.143 0.364 25485 22345 1 18 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.753 -0.366 25485 22346 1 18 . 1 1 12 12 TRP H H 12 8.205 8.205 7.783 0.422 25485 22347 1 18 . 1 1 13 13 GLU N N 13 121.877 121.877 118.934 2.943 25485 22348 1 18 . 1 1 13 13 GLU C C 13 179.425 179.425 179.102 0.323 25485 22349 1 18 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.692 0.345 25485 22350 1 18 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.283 -0.361 25485 22351 1 18 . 1 1 13 13 GLU H H 13 8.434 8.434 8.360 0.074 25485 22352 1 18 . 1 1 14 14 GLN N N 14 120.449 120.449 119.328 1.121 25485 22353 1 18 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.992 0.246 25485 22354 1 18 . 1 1 14 14 GLN C C 14 179.210 179.210 178.107 1.103 25485 22355 1 18 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.859 0.023 25485 22356 1 18 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.185 -0.435 25485 22357 1 18 . 1 1 14 14 GLN H H 14 8.124 8.124 8.427 -0.303 25485 22358 1 18 . 1 1 15 15 ALA N N 15 123.114 123.114 121.476 1.638 25485 22359 1 18 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.843 0.547 25485 22360 1 18 . 1 1 15 15 ALA C C 15 179.352 179.352 179.110 0.242 25485 22361 1 18 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.127 -0.162 25485 22362 1 18 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.948 0.715 25485 22363 1 18 . 1 1 15 15 ALA H H 15 8.344 8.344 7.463 0.881 25485 22364 1 18 . 1 1 16 16 GLN N N 16 117.718 117.718 118.389 -0.671 25485 22365 1 18 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.941 -0.159 25485 22366 1 18 . 1 1 16 16 GLN C C 16 177.719 177.719 177.568 0.151 25485 22367 1 18 . 1 1 16 16 GLN CA C 16 60.281 60.281 59.170 1.111 25485 22368 1 18 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.737 -0.201 25485 22369 1 18 . 1 1 16 16 GLN H H 16 8.500 8.500 7.652 0.848 25485 22370 1 18 . 1 1 17 17 ASP N N 17 120.040 120.040 119.320 0.720 25485 22371 1 18 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.436 0.100 25485 22372 1 18 . 1 1 17 17 ASP C C 17 177.630 177.630 178.869 -1.239 25485 22373 1 18 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.064 0.741 25485 22374 1 18 . 1 1 17 17 ASP CB C 17 41.864 41.864 41.116 0.748 25485 22375 1 18 . 1 1 17 17 ASP H H 17 7.871 7.871 7.959 -0.088 25485 22376 1 18 . 1 1 18 18 TYR N N 18 122.465 122.465 119.181 3.284 25485 22377 1 18 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.221 -0.031 25485 22378 1 18 . 1 1 18 18 TYR C C 18 178.439 178.439 178.009 0.430 25485 22379 1 18 . 1 1 18 18 TYR CA C 18 61.846 61.846 59.535 2.311 25485 22380 1 18 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.135 1.805 25485 22381 1 18 . 1 1 18 18 TYR H H 18 8.244 8.244 8.320 -0.076 25485 22382 1 18 . 1 1 19 19 LEU N N 19 117.635 117.635 118.644 -1.009 25485 22383 1 18 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.837 0.295 25485 22384 1 18 . 1 1 19 19 LEU C C 19 180.940 180.940 177.785 3.155 25485 22385 1 18 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.982 0.523 25485 22386 1 18 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.700 -1.102 25485 22387 1 18 . 1 1 19 19 LEU H H 19 8.713 8.713 7.909 0.804 25485 22388 1 18 . 1 1 20 20 LYS N N 20 124.594 124.594 117.002 7.592 25485 22389 1 18 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.023 0.061 25485 22390 1 18 . 1 1 20 20 LYS C C 20 178.387 178.387 177.808 0.579 25485 22391 1 18 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.997 0.808 25485 22392 1 18 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.201 0.255 25485 22393 1 18 . 1 1 20 20 LYS H H 20 8.815 8.815 7.383 1.432 25485 22394 1 18 . 1 1 21 21 ARG N N 21 117.535 117.535 117.691 -0.156 25485 22395 1 18 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.330 -0.611 25485 22396 1 18 . 1 1 21 21 ARG C C 21 178.498 178.498 178.277 0.221 25485 22397 1 18 . 1 1 21 21 ARG CA C 21 59.244 59.244 57.778 1.466 25485 22398 1 18 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.447 -0.006 25485 22399 1 18 . 1 1 21 21 ARG H H 21 7.810 7.810 7.077 0.733 25485 22400 1 18 . 1 1 22 22 PHE N N 22 112.113 112.113 121.130 -9.017 25485 22401 1 18 . 1 1 22 22 PHE HA H 22 4.911 4.911 3.945 0.966 25485 22402 1 18 . 1 1 22 22 PHE C C 22 174.875 174.875 174.580 0.295 25485 22403 1 18 . 1 1 22 22 PHE CA C 22 57.475 57.475 61.318 -3.843 25485 22404 1 18 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.236 -0.067 25485 22405 1 18 . 1 1 22 22 PHE H H 22 8.010 8.010 7.507 0.503 25485 22406 1 18 . 1 1 23 23 TYR N N 23 116.187 116.187 115.135 1.052 25485 22407 1 18 . 1 1 23 23 TYR C C 23 173.455 173.455 175.370 -1.915 25485 22408 1 18 . 1 1 23 23 TYR CA C 23 58.427 58.427 55.281 3.146 25485 22409 1 18 . 1 1 23 23 TYR CB C 23 39.529 39.529 37.129 2.401 25485 22410 1 18 . 1 1 23 23 TYR H H 23 7.680 7.680 7.236 0.444 25485 22411 1 18 . 1 1 24 24 LEU N N 24 115.570 115.570 116.315 -0.745 25485 22412 1 18 . 1 1 24 24 LEU HA H 24 4.150 4.150 3.959 0.191 25485 22413 1 18 . 1 1 24 24 LEU C C 24 176.661 176.661 176.032 0.629 25485 22414 1 18 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.107 1.045 25485 22415 1 18 . 1 1 24 24 LEU CB C 24 36.863 36.863 41.190 -4.327 25485 22416 1 18 . 1 1 24 24 LEU H H 24 7.238 7.238 7.395 -0.157 25485 22417 1 18 . 1 1 25 25 TYR N N 25 119.901 119.901 123.250 -3.349 25485 22418 1 18 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.544 -0.185 25485 22419 1 18 . 1 1 25 25 TYR C C 25 173.784 173.784 174.754 -0.970 25485 22420 1 18 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.928 0.319 25485 22421 1 18 . 1 1 25 25 TYR CB C 25 39.079 39.079 37.933 1.146 25485 22422 1 18 . 1 1 25 25 TYR H H 25 7.845 7.845 8.513 -0.668 25485 22423 1 18 . 1 1 26 26 ASP N N 26 129.338 129.338 128.227 1.111 25485 22424 1 18 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.068 -0.617 25485 22425 1 18 . 1 1 26 26 ASP C C 26 175.282 175.282 176.342 -1.060 25485 22426 1 18 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.322 -0.889 25485 22427 1 18 . 1 1 26 26 ASP CB C 26 41.249 41.249 41.786 -0.537 25485 22428 1 18 . 1 1 26 26 ASP H H 26 8.108 8.108 7.943 0.165 25485 22429 1 18 . 1 1 27 27 SER C C 27 175.204 175.204 176.413 -1.209 25485 22430 1 18 . 1 1 27 27 SER CA C 27 59.424 59.424 60.523 -1.099 25485 22431 1 18 . 1 1 27 27 SER CB C 27 63.535 63.535 63.742 -0.207 25485 22432 1 18 . 1 1 28 28 GLU N N 28 122.058 122.058 122.174 -0.116 25485 22433 1 18 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.214 0.111 25485 22434 1 18 . 1 1 28 28 GLU C C 28 177.073 177.073 177.507 -0.434 25485 22435 1 18 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.157 -0.945 25485 22436 1 18 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.294 0.276 25485 22437 1 18 . 1 1 28 28 GLU H H 28 8.255 8.255 8.594 -0.339 25485 22438 1 18 . 1 1 29 29 THR N N 29 114.161 114.161 113.303 0.858 25485 22439 1 18 . 1 1 29 29 THR HA H 29 4.260 4.260 4.250 0.010 25485 22440 1 18 . 1 1 29 29 THR C C 29 174.591 174.591 174.392 0.199 25485 22441 1 18 . 1 1 29 29 THR CA C 29 61.976 61.976 63.549 -1.573 25485 22442 1 18 . 1 1 29 29 THR CB C 29 69.385 69.385 69.084 0.301 25485 22443 1 18 . 1 1 29 29 THR H H 29 7.498 7.498 7.552 -0.054 25485 22444 1 18 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.005 0.213 25485 22445 1 18 . 1 1 30 30 LYS H H 30 8.218 8.218 7.603 0.615 25485 22446 1 18 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.724 -0.300 25485 22447 1 18 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.613 -1.480 25485 22448 1 18 . 1 1 32 32 ALA N N 32 126.484 126.484 123.351 3.133 25485 22449 1 18 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.216 0.080 25485 22450 1 18 . 1 1 32 32 ALA C C 32 178.012 178.012 178.190 -0.178 25485 22451 1 18 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.596 -0.836 25485 22452 1 18 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.055 -0.285 25485 22453 1 18 . 1 1 32 32 ALA H H 32 8.411 8.411 8.538 -0.127 25485 22454 1 18 . 1 1 33 33 ASN N N 33 116.885 116.885 116.009 0.876 25485 22455 1 18 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.743 -0.045 25485 22456 1 18 . 1 1 33 33 ASN C C 33 176.240 176.240 177.084 -0.844 25485 22457 1 18 . 1 1 33 33 ASN CA C 33 54.187 54.187 54.480 -0.293 25485 22458 1 18 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.072 0.513 25485 22459 1 18 . 1 1 33 33 ASN H H 33 8.309 8.309 8.462 -0.153 25485 22460 1 18 . 1 1 34 34 SER N N 34 116.836 116.836 115.331 1.505 25485 22461 1 18 . 1 1 34 34 SER HA H 34 4.544 4.544 4.283 0.261 25485 22462 1 18 . 1 1 34 34 SER C C 34 175.253 175.253 176.071 -0.818 25485 22463 1 18 . 1 1 34 34 SER CA C 34 59.583 59.583 60.672 -1.089 25485 22464 1 18 . 1 1 34 34 SER CB C 34 63.919 63.919 62.744 1.175 25485 22465 1 18 . 1 1 34 34 SER H H 34 8.115 8.115 8.524 -0.409 25485 22466 1 18 . 1 1 35 35 LEU N N 35 125.355 125.355 122.482 2.873 25485 22467 1 18 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.041 -0.465 25485 22468 1 18 . 1 1 35 35 LEU C C 35 177.973 177.973 177.953 0.020 25485 22469 1 18 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.407 0.090 25485 22470 1 18 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.901 -1.209 25485 22471 1 18 . 1 1 35 35 LEU H H 35 8.312 8.312 7.643 0.669 25485 22472 1 18 . 1 1 36 36 GLU N N 36 119.201 119.201 118.919 0.282 25485 22473 1 18 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.944 -0.030 25485 22474 1 18 . 1 1 36 36 GLU C C 36 178.141 178.141 178.848 -0.707 25485 22475 1 18 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.472 0.187 25485 22476 1 18 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.099 0.214 25485 22477 1 18 . 1 1 36 36 GLU H H 36 8.225 8.225 7.818 0.407 25485 22478 1 18 . 1 1 37 37 ALA N N 37 120.746 120.746 122.142 -1.396 25485 22479 1 18 . 1 1 37 37 ALA HA H 37 4.079 4.079 3.934 0.145 25485 22480 1 18 . 1 1 37 37 ALA C C 37 181.485 181.485 179.235 2.250 25485 22481 1 18 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.157 0.302 25485 22482 1 18 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.263 -0.096 25485 22483 1 18 . 1 1 37 37 ALA H H 37 7.917 7.917 7.656 0.261 25485 22484 1 18 . 1 1 38 38 LYS N N 38 119.326 119.326 120.116 -0.790 25485 22485 1 18 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.145 0.186 25485 22486 1 18 . 1 1 38 38 LYS C C 38 177.946 177.946 178.955 -1.009 25485 22487 1 18 . 1 1 38 38 LYS CA C 38 57.704 57.704 59.104 -1.400 25485 22488 1 18 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.694 -0.894 25485 22489 1 18 . 1 1 38 38 LYS H H 38 8.216 8.216 8.108 0.108 25485 22490 1 18 . 1 1 39 39 LEU N N 39 122.736 122.736 119.225 3.511 25485 22491 1 18 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.996 -0.055 25485 22492 1 18 . 1 1 39 39 LEU C C 39 178.819 178.819 178.770 0.049 25485 22493 1 18 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.035 0.046 25485 22494 1 18 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.477 -0.849 25485 22495 1 18 . 1 1 39 39 LEU H H 39 8.666 8.666 8.525 0.141 25485 22496 1 18 . 1 1 40 40 LYS N N 40 118.411 118.411 120.090 -1.679 25485 22497 1 18 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.953 0.685 25485 22498 1 18 . 1 1 40 40 LYS C C 40 179.329 179.329 178.772 0.557 25485 22499 1 18 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.673 0.460 25485 22500 1 18 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.420 -0.635 25485 22501 1 18 . 1 1 40 40 LYS H H 40 8.227 8.227 8.214 0.013 25485 22502 1 18 . 1 1 41 41 GLU N N 41 121.329 121.329 118.483 2.846 25485 22503 1 18 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.038 0.055 25485 22504 1 18 . 1 1 41 41 GLU C C 41 178.989 178.989 178.864 0.125 25485 22505 1 18 . 1 1 41 41 GLU CA C 41 59.760 59.760 58.953 0.807 25485 22506 1 18 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.977 0.859 25485 22507 1 18 . 1 1 41 41 GLU H H 41 7.718 7.718 7.707 0.011 25485 22508 1 18 . 1 1 42 42 MET N N 42 123.817 123.817 119.565 4.252 25485 22509 1 18 . 1 1 42 42 MET HA H 42 4.107 4.107 4.252 -0.145 25485 22510 1 18 . 1 1 42 42 MET C C 42 177.719 177.719 177.636 0.083 25485 22511 1 18 . 1 1 42 42 MET CA C 42 59.912 59.912 58.723 1.189 25485 22512 1 18 . 1 1 42 42 MET CB C 42 30.506 30.506 32.496 -1.990 25485 22513 1 18 . 1 1 42 42 MET H H 42 7.657 7.657 7.456 0.201 25485 22514 1 18 . 1 1 43 43 GLN N N 43 119.998 119.998 118.195 1.803 25485 22515 1 18 . 1 1 43 43 GLN HA H 43 3.805 3.805 3.984 -0.179 25485 22516 1 18 . 1 1 43 43 GLN C C 43 177.604 177.604 178.852 -1.248 25485 22517 1 18 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.708 1.257 25485 22518 1 18 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.694 -1.139 25485 22519 1 18 . 1 1 43 43 GLN H H 43 8.910 8.910 7.607 1.303 25485 22520 1 18 . 1 1 44 44 LYS N N 44 119.165 119.165 119.422 -0.257 25485 22521 1 18 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.210 -0.155 25485 22522 1 18 . 1 1 44 44 LYS C C 44 179.991 179.991 179.185 0.806 25485 22523 1 18 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.350 1.211 25485 22524 1 18 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.048 0.250 25485 22525 1 18 . 1 1 44 44 LYS H H 44 8.507 8.507 7.505 1.002 25485 22526 1 18 . 1 1 45 45 PHE N N 45 123.602 123.602 120.218 3.384 25485 22527 1 18 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.270 -0.369 25485 22528 1 18 . 1 1 45 45 PHE C C 45 177.606 177.606 176.190 1.416 25485 22529 1 18 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.680 2.354 25485 22530 1 18 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.412 0.454 25485 22531 1 18 . 1 1 45 45 PHE H H 45 8.445 8.445 7.726 0.719 25485 22532 1 18 . 1 1 46 46 PHE N N 46 112.715 112.715 114.896 -2.181 25485 22533 1 18 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.439 0.158 25485 22534 1 18 . 1 1 46 46 PHE C C 46 175.285 175.285 177.417 -2.132 25485 22535 1 18 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.389 1.286 25485 22536 1 18 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.162 -0.703 25485 22537 1 18 . 1 1 46 46 PHE H H 46 8.272 8.272 8.420 -0.148 25485 22538 1 18 . 1 1 47 47 GLY N N 47 110.438 110.438 107.377 3.061 25485 22539 1 18 . 1 1 47 47 GLY C C 47 174.935 174.935 174.315 0.620 25485 22540 1 18 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.339 1.672 25485 22541 1 18 . 1 1 47 47 GLY H H 47 7.926 7.926 8.423 -0.497 25485 22542 1 18 . 1 1 48 48 LEU N N 48 121.830 121.830 119.143 2.687 25485 22543 1 18 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.675 0.249 25485 22544 1 18 . 1 1 48 48 LEU C C 48 174.009 174.009 175.852 -1.843 25485 22545 1 18 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.422 -1.587 25485 22546 1 18 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.927 0.536 25485 22547 1 18 . 1 1 48 48 LEU H H 48 8.762 8.762 7.609 1.153 25485 22548 1 18 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.387 -0.149 25485 22549 1 18 . 1 1 49 49 PRO C C 49 176.874 176.874 176.780 0.094 25485 22550 1 18 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.772 -0.254 25485 22551 1 18 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.889 -0.810 25485 22552 1 18 . 1 1 50 50 ILE N N 50 126.859 126.859 117.837 9.022 25485 22553 1 18 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.002 0.099 25485 22554 1 18 . 1 1 50 50 ILE C C 50 176.540 176.540 175.560 0.980 25485 22555 1 18 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.100 -1.144 25485 22556 1 18 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.108 -0.715 25485 22557 1 18 . 1 1 50 50 ILE H H 50 8.548 8.548 7.802 0.746 25485 22558 1 18 . 1 1 51 51 THR N N 51 116.443 116.443 122.521 -6.078 25485 22559 1 18 . 1 1 51 51 THR HA H 51 4.584 4.584 4.422 0.162 25485 22560 1 18 . 1 1 51 51 THR C C 51 176.672 176.672 175.518 1.154 25485 22561 1 18 . 1 1 51 51 THR CA C 51 60.979 60.979 60.634 0.345 25485 22562 1 18 . 1 1 51 51 THR CB C 51 71.505 71.505 70.216 1.289 25485 22563 1 18 . 1 1 51 51 THR H H 51 8.001 8.001 7.852 0.149 25485 22564 1 18 . 1 1 52 52 GLY N N 52 112.719 112.719 113.363 -0.644 25485 22565 1 18 . 1 1 52 52 GLY C C 52 170.609 170.609 173.737 -3.128 25485 22566 1 18 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.644 1.103 25485 22567 1 18 . 1 1 52 52 GLY H H 52 9.499 9.499 8.800 0.699 25485 22568 1 18 . 1 1 53 53 MET N N 53 116.621 116.621 117.805 -1.184 25485 22569 1 18 . 1 1 53 53 MET HA H 53 4.023 4.023 4.588 -0.565 25485 22570 1 18 . 1 1 53 53 MET C C 53 174.695 174.695 174.438 0.257 25485 22571 1 18 . 1 1 53 53 MET CA C 53 53.460 53.460 54.291 -0.831 25485 22572 1 18 . 1 1 53 53 MET CB C 53 35.408 35.408 36.365 -0.957 25485 22573 1 18 . 1 1 53 53 MET H H 53 7.993 7.993 7.304 0.689 25485 22574 1 18 . 1 1 54 54 LEU N N 54 122.679 122.679 122.096 0.583 25485 22575 1 18 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.265 -0.514 25485 22576 1 18 . 1 1 54 54 LEU C C 54 174.784 174.784 173.685 1.099 25485 22577 1 18 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.388 -0.087 25485 22578 1 18 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.880 -0.870 25485 22579 1 18 . 1 1 54 54 LEU H H 54 7.940 7.940 8.274 -0.334 25485 22580 1 18 . 1 1 55 55 ASN N N 55 115.797 115.797 118.483 -2.686 25485 22581 1 18 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.562 0.187 25485 22582 1 18 . 1 1 55 55 ASN C C 55 175.459 175.459 174.560 0.899 25485 22583 1 18 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.010 -1.167 25485 22584 1 18 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.518 1.839 25485 22585 1 18 . 1 1 55 55 ASN H H 55 6.543 6.543 8.041 -1.498 25485 22586 1 18 . 1 1 56 56 SER N N 56 121.507 121.507 116.993 4.514 25485 22587 1 18 . 1 1 56 56 SER HA H 56 4.638 4.638 4.374 0.264 25485 22588 1 18 . 1 1 56 56 SER C C 56 175.727 175.727 175.851 -0.124 25485 22589 1 18 . 1 1 56 56 SER CA C 56 57.932 57.932 59.197 -1.265 25485 22590 1 18 . 1 1 56 56 SER CB C 56 63.786 63.786 63.792 -0.006 25485 22591 1 18 . 1 1 56 56 SER H H 56 8.213 8.213 7.952 0.261 25485 22592 1 18 . 1 1 57 57 ARG N N 57 122.951 122.951 119.778 3.173 25485 22593 1 18 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.609 -0.408 25485 22594 1 18 . 1 1 57 57 ARG C C 57 178.560 178.560 178.025 0.535 25485 22595 1 18 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.261 0.171 25485 22596 1 18 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.873 -0.768 25485 22597 1 18 . 1 1 57 57 ARG H H 57 7.895 7.895 8.413 -0.518 25485 22598 1 18 . 1 1 58 58 VAL N N 58 118.778 118.778 121.675 -2.897 25485 22599 1 18 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.527 -0.196 25485 22600 1 18 . 1 1 58 58 VAL C C 58 177.370 177.370 177.855 -0.485 25485 22601 1 18 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.588 -0.206 25485 22602 1 18 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.415 0.794 25485 22603 1 18 . 1 1 58 58 VAL H H 58 7.583 7.583 7.592 -0.009 25485 22604 1 18 . 1 1 59 59 ILE N N 59 119.159 119.159 117.453 1.706 25485 22605 1 18 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.588 -0.175 25485 22606 1 18 . 1 1 59 59 ILE C C 59 177.067 177.067 177.787 -0.720 25485 22607 1 18 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.189 0.444 25485 22608 1 18 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.647 0.049 25485 22609 1 18 . 1 1 59 59 ILE H H 59 7.323 7.323 7.908 -0.585 25485 22610 1 18 . 1 1 60 60 GLU N N 60 119.367 119.367 120.437 -1.070 25485 22611 1 18 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.969 -0.231 25485 22612 1 18 . 1 1 60 60 GLU C C 60 179.978 179.978 179.289 0.689 25485 22613 1 18 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.873 -0.616 25485 22614 1 18 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.433 -0.045 25485 22615 1 18 . 1 1 60 60 GLU H H 60 7.879 7.879 7.538 0.341 25485 22616 1 18 . 1 1 61 61 ILE N N 61 118.816 118.816 118.221 0.595 25485 22617 1 18 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.937 -0.498 25485 22618 1 18 . 1 1 61 61 ILE C C 61 179.033 179.033 177.146 1.887 25485 22619 1 18 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.160 0.678 25485 22620 1 18 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.195 -1.296 25485 22621 1 18 . 1 1 61 61 ILE H H 61 7.246 7.246 7.469 -0.223 25485 22622 1 18 . 1 1 62 62 MET N N 62 119.986 119.986 116.565 3.421 25485 22623 1 18 . 1 1 62 62 MET HA H 62 3.444 3.444 4.240 -0.796 25485 22624 1 18 . 1 1 62 62 MET C C 62 176.185 176.185 177.909 -1.724 25485 22625 1 18 . 1 1 62 62 MET CA C 62 59.014 59.014 57.475 1.539 25485 22626 1 18 . 1 1 62 62 MET CB C 62 31.250 31.250 32.525 -1.275 25485 22627 1 18 . 1 1 62 62 MET H H 62 7.835 7.835 7.366 0.469 25485 22628 1 18 . 1 1 63 63 GLN N N 63 116.163 116.163 115.018 1.145 25485 22629 1 18 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.265 0.013 25485 22630 1 18 . 1 1 63 63 GLN C C 63 176.727 176.727 176.556 0.171 25485 22631 1 18 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.577 -0.438 25485 22632 1 18 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.038 0.028 25485 22633 1 18 . 1 1 63 63 GLN H H 63 7.454 7.454 7.605 -0.151 25485 22634 1 18 . 1 1 64 64 LYS N N 64 121.430 121.430 121.361 0.069 25485 22635 1 18 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.456 0.087 25485 22636 1 18 . 1 1 64 64 LYS C C 64 174.724 174.724 174.911 -0.187 25485 22637 1 18 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.243 1.274 25485 22638 1 18 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.569 -0.973 25485 22639 1 18 . 1 1 64 64 LYS H H 64 7.483 7.483 7.328 0.155 25485 22640 1 18 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.583 -2.147 25485 22641 1 18 . 1 1 65 65 PRO C C 65 176.158 176.158 175.765 0.393 25485 22642 1 18 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.335 -0.447 25485 22643 1 18 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.395 -0.562 25485 22644 1 18 . 1 1 66 66 ARG N N 66 112.697 112.697 122.394 -9.697 25485 22645 1 18 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.681 -0.273 25485 22646 1 18 . 1 1 66 66 ARG C C 66 174.478 174.478 174.367 0.111 25485 22647 1 18 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.522 -1.886 25485 22648 1 18 . 1 1 66 66 ARG CB C 66 34.673 34.673 32.017 2.655 25485 22649 1 18 . 1 1 66 66 ARG H H 66 8.146 8.146 8.604 -0.458 25485 22650 1 18 . 1 1 67 67 CYS N N 67 121.740 121.740 117.428 4.312 25485 22651 1 18 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.753 -0.313 25485 22652 1 18 . 1 1 67 67 CYS C C 67 175.659 175.659 175.358 0.301 25485 22653 1 18 . 1 1 67 67 CYS CA C 67 59.195 59.195 57.495 1.700 25485 22654 1 18 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.610 -1.404 25485 22655 1 18 . 1 1 67 67 CYS H H 67 7.757 7.757 8.229 -0.472 25485 22656 1 18 . 1 1 68 68 GLY N N 68 116.217 116.217 113.074 3.143 25485 22657 1 18 . 1 1 68 68 GLY C C 68 172.210 172.210 172.889 -0.679 25485 22658 1 18 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.748 1.811 25485 22659 1 18 . 1 1 68 68 GLY H H 68 9.704 9.704 9.174 0.530 25485 22660 1 18 . 1 1 69 69 VAL N N 69 126.372 126.372 120.617 5.755 25485 22661 1 18 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.302 -0.471 25485 22662 1 18 . 1 1 69 69 VAL C C 69 173.538 173.538 174.382 -0.844 25485 22663 1 18 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.573 2.795 25485 22664 1 18 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.045 0.478 25485 22665 1 18 . 1 1 69 69 VAL H H 69 9.113 9.113 7.494 1.619 25485 22666 1 18 . 1 1 70 70 PRO HA H 70 4.950 4.950 5.002 -0.052 25485 22667 1 18 . 1 1 70 70 PRO C C 70 175.019 175.019 176.361 -1.342 25485 22668 1 18 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.698 0.650 25485 22669 1 18 . 1 1 70 70 PRO CB C 70 32.358 32.358 33.133 -0.775 25485 22670 1 18 . 1 1 71 71 ASP N N 71 118.986 118.986 117.745 1.241 25485 22671 1 18 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.943 -0.510 25485 22672 1 18 . 1 1 71 71 ASP C C 71 175.166 175.166 175.252 -0.086 25485 22673 1 18 . 1 1 71 71 ASP CA C 71 55.368 55.368 54.261 1.107 25485 22674 1 18 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.738 -1.874 25485 22675 1 18 . 1 1 71 71 ASP H H 71 8.054 8.054 8.694 -0.640 25485 22676 1 18 . 1 1 72 72 VAL N N 72 112.953 112.953 116.061 -3.108 25485 22677 1 18 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.454 -0.158 25485 22678 1 18 . 1 1 72 72 VAL C C 72 174.330 174.330 174.403 -0.073 25485 22679 1 18 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.947 -1.302 25485 22680 1 18 . 1 1 72 72 VAL CB C 72 33.872 33.872 34.599 -0.727 25485 22681 1 18 . 1 1 72 72 VAL H H 72 6.430 6.430 7.504 -1.074 25485 22682 1 18 . 1 1 73 73 ALA N N 73 125.869 125.869 127.548 -1.679 25485 22683 1 18 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.758 -0.453 25485 22684 1 18 . 1 1 73 73 ALA C C 73 177.382 177.382 176.188 1.194 25485 22685 1 18 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.485 0.564 25485 22686 1 18 . 1 1 73 73 ALA CB C 73 19.951 19.951 21.331 -1.380 25485 22687 1 18 . 1 1 73 73 ALA H H 73 8.177 8.177 8.118 0.059 25485 22688 1 18 . 1 1 74 74 GLU N N 74 120.724 120.724 118.450 2.274 25485 22689 1 18 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.575 -0.472 25485 22690 1 18 . 1 1 74 74 GLU C C 74 176.246 176.246 175.261 0.985 25485 22691 1 18 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.385 0.407 25485 22692 1 18 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.782 -1.997 25485 22693 1 18 . 1 1 74 74 GLU H H 74 8.381 8.381 8.446 -0.065 25485 22694 1 18 . 1 1 75 75 TYR N N 75 121.473 121.473 120.584 0.889 25485 22695 1 18 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.117 0.328 25485 22696 1 18 . 1 1 75 75 TYR C C 75 175.633 175.633 174.704 0.929 25485 22697 1 18 . 1 1 75 75 TYR CA C 75 58.327 58.327 59.126 -0.798 25485 22698 1 18 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.458 -0.045 25485 22699 1 18 . 1 1 75 75 TYR H H 75 8.065 8.065 8.793 -0.728 25485 22700 1 18 . 1 1 76 76 SER N N 76 117.860 117.860 114.164 3.696 25485 22701 1 18 . 1 1 76 76 SER HA H 76 3.886 3.886 4.223 -0.337 25485 22702 1 18 . 1 1 76 76 SER C C 76 173.859 173.859 173.782 0.077 25485 22703 1 18 . 1 1 76 76 SER CA C 76 58.250 58.250 58.496 -0.246 25485 22704 1 18 . 1 1 76 76 SER CB C 76 64.117 64.117 63.199 0.918 25485 22705 1 18 . 1 1 76 76 SER H H 76 7.748 7.748 8.221 -0.473 25485 22706 1 18 . 1 1 77 77 LEU N N 77 123.789 123.789 124.997 -1.208 25485 22707 1 18 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.856 0.290 25485 22708 1 18 . 1 1 77 77 LEU C C 77 176.451 176.451 176.473 -0.022 25485 22709 1 18 . 1 1 77 77 LEU CA C 77 55.464 55.464 54.666 0.798 25485 22710 1 18 . 1 1 77 77 LEU CB C 77 41.957 41.957 39.817 2.140 25485 22711 1 18 . 1 1 77 77 LEU H H 77 7.979 7.979 8.270 -0.291 25485 22712 1 18 . 1 1 78 78 PHE N N 78 119.275 119.275 123.750 -4.475 25485 22713 1 18 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.422 0.454 25485 22714 1 18 . 1 1 78 78 PHE C C 78 173.844 173.844 174.724 -0.880 25485 22715 1 18 . 1 1 78 78 PHE CA C 78 55.372 55.372 55.236 0.136 25485 22716 1 18 . 1 1 78 78 PHE CB C 78 39.164 39.164 37.410 1.754 25485 22717 1 18 . 1 1 78 78 PHE H H 78 7.827 7.827 7.264 0.563 25485 22718 1 18 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.359 -0.003 25485 22719 1 18 . 1 1 79 79 PRO C C 79 176.433 176.433 176.397 0.036 25485 22720 1 18 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.200 1.651 25485 22721 1 18 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.608 -0.916 25485 22722 1 18 . 1 1 80 80 ASN N N 80 118.057 118.057 119.813 -1.756 25485 22723 1 18 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.498 0.149 25485 22724 1 18 . 1 1 80 80 ASN C C 80 174.305 174.305 174.916 -0.611 25485 22725 1 18 . 1 1 80 80 ASN CA C 80 52.860 52.860 54.072 -1.212 25485 22726 1 18 . 1 1 80 80 ASN CB C 80 39.583 39.583 37.136 2.447 25485 22727 1 18 . 1 1 80 80 ASN H H 80 8.068 8.068 8.541 -0.473 25485 22728 1 18 . 1 1 81 81 SER HA H 81 4.565 4.565 4.169 0.396 25485 22729 1 18 . 1 1 81 81 SER CA C 81 56.800 56.800 58.691 -1.891 25485 22730 1 18 . 1 1 81 81 SER CB C 81 63.128 63.128 63.661 -0.533 25485 22731 1 18 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.225 0.236 25485 22732 1 18 . 1 1 82 82 PRO C C 82 174.589 174.589 175.447 -0.858 25485 22733 1 18 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.544 -0.898 25485 22734 1 18 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.118 -0.864 25485 22735 1 18 . 1 1 83 83 LYS N N 83 114.578 114.578 118.280 -3.702 25485 22736 1 18 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.302 -0.149 25485 22737 1 18 . 1 1 83 83 LYS C C 83 175.308 175.308 175.823 -0.515 25485 22738 1 18 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.058 -0.651 25485 22739 1 18 . 1 1 83 83 LYS CB C 83 34.418 34.418 34.079 0.339 25485 22740 1 18 . 1 1 83 83 LYS H H 83 7.356 7.356 7.398 -0.042 25485 22741 1 18 . 1 1 84 84 TRP N N 84 122.455 122.455 121.002 1.453 25485 22742 1 18 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.552 -0.532 25485 22743 1 18 . 1 1 84 84 TRP C C 84 177.636 177.636 176.507 1.129 25485 22744 1 18 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.358 -0.887 25485 22745 1 18 . 1 1 84 84 TRP CB C 84 30.318 30.318 30.178 0.140 25485 22746 1 18 . 1 1 84 84 TRP H H 84 8.050 8.050 8.119 -0.069 25485 22747 1 18 . 1 1 85 85 THR N N 85 113.501 113.501 114.515 -1.014 25485 22748 1 18 . 1 1 85 85 THR HA H 85 4.573 4.573 4.412 0.161 25485 22749 1 18 . 1 1 85 85 THR C C 85 174.757 174.757 174.869 -0.112 25485 22750 1 18 . 1 1 85 85 THR CA C 85 62.130 62.130 61.585 0.545 25485 22751 1 18 . 1 1 85 85 THR CB C 85 69.107 69.107 69.639 -0.532 25485 22752 1 18 . 1 1 85 85 THR H H 85 8.861 8.861 8.429 0.432 25485 22753 1 18 . 1 1 86 86 SER N N 86 117.270 117.270 117.897 -0.627 25485 22754 1 18 . 1 1 86 86 SER HA H 86 4.741 4.741 4.609 0.132 25485 22755 1 18 . 1 1 86 86 SER C C 86 173.457 173.457 174.920 -1.463 25485 22756 1 18 . 1 1 86 86 SER CA C 86 56.739 56.739 58.158 -1.419 25485 22757 1 18 . 1 1 86 86 SER CB C 86 64.717 64.717 64.324 0.393 25485 22758 1 18 . 1 1 86 86 SER H H 86 7.743 7.743 8.266 -0.523 25485 22759 1 18 . 1 1 87 87 LYS N N 87 120.329 120.329 119.444 0.885 25485 22760 1 18 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.402 -0.173 25485 22761 1 18 . 1 1 87 87 LYS CA C 87 57.592 57.592 56.863 0.729 25485 22762 1 18 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.874 -0.751 25485 22763 1 18 . 1 1 87 87 LYS H H 87 8.285 8.285 8.349 -0.064 25485 22764 1 18 . 1 1 88 88 VAL N N 88 117.531 117.531 118.564 -1.033 25485 22765 1 18 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.738 -0.083 25485 22766 1 18 . 1 1 88 88 VAL C C 88 174.868 174.868 174.261 0.607 25485 22767 1 18 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.574 -0.479 25485 22768 1 18 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.392 -1.698 25485 22769 1 18 . 1 1 88 88 VAL H H 88 7.428 7.428 7.313 0.115 25485 22770 1 18 . 1 1 89 89 VAL N N 89 131.452 131.452 126.697 4.755 25485 22771 1 18 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.345 -0.186 25485 22772 1 18 . 1 1 89 89 VAL C C 89 175.758 175.758 174.673 1.085 25485 22773 1 18 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.687 0.034 25485 22774 1 18 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.613 -0.440 25485 22775 1 18 . 1 1 89 89 VAL H H 89 8.603 8.603 9.106 -0.503 25485 22776 1 18 . 1 1 90 90 THR N N 90 118.206 118.206 116.415 1.791 25485 22777 1 18 . 1 1 90 90 THR HA H 90 5.649 5.649 5.368 0.281 25485 22778 1 18 . 1 1 90 90 THR C C 90 174.579 174.579 173.682 0.897 25485 22779 1 18 . 1 1 90 90 THR CA C 90 58.959 58.959 59.523 -0.564 25485 22780 1 18 . 1 1 90 90 THR CB C 90 72.288 72.288 71.787 0.501 25485 22781 1 18 . 1 1 90 90 THR H H 90 9.021 9.021 8.332 0.689 25485 22782 1 18 . 1 1 91 91 TYR N N 91 118.117 118.117 118.175 -0.058 25485 22783 1 18 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.708 -0.010 25485 22784 1 18 . 1 1 91 91 TYR C C 91 171.233 171.233 173.110 -1.877 25485 22785 1 18 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.297 0.134 25485 22786 1 18 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.218 1.042 25485 22787 1 18 . 1 1 91 91 TYR H H 91 8.555 8.555 7.980 0.575 25485 22788 1 18 . 1 1 92 92 ARG N N 92 120.252 120.252 120.128 0.124 25485 22789 1 18 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.652 0.045 25485 22790 1 18 . 1 1 92 92 ARG C C 92 173.932 173.932 175.003 -1.071 25485 22791 1 18 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.428 0.413 25485 22792 1 18 . 1 1 92 92 ARG CB C 92 34.686 34.686 35.312 -0.626 25485 22793 1 18 . 1 1 92 92 ARG H H 92 8.520 8.520 8.890 -0.370 25485 22794 1 18 . 1 1 93 93 ILE N N 93 128.305 128.305 125.054 3.251 25485 22795 1 18 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.303 0.329 25485 22796 1 18 . 1 1 93 93 ILE C C 93 175.468 175.468 176.905 -1.437 25485 22797 1 18 . 1 1 93 93 ILE CA C 93 61.228 61.228 62.444 -1.216 25485 22798 1 18 . 1 1 93 93 ILE CB C 93 37.225 37.225 38.261 -1.036 25485 22799 1 18 . 1 1 93 93 ILE H H 93 8.886 8.886 8.746 0.140 25485 22800 1 18 . 1 1 94 94 VAL N N 94 126.647 126.647 128.363 -1.716 25485 22801 1 18 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.066 -0.070 25485 22802 1 18 . 1 1 94 94 VAL C C 94 175.670 175.670 176.240 -0.570 25485 22803 1 18 . 1 1 94 94 VAL CA C 94 63.414 63.414 64.631 -1.217 25485 22804 1 18 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.618 0.401 25485 22805 1 18 . 1 1 94 94 VAL H H 94 9.517 9.517 8.291 1.226 25485 22806 1 18 . 1 1 95 95 SER N N 95 113.398 113.398 112.094 1.304 25485 22807 1 18 . 1 1 95 95 SER HA H 95 4.701 4.701 4.532 0.169 25485 22808 1 18 . 1 1 95 95 SER C C 95 170.684 170.684 172.620 -1.936 25485 22809 1 18 . 1 1 95 95 SER CA C 95 56.945 56.945 57.609 -0.664 25485 22810 1 18 . 1 1 95 95 SER CB C 95 65.276 65.276 64.641 0.635 25485 22811 1 18 . 1 1 95 95 SER H H 95 7.463 7.463 7.633 -0.170 25485 22812 1 18 . 1 1 96 96 TYR N N 96 116.512 116.512 119.724 -3.212 25485 22813 1 18 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.861 -0.597 25485 22814 1 18 . 1 1 96 96 TYR C C 96 174.856 174.856 174.518 0.338 25485 22815 1 18 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.480 2.156 25485 22816 1 18 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.314 1.849 25485 22817 1 18 . 1 1 96 96 TYR H H 96 8.240 8.240 7.970 0.270 25485 22818 1 18 . 1 1 97 97 THR CA C 97 57.798 57.798 61.112 -3.314 25485 22819 1 18 . 1 1 97 97 THR CB C 97 67.420 67.420 69.742 -2.321 25485 22820 1 18 . 1 1 98 98 ARG N N 98 128.156 128.156 125.497 2.659 25485 22821 1 18 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.228 0.097 25485 22822 1 18 . 1 1 98 98 ARG C C 98 177.625 177.625 176.273 1.352 25485 22823 1 18 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.371 -1.157 25485 22824 1 18 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.479 0.001 25485 22825 1 18 . 1 1 98 98 ARG H H 98 8.914 8.914 8.769 0.145 25485 22826 1 18 . 1 1 99 99 ASP N N 99 120.592 120.592 117.223 3.369 25485 22827 1 18 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.635 -0.254 25485 22828 1 18 . 1 1 99 99 ASP C C 99 175.679 175.679 175.222 0.457 25485 22829 1 18 . 1 1 99 99 ASP CA C 99 56.436 56.436 55.229 1.207 25485 22830 1 18 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.392 0.978 25485 22831 1 18 . 1 1 99 99 ASP H H 99 8.708 8.708 8.153 0.555 25485 22832 1 18 . 1 1 100 100 LEU N N 100 116.829 116.829 118.889 -2.060 25485 22833 1 18 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.646 0.310 25485 22834 1 18 . 1 1 100 100 LEU C C 100 173.335 173.335 173.759 -0.424 25485 22835 1 18 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.945 -0.908 25485 22836 1 18 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.743 1.524 25485 22837 1 18 . 1 1 100 100 LEU H H 100 6.916 6.916 7.391 -0.475 25485 22838 1 18 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.078 0.097 25485 22839 1 18 . 1 1 102 102 HIS C C 102 177.649 177.649 177.297 0.352 25485 22840 1 18 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.390 -0.717 25485 22841 1 18 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.099 -1.665 25485 22842 1 18 . 1 1 103 103 ILE N N 103 115.170 115.170 118.579 -3.409 25485 22843 1 18 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.839 0.334 25485 22844 1 18 . 1 1 103 103 ILE C C 103 177.214 177.214 177.048 0.166 25485 22845 1 18 . 1 1 103 103 ILE CA C 103 63.165 63.165 63.494 -0.329 25485 22846 1 18 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.580 0.185 25485 22847 1 18 . 1 1 103 103 ILE H H 103 8.234 8.234 8.072 0.162 25485 22848 1 18 . 1 1 104 104 THR N N 104 119.374 119.374 117.275 2.099 25485 22849 1 18 . 1 1 104 104 THR HA H 104 4.045 4.045 3.953 0.092 25485 22850 1 18 . 1 1 104 104 THR C C 104 175.612 175.612 176.245 -0.633 25485 22851 1 18 . 1 1 104 104 THR CA C 104 66.568 66.568 67.027 -0.459 25485 22852 1 18 . 1 1 104 104 THR CB C 104 68.077 68.077 68.677 -0.600 25485 22853 1 18 . 1 1 104 104 THR H H 104 6.947 6.947 7.518 -0.571 25485 22854 1 18 . 1 1 105 105 VAL N N 105 123.263 123.263 120.659 2.604 25485 22855 1 18 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.123 0.315 25485 22856 1 18 . 1 1 105 105 VAL C C 105 177.322 177.322 177.027 0.295 25485 22857 1 18 . 1 1 105 105 VAL CA C 105 67.947 67.947 65.717 2.230 25485 22858 1 18 . 1 1 105 105 VAL CB C 105 31.269 31.269 30.895 0.374 25485 22859 1 18 . 1 1 105 105 VAL H H 105 7.407 7.407 8.075 -0.668 25485 22860 1 18 . 1 1 106 106 ASP N N 106 119.972 119.972 119.967 0.005 25485 22861 1 18 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.417 -0.095 25485 22862 1 18 . 1 1 106 106 ASP C C 106 179.747 179.747 178.205 1.542 25485 22863 1 18 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.595 0.640 25485 22864 1 18 . 1 1 106 106 ASP CB C 106 40.362 40.362 41.110 -0.748 25485 22865 1 18 . 1 1 106 106 ASP H H 106 8.627 8.627 8.018 0.609 25485 22866 1 18 . 1 1 107 107 ARG N N 107 121.033 121.033 118.651 2.382 25485 22867 1 18 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.106 0.072 25485 22868 1 18 . 1 1 107 107 ARG C C 107 179.485 179.485 178.584 0.901 25485 22869 1 18 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.918 0.662 25485 22870 1 18 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.722 0.486 25485 22871 1 18 . 1 1 107 107 ARG H H 107 8.356 8.356 7.985 0.371 25485 22872 1 18 . 1 1 108 108 LEU N N 108 121.463 121.463 120.956 0.507 25485 22873 1 18 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.137 0.168 25485 22874 1 18 . 1 1 108 108 LEU C C 108 178.852 178.852 178.778 0.074 25485 22875 1 18 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.582 0.300 25485 22876 1 18 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.502 -0.188 25485 22877 1 18 . 1 1 108 108 LEU H H 108 8.790 8.790 7.798 0.992 25485 22878 1 18 . 1 1 109 109 VAL N N 109 120.233 120.233 115.968 4.265 25485 22879 1 18 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.555 -0.155 25485 22880 1 18 . 1 1 109 109 VAL C C 109 177.019 177.019 177.515 -0.496 25485 22881 1 18 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.766 1.280 25485 22882 1 18 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.206 -0.017 25485 22883 1 18 . 1 1 109 109 VAL H H 109 8.787 8.787 7.583 1.204 25485 22884 1 18 . 1 1 110 110 SER N N 110 112.862 112.862 115.921 -3.059 25485 22885 1 18 . 1 1 110 110 SER HA H 110 4.300 4.300 3.845 0.455 25485 22886 1 18 . 1 1 110 110 SER C C 110 176.770 176.770 176.663 0.107 25485 22887 1 18 . 1 1 110 110 SER CA C 110 61.744 61.744 61.225 0.519 25485 22888 1 18 . 1 1 110 110 SER CB C 110 62.742 62.742 62.681 0.061 25485 22889 1 18 . 1 1 110 110 SER H H 110 7.605 7.605 7.766 -0.161 25485 22890 1 18 . 1 1 111 111 LYS N N 111 122.319 122.319 122.004 0.315 25485 22891 1 18 . 1 1 111 111 LYS HA H 111 4.061 4.061 3.973 0.088 25485 22892 1 18 . 1 1 111 111 LYS C C 111 178.309 178.309 177.453 0.856 25485 22893 1 18 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.139 0.675 25485 22894 1 18 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.492 0.017 25485 22895 1 18 . 1 1 111 111 LYS H H 111 8.156 8.156 7.866 0.290 25485 22896 1 18 . 1 1 112 112 ALA N N 112 124.147 124.147 119.381 4.766 25485 22897 1 18 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.333 -0.234 25485 22898 1 18 . 1 1 112 112 ALA C C 112 179.445 179.445 179.032 0.413 25485 22899 1 18 . 1 1 112 112 ALA CA C 112 55.226 55.226 53.874 1.352 25485 22900 1 18 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.353 0.621 25485 22901 1 18 . 1 1 112 112 ALA H H 112 8.278 8.278 7.258 1.020 25485 22902 1 18 . 1 1 113 113 LEU N N 113 116.195 116.195 120.339 -4.144 25485 22903 1 18 . 1 1 113 113 LEU HA H 113 3.751 3.751 3.956 -0.205 25485 22904 1 18 . 1 1 113 113 LEU C C 113 179.537 179.537 177.952 1.585 25485 22905 1 18 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.920 -0.176 25485 22906 1 18 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.637 -1.082 25485 22907 1 18 . 1 1 113 113 LEU H H 113 8.021 8.021 8.431 -0.410 25485 22908 1 18 . 1 1 114 114 ASN N N 114 116.570 116.570 117.732 -1.162 25485 22909 1 18 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.487 0.059 25485 22910 1 18 . 1 1 114 114 ASN C C 114 177.136 177.136 177.385 -0.249 25485 22911 1 18 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.170 -0.406 25485 22912 1 18 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.194 0.429 25485 22913 1 18 . 1 1 114 114 ASN H H 114 8.212 8.212 8.201 0.011 25485 22914 1 18 . 1 1 115 115 MET N N 115 122.055 122.055 119.247 2.808 25485 22915 1 18 . 1 1 115 115 MET HA H 115 4.010 4.010 4.113 -0.103 25485 22916 1 18 . 1 1 115 115 MET C C 115 177.681 177.681 177.854 -0.173 25485 22917 1 18 . 1 1 115 115 MET CA C 115 59.445 59.445 59.393 0.052 25485 22918 1 18 . 1 1 115 115 MET CB C 115 31.616 31.616 32.384 -0.768 25485 22919 1 18 . 1 1 115 115 MET H H 115 7.937 7.937 7.754 0.183 25485 22920 1 18 . 1 1 116 116 TRP N N 116 117.115 117.115 118.403 -1.288 25485 22921 1 18 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.395 0.123 25485 22922 1 18 . 1 1 116 116 TRP C C 116 179.054 179.054 178.868 0.186 25485 22923 1 18 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.093 0.418 25485 22924 1 18 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.764 1.109 25485 22925 1 18 . 1 1 116 116 TRP H H 116 6.783 6.783 7.548 -0.765 25485 22926 1 18 . 1 1 117 117 GLY N N 117 104.511 104.511 106.186 -1.675 25485 22927 1 18 . 1 1 117 117 GLY C C 117 175.035 175.035 175.349 -0.314 25485 22928 1 18 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.365 0.632 25485 22929 1 18 . 1 1 117 117 GLY H H 117 9.302 9.302 8.350 0.952 25485 22930 1 18 . 1 1 118 118 LYS N N 118 118.580 118.580 120.049 -1.469 25485 22931 1 18 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.083 0.124 25485 22932 1 18 . 1 1 118 118 LYS C C 118 177.235 177.235 177.069 0.166 25485 22933 1 18 . 1 1 118 118 LYS CA C 118 57.891 57.891 58.384 -0.493 25485 22934 1 18 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.951 -0.046 25485 22935 1 18 . 1 1 118 118 LYS H H 118 7.940 7.940 8.025 -0.085 25485 22936 1 18 . 1 1 119 119 GLU N N 119 113.749 113.749 117.138 -3.389 25485 22937 1 18 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.373 0.465 25485 22938 1 18 . 1 1 119 119 GLU C C 119 178.024 178.024 175.546 2.478 25485 22939 1 18 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.941 -0.666 25485 22940 1 18 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.589 1.097 25485 22941 1 18 . 1 1 119 119 GLU H H 119 7.763 7.763 7.714 0.049 25485 22942 1 18 . 1 1 120 120 ILE N N 120 111.144 111.144 112.957 -1.813 25485 22943 1 18 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.704 0.667 25485 22944 1 18 . 1 1 120 120 ILE C C 120 174.033 174.033 173.480 0.553 25485 22945 1 18 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.551 0.903 25485 22946 1 18 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.322 2.607 25485 22947 1 18 . 1 1 120 120 ILE H H 120 7.518 7.518 7.593 -0.075 25485 22948 1 18 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.366 0.296 25485 22949 1 18 . 1 1 121 121 PRO C C 121 174.784 174.784 176.938 -2.154 25485 22950 1 18 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.618 -1.603 25485 22951 1 18 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.723 -2.338 25485 22952 1 18 . 1 1 122 122 LEU N N 122 121.531 121.531 119.744 1.787 25485 22953 1 18 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.119 0.220 25485 22954 1 18 . 1 1 122 122 LEU C C 122 173.977 173.977 176.418 -2.441 25485 22955 1 18 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.548 -0.990 25485 22956 1 18 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.723 2.676 25485 22957 1 18 . 1 1 122 122 LEU H H 122 6.847 6.847 7.650 -0.803 25485 22958 1 18 . 1 1 123 123 HIS N N 123 121.054 121.054 115.335 5.719 25485 22959 1 18 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.543 0.064 25485 22960 1 18 . 1 1 123 123 HIS C C 123 172.820 172.820 172.741 0.079 25485 22961 1 18 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.413 -0.904 25485 22962 1 18 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.081 1.029 25485 22963 1 18 . 1 1 123 123 HIS H H 123 7.760 7.760 7.862 -0.102 25485 22964 1 18 . 1 1 124 124 PHE N N 124 120.465 120.465 123.341 -2.876 25485 22965 1 18 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.566 0.268 25485 22966 1 18 . 1 1 124 124 PHE C C 124 175.677 175.677 175.424 0.253 25485 22967 1 18 . 1 1 124 124 PHE CA C 124 56.292 56.292 56.514 -0.222 25485 22968 1 18 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.509 0.313 25485 22969 1 18 . 1 1 124 124 PHE H H 124 8.306 8.306 8.475 -0.169 25485 22970 1 18 . 1 1 125 125 ARG N N 125 124.008 124.008 123.983 0.025 25485 22971 1 18 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.906 -0.195 25485 22972 1 18 . 1 1 125 125 ARG C C 125 172.901 172.901 175.543 -2.642 25485 22973 1 18 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.783 -0.509 25485 22974 1 18 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.121 -0.299 25485 22975 1 18 . 1 1 125 125 ARG H H 125 8.426 8.426 9.186 -0.760 25485 22976 1 18 . 1 1 126 126 LYS N N 126 130.004 130.004 125.235 4.769 25485 22977 1 18 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.195 -0.812 25485 22978 1 18 . 1 1 126 126 LYS C C 126 176.126 176.126 175.713 0.413 25485 22979 1 18 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.927 0.254 25485 22980 1 18 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.020 0.007 25485 22981 1 18 . 1 1 126 126 LYS H H 126 8.481 8.481 8.558 -0.077 25485 22982 1 18 . 1 1 127 127 VAL N N 127 125.288 125.288 120.789 4.499 25485 22983 1 18 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.230 0.275 25485 22984 1 18 . 1 1 127 127 VAL C C 127 175.565 175.565 175.258 0.307 25485 22985 1 18 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.767 -1.818 25485 22986 1 18 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.656 1.706 25485 22987 1 18 . 1 1 127 127 VAL H H 127 8.721 8.721 7.883 0.838 25485 22988 1 18 . 1 1 128 128 VAL N N 128 117.467 117.467 119.973 -2.506 25485 22989 1 18 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.114 0.215 25485 22990 1 18 . 1 1 128 128 VAL C C 128 174.622 174.622 175.071 -0.449 25485 22991 1 18 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.518 0.600 25485 22992 1 18 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.396 0.114 25485 22993 1 18 . 1 1 128 128 VAL H H 128 8.406 8.406 8.134 0.272 25485 22994 1 18 . 1 1 129 129 TRP N N 129 119.986 119.986 121.903 -1.917 25485 22995 1 18 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.917 -0.201 25485 22996 1 18 . 1 1 129 129 TRP C C 129 174.536 174.536 176.613 -2.077 25485 22997 1 18 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.502 -0.585 25485 22998 1 18 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.450 2.564 25485 22999 1 18 . 1 1 129 129 TRP H H 129 7.435 7.435 7.294 0.141 25485 23000 1 18 . 1 1 130 130 GLY N N 130 109.900 109.900 113.175 -3.275 25485 23001 1 18 . 1 1 130 130 GLY C C 130 173.187 173.187 173.163 0.024 25485 23002 1 18 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.303 0.177 25485 23003 1 18 . 1 1 130 130 GLY H H 130 8.006 8.006 8.339 -0.333 25485 23004 1 18 . 1 1 131 131 THR N N 131 116.142 116.142 112.441 3.701 25485 23005 1 18 . 1 1 131 131 THR HA H 131 4.162 4.162 4.472 -0.310 25485 23006 1 18 . 1 1 131 131 THR C C 131 172.766 172.766 173.580 -0.814 25485 23007 1 18 . 1 1 131 131 THR CA C 131 63.212 63.212 60.955 2.257 25485 23008 1 18 . 1 1 131 131 THR CB C 131 69.308 69.308 70.424 -1.116 25485 23009 1 18 . 1 1 131 131 THR H H 131 8.233 8.233 8.209 0.024 25485 23010 1 18 . 1 1 132 132 ALA N N 132 129.807 129.807 124.206 5.601 25485 23011 1 18 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.637 -0.121 25485 23012 1 18 . 1 1 132 132 ALA C C 132 175.358 175.358 176.765 -1.407 25485 23013 1 18 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.451 -1.085 25485 23014 1 18 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.583 1.215 25485 23015 1 18 . 1 1 132 132 ALA H H 132 7.962 7.962 8.397 -0.435 25485 23016 1 18 . 1 1 133 133 ASP N N 133 122.896 122.896 120.292 2.604 25485 23017 1 18 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.646 -0.225 25485 23018 1 18 . 1 1 133 133 ASP C C 133 177.314 177.314 177.120 0.194 25485 23019 1 18 . 1 1 133 133 ASP CA C 133 57.919 57.919 57.378 0.541 25485 23020 1 18 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.648 -1.177 25485 23021 1 18 . 1 1 133 133 ASP H H 133 8.251 8.251 8.367 -0.116 25485 23022 1 18 . 1 1 134 134 ILE N N 134 125.472 125.472 119.974 5.498 25485 23023 1 18 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.503 -0.360 25485 23024 1 18 . 1 1 134 134 ILE C C 134 174.201 174.201 174.971 -0.770 25485 23025 1 18 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.120 0.151 25485 23026 1 18 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.976 -1.266 25485 23027 1 18 . 1 1 134 134 ILE H H 134 8.802 8.802 8.229 0.573 25485 23028 1 18 . 1 1 135 135 MET N N 135 127.265 127.265 124.660 2.605 25485 23029 1 18 . 1 1 135 135 MET HA H 135 5.192 5.192 5.572 -0.380 25485 23030 1 18 . 1 1 135 135 MET C C 135 176.206 176.206 175.538 0.668 25485 23031 1 18 . 1 1 135 135 MET CA C 135 53.626 53.626 52.196 1.430 25485 23032 1 18 . 1 1 135 135 MET CB C 135 32.639 32.639 35.075 -2.436 25485 23033 1 18 . 1 1 135 135 MET H H 135 7.418 7.418 8.797 -1.379 25485 23034 1 18 . 1 1 136 136 ILE N N 136 125.440 125.440 122.516 2.924 25485 23035 1 18 . 1 1 136 136 ILE HA H 136 5.589 5.589 5.010 0.579 25485 23036 1 18 . 1 1 136 136 ILE C C 136 175.190 175.190 175.882 -0.692 25485 23037 1 18 . 1 1 136 136 ILE CA C 136 60.108 60.108 59.132 0.976 25485 23038 1 18 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.922 4.019 25485 23039 1 18 . 1 1 136 136 ILE H H 136 9.124 9.124 8.868 0.256 25485 23040 1 18 . 1 1 137 137 GLY N N 137 112.211 112.211 114.260 -2.049 25485 23041 1 18 . 1 1 137 137 GLY C C 137 170.855 170.855 172.029 -1.174 25485 23042 1 18 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.143 1.262 25485 23043 1 18 . 1 1 137 137 GLY H H 137 8.594 8.594 8.166 0.428 25485 23044 1 18 . 1 1 138 138 PHE N N 138 119.463 119.463 118.207 1.256 25485 23045 1 18 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.377 0.119 25485 23046 1 18 . 1 1 138 138 PHE C C 138 175.186 175.186 174.413 0.773 25485 23047 1 18 . 1 1 138 138 PHE CA C 138 55.995 55.995 53.743 2.252 25485 23048 1 18 . 1 1 138 138 PHE CB C 138 41.442 41.442 40.744 0.698 25485 23049 1 18 . 1 1 138 138 PHE H H 138 7.857 7.857 8.147 -0.290 25485 23050 1 18 . 1 1 139 139 ALA N N 139 123.914 123.914 125.044 -1.130 25485 23051 1 18 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.517 0.214 25485 23052 1 18 . 1 1 139 139 ALA C C 139 174.613 174.613 175.666 -1.053 25485 23053 1 18 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.461 -1.426 25485 23054 1 18 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.912 1.560 25485 23055 1 18 . 1 1 139 139 ALA H H 139 8.955 8.955 9.106 -0.151 25485 23056 1 18 . 1 1 140 140 ARG N N 140 118.339 118.339 120.240 -1.901 25485 23057 1 18 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.831 0.275 25485 23058 1 18 . 1 1 140 140 ARG C C 140 176.201 176.201 178.317 -2.116 25485 23059 1 18 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.911 -0.745 25485 23060 1 18 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.604 0.865 25485 23061 1 18 . 1 1 140 140 ARG H H 140 8.546 8.546 8.448 0.098 25485 23062 1 18 . 1 1 141 141 GLY N N 141 108.916 108.916 108.640 0.276 25485 23063 1 18 . 1 1 141 141 GLY C C 141 175.595 175.595 174.889 0.706 25485 23064 1 18 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.108 -0.818 25485 23065 1 18 . 1 1 141 141 GLY H H 141 8.989 8.989 9.286 -0.297 25485 23066 1 18 . 1 1 142 142 ALA N N 142 121.448 121.448 121.251 0.197 25485 23067 1 18 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.306 0.102 25485 23068 1 18 . 1 1 142 142 ALA C C 142 177.027 177.027 177.351 -0.324 25485 23069 1 18 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.392 0.885 25485 23070 1 18 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.043 -0.079 25485 23071 1 18 . 1 1 142 142 ALA H H 142 8.642 8.642 8.200 0.442 25485 23072 1 18 . 1 1 143 143 HIS N N 143 120.356 120.356 115.732 4.624 25485 23073 1 18 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.595 0.562 25485 23074 1 18 . 1 1 143 143 HIS C C 143 174.303 174.303 175.787 -1.484 25485 23075 1 18 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.558 -0.105 25485 23076 1 18 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.308 -1.516 25485 23077 1 18 . 1 1 143 143 HIS H H 143 8.990 8.990 8.339 0.651 25485 23078 1 18 . 1 1 144 144 GLY N N 144 112.517 112.517 107.333 5.184 25485 23079 1 18 . 1 1 144 144 GLY C C 144 173.758 173.758 173.342 0.416 25485 23080 1 18 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.700 1.395 25485 23081 1 18 . 1 1 144 144 GLY H H 144 5.175 5.175 7.842 -2.667 25485 23082 1 18 . 1 1 145 145 ASP N N 145 117.762 117.762 118.595 -0.833 25485 23083 1 18 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.688 0.010 25485 23084 1 18 . 1 1 145 145 ASP C C 145 175.851 175.851 174.963 0.888 25485 23085 1 18 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.668 -0.709 25485 23086 1 18 . 1 1 145 145 ASP CB C 145 41.799 41.799 43.171 -1.372 25485 23087 1 18 . 1 1 145 145 ASP H H 145 7.096 7.096 7.407 -0.311 25485 23088 1 18 . 1 1 146 146 SER N N 146 125.540 125.540 115.802 9.738 25485 23089 1 18 . 1 1 146 146 SER HA H 146 4.204 4.204 4.239 -0.035 25485 23090 1 18 . 1 1 146 146 SER C C 146 172.319 172.319 173.431 -1.112 25485 23091 1 18 . 1 1 146 146 SER CA C 146 58.862 58.862 58.612 0.250 25485 23092 1 18 . 1 1 146 146 SER CB C 146 62.933 62.933 63.221 -0.288 25485 23093 1 18 . 1 1 146 146 SER H H 146 8.261 8.261 8.108 0.152 25485 23094 1 18 . 1 1 147 147 TYR N N 147 120.757 120.757 114.840 5.917 25485 23095 1 18 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.185 0.637 25485 23096 1 18 . 1 1 147 147 TYR C C 147 170.372 170.372 173.789 -3.417 25485 23097 1 18 . 1 1 147 147 TYR CA C 147 53.268 53.268 56.416 -3.148 25485 23098 1 18 . 1 1 147 147 TYR CB C 147 38.296 38.296 36.559 1.737 25485 23099 1 18 . 1 1 147 147 TYR H H 147 7.450 7.450 8.070 -0.620 25485 23100 1 18 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.244 0.628 25485 23101 1 18 . 1 1 148 148 PRO C C 148 179.009 179.009 176.422 2.587 25485 23102 1 18 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.186 1.189 25485 23103 1 18 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.143 -1.234 25485 23104 1 18 . 1 1 149 149 PHE N N 149 120.514 120.514 118.547 1.967 25485 23105 1 18 . 1 1 149 149 PHE C C 149 176.813 176.813 175.805 1.008 25485 23106 1 18 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.269 -0.816 25485 23107 1 18 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.489 0.084 25485 23108 1 18 . 1 1 149 149 PHE H H 149 8.024 8.024 7.477 0.547 25485 23109 1 18 . 1 1 150 150 ASP N N 150 115.555 115.555 117.399 -1.844 25485 23110 1 18 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.320 0.519 25485 23111 1 18 . 1 1 150 150 ASP C C 150 177.007 177.007 175.839 1.168 25485 23112 1 18 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.732 -0.861 25485 23113 1 18 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.478 2.458 25485 23114 1 18 . 1 1 150 150 ASP H H 150 7.511 7.511 7.961 -0.450 25485 23115 1 18 . 1 1 151 151 GLY N N 151 110.650 110.650 108.979 1.671 25485 23116 1 18 . 1 1 151 151 GLY C C 151 170.281 170.281 172.261 -1.980 25485 23117 1 18 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.587 -0.189 25485 23118 1 18 . 1 1 151 151 GLY H H 151 9.080 9.080 8.271 0.809 25485 23119 1 18 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.357 -0.301 25485 23120 1 18 . 1 1 152 152 PRO C C 152 178.300 178.300 176.706 1.594 25485 23121 1 18 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.286 0.564 25485 23122 1 18 . 1 1 152 152 PRO CB C 152 31.260 31.260 32.154 -0.893 25485 23123 1 18 . 1 1 153 153 GLY N N 153 118.783 118.783 111.856 6.927 25485 23124 1 18 . 1 1 153 153 GLY C C 153 174.098 174.098 173.164 0.934 25485 23125 1 18 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.481 -0.875 25485 23126 1 18 . 1 1 153 153 GLY H H 153 11.431 11.431 8.388 3.043 25485 23127 1 18 . 1 1 154 154 ASN N N 154 120.679 120.679 123.090 -2.411 25485 23128 1 18 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.464 -0.220 25485 23129 1 18 . 1 1 154 154 ASN C C 154 174.636 174.636 174.593 0.043 25485 23130 1 18 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.664 2.004 25485 23131 1 18 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.627 -1.657 25485 23132 1 18 . 1 1 154 154 ASN H H 154 9.247 9.247 8.578 0.669 25485 23133 1 18 . 1 1 155 155 THR N N 155 118.252 118.252 111.231 7.021 25485 23134 1 18 . 1 1 155 155 THR HA H 155 5.577 5.577 3.916 1.661 25485 23135 1 18 . 1 1 155 155 THR C C 155 176.596 176.596 173.173 3.423 25485 23136 1 18 . 1 1 155 155 THR CA C 155 61.731 61.731 63.003 -1.272 25485 23137 1 18 . 1 1 155 155 THR CB C 155 71.325 71.325 68.558 2.767 25485 23138 1 18 . 1 1 155 155 THR H H 155 9.501 9.501 8.467 1.034 25485 23139 1 18 . 1 1 156 156 LEU N N 156 122.598 122.598 121.774 0.824 25485 23140 1 18 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.933 -0.062 25485 23141 1 18 . 1 1 156 156 LEU C C 156 175.655 175.655 176.327 -0.672 25485 23142 1 18 . 1 1 156 156 LEU CA C 156 55.538 55.538 55.759 -0.221 25485 23143 1 18 . 1 1 156 156 LEU CB C 156 44.511 44.511 43.614 0.897 25485 23144 1 18 . 1 1 156 156 LEU H H 156 8.492 8.492 8.199 0.293 25485 23145 1 18 . 1 1 157 157 ALA N N 157 115.389 115.389 116.745 -1.356 25485 23146 1 18 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.463 0.572 25485 23147 1 18 . 1 1 157 157 ALA C C 157 175.739 175.739 174.879 0.860 25485 23148 1 18 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.320 -0.381 25485 23149 1 18 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.571 1.883 25485 23150 1 18 . 1 1 157 157 ALA H H 157 7.567 7.567 7.606 -0.039 25485 23151 1 18 . 1 1 158 158 HIS N N 158 111.900 111.900 118.174 -6.274 25485 23152 1 18 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.802 -0.197 25485 23153 1 18 . 1 1 158 158 HIS C C 158 170.186 170.186 172.266 -2.080 25485 23154 1 18 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.224 1.851 25485 23155 1 18 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.415 -1.229 25485 23156 1 18 . 1 1 158 158 HIS H H 158 8.757 8.757 8.045 0.712 25485 23157 1 18 . 1 1 159 159 ALA N N 159 118.286 118.286 126.537 -8.251 25485 23158 1 18 . 1 1 159 159 ALA HA H 159 4.654 4.654 3.937 0.717 25485 23159 1 18 . 1 1 159 159 ALA C C 159 174.036 174.036 175.223 -1.187 25485 23160 1 18 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.549 0.584 25485 23161 1 18 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.534 2.503 25485 23162 1 18 . 1 1 159 159 ALA H H 159 6.110 6.110 8.268 -2.158 25485 23163 1 18 . 1 1 160 160 PHE N N 160 117.937 117.937 119.081 -1.144 25485 23164 1 18 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.907 -0.404 25485 23165 1 18 . 1 1 160 160 PHE C C 160 174.455 174.455 174.473 -0.018 25485 23166 1 18 . 1 1 160 160 PHE CA C 160 56.813 56.813 54.852 1.961 25485 23167 1 18 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.327 0.868 25485 23168 1 18 . 1 1 160 160 PHE H H 160 7.912 7.912 7.658 0.254 25485 23169 1 18 . 1 1 161 161 ALA N N 161 123.531 123.531 121.136 2.395 25485 23170 1 18 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.738 -0.247 25485 23171 1 18 . 1 1 161 161 ALA C C 161 175.503 175.503 175.725 -0.222 25485 23172 1 18 . 1 1 161 161 ALA CA C 161 50.633 50.633 48.798 1.835 25485 23173 1 18 . 1 1 161 161 ALA CB C 161 16.556 16.556 20.108 -3.552 25485 23174 1 18 . 1 1 161 161 ALA H H 161 8.107 8.107 8.480 -0.373 25485 23175 1 18 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.883 -0.973 25485 23176 1 18 . 1 1 162 162 PRO C C 162 173.465 173.465 176.002 -2.537 25485 23177 1 18 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.397 1.860 25485 23178 1 18 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.594 1.648 25485 23179 1 18 . 1 1 163 163 GLY N N 163 107.206 107.206 110.561 -3.355 25485 23180 1 18 . 1 1 163 163 GLY C C 163 172.092 172.092 173.712 -1.620 25485 23181 1 18 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.891 -0.898 25485 23182 1 18 . 1 1 163 163 GLY H H 163 5.997 5.997 7.727 -1.730 25485 23183 1 18 . 1 1 165 165 GLY N N 165 103.110 103.110 108.596 -5.486 25485 23184 1 18 . 1 1 165 165 GLY C C 165 177.158 177.158 173.762 3.396 25485 23185 1 18 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.213 -0.970 25485 23186 1 18 . 1 1 165 165 GLY H H 165 9.145 9.145 8.078 1.067 25485 23187 1 18 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.338 -0.159 25485 23188 1 18 . 1 1 166 166 LEU C C 166 176.437 176.437 177.421 -0.984 25485 23189 1 18 . 1 1 166 166 LEU CA C 166 56.200 56.200 56.145 0.055 25485 23190 1 18 . 1 1 166 166 LEU CB C 166 41.834 41.834 40.896 0.938 25485 23191 1 18 . 1 1 167 167 GLY N N 167 103.318 103.318 107.227 -3.909 25485 23192 1 18 . 1 1 167 167 GLY C C 167 174.803 174.803 175.427 -0.624 25485 23193 1 18 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.639 2.594 25485 23194 1 18 . 1 1 167 167 GLY H H 167 7.768 7.768 7.536 0.232 25485 23195 1 18 . 1 1 168 168 GLY N N 168 121.051 121.051 106.846 14.205 25485 23196 1 18 . 1 1 168 168 GLY C C 168 172.122 172.122 174.061 -1.939 25485 23197 1 18 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.529 1.073 25485 23198 1 18 . 1 1 168 168 GLY H H 168 7.698 7.698 8.513 -0.815 25485 23199 1 18 . 1 1 169 169 ASP N N 169 123.641 123.641 120.189 3.452 25485 23200 1 18 . 1 1 169 169 ASP C C 169 173.942 173.942 173.825 0.117 25485 23201 1 18 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.359 2.483 25485 23202 1 18 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.680 -2.810 25485 23203 1 18 . 1 1 169 169 ASP H H 169 8.595 8.595 7.810 0.785 25485 23204 1 18 . 1 1 170 170 ALA N N 170 119.366 119.366 119.442 -0.076 25485 23205 1 18 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.424 0.306 25485 23206 1 18 . 1 1 170 170 ALA C C 170 174.593 174.593 175.167 -0.574 25485 23207 1 18 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.856 0.268 25485 23208 1 18 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.437 0.898 25485 23209 1 18 . 1 1 170 170 ALA H H 170 8.324 8.324 8.422 -0.098 25485 23210 1 18 . 1 1 171 171 HIS N N 171 120.239 120.239 120.701 -0.462 25485 23211 1 18 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.633 0.115 25485 23212 1 18 . 1 1 171 171 HIS C C 171 172.949 172.949 173.951 -1.002 25485 23213 1 18 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.324 -2.600 25485 23214 1 18 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.746 0.795 25485 23215 1 18 . 1 1 171 171 HIS H H 171 8.499 8.499 7.655 0.844 25485 23216 1 18 . 1 1 172 172 PHE N N 172 121.125 121.125 118.253 2.872 25485 23217 1 18 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.497 0.031 25485 23218 1 18 . 1 1 172 172 PHE C C 172 173.875 173.875 173.725 0.150 25485 23219 1 18 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.932 -0.012 25485 23220 1 18 . 1 1 172 172 PHE CB C 172 41.903 41.903 42.780 -0.877 25485 23221 1 18 . 1 1 172 172 PHE H H 172 8.445 8.445 8.226 0.219 25485 23222 1 18 . 1 1 173 173 ASP N N 173 124.014 124.014 122.511 1.503 25485 23223 1 18 . 1 1 173 173 ASP HA H 173 3.914 3.914 5.320 -1.406 25485 23224 1 18 . 1 1 173 173 ASP C C 173 178.613 178.613 177.880 0.733 25485 23225 1 18 . 1 1 173 173 ASP CA C 173 54.798 54.798 52.934 1.863 25485 23226 1 18 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.248 -0.505 25485 23227 1 18 . 1 1 173 173 ASP H H 173 7.927 7.927 8.738 -0.811 25485 23228 1 18 . 1 1 174 174 GLU N N 174 132.469 132.469 127.205 5.264 25485 23229 1 18 . 1 1 174 174 GLU C C 174 176.442 176.442 177.226 -0.784 25485 23230 1 18 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.648 -1.464 25485 23231 1 18 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.307 0.978 25485 23232 1 18 . 1 1 174 174 GLU H H 174 9.528 9.528 8.646 0.882 25485 23233 1 18 . 1 1 175 175 ASP N N 175 117.394 117.394 119.510 -2.116 25485 23234 1 18 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.576 0.217 25485 23235 1 18 . 1 1 175 175 ASP C C 175 176.645 176.645 176.206 0.439 25485 23236 1 18 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.766 0.165 25485 23237 1 18 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.454 -1.313 25485 23238 1 18 . 1 1 175 175 ASP H H 175 8.768 8.768 8.617 0.151 25485 23239 1 18 . 1 1 176 176 GLU N N 176 116.493 116.493 117.437 -0.944 25485 23240 1 18 . 1 1 176 176 GLU C C 176 175.038 175.038 175.490 -0.452 25485 23241 1 18 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.476 -1.811 25485 23242 1 18 . 1 1 176 176 GLU CB C 176 26.223 26.223 31.093 -4.870 25485 23243 1 18 . 1 1 176 176 GLU H H 176 7.159 7.159 7.793 -0.634 25485 23244 1 18 . 1 1 177 177 ARG N N 177 122.186 122.186 119.344 2.842 25485 23245 1 18 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.341 0.348 25485 23246 1 18 . 1 1 177 177 ARG C C 177 174.482 174.482 174.562 -0.080 25485 23247 1 18 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.347 -1.660 25485 23248 1 18 . 1 1 177 177 ARG CB C 177 29.084 29.084 31.146 -2.062 25485 23249 1 18 . 1 1 177 177 ARG H H 177 7.560 7.560 8.197 -0.637 25485 23250 1 18 . 1 1 178 178 TRP N N 178 129.179 129.179 125.443 3.736 25485 23251 1 18 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.437 -0.337 25485 23252 1 18 . 1 1 178 178 TRP C C 178 176.298 176.298 176.101 0.197 25485 23253 1 18 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.011 0.802 25485 23254 1 18 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.631 -0.434 25485 23255 1 18 . 1 1 178 178 TRP H H 178 8.807 8.807 8.570 0.237 25485 23256 1 18 . 1 1 179 179 THR N N 179 112.792 112.792 111.431 1.361 25485 23257 1 18 . 1 1 179 179 THR HA H 179 4.985 4.985 4.796 0.189 25485 23258 1 18 . 1 1 179 179 THR C C 179 172.765 172.765 172.470 0.295 25485 23259 1 18 . 1 1 179 179 THR CA C 179 59.106 59.106 60.389 -1.283 25485 23260 1 18 . 1 1 179 179 THR CB C 179 71.786 71.786 72.219 -0.433 25485 23261 1 18 . 1 1 179 179 THR H H 179 8.974 8.974 8.429 0.545 25485 23262 1 18 . 1 1 180 180 ASP N N 180 122.074 122.074 121.363 0.711 25485 23263 1 18 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.258 -0.795 25485 23264 1 18 . 1 1 180 180 ASP C C 180 176.366 176.366 178.028 -1.662 25485 23265 1 18 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.612 -2.569 25485 23266 1 18 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.784 -1.056 25485 23267 1 18 . 1 1 180 180 ASP H H 180 8.485 8.485 8.470 0.015 25485 23268 1 18 . 1 1 181 181 GLY N N 181 110.123 110.123 107.822 2.301 25485 23269 1 18 . 1 1 181 181 GLY C C 181 174.325 174.325 175.194 -0.869 25485 23270 1 18 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.094 1.567 25485 23271 1 18 . 1 1 181 181 GLY H H 181 8.569 8.569 8.065 0.504 25485 23272 1 18 . 1 1 182 182 SER N N 182 115.562 115.562 114.268 1.294 25485 23273 1 18 . 1 1 182 182 SER HA H 182 4.519 4.519 4.561 -0.042 25485 23274 1 18 . 1 1 182 182 SER C C 182 173.783 173.783 174.026 -0.243 25485 23275 1 18 . 1 1 182 182 SER CA C 182 57.965 57.965 57.924 0.041 25485 23276 1 18 . 1 1 182 182 SER CB C 182 64.166 64.166 63.939 0.227 25485 23277 1 18 . 1 1 182 182 SER H H 182 8.160 8.160 7.841 0.319 25485 23278 1 18 . 1 1 183 183 SER N N 183 117.153 117.153 115.308 1.845 25485 23279 1 18 . 1 1 183 183 SER HA H 183 4.275 4.275 4.207 0.068 25485 23280 1 18 . 1 1 183 183 SER C C 183 173.333 173.333 174.263 -0.930 25485 23281 1 18 . 1 1 183 183 SER CA C 183 59.902 59.902 59.145 0.757 25485 23282 1 18 . 1 1 183 183 SER CB C 183 64.941 64.941 61.865 3.076 25485 23283 1 18 . 1 1 183 183 SER H H 183 7.796 7.796 8.215 -0.419 25485 23284 1 18 . 1 1 184 184 LEU N N 184 122.351 122.351 120.082 2.269 25485 23285 1 18 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.269 0.123 25485 23286 1 18 . 1 1 184 184 LEU C C 184 176.250 176.250 177.136 -0.886 25485 23287 1 18 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.882 -0.307 25485 23288 1 18 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.173 -0.092 25485 23289 1 18 . 1 1 184 184 LEU H H 184 8.092 8.092 8.363 -0.271 25485 23290 1 18 . 1 1 185 185 GLY N N 185 108.871 108.871 106.117 2.754 25485 23291 1 18 . 1 1 185 185 GLY C C 185 172.375 172.375 173.876 -1.501 25485 23292 1 18 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.724 -0.344 25485 23293 1 18 . 1 1 185 185 GLY H H 185 7.960 7.960 7.488 0.472 25485 23294 1 18 . 1 1 186 186 ILE N N 186 123.096 123.096 123.059 0.037 25485 23295 1 18 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.129 -0.288 25485 23296 1 18 . 1 1 186 186 ILE C C 186 175.350 175.350 175.601 -0.251 25485 23297 1 18 . 1 1 186 186 ILE CA C 186 58.401 58.401 58.814 -0.413 25485 23298 1 18 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.132 0.324 25485 23299 1 18 . 1 1 186 186 ILE H H 186 8.893 8.893 7.927 0.966 25485 23300 1 18 . 1 1 187 187 ASN N N 187 127.167 127.167 127.085 0.082 25485 23301 1 18 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.871 -0.518 25485 23302 1 18 . 1 1 187 187 ASN C C 187 175.849 175.849 176.880 -1.031 25485 23303 1 18 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.059 1.655 25485 23304 1 18 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.676 0.454 25485 23305 1 18 . 1 1 187 187 ASN H H 187 8.580 8.580 8.170 0.410 25485 23306 1 18 . 1 1 188 188 PHE N N 188 129.985 129.985 127.926 2.059 25485 23307 1 18 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.271 0.302 25485 23308 1 18 . 1 1 188 188 PHE C C 188 175.578 175.578 177.172 -1.594 25485 23309 1 18 . 1 1 188 188 PHE CA C 188 61.728 61.728 61.894 -0.166 25485 23310 1 18 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.509 -0.077 25485 23311 1 18 . 1 1 188 188 PHE H H 188 9.361 9.361 9.645 -0.284 25485 23312 1 18 . 1 1 189 189 LEU N N 189 119.113 119.113 119.518 -0.405 25485 23313 1 18 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.140 -0.339 25485 23314 1 18 . 1 1 189 189 LEU C C 189 179.601 179.601 178.927 0.674 25485 23315 1 18 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.521 -0.012 25485 23316 1 18 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.225 -1.348 25485 23317 1 18 . 1 1 189 189 LEU H H 189 8.562 8.562 7.976 0.586 25485 23318 1 18 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.929 -0.012 25485 23319 1 18 . 1 1 190 190 TYR C C 190 177.621 177.621 178.572 -0.951 25485 23320 1 18 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.816 -0.008 25485 23321 1 18 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.211 2.558 25485 23322 1 18 . 1 1 191 191 ALA N N 191 120.352 120.352 121.904 -1.552 25485 23323 1 18 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.038 0.277 25485 23324 1 18 . 1 1 191 191 ALA C C 191 180.252 180.252 178.933 1.319 25485 23325 1 18 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.892 0.289 25485 23326 1 18 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.282 0.860 25485 23327 1 18 . 1 1 191 191 ALA H H 191 7.993 7.993 9.072 -1.079 25485 23328 1 18 . 1 1 192 192 ALA N N 192 121.409 121.409 120.623 0.786 25485 23329 1 18 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.138 -0.081 25485 23330 1 18 . 1 1 192 192 ALA C C 192 178.575 178.575 179.229 -0.654 25485 23331 1 18 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.896 -0.711 25485 23332 1 18 . 1 1 192 192 ALA CB C 192 16.198 16.198 17.881 -1.683 25485 23333 1 18 . 1 1 192 192 ALA H H 192 9.297 9.297 8.005 1.292 25485 23334 1 18 . 1 1 193 193 THR N N 193 116.996 116.996 114.341 2.655 25485 23335 1 18 . 1 1 193 193 THR HA H 193 3.833 3.833 4.169 -0.336 25485 23336 1 18 . 1 1 193 193 THR CA C 193 69.138 69.138 67.218 1.920 25485 23337 1 18 . 1 1 193 193 THR CB C 193 67.365 67.365 68.182 -0.817 25485 23338 1 18 . 1 1 193 193 THR H H 193 8.226 8.226 7.767 0.459 25485 23339 1 18 . 1 1 194 194 HIS N N 194 120.296 120.296 121.686 -1.390 25485 23340 1 18 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.062 0.174 25485 23341 1 18 . 1 1 194 194 HIS C C 194 175.962 175.962 176.982 -1.020 25485 23342 1 18 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.365 1.382 25485 23343 1 18 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.880 -1.961 25485 23344 1 18 . 1 1 194 194 HIS H H 194 7.782 7.782 7.713 0.069 25485 23345 1 18 . 1 1 195 195 ALA N N 195 121.290 121.290 122.737 -1.447 25485 23346 1 18 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.977 0.179 25485 23347 1 18 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.900 1.064 25485 23348 1 18 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.651 0.059 25485 23349 1 18 . 1 1 195 195 ALA H H 195 8.690 8.690 8.352 0.338 25485 23350 1 18 . 1 1 196 196 LEU N N 196 114.899 114.899 118.414 -3.515 25485 23351 1 18 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.085 0.085 25485 23352 1 18 . 1 1 196 196 LEU C C 196 177.946 177.946 179.931 -1.985 25485 23353 1 18 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.528 -1.300 25485 23354 1 18 . 1 1 196 196 LEU CB C 196 39.776 39.776 40.902 -1.126 25485 23355 1 18 . 1 1 196 196 LEU H H 196 8.715 8.715 8.987 -0.272 25485 23356 1 18 . 1 1 197 197 GLY N N 197 107.901 107.901 106.105 1.796 25485 23357 1 18 . 1 1 197 197 GLY C C 197 178.641 178.641 175.181 3.460 25485 23358 1 18 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.979 0.588 25485 23359 1 18 . 1 1 197 197 GLY H H 197 7.546 7.546 8.178 -0.632 25485 23360 1 18 . 1 1 198 198 HIS N N 198 122.017 122.017 119.432 2.585 25485 23361 1 18 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.447 0.410 25485 23362 1 18 . 1 1 198 198 HIS C C 198 179.874 179.874 178.209 1.665 25485 23363 1 18 . 1 1 198 198 HIS CA C 198 58.522 58.522 58.321 0.201 25485 23364 1 18 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.537 -1.991 25485 23365 1 18 . 1 1 198 198 HIS H H 198 7.196 7.196 7.312 -0.116 25485 23366 1 18 . 1 1 199 199 SER N N 199 118.486 118.486 115.050 3.436 25485 23367 1 18 . 1 1 199 199 SER HA H 199 4.490 4.490 4.596 -0.106 25485 23368 1 18 . 1 1 199 199 SER C C 199 174.493 174.493 175.571 -1.078 25485 23369 1 18 . 1 1 199 199 SER CA C 199 58.173 58.173 60.870 -2.697 25485 23370 1 18 . 1 1 199 199 SER CB C 199 63.589 63.589 63.271 0.318 25485 23371 1 18 . 1 1 199 199 SER H H 199 7.884 7.884 7.926 -0.042 25485 23372 1 18 . 1 1 200 200 LEU N N 200 114.686 114.686 117.898 -3.212 25485 23373 1 18 . 1 1 200 200 LEU C C 200 177.720 177.720 177.389 0.331 25485 23374 1 18 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.603 0.234 25485 23375 1 18 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.952 0.405 25485 23376 1 18 . 1 1 200 200 LEU H H 200 7.108 7.108 7.071 0.037 25485 23377 1 18 . 1 1 201 201 GLY N N 201 108.363 108.363 106.657 1.706 25485 23378 1 18 . 1 1 201 201 GLY C C 201 174.008 174.008 174.823 -0.815 25485 23379 1 18 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.546 -1.132 25485 23380 1 18 . 1 1 201 201 GLY H H 201 8.195 8.195 7.476 0.719 25485 23381 1 18 . 1 1 202 202 MET N N 202 119.635 119.635 121.678 -2.043 25485 23382 1 18 . 1 1 202 202 MET HA H 202 4.473 4.473 4.391 0.082 25485 23383 1 18 . 1 1 202 202 MET C C 202 176.593 176.593 175.275 1.318 25485 23384 1 18 . 1 1 202 202 MET CA C 202 54.500 54.500 55.677 -1.177 25485 23385 1 18 . 1 1 202 202 MET CB C 202 32.161 32.161 33.350 -1.189 25485 23386 1 18 . 1 1 202 202 MET H H 202 8.182 8.182 7.293 0.889 25485 23387 1 18 . 1 1 203 203 GLY N N 203 109.749 109.749 113.492 -3.743 25485 23388 1 18 . 1 1 203 203 GLY C C 203 174.042 174.042 173.488 0.554 25485 23389 1 18 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.491 -0.487 25485 23390 1 18 . 1 1 203 203 GLY H H 203 8.405 8.405 8.445 -0.040 25485 23391 1 18 . 1 1 204 204 HIS N N 204 115.732 115.732 118.650 -2.918 25485 23392 1 18 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.429 0.971 25485 23393 1 18 . 1 1 204 204 HIS C C 204 174.430 174.430 174.640 -0.210 25485 23394 1 18 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.735 -1.921 25485 23395 1 18 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.227 -0.401 25485 23396 1 18 . 1 1 204 204 HIS H H 204 8.364 8.364 8.540 -0.176 25485 23397 1 18 . 1 1 205 205 SER N N 205 115.484 115.484 116.319 -0.835 25485 23398 1 18 . 1 1 205 205 SER HA H 205 4.766 4.766 4.708 0.058 25485 23399 1 18 . 1 1 205 205 SER C C 205 173.611 173.611 174.804 -1.193 25485 23400 1 18 . 1 1 205 205 SER CA C 205 54.729 54.729 57.618 -2.889 25485 23401 1 18 . 1 1 205 205 SER CB C 205 65.855 65.855 65.766 0.089 25485 23402 1 18 . 1 1 205 205 SER H H 205 7.231 7.231 8.346 -1.115 25485 23403 1 18 . 1 1 206 206 SER N N 206 119.263 119.263 117.789 1.474 25485 23404 1 18 . 1 1 206 206 SER HA H 206 3.701 3.701 4.563 -0.862 25485 23405 1 18 . 1 1 206 206 SER C C 206 173.635 173.635 174.112 -0.477 25485 23406 1 18 . 1 1 206 206 SER CA C 206 63.846 63.846 59.188 4.658 25485 23407 1 18 . 1 1 206 206 SER CB C 206 63.764 63.764 63.880 -0.116 25485 23408 1 18 . 1 1 206 206 SER H H 206 8.289 8.289 8.714 -0.425 25485 23409 1 18 . 1 1 207 207 ASP N N 207 126.646 126.646 122.973 3.673 25485 23410 1 18 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.694 0.235 25485 23411 1 18 . 1 1 207 207 ASP C C 207 174.614 174.614 175.351 -0.737 25485 23412 1 18 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.750 -1.478 25485 23413 1 18 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.306 -1.018 25485 23414 1 18 . 1 1 207 207 ASP H H 207 8.541 8.541 7.964 0.577 25485 23415 1 18 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.389 0.398 25485 23416 1 18 . 1 1 208 208 PRO C C 208 177.467 177.467 175.519 1.948 25485 23417 1 18 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.914 -1.078 25485 23418 1 18 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.641 -0.044 25485 23419 1 18 . 1 1 209 209 ASN N N 209 116.020 116.020 114.056 1.964 25485 23420 1 18 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.672 -0.031 25485 23421 1 18 . 1 1 209 209 ASN C C 209 174.695 174.695 174.355 0.340 25485 23422 1 18 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.194 2.026 25485 23423 1 18 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.371 0.739 25485 23424 1 18 . 1 1 209 209 ASN H H 209 8.350 8.350 7.825 0.525 25485 23425 1 18 . 1 1 210 210 ALA N N 210 124.892 124.892 122.687 2.205 25485 23426 1 18 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.400 -0.305 25485 23427 1 18 . 1 1 210 210 ALA C C 210 179.495 179.495 178.211 1.284 25485 23428 1 18 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.781 1.273 25485 23429 1 18 . 1 1 210 210 ALA CB C 210 19.199 19.199 21.075 -1.876 25485 23430 1 18 . 1 1 210 210 ALA H H 210 8.193 8.193 7.074 1.119 25485 23431 1 18 . 1 1 211 211 VAL N N 211 130.402 130.402 122.231 8.171 25485 23432 1 18 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.785 0.478 25485 23433 1 18 . 1 1 211 211 VAL C C 211 179.408 179.408 176.452 2.956 25485 23434 1 18 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.860 0.192 25485 23435 1 18 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.027 -1.044 25485 23436 1 18 . 1 1 211 211 VAL H H 211 11.592 11.592 8.779 2.813 25485 23437 1 18 . 1 1 212 212 MET N N 212 113.285 113.285 114.040 -0.755 25485 23438 1 18 . 1 1 212 212 MET C C 212 176.996 176.996 174.809 2.187 25485 23439 1 18 . 1 1 212 212 MET CA C 212 53.614 53.614 54.541 -0.927 25485 23440 1 18 . 1 1 212 212 MET CB C 212 26.975 26.975 31.189 -4.214 25485 23441 1 18 . 1 1 212 212 MET H H 212 7.724 7.724 7.545 0.179 25485 23442 1 18 . 1 1 213 213 TYR N N 213 129.919 129.919 123.855 6.064 25485 23443 1 18 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.464 1.232 25485 23444 1 18 . 1 1 213 213 TYR C C 213 178.411 178.411 175.048 3.363 25485 23445 1 18 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.150 -0.019 25485 23446 1 18 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.456 0.710 25485 23447 1 18 . 1 1 213 213 TYR H H 213 7.902 7.902 7.295 0.607 25485 23448 1 18 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.440 -0.965 25485 23449 1 18 . 1 1 214 214 PRO C C 214 177.694 177.694 176.717 0.977 25485 23450 1 18 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.073 1.956 25485 23451 1 18 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.563 1.260 25485 23452 1 18 . 1 1 215 215 THR N N 215 104.450 104.450 115.956 -11.506 25485 23453 1 18 . 1 1 215 215 THR HA H 215 4.444 4.444 4.265 0.179 25485 23454 1 18 . 1 1 215 215 THR C C 215 173.429 173.429 173.125 0.304 25485 23455 1 18 . 1 1 215 215 THR CA C 215 60.528 60.528 61.403 -0.875 25485 23456 1 18 . 1 1 215 215 THR CB C 215 69.614 69.614 67.342 2.272 25485 23457 1 18 . 1 1 215 215 THR H H 215 6.407 6.407 7.423 -1.016 25485 23458 1 18 . 1 1 216 216 TYR N N 216 124.618 124.618 125.477 -0.859 25485 23459 1 18 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.414 -0.182 25485 23460 1 18 . 1 1 216 216 TYR C C 216 175.669 175.669 174.770 0.899 25485 23461 1 18 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.576 0.011 25485 23462 1 18 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.473 2.418 25485 23463 1 18 . 1 1 216 216 TYR H H 216 8.331 8.331 7.955 0.376 25485 23464 1 18 . 1 1 217 217 GLY N N 217 116.089 116.089 115.667 0.422 25485 23465 1 18 . 1 1 217 217 GLY C C 217 173.560 173.560 174.043 -0.483 25485 23466 1 18 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.780 0.538 25485 23467 1 18 . 1 1 217 217 GLY H H 217 7.695 7.695 8.647 -0.952 25485 23468 1 18 . 1 1 218 218 ASN N N 218 120.167 120.167 121.276 -1.109 25485 23469 1 18 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.616 0.050 25485 23470 1 18 . 1 1 218 218 ASN C C 218 175.343 175.343 176.257 -0.914 25485 23471 1 18 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.907 -0.292 25485 23472 1 18 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.562 -0.016 25485 23473 1 18 . 1 1 218 218 ASN H H 218 8.237 8.237 8.314 -0.077 25485 23474 1 18 . 1 1 219 219 GLY N N 219 109.322 109.322 106.730 2.592 25485 23475 1 18 . 1 1 219 219 GLY C C 219 172.842 172.842 174.207 -1.365 25485 23476 1 18 . 1 1 219 219 GLY CA C 219 44.718 44.718 45.105 -0.387 25485 23477 1 18 . 1 1 219 219 GLY H H 219 8.027 8.027 8.442 -0.415 25485 23478 1 18 . 1 1 220 220 ASP N N 220 123.006 123.006 124.272 -1.266 25485 23479 1 18 . 1 1 220 220 ASP H H 220 8.273 8.273 8.248 0.025 25485 23480 1 18 . 1 1 221 221 PRO C C 221 177.138 177.138 177.089 0.049 25485 23481 1 18 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.525 -5.462 25485 23482 1 18 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.835 -1.139 25485 23483 1 18 . 1 1 222 222 GLN N N 222 116.718 116.718 118.507 -1.789 25485 23484 1 18 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.165 0.171 25485 23485 1 18 . 1 1 222 222 GLN C C 222 176.321 176.321 177.976 -1.655 25485 23486 1 18 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.402 -1.259 25485 23487 1 18 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.021 0.476 25485 23488 1 18 . 1 1 222 222 GLN H H 222 8.240 8.240 8.652 -0.412 25485 23489 1 18 . 1 1 223 223 ASN N N 223 118.368 118.368 116.012 2.356 25485 23490 1 18 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.804 0.112 25485 23491 1 18 . 1 1 223 223 ASN C C 223 173.271 173.271 174.937 -1.666 25485 23492 1 18 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.026 -0.430 25485 23493 1 18 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.942 -0.727 25485 23494 1 18 . 1 1 223 223 ASN H H 223 7.946 7.946 8.233 -0.287 25485 23495 1 18 . 1 1 224 224 PHE N N 224 118.429 118.429 118.173 0.256 25485 23496 1 18 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.274 0.177 25485 23497 1 18 . 1 1 224 224 PHE C C 224 172.897 172.897 173.290 -0.393 25485 23498 1 18 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.913 0.496 25485 23499 1 18 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.671 1.030 25485 23500 1 18 . 1 1 224 224 PHE H H 224 6.992 6.992 7.806 -0.814 25485 23501 1 18 . 1 1 225 225 LYS N N 225 121.714 121.714 123.831 -2.117 25485 23502 1 18 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.819 0.611 25485 23503 1 18 . 1 1 225 225 LYS C C 225 174.664 174.664 174.270 0.394 25485 23504 1 18 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.678 0.634 25485 23505 1 18 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.052 0.675 25485 23506 1 18 . 1 1 225 225 LYS H H 225 7.709 7.709 8.025 -0.316 25485 23507 1 18 . 1 1 226 226 LEU N N 226 119.026 119.026 120.729 -1.703 25485 23508 1 18 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.068 0.072 25485 23509 1 18 . 1 1 226 226 LEU C C 226 177.495 177.495 177.240 0.255 25485 23510 1 18 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.340 0.259 25485 23511 1 18 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.712 -0.431 25485 23512 1 18 . 1 1 226 226 LEU H H 226 8.015 8.015 8.097 -0.082 25485 23513 1 18 . 1 1 227 227 SER N N 227 120.320 120.320 116.497 3.823 25485 23514 1 18 . 1 1 227 227 SER HA H 227 4.600 4.600 4.514 0.085 25485 23515 1 18 . 1 1 227 227 SER C C 227 175.492 175.492 175.558 -0.066 25485 23516 1 18 . 1 1 227 227 SER CA C 227 57.239 57.239 57.208 0.031 25485 23517 1 18 . 1 1 227 227 SER CB C 227 66.278 66.278 65.433 0.845 25485 23518 1 18 . 1 1 227 227 SER H H 227 9.654 9.654 8.276 1.378 25485 23519 1 18 . 1 1 228 228 GLN N N 228 127.511 127.511 124.876 2.635 25485 23520 1 18 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.943 0.751 25485 23521 1 18 . 1 1 228 228 GLN H H 228 8.248 8.248 8.753 -0.505 25485 23522 1 18 . 1 1 229 229 ASP N N 229 124.358 124.358 118.487 5.871 25485 23523 1 18 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.359 0.015 25485 23524 1 18 . 1 1 229 229 ASP C C 229 178.793 178.793 178.438 0.355 25485 23525 1 18 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.627 0.515 25485 23526 1 18 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.305 2.937 25485 23527 1 18 . 1 1 229 229 ASP H H 229 8.138 8.138 8.591 -0.453 25485 23528 1 18 . 1 1 230 230 ASP N N 230 119.694 119.694 120.177 -0.483 25485 23529 1 18 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.526 -0.104 25485 23530 1 18 . 1 1 230 230 ASP C C 230 177.736 177.736 178.357 -0.621 25485 23531 1 18 . 1 1 230 230 ASP CA C 230 57.922 57.922 56.832 1.090 25485 23532 1 18 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.902 2.334 25485 23533 1 18 . 1 1 230 230 ASP H H 230 7.393 7.393 7.612 -0.219 25485 23534 1 18 . 1 1 231 231 ILE N N 231 120.364 120.364 119.735 0.629 25485 23535 1 18 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.731 -0.066 25485 23536 1 18 . 1 1 231 231 ILE C C 231 177.631 177.631 177.918 -0.287 25485 23537 1 18 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.349 0.150 25485 23538 1 18 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.069 0.445 25485 23539 1 18 . 1 1 231 231 ILE H H 231 8.115 8.115 7.873 0.242 25485 23540 1 18 . 1 1 232 232 LYS N N 232 119.156 119.156 119.751 -0.595 25485 23541 1 18 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.053 0.061 25485 23542 1 18 . 1 1 232 232 LYS C C 232 180.574 180.574 178.967 1.607 25485 23543 1 18 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.644 -0.084 25485 23544 1 18 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.793 0.004 25485 23545 1 18 . 1 1 232 232 LYS H H 232 8.607 8.607 8.225 0.382 25485 23546 1 18 . 1 1 233 233 GLY N N 233 106.425 106.425 108.138 -1.713 25485 23547 1 18 . 1 1 233 233 GLY C C 233 176.098 176.098 175.892 0.206 25485 23548 1 18 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.808 0.829 25485 23549 1 18 . 1 1 233 233 GLY H H 233 8.075 8.075 7.890 0.185 25485 23550 1 18 . 1 1 234 234 ILE N N 234 125.119 125.119 121.602 3.517 25485 23551 1 18 . 1 1 234 234 ILE C C 234 178.231 178.231 177.166 1.065 25485 23552 1 18 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.378 -1.785 25485 23553 1 18 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.265 -0.719 25485 23554 1 18 . 1 1 234 234 ILE H H 234 8.539 8.539 7.590 0.949 25485 23555 1 18 . 1 1 235 235 GLN N N 235 122.877 122.877 118.791 4.086 25485 23556 1 18 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.083 0.274 25485 23557 1 18 . 1 1 235 235 GLN C C 235 180.105 180.105 178.305 1.800 25485 23558 1 18 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.397 -1.510 25485 23559 1 18 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.434 -0.897 25485 23560 1 18 . 1 1 235 235 GLN H H 235 8.296 8.296 8.029 0.267 25485 23561 1 18 . 1 1 236 236 LYS N N 236 123.678 123.678 118.870 4.808 25485 23562 1 18 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.343 -0.261 25485 23563 1 18 . 1 1 236 236 LYS C C 236 178.169 178.169 177.364 0.805 25485 23564 1 18 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.475 0.901 25485 23565 1 18 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.781 0.197 25485 23566 1 18 . 1 1 236 236 LYS H H 236 8.024 8.024 7.573 0.451 25485 23567 1 18 . 1 1 237 237 LEU N N 237 116.873 116.873 119.802 -2.929 25485 23568 1 18 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.341 -0.354 25485 23569 1 18 . 1 1 237 237 LEU C C 237 177.893 177.893 178.096 -0.203 25485 23570 1 18 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.801 0.638 25485 23571 1 18 . 1 1 237 237 LEU CB C 237 43.613 43.613 43.166 0.447 25485 23572 1 18 . 1 1 237 237 LEU H H 237 6.888 6.888 7.661 -0.773 25485 23573 1 18 . 1 1 238 238 TYR N N 238 112.237 112.237 117.585 -5.348 25485 23574 1 18 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.513 0.138 25485 23575 1 18 . 1 1 238 238 TYR C C 238 176.082 176.082 176.912 -0.830 25485 23576 1 18 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.414 -0.778 25485 23577 1 18 . 1 1 238 238 TYR CB C 238 41.398 41.398 40.043 1.355 25485 23578 1 18 . 1 1 238 238 TYR H H 238 7.445 7.445 8.875 -1.430 25485 23579 1 18 . 1 1 239 239 GLY N N 239 110.906 110.906 105.872 5.034 25485 23580 1 18 . 1 1 239 239 GLY C C 239 171.269 171.269 172.651 -1.382 25485 23581 1 18 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.169 -1.283 25485 23582 1 18 . 1 1 239 239 GLY H H 239 8.443 8.443 7.985 0.458 25485 23583 1 18 . 1 1 240 240 LYS N N 240 114.281 114.281 122.552 -8.271 25485 23584 1 18 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.547 0.191 25485 23585 1 18 . 1 1 240 240 LYS C C 240 177.527 177.527 175.132 2.395 25485 23586 1 18 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.977 -1.019 25485 23587 1 18 . 1 1 240 240 LYS CB C 240 34.275 34.275 32.577 1.698 25485 23588 1 18 . 1 1 240 240 LYS H H 240 7.873 7.873 8.499 -0.626 25485 23589 1 18 . 1 1 241 241 ARG N N 241 123.758 123.758 124.015 -0.257 25485 23590 1 18 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.527 -0.530 25485 23591 1 18 . 1 1 241 241 ARG C C 241 176.026 176.026 174.034 1.992 25485 23592 1 18 . 1 1 241 241 ARG CA C 241 57.492 57.492 55.226 2.266 25485 23593 1 18 . 1 1 241 241 ARG CB C 241 30.371 30.371 32.960 -2.589 25485 23594 1 18 . 1 1 241 241 ARG H H 241 7.742 7.742 8.475 -0.733 25485 23595 1 18 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.639 -0.299 25485 23596 1 18 . 1 1 246 246 LYS C C 246 175.403 175.403 175.115 0.288 25485 23597 1 18 . 1 1 246 246 LYS CA C 246 56.509 56.509 55.529 0.980 25485 23598 1 18 . 1 1 246 246 LYS CB C 246 32.858 32.858 33.463 -0.605 25485 23599 1 19 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.614 -0.307 25485 23600 1 19 . 1 1 2 2 GLN C C 2 176.492 176.492 175.941 0.551 25485 23601 1 19 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.148 0.601 25485 23602 1 19 . 1 1 2 2 GLN CB C 2 28.654 28.654 29.115 -0.461 25485 23603 1 19 . 1 1 3 3 GLU N N 3 121.668 121.668 122.876 -1.208 25485 23604 1 19 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.292 -0.503 25485 23605 1 19 . 1 1 3 3 GLU C C 3 176.278 176.278 177.640 -1.362 25485 23606 1 19 . 1 1 3 3 GLU CA C 3 57.059 57.059 56.952 0.107 25485 23607 1 19 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.664 0.027 25485 23608 1 19 . 1 1 3 3 GLU H H 3 8.331 8.331 8.697 -0.366 25485 23609 1 19 . 1 1 4 4 ALA N N 4 124.493 124.493 125.124 -0.631 25485 23610 1 19 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.199 0.311 25485 23611 1 19 . 1 1 4 4 ALA C C 4 178.428 178.428 180.161 -1.733 25485 23612 1 19 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.317 0.360 25485 23613 1 19 . 1 1 4 4 ALA CB C 4 18.709 18.709 17.898 0.811 25485 23614 1 19 . 1 1 4 4 ALA H H 4 8.131 8.131 8.542 -0.411 25485 23615 1 19 . 1 1 5 5 GLY N N 5 108.204 108.204 107.831 0.373 25485 23616 1 19 . 1 1 5 5 GLY C C 5 174.858 174.858 175.423 -0.565 25485 23617 1 19 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.044 1.617 25485 23618 1 19 . 1 1 5 5 GLY H H 5 8.279 8.279 8.565 -0.286 25485 23619 1 19 . 1 1 6 6 GLY N N 6 108.820 108.820 107.494 1.326 25485 23620 1 19 . 1 1 6 6 GLY C C 6 174.189 174.189 174.141 0.048 25485 23621 1 19 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.254 0.159 25485 23622 1 19 . 1 1 6 6 GLY H H 6 8.246 8.246 7.885 0.361 25485 23623 1 19 . 1 1 7 7 MET N N 7 119.938 119.938 119.495 0.443 25485 23624 1 19 . 1 1 7 7 MET HA H 7 4.659 4.659 4.404 0.255 25485 23625 1 19 . 1 1 7 7 MET C C 7 176.191 176.191 176.346 -0.155 25485 23626 1 19 . 1 1 7 7 MET CA C 7 54.799 54.799 56.855 -2.056 25485 23627 1 19 . 1 1 7 7 MET CB C 7 33.046 33.046 33.458 -0.412 25485 23628 1 19 . 1 1 7 7 MET H H 7 8.005 8.005 7.581 0.424 25485 23629 1 19 . 1 1 8 8 SER N N 8 118.919 118.919 115.550 3.369 25485 23630 1 19 . 1 1 8 8 SER HA H 8 4.239 4.239 4.750 -0.511 25485 23631 1 19 . 1 1 8 8 SER C C 8 174.949 174.949 174.763 0.186 25485 23632 1 19 . 1 1 8 8 SER CA C 8 58.160 58.160 56.959 1.201 25485 23633 1 19 . 1 1 8 8 SER CB C 8 65.440 65.440 64.941 0.499 25485 23634 1 19 . 1 1 8 8 SER H H 8 8.731 8.731 8.724 0.007 25485 23635 1 19 . 1 1 9 9 GLU N N 9 122.442 122.442 122.063 0.379 25485 23636 1 19 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.104 0.217 25485 23637 1 19 . 1 1 9 9 GLU C C 9 178.604 178.604 178.733 -0.129 25485 23638 1 19 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.787 -0.320 25485 23639 1 19 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.551 -0.375 25485 23640 1 19 . 1 1 9 9 GLU H H 9 8.901 8.901 8.889 0.012 25485 23641 1 19 . 1 1 10 10 LEU N N 10 120.568 120.568 118.862 1.706 25485 23642 1 19 . 1 1 10 10 LEU C C 10 179.307 179.307 179.032 0.275 25485 23643 1 19 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.081 -0.601 25485 23644 1 19 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.796 -0.221 25485 23645 1 19 . 1 1 10 10 LEU H H 10 8.020 8.020 8.155 -0.135 25485 23646 1 19 . 1 1 11 11 GLN N N 11 119.930 119.930 118.371 1.559 25485 23647 1 19 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.002 0.132 25485 23648 1 19 . 1 1 11 11 GLN C C 11 178.330 178.330 178.537 -0.207 25485 23649 1 19 . 1 1 11 11 GLN CA C 11 58.818 58.818 59.409 -0.591 25485 23650 1 19 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.339 -0.475 25485 23651 1 19 . 1 1 11 11 GLN H H 11 7.811 7.811 7.774 0.037 25485 23652 1 19 . 1 1 12 12 TRP N N 12 121.031 121.031 120.347 0.684 25485 23653 1 19 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.375 0.039 25485 23654 1 19 . 1 1 12 12 TRP C C 12 178.874 178.874 178.178 0.696 25485 23655 1 19 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.291 0.216 25485 23656 1 19 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.624 -0.237 25485 23657 1 19 . 1 1 12 12 TRP H H 12 8.205 8.205 7.838 0.367 25485 23658 1 19 . 1 1 13 13 GLU N N 13 121.877 121.877 119.249 2.628 25485 23659 1 19 . 1 1 13 13 GLU C C 13 179.425 179.425 179.227 0.198 25485 23660 1 19 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.497 0.540 25485 23661 1 19 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.360 -0.438 25485 23662 1 19 . 1 1 13 13 GLU H H 13 8.434 8.434 8.294 0.140 25485 23663 1 19 . 1 1 14 14 GLN N N 14 120.449 120.449 119.085 1.364 25485 23664 1 19 . 1 1 14 14 GLN HA H 14 4.238 4.238 4.044 0.194 25485 23665 1 19 . 1 1 14 14 GLN C C 14 179.210 179.210 178.135 1.075 25485 23666 1 19 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.911 -0.029 25485 23667 1 19 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.808 -1.058 25485 23668 1 19 . 1 1 14 14 GLN H H 14 8.124 8.124 8.125 -0.001 25485 23669 1 19 . 1 1 15 15 ALA N N 15 123.114 123.114 121.030 2.084 25485 23670 1 19 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.904 0.486 25485 23671 1 19 . 1 1 15 15 ALA C C 15 179.352 179.352 179.254 0.098 25485 23672 1 19 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.104 -0.139 25485 23673 1 19 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.790 0.873 25485 23674 1 19 . 1 1 15 15 ALA H H 15 8.344 8.344 7.814 0.530 25485 23675 1 19 . 1 1 16 16 GLN N N 16 117.718 117.718 117.737 -0.019 25485 23676 1 19 . 1 1 16 16 GLN HA H 16 3.782 3.782 4.069 -0.287 25485 23677 1 19 . 1 1 16 16 GLN C C 16 177.719 177.719 177.691 0.028 25485 23678 1 19 . 1 1 16 16 GLN CA C 16 60.281 60.281 59.348 0.933 25485 23679 1 19 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.535 0.001 25485 23680 1 19 . 1 1 16 16 GLN H H 16 8.500 8.500 7.812 0.688 25485 23681 1 19 . 1 1 17 17 ASP N N 17 120.040 120.040 118.474 1.566 25485 23682 1 19 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.425 0.111 25485 23683 1 19 . 1 1 17 17 ASP C C 17 177.630 177.630 178.161 -0.531 25485 23684 1 19 . 1 1 17 17 ASP CA C 17 57.805 57.805 56.742 1.063 25485 23685 1 19 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.618 1.246 25485 23686 1 19 . 1 1 17 17 ASP H H 17 7.871 7.871 7.622 0.249 25485 23687 1 19 . 1 1 18 18 TYR N N 18 122.465 122.465 122.491 -0.026 25485 23688 1 19 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.069 0.121 25485 23689 1 19 . 1 1 18 18 TYR C C 18 178.439 178.439 177.218 1.221 25485 23690 1 19 . 1 1 18 18 TYR CA C 18 61.846 61.846 61.588 0.258 25485 23691 1 19 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.692 1.248 25485 23692 1 19 . 1 1 18 18 TYR H H 18 8.244 8.244 8.449 -0.205 25485 23693 1 19 . 1 1 19 19 LEU N N 19 117.635 117.635 118.961 -1.326 25485 23694 1 19 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.142 -0.010 25485 23695 1 19 . 1 1 19 19 LEU C C 19 180.940 180.940 177.951 2.989 25485 23696 1 19 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.784 0.721 25485 23697 1 19 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.846 -1.248 25485 23698 1 19 . 1 1 19 19 LEU H H 19 8.713 8.713 8.380 0.333 25485 23699 1 19 . 1 1 20 20 LYS N N 20 124.594 124.594 118.069 6.525 25485 23700 1 19 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.096 -0.012 25485 23701 1 19 . 1 1 20 20 LYS C C 20 178.387 178.387 178.260 0.127 25485 23702 1 19 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.952 0.853 25485 23703 1 19 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.315 0.141 25485 23704 1 19 . 1 1 20 20 LYS H H 20 8.815 8.815 7.564 1.251 25485 23705 1 19 . 1 1 21 21 ARG N N 21 117.535 117.535 118.432 -0.897 25485 23706 1 19 . 1 1 21 21 ARG HA H 21 3.719 3.719 3.915 -0.196 25485 23707 1 19 . 1 1 21 21 ARG C C 21 178.498 178.498 178.674 -0.176 25485 23708 1 19 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.391 0.853 25485 23709 1 19 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.410 0.031 25485 23710 1 19 . 1 1 21 21 ARG H H 21 7.810 7.810 7.301 0.509 25485 23711 1 19 . 1 1 22 22 PHE N N 22 112.113 112.113 120.291 -8.178 25485 23712 1 19 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.009 0.902 25485 23713 1 19 . 1 1 22 22 PHE C C 22 174.875 174.875 174.175 0.700 25485 23714 1 19 . 1 1 22 22 PHE CA C 22 57.475 57.475 59.325 -1.850 25485 23715 1 19 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.056 0.113 25485 23716 1 19 . 1 1 22 22 PHE H H 22 8.010 8.010 7.418 0.592 25485 23717 1 19 . 1 1 23 23 TYR N N 23 116.187 116.187 114.964 1.223 25485 23718 1 19 . 1 1 23 23 TYR C C 23 173.455 173.455 175.756 -2.301 25485 23719 1 19 . 1 1 23 23 TYR CA C 23 58.427 58.427 59.617 -1.190 25485 23720 1 19 . 1 1 23 23 TYR CB C 23 39.529 39.529 40.709 -1.180 25485 23721 1 19 . 1 1 23 23 TYR H H 23 7.680 7.680 7.184 0.495 25485 23722 1 19 . 1 1 24 24 LEU N N 24 115.570 115.570 113.881 1.689 25485 23723 1 19 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.537 -0.387 25485 23724 1 19 . 1 1 24 24 LEU C C 24 176.661 176.661 174.800 1.861 25485 23725 1 19 . 1 1 24 24 LEU CA C 24 56.152 56.152 54.236 1.917 25485 23726 1 19 . 1 1 24 24 LEU CB C 24 36.863 36.863 46.291 -9.428 25485 23727 1 19 . 1 1 24 24 LEU H H 24 7.238 7.238 7.712 -0.474 25485 23728 1 19 . 1 1 25 25 TYR N N 25 119.901 119.901 122.041 -2.140 25485 23729 1 19 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.633 -0.274 25485 23730 1 19 . 1 1 25 25 TYR C C 25 173.784 173.784 174.298 -0.514 25485 23731 1 19 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.377 0.870 25485 23732 1 19 . 1 1 25 25 TYR CB C 25 39.079 39.079 38.388 0.691 25485 23733 1 19 . 1 1 25 25 TYR H H 25 7.845 7.845 8.665 -0.820 25485 23734 1 19 . 1 1 26 26 ASP N N 26 129.338 129.338 125.965 3.373 25485 23735 1 19 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.001 -0.550 25485 23736 1 19 . 1 1 26 26 ASP C C 26 175.282 175.282 176.144 -0.862 25485 23737 1 19 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.297 -0.864 25485 23738 1 19 . 1 1 26 26 ASP CB C 26 41.249 41.249 43.167 -1.918 25485 23739 1 19 . 1 1 26 26 ASP H H 26 8.108 8.108 8.006 0.102 25485 23740 1 19 . 1 1 27 27 SER C C 27 175.204 175.204 176.298 -1.094 25485 23741 1 19 . 1 1 27 27 SER CA C 27 59.424 59.424 59.875 -0.451 25485 23742 1 19 . 1 1 27 27 SER CB C 27 63.535 63.535 63.498 0.037 25485 23743 1 19 . 1 1 28 28 GLU N N 28 122.058 122.058 121.810 0.248 25485 23744 1 19 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.172 0.153 25485 23745 1 19 . 1 1 28 28 GLU C C 28 177.073 177.073 177.201 -0.128 25485 23746 1 19 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.882 -1.670 25485 23747 1 19 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.757 -0.187 25485 23748 1 19 . 1 1 28 28 GLU H H 28 8.255 8.255 8.467 -0.212 25485 23749 1 19 . 1 1 29 29 THR N N 29 114.161 114.161 111.613 2.548 25485 23750 1 19 . 1 1 29 29 THR HA H 29 4.260 4.260 4.434 -0.174 25485 23751 1 19 . 1 1 29 29 THR C C 29 174.591 174.591 173.743 0.848 25485 23752 1 19 . 1 1 29 29 THR CA C 29 61.976 61.976 61.833 0.143 25485 23753 1 19 . 1 1 29 29 THR CB C 29 69.385 69.385 68.680 0.705 25485 23754 1 19 . 1 1 29 29 THR H H 29 7.498 7.498 7.719 -0.221 25485 23755 1 19 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.098 0.120 25485 23756 1 19 . 1 1 30 30 LYS H H 30 8.218 8.218 7.403 0.815 25485 23757 1 19 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.717 -0.293 25485 23758 1 19 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.817 -1.684 25485 23759 1 19 . 1 1 32 32 ALA N N 32 126.484 126.484 123.650 2.834 25485 23760 1 19 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.249 0.047 25485 23761 1 19 . 1 1 32 32 ALA C C 32 178.012 178.012 178.662 -0.650 25485 23762 1 19 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.352 -0.593 25485 23763 1 19 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.183 -0.413 25485 23764 1 19 . 1 1 32 32 ALA H H 32 8.411 8.411 8.679 -0.268 25485 23765 1 19 . 1 1 33 33 ASN N N 33 116.885 116.885 116.167 0.718 25485 23766 1 19 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.629 0.069 25485 23767 1 19 . 1 1 33 33 ASN C C 33 176.240 176.240 177.172 -0.932 25485 23768 1 19 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.352 -1.165 25485 23769 1 19 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.580 0.005 25485 23770 1 19 . 1 1 33 33 ASN H H 33 8.309 8.309 8.437 -0.128 25485 23771 1 19 . 1 1 34 34 SER N N 34 116.836 116.836 116.676 0.160 25485 23772 1 19 . 1 1 34 34 SER HA H 34 4.544 4.544 4.220 0.324 25485 23773 1 19 . 1 1 34 34 SER C C 34 175.253 175.253 176.156 -0.903 25485 23774 1 19 . 1 1 34 34 SER CA C 34 59.583 59.583 60.846 -1.263 25485 23775 1 19 . 1 1 34 34 SER CB C 34 63.919 63.919 62.831 1.088 25485 23776 1 19 . 1 1 34 34 SER H H 34 8.115 8.115 8.314 -0.199 25485 23777 1 19 . 1 1 35 35 LEU N N 35 125.355 125.355 121.865 3.490 25485 23778 1 19 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.055 -0.479 25485 23779 1 19 . 1 1 35 35 LEU C C 35 177.973 177.973 178.272 -0.299 25485 23780 1 19 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.272 0.225 25485 23781 1 19 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.325 -0.633 25485 23782 1 19 . 1 1 35 35 LEU H H 35 8.312 8.312 7.713 0.599 25485 23783 1 19 . 1 1 36 36 GLU N N 36 119.201 119.201 118.477 0.724 25485 23784 1 19 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.970 -0.056 25485 23785 1 19 . 1 1 36 36 GLU C C 36 178.141 178.141 178.785 -0.644 25485 23786 1 19 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.563 0.096 25485 23787 1 19 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.110 0.203 25485 23788 1 19 . 1 1 36 36 GLU H H 36 8.225 8.225 7.885 0.340 25485 23789 1 19 . 1 1 37 37 ALA N N 37 120.746 120.746 121.982 -1.236 25485 23790 1 19 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.112 -0.033 25485 23791 1 19 . 1 1 37 37 ALA C C 37 181.485 181.485 179.885 1.600 25485 23792 1 19 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.843 0.617 25485 23793 1 19 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.265 -0.098 25485 23794 1 19 . 1 1 37 37 ALA H H 37 7.917 7.917 7.549 0.368 25485 23795 1 19 . 1 1 38 38 LYS N N 38 119.326 119.326 119.203 0.123 25485 23796 1 19 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.111 0.220 25485 23797 1 19 . 1 1 38 38 LYS C C 38 177.946 177.946 179.051 -1.105 25485 23798 1 19 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.336 -0.632 25485 23799 1 19 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.277 -0.477 25485 23800 1 19 . 1 1 38 38 LYS H H 38 8.216 8.216 7.938 0.278 25485 23801 1 19 . 1 1 39 39 LEU N N 39 122.736 122.736 120.083 2.653 25485 23802 1 19 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.938 0.003 25485 23803 1 19 . 1 1 39 39 LEU C C 39 178.819 178.819 178.918 -0.099 25485 23804 1 19 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.274 -0.193 25485 23805 1 19 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.408 -0.780 25485 23806 1 19 . 1 1 39 39 LEU H H 39 8.666 8.666 8.761 -0.095 25485 23807 1 19 . 1 1 40 40 LYS N N 40 118.411 118.411 118.903 -0.492 25485 23808 1 19 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.939 0.699 25485 23809 1 19 . 1 1 40 40 LYS C C 40 179.329 179.329 178.572 0.757 25485 23810 1 19 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.878 0.255 25485 23811 1 19 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.205 -0.420 25485 23812 1 19 . 1 1 40 40 LYS H H 40 8.227 8.227 7.633 0.594 25485 23813 1 19 . 1 1 41 41 GLU N N 41 121.329 121.329 118.353 2.976 25485 23814 1 19 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.138 -0.045 25485 23815 1 19 . 1 1 41 41 GLU C C 41 178.989 178.989 178.952 0.037 25485 23816 1 19 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.022 0.738 25485 23817 1 19 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.863 0.973 25485 23818 1 19 . 1 1 41 41 GLU H H 41 7.718 7.718 7.616 0.102 25485 23819 1 19 . 1 1 42 42 MET N N 42 123.817 123.817 120.691 3.126 25485 23820 1 19 . 1 1 42 42 MET HA H 42 4.107 4.107 4.401 -0.294 25485 23821 1 19 . 1 1 42 42 MET C C 42 177.719 177.719 178.066 -0.347 25485 23822 1 19 . 1 1 42 42 MET CA C 42 59.912 59.912 58.639 1.272 25485 23823 1 19 . 1 1 42 42 MET CB C 42 30.506 30.506 32.598 -2.092 25485 23824 1 19 . 1 1 42 42 MET H H 42 7.657 7.657 7.646 0.011 25485 23825 1 19 . 1 1 43 43 GLN N N 43 119.998 119.998 118.355 1.643 25485 23826 1 19 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.038 -0.233 25485 23827 1 19 . 1 1 43 43 GLN C C 43 177.604 177.604 178.954 -1.350 25485 23828 1 19 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.622 1.343 25485 23829 1 19 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.698 -1.143 25485 23830 1 19 . 1 1 43 43 GLN H H 43 8.910 8.910 7.925 0.985 25485 23831 1 19 . 1 1 44 44 LYS N N 44 119.165 119.165 119.419 -0.254 25485 23832 1 19 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.273 -0.218 25485 23833 1 19 . 1 1 44 44 LYS C C 44 179.991 179.991 179.222 0.769 25485 23834 1 19 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.202 1.359 25485 23835 1 19 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.074 0.224 25485 23836 1 19 . 1 1 44 44 LYS H H 44 8.507 8.507 7.544 0.963 25485 23837 1 19 . 1 1 45 45 PHE N N 45 123.602 123.602 120.272 3.330 25485 23838 1 19 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.422 -0.521 25485 23839 1 19 . 1 1 45 45 PHE C C 45 177.606 177.606 176.829 0.777 25485 23840 1 19 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.813 2.221 25485 23841 1 19 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.601 0.265 25485 23842 1 19 . 1 1 45 45 PHE H H 45 8.445 8.445 7.889 0.556 25485 23843 1 19 . 1 1 46 46 PHE N N 46 112.715 112.715 116.041 -3.326 25485 23844 1 19 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.592 0.005 25485 23845 1 19 . 1 1 46 46 PHE C C 46 175.285 175.285 177.345 -2.060 25485 23846 1 19 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.328 1.347 25485 23847 1 19 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.285 -0.826 25485 23848 1 19 . 1 1 46 46 PHE H H 46 8.272 8.272 8.561 -0.289 25485 23849 1 19 . 1 1 47 47 GLY N N 47 110.438 110.438 107.723 2.715 25485 23850 1 19 . 1 1 47 47 GLY C C 47 174.935 174.935 174.729 0.206 25485 23851 1 19 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.221 1.790 25485 23852 1 19 . 1 1 47 47 GLY H H 47 7.926 7.926 8.433 -0.507 25485 23853 1 19 . 1 1 48 48 LEU N N 48 121.830 121.830 119.362 2.468 25485 23854 1 19 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.667 0.257 25485 23855 1 19 . 1 1 48 48 LEU C C 48 174.009 174.009 175.753 -1.744 25485 23856 1 19 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.483 -1.648 25485 23857 1 19 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.710 0.753 25485 23858 1 19 . 1 1 48 48 LEU H H 48 8.762 8.762 7.627 1.135 25485 23859 1 19 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.393 -0.155 25485 23860 1 19 . 1 1 49 49 PRO C C 49 176.874 176.874 176.789 0.085 25485 23861 1 19 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.775 -0.257 25485 23862 1 19 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.849 -0.770 25485 23863 1 19 . 1 1 50 50 ILE N N 50 126.859 126.859 117.364 9.495 25485 23864 1 19 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.085 0.016 25485 23865 1 19 . 1 1 50 50 ILE C C 50 176.540 176.540 175.523 1.017 25485 23866 1 19 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.736 -0.780 25485 23867 1 19 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.581 -1.188 25485 23868 1 19 . 1 1 50 50 ILE H H 50 8.548 8.548 7.902 0.646 25485 23869 1 19 . 1 1 51 51 THR N N 51 116.443 116.443 118.152 -1.709 25485 23870 1 19 . 1 1 51 51 THR HA H 51 4.584 4.584 4.489 0.095 25485 23871 1 19 . 1 1 51 51 THR C C 51 176.672 176.672 175.432 1.240 25485 23872 1 19 . 1 1 51 51 THR CA C 51 60.979 60.979 60.674 0.305 25485 23873 1 19 . 1 1 51 51 THR CB C 51 71.505 71.505 70.072 1.433 25485 23874 1 19 . 1 1 51 51 THR H H 51 8.001 8.001 8.101 -0.100 25485 23875 1 19 . 1 1 52 52 GLY N N 52 112.719 112.719 111.056 1.663 25485 23876 1 19 . 1 1 52 52 GLY C C 52 170.609 170.609 173.881 -3.272 25485 23877 1 19 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.733 1.013 25485 23878 1 19 . 1 1 52 52 GLY H H 52 9.499 9.499 8.684 0.815 25485 23879 1 19 . 1 1 53 53 MET N N 53 116.621 116.621 118.766 -2.145 25485 23880 1 19 . 1 1 53 53 MET HA H 53 4.023 4.023 4.809 -0.786 25485 23881 1 19 . 1 1 53 53 MET C C 53 174.695 174.695 174.103 0.592 25485 23882 1 19 . 1 1 53 53 MET CA C 53 53.460 53.460 54.611 -1.151 25485 23883 1 19 . 1 1 53 53 MET CB C 53 35.408 35.408 35.832 -0.424 25485 23884 1 19 . 1 1 53 53 MET H H 53 7.993 7.993 7.455 0.538 25485 23885 1 19 . 1 1 54 54 LEU N N 54 122.679 122.679 120.165 2.514 25485 23886 1 19 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.505 -0.754 25485 23887 1 19 . 1 1 54 54 LEU C C 54 174.784 174.784 174.413 0.371 25485 23888 1 19 . 1 1 54 54 LEU CA C 54 55.301 55.301 54.904 0.397 25485 23889 1 19 . 1 1 54 54 LEU CB C 54 42.010 42.010 44.852 -2.842 25485 23890 1 19 . 1 1 54 54 LEU H H 54 7.940 7.940 8.328 -0.388 25485 23891 1 19 . 1 1 55 55 ASN N N 55 115.797 115.797 117.550 -1.753 25485 23892 1 19 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.521 0.228 25485 23893 1 19 . 1 1 55 55 ASN C C 55 175.459 175.459 174.096 1.363 25485 23894 1 19 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.178 -1.335 25485 23895 1 19 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.366 1.991 25485 23896 1 19 . 1 1 55 55 ASN H H 55 6.543 6.543 8.282 -1.739 25485 23897 1 19 . 1 1 56 56 SER N N 56 121.507 121.507 115.824 5.683 25485 23898 1 19 . 1 1 56 56 SER HA H 56 4.638 4.638 4.465 0.173 25485 23899 1 19 . 1 1 56 56 SER C C 56 175.727 175.727 175.804 -0.077 25485 23900 1 19 . 1 1 56 56 SER CA C 56 57.932 57.932 59.346 -1.414 25485 23901 1 19 . 1 1 56 56 SER CB C 56 63.786 63.786 63.942 -0.156 25485 23902 1 19 . 1 1 56 56 SER H H 56 8.213 8.213 7.960 0.253 25485 23903 1 19 . 1 1 57 57 ARG N N 57 122.951 122.951 121.053 1.898 25485 23904 1 19 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.409 -0.208 25485 23905 1 19 . 1 1 57 57 ARG C C 57 178.560 178.560 178.102 0.458 25485 23906 1 19 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.333 0.099 25485 23907 1 19 . 1 1 57 57 ARG CB C 57 29.105 29.105 30.010 -0.905 25485 23908 1 19 . 1 1 57 57 ARG H H 57 7.895 7.895 8.414 -0.519 25485 23909 1 19 . 1 1 58 58 VAL N N 58 118.778 118.778 120.390 -1.612 25485 23910 1 19 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.726 -0.395 25485 23911 1 19 . 1 1 58 58 VAL C C 58 177.370 177.370 177.994 -0.624 25485 23912 1 19 . 1 1 58 58 VAL CA C 58 66.382 66.382 65.991 0.391 25485 23913 1 19 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.452 0.757 25485 23914 1 19 . 1 1 58 58 VAL H H 58 7.583 7.583 7.957 -0.374 25485 23915 1 19 . 1 1 59 59 ILE N N 59 119.159 119.159 117.493 1.666 25485 23916 1 19 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.556 -0.143 25485 23917 1 19 . 1 1 59 59 ILE C C 59 177.067 177.067 177.731 -0.664 25485 23918 1 19 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.105 0.528 25485 23919 1 19 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.747 -0.051 25485 23920 1 19 . 1 1 59 59 ILE H H 59 7.323 7.323 7.919 -0.596 25485 23921 1 19 . 1 1 60 60 GLU N N 60 119.367 119.367 120.241 -0.874 25485 23922 1 19 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.897 -0.159 25485 23923 1 19 . 1 1 60 60 GLU C C 60 179.978 179.978 179.174 0.804 25485 23924 1 19 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.734 -0.476 25485 23925 1 19 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.401 -0.013 25485 23926 1 19 . 1 1 60 60 GLU H H 60 7.879 7.879 7.459 0.420 25485 23927 1 19 . 1 1 61 61 ILE N N 61 118.816 118.816 117.913 0.903 25485 23928 1 19 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.890 -0.451 25485 23929 1 19 . 1 1 61 61 ILE C C 61 179.033 179.033 177.286 1.747 25485 23930 1 19 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.446 0.392 25485 23931 1 19 . 1 1 61 61 ILE CB C 61 36.899 36.899 38.260 -1.361 25485 23932 1 19 . 1 1 61 61 ILE H H 61 7.246 7.246 7.380 -0.134 25485 23933 1 19 . 1 1 62 62 MET N N 62 119.986 119.986 115.278 4.708 25485 23934 1 19 . 1 1 62 62 MET HA H 62 3.444 3.444 4.196 -0.752 25485 23935 1 19 . 1 1 62 62 MET C C 62 176.185 176.185 177.262 -1.077 25485 23936 1 19 . 1 1 62 62 MET CA C 62 59.014 59.014 56.976 2.038 25485 23937 1 19 . 1 1 62 62 MET CB C 62 31.250 31.250 32.129 -0.879 25485 23938 1 19 . 1 1 62 62 MET H H 62 7.835 7.835 7.271 0.564 25485 23939 1 19 . 1 1 63 63 GLN N N 63 116.163 116.163 115.617 0.546 25485 23940 1 19 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.133 0.145 25485 23941 1 19 . 1 1 63 63 GLN C C 63 176.727 176.727 176.582 0.145 25485 23942 1 19 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.516 -0.378 25485 23943 1 19 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.267 -0.201 25485 23944 1 19 . 1 1 63 63 GLN H H 63 7.454 7.454 7.559 -0.105 25485 23945 1 19 . 1 1 64 64 LYS N N 64 121.430 121.430 121.044 0.386 25485 23946 1 19 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.460 0.083 25485 23947 1 19 . 1 1 64 64 LYS C C 64 174.724 174.724 174.885 -0.161 25485 23948 1 19 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.213 1.304 25485 23949 1 19 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.562 -0.966 25485 23950 1 19 . 1 1 64 64 LYS H H 64 7.483 7.483 7.494 -0.011 25485 23951 1 19 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.529 -2.093 25485 23952 1 19 . 1 1 65 65 PRO C C 65 176.158 176.158 176.085 0.073 25485 23953 1 19 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.005 -0.117 25485 23954 1 19 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.510 -0.677 25485 23955 1 19 . 1 1 66 66 ARG N N 66 112.697 112.697 120.380 -7.683 25485 23956 1 19 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.650 -0.242 25485 23957 1 19 . 1 1 66 66 ARG C C 66 174.478 174.478 173.869 0.609 25485 23958 1 19 . 1 1 66 66 ARG CA C 66 54.636 54.636 57.015 -2.379 25485 23959 1 19 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.216 3.457 25485 23960 1 19 . 1 1 66 66 ARG H H 66 8.146 8.146 8.719 -0.573 25485 23961 1 19 . 1 1 67 67 CYS N N 67 121.740 121.740 117.174 4.566 25485 23962 1 19 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.578 -0.138 25485 23963 1 19 . 1 1 67 67 CYS C C 67 175.659 175.659 175.365 0.294 25485 23964 1 19 . 1 1 67 67 CYS CA C 67 59.195 59.195 58.080 1.115 25485 23965 1 19 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.599 -1.393 25485 23966 1 19 . 1 1 67 67 CYS H H 67 7.757 7.757 8.139 -0.382 25485 23967 1 19 . 1 1 68 68 GLY N N 68 116.217 116.217 113.325 2.892 25485 23968 1 19 . 1 1 68 68 GLY C C 68 172.210 172.210 173.315 -1.105 25485 23969 1 19 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.212 1.347 25485 23970 1 19 . 1 1 68 68 GLY H H 68 9.704 9.704 9.310 0.394 25485 23971 1 19 . 1 1 69 69 VAL N N 69 126.372 126.372 120.010 6.362 25485 23972 1 19 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.248 -0.417 25485 23973 1 19 . 1 1 69 69 VAL C C 69 173.538 173.538 173.870 -0.332 25485 23974 1 19 . 1 1 69 69 VAL CA C 69 61.368 61.368 57.784 3.584 25485 23975 1 19 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.479 0.044 25485 23976 1 19 . 1 1 69 69 VAL H H 69 9.113 9.113 7.660 1.453 25485 23977 1 19 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.341 0.609 25485 23978 1 19 . 1 1 70 70 PRO C C 70 175.019 175.019 176.214 -1.195 25485 23979 1 19 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.336 1.012 25485 23980 1 19 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.799 -0.441 25485 23981 1 19 . 1 1 71 71 ASP N N 71 118.986 118.986 118.880 0.106 25485 23982 1 19 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.916 -0.483 25485 23983 1 19 . 1 1 71 71 ASP C C 71 175.166 175.166 175.257 -0.091 25485 23984 1 19 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.838 1.530 25485 23985 1 19 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.145 -1.281 25485 23986 1 19 . 1 1 71 71 ASP H H 71 8.054 8.054 8.584 -0.530 25485 23987 1 19 . 1 1 72 72 VAL N N 72 112.953 112.953 115.224 -2.271 25485 23988 1 19 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.377 -0.081 25485 23989 1 19 . 1 1 72 72 VAL C C 72 174.330 174.330 174.542 -0.212 25485 23990 1 19 . 1 1 72 72 VAL CA C 72 59.645 59.645 61.177 -1.532 25485 23991 1 19 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.700 0.172 25485 23992 1 19 . 1 1 72 72 VAL H H 72 6.430 6.430 7.673 -1.243 25485 23993 1 19 . 1 1 73 73 ALA N N 73 125.869 125.869 129.706 -3.837 25485 23994 1 19 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.756 -0.451 25485 23995 1 19 . 1 1 73 73 ALA C C 73 177.382 177.382 176.047 1.335 25485 23996 1 19 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.861 0.188 25485 23997 1 19 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.729 -0.777 25485 23998 1 19 . 1 1 73 73 ALA H H 73 8.177 8.177 8.302 -0.125 25485 23999 1 19 . 1 1 74 74 GLU N N 74 120.724 120.724 118.508 2.216 25485 24000 1 19 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.473 -0.370 25485 24001 1 19 . 1 1 74 74 GLU C C 74 176.246 176.246 174.942 1.304 25485 24002 1 19 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.295 0.497 25485 24003 1 19 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.625 -1.841 25485 24004 1 19 . 1 1 74 74 GLU H H 74 8.381 8.381 8.543 -0.162 25485 24005 1 19 . 1 1 75 75 TYR N N 75 121.473 121.473 119.281 2.192 25485 24006 1 19 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.220 0.225 25485 24007 1 19 . 1 1 75 75 TYR C C 75 175.633 175.633 174.396 1.237 25485 24008 1 19 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.376 -0.049 25485 24009 1 19 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.828 -0.415 25485 24010 1 19 . 1 1 75 75 TYR H H 75 8.065 8.065 8.317 -0.252 25485 24011 1 19 . 1 1 76 76 SER N N 76 117.860 117.860 117.935 -0.075 25485 24012 1 19 . 1 1 76 76 SER HA H 76 3.886 3.886 4.397 -0.511 25485 24013 1 19 . 1 1 76 76 SER C C 76 173.859 173.859 174.883 -1.024 25485 24014 1 19 . 1 1 76 76 SER CA C 76 58.250 58.250 58.558 -0.308 25485 24015 1 19 . 1 1 76 76 SER CB C 76 64.117 64.117 63.537 0.580 25485 24016 1 19 . 1 1 76 76 SER H H 76 7.748 7.748 8.214 -0.466 25485 24017 1 19 . 1 1 77 77 LEU N N 77 123.789 123.789 127.061 -3.272 25485 24018 1 19 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.027 0.119 25485 24019 1 19 . 1 1 77 77 LEU C C 77 176.451 176.451 177.730 -1.279 25485 24020 1 19 . 1 1 77 77 LEU CA C 77 55.464 55.464 57.657 -2.193 25485 24021 1 19 . 1 1 77 77 LEU CB C 77 41.957 41.957 42.175 -0.217 25485 24022 1 19 . 1 1 77 77 LEU H H 77 7.979 7.979 8.521 -0.542 25485 24023 1 19 . 1 1 78 78 PHE N N 78 119.275 119.275 112.578 6.697 25485 24024 1 19 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.450 0.426 25485 24025 1 19 . 1 1 78 78 PHE C C 78 173.844 173.844 174.060 -0.216 25485 24026 1 19 . 1 1 78 78 PHE CA C 78 55.372 55.372 57.386 -2.014 25485 24027 1 19 . 1 1 78 78 PHE CB C 78 39.164 39.164 36.537 2.627 25485 24028 1 19 . 1 1 78 78 PHE H H 78 7.827 7.827 7.985 -0.158 25485 24029 1 19 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.487 -0.131 25485 24030 1 19 . 1 1 79 79 PRO C C 79 176.433 176.433 176.108 0.325 25485 24031 1 19 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.602 1.248 25485 24032 1 19 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.326 -0.634 25485 24033 1 19 . 1 1 80 80 ASN N N 80 118.057 118.057 119.596 -1.539 25485 24034 1 19 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.756 -0.109 25485 24035 1 19 . 1 1 80 80 ASN C C 80 174.305 174.305 174.662 -0.357 25485 24036 1 19 . 1 1 80 80 ASN CA C 80 52.860 52.860 53.085 -0.225 25485 24037 1 19 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.253 1.330 25485 24038 1 19 . 1 1 80 80 ASN H H 80 8.068 8.068 8.551 -0.483 25485 24039 1 19 . 1 1 81 81 SER HA H 81 4.565 4.565 4.274 0.291 25485 24040 1 19 . 1 1 81 81 SER CA C 81 56.800 56.800 58.723 -1.923 25485 24041 1 19 . 1 1 81 81 SER CB C 81 63.128 63.128 63.836 -0.708 25485 24042 1 19 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.431 0.030 25485 24043 1 19 . 1 1 82 82 PRO C C 82 174.589 174.589 176.585 -1.996 25485 24044 1 19 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.632 -0.986 25485 24045 1 19 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.283 -1.029 25485 24046 1 19 . 1 1 83 83 LYS N N 83 114.578 114.578 118.223 -3.645 25485 24047 1 19 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.691 -0.538 25485 24048 1 19 . 1 1 83 83 LYS C C 83 175.308 175.308 176.202 -0.894 25485 24049 1 19 . 1 1 83 83 LYS CA C 83 54.407 54.407 54.839 -0.432 25485 24050 1 19 . 1 1 83 83 LYS CB C 83 34.418 34.418 34.280 0.138 25485 24051 1 19 . 1 1 83 83 LYS H H 83 7.356 7.356 7.587 -0.231 25485 24052 1 19 . 1 1 84 84 TRP N N 84 122.455 122.455 120.515 1.940 25485 24053 1 19 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.671 -0.651 25485 24054 1 19 . 1 1 84 84 TRP C C 84 177.636 177.636 176.917 0.719 25485 24055 1 19 . 1 1 84 84 TRP CA C 84 57.471 57.471 57.480 -0.009 25485 24056 1 19 . 1 1 84 84 TRP CB C 84 30.318 30.318 28.047 2.272 25485 24057 1 19 . 1 1 84 84 TRP H H 84 8.050 8.050 8.471 -0.421 25485 24058 1 19 . 1 1 85 85 THR N N 85 113.501 113.501 116.017 -2.516 25485 24059 1 19 . 1 1 85 85 THR HA H 85 4.573 4.573 4.398 0.175 25485 24060 1 19 . 1 1 85 85 THR C C 85 174.757 174.757 174.626 0.131 25485 24061 1 19 . 1 1 85 85 THR CA C 85 62.130 62.130 61.791 0.339 25485 24062 1 19 . 1 1 85 85 THR CB C 85 69.107 69.107 69.581 -0.474 25485 24063 1 19 . 1 1 85 85 THR H H 85 8.861 8.861 8.283 0.578 25485 24064 1 19 . 1 1 86 86 SER N N 86 117.270 117.270 117.407 -0.137 25485 24065 1 19 . 1 1 86 86 SER HA H 86 4.741 4.741 4.463 0.278 25485 24066 1 19 . 1 1 86 86 SER C C 86 173.457 173.457 174.421 -0.964 25485 24067 1 19 . 1 1 86 86 SER CA C 86 56.739 56.739 58.434 -1.695 25485 24068 1 19 . 1 1 86 86 SER CB C 86 64.717 64.717 64.165 0.552 25485 24069 1 19 . 1 1 86 86 SER H H 86 7.743 7.743 7.901 -0.158 25485 24070 1 19 . 1 1 87 87 LYS N N 87 120.329 120.329 120.236 0.093 25485 24071 1 19 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.186 0.043 25485 24072 1 19 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.728 -0.137 25485 24073 1 19 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.645 -0.522 25485 24074 1 19 . 1 1 87 87 LYS H H 87 8.285 8.285 8.446 -0.161 25485 24075 1 19 . 1 1 88 88 VAL N N 88 117.531 117.531 116.564 0.967 25485 24076 1 19 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.787 -0.132 25485 24077 1 19 . 1 1 88 88 VAL C C 88 174.868 174.868 174.028 0.840 25485 24078 1 19 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.173 -0.078 25485 24079 1 19 . 1 1 88 88 VAL CB C 88 33.695 33.695 34.891 -1.196 25485 24080 1 19 . 1 1 88 88 VAL H H 88 7.428 7.428 7.328 0.100 25485 24081 1 19 . 1 1 89 89 VAL N N 89 131.452 131.452 124.251 7.201 25485 24082 1 19 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.452 -0.293 25485 24083 1 19 . 1 1 89 89 VAL C C 89 175.758 175.758 174.863 0.895 25485 24084 1 19 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.192 0.529 25485 24085 1 19 . 1 1 89 89 VAL CB C 89 34.173 34.173 35.323 -1.150 25485 24086 1 19 . 1 1 89 89 VAL H H 89 8.603 8.603 8.834 -0.231 25485 24087 1 19 . 1 1 90 90 THR N N 90 118.206 118.206 116.060 2.146 25485 24088 1 19 . 1 1 90 90 THR HA H 90 5.649 5.649 5.410 0.239 25485 24089 1 19 . 1 1 90 90 THR C C 90 174.579 174.579 173.650 0.929 25485 24090 1 19 . 1 1 90 90 THR CA C 90 58.959 58.959 59.571 -0.612 25485 24091 1 19 . 1 1 90 90 THR CB C 90 72.288 72.288 72.358 -0.070 25485 24092 1 19 . 1 1 90 90 THR H H 90 9.021 9.021 8.334 0.687 25485 24093 1 19 . 1 1 91 91 TYR N N 91 118.117 118.117 119.109 -0.992 25485 24094 1 19 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.586 0.112 25485 24095 1 19 . 1 1 91 91 TYR C C 91 171.233 171.233 173.063 -1.830 25485 24096 1 19 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.252 0.180 25485 24097 1 19 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.460 0.800 25485 24098 1 19 . 1 1 91 91 TYR H H 91 8.555 8.555 8.122 0.433 25485 24099 1 19 . 1 1 92 92 ARG N N 92 120.252 120.252 120.346 -0.094 25485 24100 1 19 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.607 0.090 25485 24101 1 19 . 1 1 92 92 ARG C C 92 173.932 173.932 174.706 -0.774 25485 24102 1 19 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.376 0.465 25485 24103 1 19 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.909 -0.223 25485 24104 1 19 . 1 1 92 92 ARG H H 92 8.520 8.520 9.018 -0.498 25485 24105 1 19 . 1 1 93 93 ILE N N 93 128.305 128.305 126.483 1.822 25485 24106 1 19 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.405 0.227 25485 24107 1 19 . 1 1 93 93 ILE C C 93 175.468 175.468 176.587 -1.119 25485 24108 1 19 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.236 0.992 25485 24109 1 19 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.533 0.692 25485 24110 1 19 . 1 1 93 93 ILE H H 93 8.886 8.886 8.832 0.054 25485 24111 1 19 . 1 1 94 94 VAL N N 94 126.647 126.647 127.956 -1.309 25485 24112 1 19 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.112 -0.116 25485 24113 1 19 . 1 1 94 94 VAL C C 94 175.670 175.670 176.472 -0.802 25485 24114 1 19 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.571 -0.157 25485 24115 1 19 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.374 0.645 25485 24116 1 19 . 1 1 94 94 VAL H H 94 9.517 9.517 8.380 1.137 25485 24117 1 19 . 1 1 95 95 SER N N 95 113.398 113.398 112.489 0.909 25485 24118 1 19 . 1 1 95 95 SER HA H 95 4.701 4.701 4.651 0.050 25485 24119 1 19 . 1 1 95 95 SER C C 95 170.684 170.684 172.529 -1.845 25485 24120 1 19 . 1 1 95 95 SER CA C 95 56.945 56.945 57.515 -0.570 25485 24121 1 19 . 1 1 95 95 SER CB C 95 65.276 65.276 64.680 0.596 25485 24122 1 19 . 1 1 95 95 SER H H 95 7.463 7.463 7.648 -0.185 25485 24123 1 19 . 1 1 96 96 TYR N N 96 116.512 116.512 119.410 -2.898 25485 24124 1 19 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.830 -0.566 25485 24125 1 19 . 1 1 96 96 TYR C C 96 174.856 174.856 174.176 0.680 25485 24126 1 19 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.728 1.909 25485 24127 1 19 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.721 1.442 25485 24128 1 19 . 1 1 96 96 TYR H H 96 8.240 8.240 8.260 -0.020 25485 24129 1 19 . 1 1 97 97 THR CA C 97 57.798 57.798 60.753 -2.955 25485 24130 1 19 . 1 1 97 97 THR CB C 97 67.420 67.420 69.580 -2.160 25485 24131 1 19 . 1 1 98 98 ARG N N 98 128.156 128.156 124.645 3.511 25485 24132 1 19 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.159 0.166 25485 24133 1 19 . 1 1 98 98 ARG C C 98 177.625 177.625 176.052 1.573 25485 24134 1 19 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.569 -1.355 25485 24135 1 19 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.609 -0.129 25485 24136 1 19 . 1 1 98 98 ARG H H 98 8.914 8.914 8.671 0.243 25485 24137 1 19 . 1 1 99 99 ASP N N 99 120.592 120.592 117.125 3.467 25485 24138 1 19 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.668 -0.287 25485 24139 1 19 . 1 1 99 99 ASP C C 99 175.679 175.679 175.049 0.630 25485 24140 1 19 . 1 1 99 99 ASP CA C 99 56.436 56.436 54.794 1.642 25485 24141 1 19 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.535 0.835 25485 24142 1 19 . 1 1 99 99 ASP H H 99 8.708 8.708 8.076 0.632 25485 24143 1 19 . 1 1 100 100 LEU N N 100 116.829 116.829 119.082 -2.253 25485 24144 1 19 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.692 0.264 25485 24145 1 19 . 1 1 100 100 LEU C C 100 173.335 173.335 174.121 -0.786 25485 24146 1 19 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.728 -0.691 25485 24147 1 19 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.680 1.587 25485 24148 1 19 . 1 1 100 100 LEU H H 100 6.916 6.916 7.545 -0.629 25485 24149 1 19 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.093 0.082 25485 24150 1 19 . 1 1 102 102 HIS C C 102 177.649 177.649 177.406 0.243 25485 24151 1 19 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.567 -0.894 25485 24152 1 19 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.127 -1.693 25485 24153 1 19 . 1 1 103 103 ILE N N 103 115.170 115.170 118.751 -3.581 25485 24154 1 19 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.862 0.311 25485 24155 1 19 . 1 1 103 103 ILE C C 103 177.214 177.214 177.245 -0.031 25485 24156 1 19 . 1 1 103 103 ILE CA C 103 63.165 63.165 63.710 -0.545 25485 24157 1 19 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.624 0.141 25485 24158 1 19 . 1 1 103 103 ILE H H 103 8.234 8.234 8.093 0.141 25485 24159 1 19 . 1 1 104 104 THR N N 104 119.374 119.374 117.216 2.158 25485 24160 1 19 . 1 1 104 104 THR HA H 104 4.045 4.045 4.044 0.001 25485 24161 1 19 . 1 1 104 104 THR C C 104 175.612 175.612 176.798 -1.186 25485 24162 1 19 . 1 1 104 104 THR CA C 104 66.568 66.568 66.796 -0.228 25485 24163 1 19 . 1 1 104 104 THR CB C 104 68.077 68.077 68.449 -0.372 25485 24164 1 19 . 1 1 104 104 THR H H 104 6.947 6.947 7.643 -0.696 25485 24165 1 19 . 1 1 105 105 VAL N N 105 123.263 123.263 120.958 2.305 25485 24166 1 19 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.049 0.389 25485 24167 1 19 . 1 1 105 105 VAL C C 105 177.322 177.322 177.330 -0.008 25485 24168 1 19 . 1 1 105 105 VAL CA C 105 67.947 67.947 65.520 2.427 25485 24169 1 19 . 1 1 105 105 VAL CB C 105 31.269 31.269 30.910 0.359 25485 24170 1 19 . 1 1 105 105 VAL H H 105 7.407 7.407 8.197 -0.790 25485 24171 1 19 . 1 1 106 106 ASP N N 106 119.972 119.972 119.589 0.383 25485 24172 1 19 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.418 -0.096 25485 24173 1 19 . 1 1 106 106 ASP C C 106 179.747 179.747 178.217 1.530 25485 24174 1 19 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.747 0.488 25485 24175 1 19 . 1 1 106 106 ASP CB C 106 40.362 40.362 41.084 -0.722 25485 24176 1 19 . 1 1 106 106 ASP H H 106 8.627 8.627 7.988 0.639 25485 24177 1 19 . 1 1 107 107 ARG N N 107 121.033 121.033 119.180 1.853 25485 24178 1 19 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.147 0.031 25485 24179 1 19 . 1 1 107 107 ARG C C 107 179.485 179.485 178.388 1.097 25485 24180 1 19 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.657 0.923 25485 24181 1 19 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.429 0.779 25485 24182 1 19 . 1 1 107 107 ARG H H 107 8.356 8.356 7.773 0.583 25485 24183 1 19 . 1 1 108 108 LEU N N 108 121.463 121.463 120.900 0.563 25485 24184 1 19 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.159 0.146 25485 24185 1 19 . 1 1 108 108 LEU C C 108 178.852 178.852 178.846 0.006 25485 24186 1 19 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.656 0.226 25485 24187 1 19 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.228 0.087 25485 24188 1 19 . 1 1 108 108 LEU H H 108 8.790 8.790 7.803 0.987 25485 24189 1 19 . 1 1 109 109 VAL N N 109 120.233 120.233 116.410 3.823 25485 24190 1 19 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.633 -0.233 25485 24191 1 19 . 1 1 109 109 VAL C C 109 177.019 177.019 177.621 -0.602 25485 24192 1 19 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.988 1.058 25485 24193 1 19 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.271 -0.082 25485 24194 1 19 . 1 1 109 109 VAL H H 109 8.787 8.787 7.859 0.927 25485 24195 1 19 . 1 1 110 110 SER N N 110 112.862 112.862 116.082 -3.220 25485 24196 1 19 . 1 1 110 110 SER HA H 110 4.300 4.300 3.977 0.323 25485 24197 1 19 . 1 1 110 110 SER C C 110 176.770 176.770 176.788 -0.018 25485 24198 1 19 . 1 1 110 110 SER CA C 110 61.744 61.744 61.463 0.281 25485 24199 1 19 . 1 1 110 110 SER CB C 110 62.742 62.742 62.822 -0.080 25485 24200 1 19 . 1 1 110 110 SER H H 110 7.605 7.605 7.926 -0.321 25485 24201 1 19 . 1 1 111 111 LYS N N 111 122.319 122.319 121.884 0.435 25485 24202 1 19 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.059 0.002 25485 24203 1 19 . 1 1 111 111 LYS C C 111 178.309 178.309 178.654 -0.345 25485 24204 1 19 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.280 0.534 25485 24205 1 19 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.569 -0.060 25485 24206 1 19 . 1 1 111 111 LYS H H 111 8.156 8.156 8.054 0.102 25485 24207 1 19 . 1 1 112 112 ALA N N 112 124.147 124.147 121.033 3.114 25485 24208 1 19 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.313 -0.214 25485 24209 1 19 . 1 1 112 112 ALA C C 112 179.445 179.445 179.002 0.443 25485 24210 1 19 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.270 0.956 25485 24211 1 19 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.035 0.939 25485 24212 1 19 . 1 1 112 112 ALA H H 112 8.278 8.278 7.521 0.757 25485 24213 1 19 . 1 1 113 113 LEU N N 113 116.195 116.195 120.236 -4.041 25485 24214 1 19 . 1 1 113 113 LEU HA H 113 3.751 3.751 3.998 -0.247 25485 24215 1 19 . 1 1 113 113 LEU C C 113 179.537 179.537 178.041 1.496 25485 24216 1 19 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.824 -0.080 25485 24217 1 19 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.758 -1.203 25485 24218 1 19 . 1 1 113 113 LEU H H 113 8.021 8.021 8.477 -0.456 25485 24219 1 19 . 1 1 114 114 ASN N N 114 116.570 116.570 117.522 -0.952 25485 24220 1 19 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.754 -0.208 25485 24221 1 19 . 1 1 114 114 ASN C C 114 177.136 177.136 177.384 -0.248 25485 24222 1 19 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.043 -0.279 25485 24223 1 19 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.314 0.309 25485 24224 1 19 . 1 1 114 114 ASN H H 114 8.212 8.212 8.265 -0.053 25485 24225 1 19 . 1 1 115 115 MET N N 115 122.055 122.055 119.470 2.585 25485 24226 1 19 . 1 1 115 115 MET HA H 115 4.010 4.010 4.075 -0.065 25485 24227 1 19 . 1 1 115 115 MET C C 115 177.681 177.681 177.535 0.146 25485 24228 1 19 . 1 1 115 115 MET CA C 115 59.445 59.445 59.446 -0.000 25485 24229 1 19 . 1 1 115 115 MET CB C 115 31.616 31.616 32.234 -0.618 25485 24230 1 19 . 1 1 115 115 MET H H 115 7.937 7.937 7.627 0.310 25485 24231 1 19 . 1 1 116 116 TRP N N 116 117.115 117.115 118.462 -1.347 25485 24232 1 19 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.257 0.261 25485 24233 1 19 . 1 1 116 116 TRP C C 116 179.054 179.054 179.282 -0.228 25485 24234 1 19 . 1 1 116 116 TRP CA C 116 59.511 59.511 58.810 0.701 25485 24235 1 19 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.374 1.499 25485 24236 1 19 . 1 1 116 116 TRP H H 116 6.783 6.783 7.388 -0.606 25485 24237 1 19 . 1 1 117 117 GLY N N 117 104.511 104.511 106.607 -2.096 25485 24238 1 19 . 1 1 117 117 GLY C C 117 175.035 175.035 176.231 -1.196 25485 24239 1 19 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.739 0.258 25485 24240 1 19 . 1 1 117 117 GLY H H 117 9.302 9.302 8.323 0.979 25485 24241 1 19 . 1 1 118 118 LYS N N 118 118.580 118.580 119.913 -1.333 25485 24242 1 19 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.092 0.115 25485 24243 1 19 . 1 1 118 118 LYS C C 118 177.235 177.235 177.278 -0.043 25485 24244 1 19 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.813 0.078 25485 24245 1 19 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.091 -0.186 25485 24246 1 19 . 1 1 118 118 LYS H H 118 7.940 7.940 8.077 -0.137 25485 24247 1 19 . 1 1 119 119 GLU N N 119 113.749 113.749 116.546 -2.797 25485 24248 1 19 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.504 0.334 25485 24249 1 19 . 1 1 119 119 GLU C C 119 178.024 178.024 175.396 2.628 25485 24250 1 19 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.929 -0.654 25485 24251 1 19 . 1 1 119 119 GLU CB C 119 30.686 30.686 30.343 0.343 25485 24252 1 19 . 1 1 119 119 GLU H H 119 7.763 7.763 7.623 0.140 25485 24253 1 19 . 1 1 120 120 ILE N N 120 111.144 111.144 113.382 -2.238 25485 24254 1 19 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.737 0.634 25485 24255 1 19 . 1 1 120 120 ILE C C 120 174.033 174.033 174.338 -0.305 25485 24256 1 19 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.726 0.728 25485 24257 1 19 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.973 1.956 25485 24258 1 19 . 1 1 120 120 ILE H H 120 7.518 7.518 7.647 -0.129 25485 24259 1 19 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.521 0.141 25485 24260 1 19 . 1 1 121 121 PRO C C 121 174.784 174.784 176.123 -1.339 25485 24261 1 19 . 1 1 121 121 PRO CA C 121 62.015 62.015 62.953 -0.938 25485 24262 1 19 . 1 1 121 121 PRO CB C 121 29.385 29.385 30.160 -0.775 25485 24263 1 19 . 1 1 122 122 LEU N N 122 121.531 121.531 119.052 2.479 25485 24264 1 19 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.430 -0.091 25485 24265 1 19 . 1 1 122 122 LEU C C 122 173.977 173.977 176.942 -2.965 25485 24266 1 19 . 1 1 122 122 LEU CA C 122 54.558 54.558 54.782 -0.224 25485 24267 1 19 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.961 2.438 25485 24268 1 19 . 1 1 122 122 LEU H H 122 6.847 6.847 7.584 -0.737 25485 24269 1 19 . 1 1 123 123 HIS N N 123 121.054 121.054 116.601 4.453 25485 24270 1 19 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.457 0.149 25485 24271 1 19 . 1 1 123 123 HIS C C 123 172.820 172.820 173.218 -0.398 25485 24272 1 19 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.340 -0.831 25485 24273 1 19 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.171 0.939 25485 24274 1 19 . 1 1 123 123 HIS H H 123 7.760 7.760 8.198 -0.438 25485 24275 1 19 . 1 1 124 124 PHE N N 124 120.465 120.465 124.312 -3.847 25485 24276 1 19 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.639 0.195 25485 24277 1 19 . 1 1 124 124 PHE C C 124 175.677 175.677 175.415 0.262 25485 24278 1 19 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.660 0.632 25485 24279 1 19 . 1 1 124 124 PHE CB C 124 41.822 41.822 40.783 1.039 25485 24280 1 19 . 1 1 124 124 PHE H H 124 8.306 8.306 8.440 -0.134 25485 24281 1 19 . 1 1 125 125 ARG N N 125 124.008 124.008 123.864 0.144 25485 24282 1 19 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.912 -0.201 25485 24283 1 19 . 1 1 125 125 ARG C C 125 172.901 172.901 175.493 -2.592 25485 24284 1 19 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.683 -0.409 25485 24285 1 19 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.292 -0.470 25485 24286 1 19 . 1 1 125 125 ARG H H 125 8.426 8.426 9.231 -0.805 25485 24287 1 19 . 1 1 126 126 LYS N N 126 130.004 130.004 125.167 4.837 25485 24288 1 19 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.261 -0.878 25485 24289 1 19 . 1 1 126 126 LYS C C 126 176.126 176.126 175.573 0.553 25485 24290 1 19 . 1 1 126 126 LYS CA C 126 56.181 56.181 56.033 0.148 25485 24291 1 19 . 1 1 126 126 LYS CB C 126 33.027 33.027 32.953 0.075 25485 24292 1 19 . 1 1 126 126 LYS H H 126 8.481 8.481 8.513 -0.032 25485 24293 1 19 . 1 1 127 127 VAL N N 127 125.288 125.288 119.960 5.328 25485 24294 1 19 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.235 0.270 25485 24295 1 19 . 1 1 127 127 VAL C C 127 175.565 175.565 175.380 0.185 25485 24296 1 19 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.710 -1.761 25485 24297 1 19 . 1 1 127 127 VAL CB C 127 34.362 34.362 33.154 1.208 25485 24298 1 19 . 1 1 127 127 VAL H H 127 8.721 8.721 7.855 0.866 25485 24299 1 19 . 1 1 128 128 VAL N N 128 117.467 117.467 118.002 -0.535 25485 24300 1 19 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.047 0.282 25485 24301 1 19 . 1 1 128 128 VAL C C 128 174.622 174.622 175.233 -0.611 25485 24302 1 19 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.746 0.372 25485 24303 1 19 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.336 0.174 25485 24304 1 19 . 1 1 128 128 VAL H H 128 8.406 8.406 7.973 0.433 25485 24305 1 19 . 1 1 129 129 TRP N N 129 119.986 119.986 122.464 -2.478 25485 24306 1 19 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.933 -0.217 25485 24307 1 19 . 1 1 129 129 TRP C C 129 174.536 174.536 176.201 -1.665 25485 24308 1 19 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.703 -0.785 25485 24309 1 19 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.140 2.874 25485 24310 1 19 . 1 1 129 129 TRP H H 129 7.435 7.435 7.335 0.100 25485 24311 1 19 . 1 1 130 130 GLY N N 130 109.900 109.900 111.591 -1.691 25485 24312 1 19 . 1 1 130 130 GLY C C 130 173.187 173.187 173.877 -0.690 25485 24313 1 19 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.224 0.256 25485 24314 1 19 . 1 1 130 130 GLY H H 130 8.006 8.006 8.197 -0.191 25485 24315 1 19 . 1 1 131 131 THR N N 131 116.142 116.142 115.651 0.491 25485 24316 1 19 . 1 1 131 131 THR HA H 131 4.162 4.162 4.379 -0.217 25485 24317 1 19 . 1 1 131 131 THR C C 131 172.766 172.766 173.884 -1.118 25485 24318 1 19 . 1 1 131 131 THR CA C 131 63.212 63.212 62.488 0.724 25485 24319 1 19 . 1 1 131 131 THR CB C 131 69.308 69.308 69.658 -0.350 25485 24320 1 19 . 1 1 131 131 THR H H 131 8.233 8.233 8.294 -0.061 25485 24321 1 19 . 1 1 132 132 ALA N N 132 129.807 129.807 125.094 4.713 25485 24322 1 19 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.596 -0.080 25485 24323 1 19 . 1 1 132 132 ALA C C 132 175.358 175.358 176.456 -1.098 25485 24324 1 19 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.466 -1.100 25485 24325 1 19 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.300 1.498 25485 24326 1 19 . 1 1 132 132 ALA H H 132 7.962 7.962 8.457 -0.495 25485 24327 1 19 . 1 1 133 133 ASP N N 133 122.896 122.896 119.905 2.991 25485 24328 1 19 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.612 -0.191 25485 24329 1 19 . 1 1 133 133 ASP C C 133 177.314 177.314 177.090 0.224 25485 24330 1 19 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.819 1.100 25485 24331 1 19 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.819 -1.348 25485 24332 1 19 . 1 1 133 133 ASP H H 133 8.251 8.251 8.323 -0.072 25485 24333 1 19 . 1 1 134 134 ILE N N 134 125.472 125.472 121.588 3.884 25485 24334 1 19 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.334 -0.191 25485 24335 1 19 . 1 1 134 134 ILE C C 134 174.201 174.201 175.262 -1.061 25485 24336 1 19 . 1 1 134 134 ILE CA C 134 61.271 61.271 59.509 1.762 25485 24337 1 19 . 1 1 134 134 ILE CB C 134 38.710 38.710 35.796 2.914 25485 24338 1 19 . 1 1 134 134 ILE H H 134 8.802 8.802 8.603 0.199 25485 24339 1 19 . 1 1 135 135 MET N N 135 127.265 127.265 128.134 -0.869 25485 24340 1 19 . 1 1 135 135 MET HA H 135 5.192 5.192 5.450 -0.258 25485 24341 1 19 . 1 1 135 135 MET C C 135 176.206 176.206 175.791 0.415 25485 24342 1 19 . 1 1 135 135 MET CA C 135 53.626 53.626 52.542 1.084 25485 24343 1 19 . 1 1 135 135 MET CB C 135 32.639 32.639 33.290 -0.651 25485 24344 1 19 . 1 1 135 135 MET H H 135 7.418 7.418 8.972 -1.554 25485 24345 1 19 . 1 1 136 136 ILE N N 136 125.440 125.440 124.178 1.262 25485 24346 1 19 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.911 0.678 25485 24347 1 19 . 1 1 136 136 ILE C C 136 175.190 175.190 175.918 -0.728 25485 24348 1 19 . 1 1 136 136 ILE CA C 136 60.108 60.108 59.017 1.091 25485 24349 1 19 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.671 4.269 25485 24350 1 19 . 1 1 136 136 ILE H H 136 9.124 9.124 8.748 0.376 25485 24351 1 19 . 1 1 137 137 GLY N N 137 112.211 112.211 114.645 -2.434 25485 24352 1 19 . 1 1 137 137 GLY C C 137 170.855 170.855 172.123 -1.268 25485 24353 1 19 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.254 1.151 25485 24354 1 19 . 1 1 137 137 GLY H H 137 8.594 8.594 8.276 0.318 25485 24355 1 19 . 1 1 138 138 PHE N N 138 119.463 119.463 118.263 1.200 25485 24356 1 19 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.535 -0.039 25485 24357 1 19 . 1 1 138 138 PHE C C 138 175.186 175.186 174.566 0.620 25485 24358 1 19 . 1 1 138 138 PHE CA C 138 55.995 55.995 54.154 1.841 25485 24359 1 19 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.145 0.297 25485 24360 1 19 . 1 1 138 138 PHE H H 138 7.857 7.857 8.295 -0.438 25485 24361 1 19 . 1 1 139 139 ALA N N 139 123.914 123.914 125.383 -1.469 25485 24362 1 19 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.405 0.326 25485 24363 1 19 . 1 1 139 139 ALA C C 139 174.613 174.613 175.375 -0.762 25485 24364 1 19 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.162 -1.127 25485 24365 1 19 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.836 1.636 25485 24366 1 19 . 1 1 139 139 ALA H H 139 8.955 8.955 9.233 -0.278 25485 24367 1 19 . 1 1 140 140 ARG N N 140 118.339 118.339 119.658 -1.319 25485 24368 1 19 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.887 0.219 25485 24369 1 19 . 1 1 140 140 ARG C C 140 176.201 176.201 178.081 -1.880 25485 24370 1 19 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.844 -0.678 25485 24371 1 19 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.213 1.256 25485 24372 1 19 . 1 1 140 140 ARG H H 140 8.546 8.546 8.503 0.043 25485 24373 1 19 . 1 1 141 141 GLY N N 141 108.916 108.916 108.912 0.004 25485 24374 1 19 . 1 1 141 141 GLY C C 141 175.595 175.595 175.289 0.306 25485 24375 1 19 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.318 -1.028 25485 24376 1 19 . 1 1 141 141 GLY H H 141 8.989 8.989 8.913 0.076 25485 24377 1 19 . 1 1 142 142 ALA N N 142 121.448 121.448 121.816 -0.368 25485 24378 1 19 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.308 0.100 25485 24379 1 19 . 1 1 142 142 ALA C C 142 177.027 177.027 177.732 -0.705 25485 24380 1 19 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.852 0.425 25485 24381 1 19 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.115 -0.151 25485 24382 1 19 . 1 1 142 142 ALA H H 142 8.642 8.642 8.263 0.379 25485 24383 1 19 . 1 1 143 143 HIS N N 143 120.356 120.356 114.565 5.791 25485 24384 1 19 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.485 0.672 25485 24385 1 19 . 1 1 143 143 HIS C C 143 174.303 174.303 176.108 -1.805 25485 24386 1 19 . 1 1 143 143 HIS CA C 143 55.453 55.453 55.711 -0.258 25485 24387 1 19 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.475 -1.684 25485 24388 1 19 . 1 1 143 143 HIS H H 143 8.990 8.990 7.992 0.998 25485 24389 1 19 . 1 1 144 144 GLY N N 144 112.517 112.517 107.765 4.752 25485 24390 1 19 . 1 1 144 144 GLY C C 144 173.758 173.758 173.231 0.527 25485 24391 1 19 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.644 1.451 25485 24392 1 19 . 1 1 144 144 GLY H H 144 5.175 5.175 7.595 -2.420 25485 24393 1 19 . 1 1 145 145 ASP N N 145 117.762 117.762 118.396 -0.634 25485 24394 1 19 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.658 0.040 25485 24395 1 19 . 1 1 145 145 ASP C C 145 175.851 175.851 174.857 0.994 25485 24396 1 19 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.745 -0.786 25485 24397 1 19 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.514 -0.715 25485 24398 1 19 . 1 1 145 145 ASP H H 145 7.096 7.096 7.563 -0.467 25485 24399 1 19 . 1 1 146 146 SER N N 146 125.540 125.540 115.737 9.803 25485 24400 1 19 . 1 1 146 146 SER HA H 146 4.204 4.204 4.331 -0.127 25485 24401 1 19 . 1 1 146 146 SER C C 146 172.319 172.319 173.535 -1.216 25485 24402 1 19 . 1 1 146 146 SER CA C 146 58.862 58.862 58.670 0.192 25485 24403 1 19 . 1 1 146 146 SER CB C 146 62.933 62.933 63.652 -0.719 25485 24404 1 19 . 1 1 146 146 SER H H 146 8.261 8.261 8.293 -0.032 25485 24405 1 19 . 1 1 147 147 TYR N N 147 120.757 120.757 118.155 2.602 25485 24406 1 19 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.230 0.592 25485 24407 1 19 . 1 1 147 147 TYR C C 147 170.372 170.372 173.528 -3.156 25485 24408 1 19 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.600 -4.332 25485 24409 1 19 . 1 1 147 147 TYR CB C 147 38.296 38.296 38.160 0.136 25485 24410 1 19 . 1 1 147 147 TYR H H 147 7.450 7.450 8.357 -0.907 25485 24411 1 19 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.250 0.622 25485 24412 1 19 . 1 1 148 148 PRO C C 148 179.009 179.009 176.113 2.896 25485 24413 1 19 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.261 1.114 25485 24414 1 19 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.139 -1.230 25485 24415 1 19 . 1 1 149 149 PHE N N 149 120.514 120.514 117.075 3.439 25485 24416 1 19 . 1 1 149 149 PHE C C 149 176.813 176.813 175.354 1.459 25485 24417 1 19 . 1 1 149 149 PHE CA C 149 58.453 58.453 58.805 -0.352 25485 24418 1 19 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.330 0.243 25485 24419 1 19 . 1 1 149 149 PHE H H 149 8.024 8.024 7.335 0.689 25485 24420 1 19 . 1 1 150 150 ASP N N 150 115.555 115.555 114.694 0.861 25485 24421 1 19 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.416 0.423 25485 24422 1 19 . 1 1 150 150 ASP C C 150 177.007 177.007 176.878 0.129 25485 24423 1 19 . 1 1 150 150 ASP CA C 150 53.871 53.871 55.303 -1.432 25485 24424 1 19 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.677 2.259 25485 24425 1 19 . 1 1 150 150 ASP H H 150 7.511 7.511 7.978 -0.467 25485 24426 1 19 . 1 1 151 151 GLY N N 151 110.650 110.650 109.174 1.476 25485 24427 1 19 . 1 1 151 151 GLY C C 151 170.281 170.281 172.423 -2.142 25485 24428 1 19 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.877 -0.479 25485 24429 1 19 . 1 1 151 151 GLY H H 151 9.080 9.080 8.604 0.476 25485 24430 1 19 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.130 -0.074 25485 24431 1 19 . 1 1 152 152 PRO C C 152 178.300 178.300 176.943 1.357 25485 24432 1 19 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.154 0.696 25485 24433 1 19 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.904 -0.644 25485 24434 1 19 . 1 1 153 153 GLY N N 153 118.783 118.783 113.403 5.380 25485 24435 1 19 . 1 1 153 153 GLY C C 153 174.098 174.098 172.937 1.161 25485 24436 1 19 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.479 -0.873 25485 24437 1 19 . 1 1 153 153 GLY H H 153 11.431 11.431 8.185 3.246 25485 24438 1 19 . 1 1 154 154 ASN N N 154 120.679 120.679 123.106 -2.427 25485 24439 1 19 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.427 -0.183 25485 24440 1 19 . 1 1 154 154 ASN C C 154 174.636 174.636 175.580 -0.944 25485 24441 1 19 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.610 2.058 25485 24442 1 19 . 1 1 154 154 ASN CB C 154 36.971 36.971 39.167 -2.196 25485 24443 1 19 . 1 1 154 154 ASN H H 154 9.247 9.247 8.521 0.726 25485 24444 1 19 . 1 1 155 155 THR N N 155 118.252 118.252 110.608 7.644 25485 24445 1 19 . 1 1 155 155 THR HA H 155 5.577 5.577 4.064 1.513 25485 24446 1 19 . 1 1 155 155 THR C C 155 176.596 176.596 172.842 3.754 25485 24447 1 19 . 1 1 155 155 THR CA C 155 61.731 61.731 63.147 -1.416 25485 24448 1 19 . 1 1 155 155 THR CB C 155 71.325 71.325 68.700 2.626 25485 24449 1 19 . 1 1 155 155 THR H H 155 9.501 9.501 8.689 0.812 25485 24450 1 19 . 1 1 156 156 LEU N N 156 122.598 122.598 121.900 0.698 25485 24451 1 19 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.646 0.225 25485 24452 1 19 . 1 1 156 156 LEU C C 156 175.655 175.655 175.908 -0.253 25485 24453 1 19 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.394 -0.856 25485 24454 1 19 . 1 1 156 156 LEU CB C 156 44.511 44.511 43.106 1.405 25485 24455 1 19 . 1 1 156 156 LEU H H 156 8.492 8.492 8.362 0.130 25485 24456 1 19 . 1 1 157 157 ALA N N 157 115.389 115.389 115.540 -0.151 25485 24457 1 19 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.484 0.551 25485 24458 1 19 . 1 1 157 157 ALA C C 157 175.739 175.739 175.001 0.738 25485 24459 1 19 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.465 -0.526 25485 24460 1 19 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.787 1.667 25485 24461 1 19 . 1 1 157 157 ALA H H 157 7.567 7.567 7.777 -0.210 25485 24462 1 19 . 1 1 158 158 HIS N N 158 111.900 111.900 117.242 -5.342 25485 24463 1 19 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.797 -0.192 25485 24464 1 19 . 1 1 158 158 HIS C C 158 170.186 170.186 172.273 -2.087 25485 24465 1 19 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.154 1.921 25485 24466 1 19 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.575 -1.389 25485 24467 1 19 . 1 1 158 158 HIS H H 158 8.757 8.757 7.886 0.871 25485 24468 1 19 . 1 1 159 159 ALA N N 159 118.286 118.286 126.179 -7.893 25485 24469 1 19 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.081 0.573 25485 24470 1 19 . 1 1 159 159 ALA C C 159 174.036 174.036 175.252 -1.216 25485 24471 1 19 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.256 0.877 25485 24472 1 19 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.777 2.260 25485 24473 1 19 . 1 1 159 159 ALA H H 159 6.110 6.110 8.233 -2.123 25485 24474 1 19 . 1 1 160 160 PHE N N 160 117.937 117.937 117.038 0.899 25485 24475 1 19 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.820 -0.317 25485 24476 1 19 . 1 1 160 160 PHE C C 160 174.455 174.455 174.715 -0.260 25485 24477 1 19 . 1 1 160 160 PHE CA C 160 56.813 56.813 54.490 2.323 25485 24478 1 19 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.710 0.484 25485 24479 1 19 . 1 1 160 160 PHE H H 160 7.912 7.912 7.731 0.181 25485 24480 1 19 . 1 1 161 161 ALA N N 161 123.531 123.531 122.660 0.871 25485 24481 1 19 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.775 -0.284 25485 24482 1 19 . 1 1 161 161 ALA C C 161 175.503 175.503 176.578 -1.075 25485 24483 1 19 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.650 0.983 25485 24484 1 19 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.319 -2.763 25485 24485 1 19 . 1 1 161 161 ALA H H 161 8.107 8.107 8.589 -0.482 25485 24486 1 19 . 1 1 162 162 PRO HA H 162 2.910 2.910 4.458 -1.548 25485 24487 1 19 . 1 1 162 162 PRO C C 162 173.465 173.465 175.928 -2.463 25485 24488 1 19 . 1 1 162 162 PRO CA C 162 64.257 64.257 63.221 1.036 25485 24489 1 19 . 1 1 162 162 PRO CB C 162 31.242 31.242 30.360 0.882 25485 24490 1 19 . 1 1 163 163 GLY N N 163 107.206 107.206 109.616 -2.410 25485 24491 1 19 . 1 1 163 163 GLY C C 163 172.092 172.092 172.867 -0.775 25485 24492 1 19 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.938 -0.945 25485 24493 1 19 . 1 1 163 163 GLY H H 163 5.997 5.997 8.232 -2.235 25485 24494 1 19 . 1 1 165 165 GLY N N 165 103.110 103.110 109.336 -6.226 25485 24495 1 19 . 1 1 165 165 GLY C C 165 177.158 177.158 175.485 1.673 25485 24496 1 19 . 1 1 165 165 GLY CA C 165 44.243 44.243 46.838 -2.595 25485 24497 1 19 . 1 1 165 165 GLY H H 165 9.145 9.145 8.532 0.613 25485 24498 1 19 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.266 -0.087 25485 24499 1 19 . 1 1 166 166 LEU C C 166 176.437 176.437 177.289 -0.852 25485 24500 1 19 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.281 0.919 25485 24501 1 19 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.178 -0.344 25485 24502 1 19 . 1 1 167 167 GLY N N 167 103.318 103.318 103.827 -0.509 25485 24503 1 19 . 1 1 167 167 GLY C C 167 174.803 174.803 174.802 0.001 25485 24504 1 19 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.893 2.340 25485 24505 1 19 . 1 1 167 167 GLY H H 167 7.768 7.768 7.573 0.195 25485 24506 1 19 . 1 1 168 168 GLY N N 168 121.051 121.051 110.492 10.559 25485 24507 1 19 . 1 1 168 168 GLY C C 168 172.122 172.122 174.482 -2.360 25485 24508 1 19 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.409 1.193 25485 24509 1 19 . 1 1 168 168 GLY H H 168 7.698 7.698 8.307 -0.609 25485 24510 1 19 . 1 1 169 169 ASP N N 169 123.641 123.641 122.080 1.561 25485 24511 1 19 . 1 1 169 169 ASP C C 169 173.942 173.942 173.902 0.040 25485 24512 1 19 . 1 1 169 169 ASP CA C 169 55.842 55.842 54.469 1.373 25485 24513 1 19 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.149 -2.279 25485 24514 1 19 . 1 1 169 169 ASP H H 169 8.595 8.595 7.654 0.941 25485 24515 1 19 . 1 1 170 170 ALA N N 170 119.366 119.366 123.724 -4.358 25485 24516 1 19 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.337 0.393 25485 24517 1 19 . 1 1 170 170 ALA C C 170 174.593 174.593 175.191 -0.598 25485 24518 1 19 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.657 0.467 25485 24519 1 19 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.251 1.084 25485 24520 1 19 . 1 1 170 170 ALA H H 170 8.324 8.324 8.525 -0.201 25485 24521 1 19 . 1 1 171 171 HIS N N 171 120.239 120.239 121.255 -1.016 25485 24522 1 19 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.477 0.271 25485 24523 1 19 . 1 1 171 171 HIS C C 171 172.949 172.949 173.892 -0.943 25485 24524 1 19 . 1 1 171 171 HIS CA C 171 50.724 50.724 52.943 -2.219 25485 24525 1 19 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.037 1.504 25485 24526 1 19 . 1 1 171 171 HIS H H 171 8.499 8.499 7.644 0.855 25485 24527 1 19 . 1 1 172 172 PHE N N 172 121.125 121.125 120.971 0.154 25485 24528 1 19 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.520 0.008 25485 24529 1 19 . 1 1 172 172 PHE C C 172 173.875 173.875 174.134 -0.259 25485 24530 1 19 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.560 0.360 25485 24531 1 19 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.024 0.879 25485 24532 1 19 . 1 1 172 172 PHE H H 172 8.445 8.445 8.926 -0.481 25485 24533 1 19 . 1 1 173 173 ASP N N 173 124.014 124.014 122.823 1.191 25485 24534 1 19 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.929 -1.015 25485 24535 1 19 . 1 1 173 173 ASP C C 173 178.613 178.613 177.918 0.695 25485 24536 1 19 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.764 1.034 25485 24537 1 19 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.227 -0.484 25485 24538 1 19 . 1 1 173 173 ASP H H 173 7.927 7.927 8.602 -0.675 25485 24539 1 19 . 1 1 174 174 GLU N N 174 132.469 132.469 127.063 5.406 25485 24540 1 19 . 1 1 174 174 GLU C C 174 176.442 176.442 177.244 -0.802 25485 24541 1 19 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.814 -1.630 25485 24542 1 19 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.284 1.001 25485 24543 1 19 . 1 1 174 174 GLU H H 174 9.528 9.528 8.758 0.770 25485 24544 1 19 . 1 1 175 175 ASP N N 175 117.394 117.394 118.990 -1.596 25485 24545 1 19 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.686 0.107 25485 24546 1 19 . 1 1 175 175 ASP C C 175 176.645 176.645 176.520 0.125 25485 24547 1 19 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.490 0.441 25485 24548 1 19 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.551 -1.411 25485 24549 1 19 . 1 1 175 175 ASP H H 175 8.768 8.768 8.737 0.031 25485 24550 1 19 . 1 1 176 176 GLU N N 176 116.493 116.493 118.720 -2.227 25485 24551 1 19 . 1 1 176 176 GLU C C 176 175.038 175.038 175.783 -0.745 25485 24552 1 19 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.452 -1.787 25485 24553 1 19 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.566 -4.343 25485 24554 1 19 . 1 1 176 176 GLU H H 176 7.159 7.159 8.198 -1.039 25485 24555 1 19 . 1 1 177 177 ARG N N 177 122.186 122.186 119.467 2.719 25485 24556 1 19 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.207 0.482 25485 24557 1 19 . 1 1 177 177 ARG C C 177 174.482 174.482 174.486 -0.004 25485 24558 1 19 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.196 -1.509 25485 24559 1 19 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.829 -1.745 25485 24560 1 19 . 1 1 177 177 ARG H H 177 7.560 7.560 8.207 -0.647 25485 24561 1 19 . 1 1 178 178 TRP N N 178 129.179 129.179 124.754 4.425 25485 24562 1 19 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.355 -0.255 25485 24563 1 19 . 1 1 178 178 TRP C C 178 176.298 176.298 176.601 -0.303 25485 24564 1 19 . 1 1 178 178 TRP CA C 178 56.813 56.813 55.898 0.915 25485 24565 1 19 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.768 -0.571 25485 24566 1 19 . 1 1 178 178 TRP H H 178 8.807 8.807 8.447 0.360 25485 24567 1 19 . 1 1 179 179 THR N N 179 112.792 112.792 116.654 -3.862 25485 24568 1 19 . 1 1 179 179 THR HA H 179 4.985 4.985 4.537 0.448 25485 24569 1 19 . 1 1 179 179 THR C C 179 172.765 172.765 172.238 0.527 25485 24570 1 19 . 1 1 179 179 THR CA C 179 59.106 59.106 60.952 -1.846 25485 24571 1 19 . 1 1 179 179 THR CB C 179 71.786 71.786 69.862 1.924 25485 24572 1 19 . 1 1 179 179 THR H H 179 8.974 8.974 8.702 0.272 25485 24573 1 19 . 1 1 180 180 ASP N N 180 122.074 122.074 124.602 -2.528 25485 24574 1 19 . 1 1 180 180 ASP HA H 180 4.463 4.463 4.842 -0.379 25485 24575 1 19 . 1 1 180 180 ASP C C 180 176.366 176.366 178.163 -1.797 25485 24576 1 19 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.937 -2.894 25485 24577 1 19 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.119 -0.391 25485 24578 1 19 . 1 1 180 180 ASP H H 180 8.485 8.485 8.874 -0.389 25485 24579 1 19 . 1 1 181 181 GLY N N 181 110.123 110.123 108.357 1.766 25485 24580 1 19 . 1 1 181 181 GLY C C 181 174.325 174.325 175.342 -1.017 25485 24581 1 19 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.673 0.988 25485 24582 1 19 . 1 1 181 181 GLY H H 181 8.569 8.569 8.713 -0.144 25485 24583 1 19 . 1 1 182 182 SER N N 182 115.562 115.562 115.340 0.222 25485 24584 1 19 . 1 1 182 182 SER HA H 182 4.519 4.519 4.570 -0.051 25485 24585 1 19 . 1 1 182 182 SER C C 182 173.783 173.783 173.630 0.153 25485 24586 1 19 . 1 1 182 182 SER CA C 182 57.965 57.965 57.921 0.044 25485 24587 1 19 . 1 1 182 182 SER CB C 182 64.166 64.166 64.136 0.030 25485 24588 1 19 . 1 1 182 182 SER H H 182 8.160 8.160 7.778 0.382 25485 24589 1 19 . 1 1 183 183 SER N N 183 117.153 117.153 114.858 2.295 25485 24590 1 19 . 1 1 183 183 SER HA H 183 4.275 4.275 4.128 0.147 25485 24591 1 19 . 1 1 183 183 SER C C 183 173.333 173.333 174.624 -1.291 25485 24592 1 19 . 1 1 183 183 SER CA C 183 59.902 59.902 58.940 0.962 25485 24593 1 19 . 1 1 183 183 SER CB C 183 64.941 64.941 62.385 2.556 25485 24594 1 19 . 1 1 183 183 SER H H 183 7.796 7.796 7.627 0.169 25485 24595 1 19 . 1 1 184 184 LEU N N 184 122.351 122.351 120.554 1.797 25485 24596 1 19 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.477 -0.085 25485 24597 1 19 . 1 1 184 184 LEU C C 184 176.250 176.250 175.867 0.383 25485 24598 1 19 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.618 -0.043 25485 24599 1 19 . 1 1 184 184 LEU CB C 184 42.081 42.081 43.315 -1.234 25485 24600 1 19 . 1 1 184 184 LEU H H 184 8.092 8.092 8.151 -0.059 25485 24601 1 19 . 1 1 185 185 GLY N N 185 108.871 108.871 106.539 2.332 25485 24602 1 19 . 1 1 185 185 GLY C C 185 172.375 172.375 173.870 -1.495 25485 24603 1 19 . 1 1 185 185 GLY CA C 185 44.380 44.380 43.914 0.466 25485 24604 1 19 . 1 1 185 185 GLY H H 185 7.960 7.960 7.472 0.488 25485 24605 1 19 . 1 1 186 186 ILE N N 186 123.096 123.096 122.215 0.881 25485 24606 1 19 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.065 -0.224 25485 24607 1 19 . 1 1 186 186 ILE C C 186 175.350 175.350 175.937 -0.587 25485 24608 1 19 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.194 -0.793 25485 24609 1 19 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.645 -0.189 25485 24610 1 19 . 1 1 186 186 ILE H H 186 8.893 8.893 8.012 0.881 25485 24611 1 19 . 1 1 187 187 ASN N N 187 127.167 127.167 126.413 0.754 25485 24612 1 19 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.842 -0.489 25485 24613 1 19 . 1 1 187 187 ASN C C 187 175.849 175.849 176.721 -0.872 25485 24614 1 19 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.640 1.074 25485 24615 1 19 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.823 0.307 25485 24616 1 19 . 1 1 187 187 ASN H H 187 8.580 8.580 8.580 0.000 25485 24617 1 19 . 1 1 188 188 PHE N N 188 129.985 129.985 127.201 2.784 25485 24618 1 19 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.215 0.358 25485 24619 1 19 . 1 1 188 188 PHE C C 188 175.578 175.578 177.277 -1.699 25485 24620 1 19 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.426 -0.698 25485 24621 1 19 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.461 -0.029 25485 24622 1 19 . 1 1 188 188 PHE H H 188 9.361 9.361 8.300 1.061 25485 24623 1 19 . 1 1 189 189 LEU N N 189 119.113 119.113 119.538 -0.425 25485 24624 1 19 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.146 -0.345 25485 24625 1 19 . 1 1 189 189 LEU C C 189 179.601 179.601 178.218 1.383 25485 24626 1 19 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.071 0.438 25485 24627 1 19 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.309 -1.431 25485 24628 1 19 . 1 1 189 189 LEU H H 189 8.562 8.562 8.339 0.223 25485 24629 1 19 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.650 0.267 25485 24630 1 19 . 1 1 190 190 TYR C C 190 177.621 177.621 177.805 -0.184 25485 24631 1 19 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.193 -0.385 25485 24632 1 19 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.050 2.719 25485 24633 1 19 . 1 1 191 191 ALA N N 191 120.352 120.352 120.691 -0.339 25485 24634 1 19 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.043 0.272 25485 24635 1 19 . 1 1 191 191 ALA C C 191 180.252 180.252 178.902 1.350 25485 24636 1 19 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.272 0.910 25485 24637 1 19 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.472 0.670 25485 24638 1 19 . 1 1 191 191 ALA H H 191 7.993 7.993 8.748 -0.755 25485 24639 1 19 . 1 1 192 192 ALA N N 192 121.409 121.409 121.725 -0.316 25485 24640 1 19 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.111 -0.054 25485 24641 1 19 . 1 1 192 192 ALA C C 192 178.575 178.575 179.556 -0.981 25485 24642 1 19 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.493 -0.308 25485 24643 1 19 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.224 -2.026 25485 24644 1 19 . 1 1 192 192 ALA H H 192 9.297 9.297 8.341 0.956 25485 24645 1 19 . 1 1 193 193 THR N N 193 116.996 116.996 115.035 1.961 25485 24646 1 19 . 1 1 193 193 THR HA H 193 3.833 3.833 3.952 -0.119 25485 24647 1 19 . 1 1 193 193 THR CA C 193 69.138 69.138 68.092 1.046 25485 24648 1 19 . 1 1 193 193 THR CB C 193 67.365 67.365 68.280 -0.915 25485 24649 1 19 . 1 1 193 193 THR H H 193 8.226 8.226 7.753 0.473 25485 24650 1 19 . 1 1 194 194 HIS N N 194 120.296 120.296 121.881 -1.585 25485 24651 1 19 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.212 0.024 25485 24652 1 19 . 1 1 194 194 HIS C C 194 175.962 175.962 176.702 -0.740 25485 24653 1 19 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.239 1.508 25485 24654 1 19 . 1 1 194 194 HIS CB C 194 27.919 27.919 30.055 -2.136 25485 24655 1 19 . 1 1 194 194 HIS H H 194 7.782 7.782 7.480 0.302 25485 24656 1 19 . 1 1 195 195 ALA N N 195 121.290 121.290 122.579 -1.289 25485 24657 1 19 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.986 0.170 25485 24658 1 19 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.967 0.997 25485 24659 1 19 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.524 0.186 25485 24660 1 19 . 1 1 195 195 ALA H H 195 8.690 8.690 8.427 0.263 25485 24661 1 19 . 1 1 196 196 LEU N N 196 114.899 114.899 118.709 -3.810 25485 24662 1 19 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.168 0.002 25485 24663 1 19 . 1 1 196 196 LEU C C 196 177.946 177.946 179.784 -1.838 25485 24664 1 19 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.599 -1.371 25485 24665 1 19 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.023 -1.247 25485 24666 1 19 . 1 1 196 196 LEU H H 196 8.715 8.715 8.853 -0.138 25485 24667 1 19 . 1 1 197 197 GLY N N 197 107.901 107.901 104.625 3.276 25485 24668 1 19 . 1 1 197 197 GLY C C 197 178.641 178.641 175.368 3.273 25485 24669 1 19 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.869 0.698 25485 24670 1 19 . 1 1 197 197 GLY H H 197 7.546 7.546 8.229 -0.683 25485 24671 1 19 . 1 1 198 198 HIS N N 198 122.017 122.017 120.180 1.837 25485 24672 1 19 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.451 0.406 25485 24673 1 19 . 1 1 198 198 HIS C C 198 179.874 179.874 178.449 1.425 25485 24674 1 19 . 1 1 198 198 HIS CA C 198 58.522 58.522 58.304 0.218 25485 24675 1 19 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.463 -1.917 25485 24676 1 19 . 1 1 198 198 HIS H H 198 7.196 7.196 7.298 -0.102 25485 24677 1 19 . 1 1 199 199 SER N N 199 118.486 118.486 115.645 2.841 25485 24678 1 19 . 1 1 199 199 SER HA H 199 4.490 4.490 4.623 -0.133 25485 24679 1 19 . 1 1 199 199 SER C C 199 174.493 174.493 175.826 -1.333 25485 24680 1 19 . 1 1 199 199 SER CA C 199 58.173 58.173 60.746 -2.573 25485 24681 1 19 . 1 1 199 199 SER CB C 199 63.589 63.589 63.301 0.288 25485 24682 1 19 . 1 1 199 199 SER H H 199 7.884 7.884 7.814 0.070 25485 24683 1 19 . 1 1 200 200 LEU N N 200 114.686 114.686 118.059 -3.373 25485 24684 1 19 . 1 1 200 200 LEU C C 200 177.720 177.720 177.432 0.288 25485 24685 1 19 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.266 0.571 25485 24686 1 19 . 1 1 200 200 LEU CB C 200 42.357 42.357 40.375 1.982 25485 24687 1 19 . 1 1 200 200 LEU H H 200 7.108 7.108 6.802 0.306 25485 24688 1 19 . 1 1 201 201 GLY N N 201 108.363 108.363 106.841 1.522 25485 24689 1 19 . 1 1 201 201 GLY C C 201 174.008 174.008 174.896 -0.888 25485 24690 1 19 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.648 -1.234 25485 24691 1 19 . 1 1 201 201 GLY H H 201 8.195 8.195 7.962 0.233 25485 24692 1 19 . 1 1 202 202 MET N N 202 119.635 119.635 120.479 -0.844 25485 24693 1 19 . 1 1 202 202 MET HA H 202 4.473 4.473 4.287 0.186 25485 24694 1 19 . 1 1 202 202 MET C C 202 176.593 176.593 175.736 0.857 25485 24695 1 19 . 1 1 202 202 MET CA C 202 54.500 54.500 56.717 -2.217 25485 24696 1 19 . 1 1 202 202 MET CB C 202 32.161 32.161 32.748 -0.587 25485 24697 1 19 . 1 1 202 202 MET H H 202 8.182 8.182 7.154 1.028 25485 24698 1 19 . 1 1 203 203 GLY N N 203 109.749 109.749 110.271 -0.522 25485 24699 1 19 . 1 1 203 203 GLY C C 203 174.042 174.042 173.775 0.267 25485 24700 1 19 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.172 -0.168 25485 24701 1 19 . 1 1 203 203 GLY H H 203 8.405 8.405 8.407 -0.002 25485 24702 1 19 . 1 1 204 204 HIS N N 204 115.732 115.732 118.070 -2.338 25485 24703 1 19 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.559 0.841 25485 24704 1 19 . 1 1 204 204 HIS C C 204 174.430 174.430 174.358 0.072 25485 24705 1 19 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.693 -1.879 25485 24706 1 19 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.494 -0.668 25485 24707 1 19 . 1 1 204 204 HIS H H 204 8.364 8.364 8.734 -0.370 25485 24708 1 19 . 1 1 205 205 SER N N 205 115.484 115.484 114.495 0.989 25485 24709 1 19 . 1 1 205 205 SER HA H 205 4.766 4.766 4.700 0.066 25485 24710 1 19 . 1 1 205 205 SER C C 205 173.611 173.611 175.095 -1.484 25485 24711 1 19 . 1 1 205 205 SER CA C 205 54.729 54.729 57.331 -2.602 25485 24712 1 19 . 1 1 205 205 SER CB C 205 65.855 65.855 66.144 -0.289 25485 24713 1 19 . 1 1 205 205 SER H H 205 7.231 7.231 8.409 -1.178 25485 24714 1 19 . 1 1 206 206 SER N N 206 119.263 119.263 118.018 1.245 25485 24715 1 19 . 1 1 206 206 SER HA H 206 3.701 3.701 4.626 -0.925 25485 24716 1 19 . 1 1 206 206 SER C C 206 173.635 173.635 174.159 -0.524 25485 24717 1 19 . 1 1 206 206 SER CA C 206 63.846 63.846 59.337 4.509 25485 24718 1 19 . 1 1 206 206 SER CB C 206 63.764 63.764 63.694 0.070 25485 24719 1 19 . 1 1 206 206 SER H H 206 8.289 8.289 8.705 -0.416 25485 24720 1 19 . 1 1 207 207 ASP N N 207 126.646 126.646 122.372 4.274 25485 24721 1 19 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.633 0.296 25485 24722 1 19 . 1 1 207 207 ASP C C 207 174.614 174.614 175.793 -1.179 25485 24723 1 19 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.444 -1.172 25485 24724 1 19 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.245 -0.957 25485 24725 1 19 . 1 1 207 207 ASP H H 207 8.541 8.541 8.040 0.501 25485 24726 1 19 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.537 0.250 25485 24727 1 19 . 1 1 208 208 PRO C C 208 177.467 177.467 175.759 1.708 25485 24728 1 19 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.636 -0.800 25485 24729 1 19 . 1 1 208 208 PRO CB C 208 31.597 31.597 31.617 -0.020 25485 24730 1 19 . 1 1 209 209 ASN N N 209 116.020 116.020 114.405 1.615 25485 24731 1 19 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.691 -0.051 25485 24732 1 19 . 1 1 209 209 ASN C C 209 174.695 174.695 174.033 0.662 25485 24733 1 19 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.640 1.580 25485 24734 1 19 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.672 0.438 25485 24735 1 19 . 1 1 209 209 ASN H H 209 8.350 8.350 7.582 0.768 25485 24736 1 19 . 1 1 210 210 ALA N N 210 124.892 124.892 122.426 2.466 25485 24737 1 19 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.401 -0.306 25485 24738 1 19 . 1 1 210 210 ALA C C 210 179.495 179.495 178.107 1.388 25485 24739 1 19 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.776 1.278 25485 24740 1 19 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.747 -1.548 25485 24741 1 19 . 1 1 210 210 ALA H H 210 8.193 8.193 7.084 1.109 25485 24742 1 19 . 1 1 211 211 VAL N N 211 130.402 130.402 122.923 7.479 25485 24743 1 19 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.776 0.487 25485 24744 1 19 . 1 1 211 211 VAL C C 211 179.408 179.408 176.074 3.334 25485 24745 1 19 . 1 1 211 211 VAL CA C 211 65.052 65.052 64.924 0.128 25485 24746 1 19 . 1 1 211 211 VAL CB C 211 30.983 30.983 31.924 -0.941 25485 24747 1 19 . 1 1 211 211 VAL H H 211 11.592 11.592 8.851 2.741 25485 24748 1 19 . 1 1 212 212 MET N N 212 113.285 113.285 114.837 -1.552 25485 24749 1 19 . 1 1 212 212 MET C C 212 176.996 176.996 174.496 2.500 25485 24750 1 19 . 1 1 212 212 MET CA C 212 53.614 53.614 53.593 0.021 25485 24751 1 19 . 1 1 212 212 MET CB C 212 26.975 26.975 32.663 -5.688 25485 24752 1 19 . 1 1 212 212 MET H H 212 7.724 7.724 7.658 0.066 25485 24753 1 19 . 1 1 213 213 TYR N N 213 129.919 129.919 123.321 6.598 25485 24754 1 19 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.445 1.251 25485 24755 1 19 . 1 1 213 213 TYR C C 213 178.411 178.411 175.184 3.227 25485 24756 1 19 . 1 1 213 213 TYR CA C 213 57.131 57.131 56.965 0.167 25485 24757 1 19 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.133 1.034 25485 24758 1 19 . 1 1 213 213 TYR H H 213 7.902 7.902 7.246 0.656 25485 24759 1 19 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.540 -1.065 25485 24760 1 19 . 1 1 214 214 PRO C C 214 177.694 177.694 176.581 1.113 25485 24761 1 19 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.143 1.885 25485 24762 1 19 . 1 1 214 214 PRO CB C 214 32.823 32.823 32.046 0.777 25485 24763 1 19 . 1 1 215 215 THR N N 215 104.450 104.450 114.333 -9.883 25485 24764 1 19 . 1 1 215 215 THR HA H 215 4.444 4.444 4.154 0.290 25485 24765 1 19 . 1 1 215 215 THR C C 215 173.429 173.429 173.256 0.173 25485 24766 1 19 . 1 1 215 215 THR CA C 215 60.528 60.528 61.602 -1.075 25485 24767 1 19 . 1 1 215 215 THR CB C 215 69.614 69.614 66.968 2.646 25485 24768 1 19 . 1 1 215 215 THR H H 215 6.407 6.407 7.314 -0.907 25485 24769 1 19 . 1 1 216 216 TYR N N 216 124.618 124.618 125.083 -0.465 25485 24770 1 19 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.377 -0.145 25485 24771 1 19 . 1 1 216 216 TYR C C 216 175.669 175.669 175.474 0.195 25485 24772 1 19 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.503 0.084 25485 24773 1 19 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.785 2.106 25485 24774 1 19 . 1 1 216 216 TYR H H 216 8.331 8.331 7.807 0.524 25485 24775 1 19 . 1 1 217 217 GLY N N 217 116.089 116.089 116.218 -0.129 25485 24776 1 19 . 1 1 217 217 GLY C C 217 173.560 173.560 172.536 1.024 25485 24777 1 19 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.807 0.511 25485 24778 1 19 . 1 1 217 217 GLY H H 217 7.695 7.695 8.442 -0.747 25485 24779 1 19 . 1 1 218 218 ASN N N 218 120.167 120.167 118.245 1.922 25485 24780 1 19 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.893 -0.227 25485 24781 1 19 . 1 1 218 218 ASN C C 218 175.343 175.343 174.675 0.668 25485 24782 1 19 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.242 0.373 25485 24783 1 19 . 1 1 218 218 ASN CB C 218 38.546 38.546 40.574 -2.028 25485 24784 1 19 . 1 1 218 218 ASN H H 218 8.237 8.237 8.095 0.142 25485 24785 1 19 . 1 1 219 219 GLY N N 219 109.322 109.322 109.624 -0.302 25485 24786 1 19 . 1 1 219 219 GLY C C 219 172.842 172.842 174.884 -2.042 25485 24787 1 19 . 1 1 219 219 GLY CA C 219 44.718 44.718 45.782 -1.064 25485 24788 1 19 . 1 1 219 219 GLY H H 219 8.027 8.027 8.463 -0.436 25485 24789 1 19 . 1 1 220 220 ASP N N 220 123.006 123.006 125.752 -2.746 25485 24790 1 19 . 1 1 220 220 ASP H H 220 8.273 8.273 8.055 0.218 25485 24791 1 19 . 1 1 221 221 PRO C C 221 177.138 177.138 176.620 0.518 25485 24792 1 19 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.629 -5.566 25485 24793 1 19 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.675 -0.979 25485 24794 1 19 . 1 1 222 222 GLN N N 222 116.718 116.718 118.960 -2.242 25485 24795 1 19 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.248 0.088 25485 24796 1 19 . 1 1 222 222 GLN C C 222 176.321 176.321 177.543 -1.222 25485 24797 1 19 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.725 -1.582 25485 24798 1 19 . 1 1 222 222 GLN CB C 222 29.497 29.497 29.071 0.426 25485 24799 1 19 . 1 1 222 222 GLN H H 222 8.240 8.240 8.585 -0.345 25485 24800 1 19 . 1 1 223 223 ASN N N 223 118.368 118.368 115.137 3.231 25485 24801 1 19 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.783 0.133 25485 24802 1 19 . 1 1 223 223 ASN C C 223 173.271 173.271 174.403 -1.132 25485 24803 1 19 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.211 -0.615 25485 24804 1 19 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.845 -0.630 25485 24805 1 19 . 1 1 223 223 ASN H H 223 7.946 7.946 8.094 -0.148 25485 24806 1 19 . 1 1 224 224 PHE N N 224 118.429 118.429 117.796 0.633 25485 24807 1 19 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.144 0.307 25485 24808 1 19 . 1 1 224 224 PHE C C 224 172.897 172.897 173.437 -0.540 25485 24809 1 19 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.613 0.796 25485 24810 1 19 . 1 1 224 224 PHE CB C 224 39.701 39.701 37.911 1.790 25485 24811 1 19 . 1 1 224 224 PHE H H 224 6.992 6.992 7.814 -0.822 25485 24812 1 19 . 1 1 225 225 LYS N N 225 121.714 121.714 126.439 -4.725 25485 24813 1 19 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.777 0.653 25485 24814 1 19 . 1 1 225 225 LYS C C 225 174.664 174.664 174.563 0.101 25485 24815 1 19 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.892 0.420 25485 24816 1 19 . 1 1 225 225 LYS CB C 225 34.727 34.727 35.419 -0.692 25485 24817 1 19 . 1 1 225 225 LYS H H 225 7.709 7.709 8.073 -0.364 25485 24818 1 19 . 1 1 226 226 LEU N N 226 119.026 119.026 121.479 -2.453 25485 24819 1 19 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.077 0.063 25485 24820 1 19 . 1 1 226 226 LEU C C 226 177.495 177.495 176.982 0.513 25485 24821 1 19 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.089 0.510 25485 24822 1 19 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.316 -1.035 25485 24823 1 19 . 1 1 226 226 LEU H H 226 8.015 8.015 8.033 -0.018 25485 24824 1 19 . 1 1 227 227 SER N N 227 120.320 120.320 116.592 3.728 25485 24825 1 19 . 1 1 227 227 SER HA H 227 4.600 4.600 4.528 0.072 25485 24826 1 19 . 1 1 227 227 SER C C 227 175.492 175.492 175.512 -0.020 25485 24827 1 19 . 1 1 227 227 SER CA C 227 57.239 57.239 57.066 0.173 25485 24828 1 19 . 1 1 227 227 SER CB C 227 66.278 66.278 64.403 1.875 25485 24829 1 19 . 1 1 227 227 SER H H 227 9.654 9.654 7.926 1.728 25485 24830 1 19 . 1 1 228 228 GLN N N 228 127.511 127.511 125.491 2.020 25485 24831 1 19 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.968 0.726 25485 24832 1 19 . 1 1 228 228 GLN H H 228 8.248 8.248 8.870 -0.622 25485 24833 1 19 . 1 1 229 229 ASP N N 229 124.358 124.358 118.324 6.034 25485 24834 1 19 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.356 0.018 25485 24835 1 19 . 1 1 229 229 ASP C C 229 178.793 178.793 178.517 0.276 25485 24836 1 19 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.108 1.034 25485 24837 1 19 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.081 3.160 25485 24838 1 19 . 1 1 229 229 ASP H H 229 8.138 8.138 8.470 -0.332 25485 24839 1 19 . 1 1 230 230 ASP N N 230 119.694 119.694 120.211 -0.517 25485 24840 1 19 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.494 -0.072 25485 24841 1 19 . 1 1 230 230 ASP C C 230 177.736 177.736 178.226 -0.490 25485 24842 1 19 . 1 1 230 230 ASP CA C 230 57.922 57.922 56.810 1.112 25485 24843 1 19 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.055 2.181 25485 24844 1 19 . 1 1 230 230 ASP H H 230 7.393 7.393 7.545 -0.152 25485 24845 1 19 . 1 1 231 231 ILE N N 231 120.364 120.364 119.910 0.454 25485 24846 1 19 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.736 -0.071 25485 24847 1 19 . 1 1 231 231 ILE C C 231 177.631 177.631 177.906 -0.275 25485 24848 1 19 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.146 0.353 25485 24849 1 19 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.094 0.419 25485 24850 1 19 . 1 1 231 231 ILE H H 231 8.115 8.115 7.901 0.214 25485 24851 1 19 . 1 1 232 232 LYS N N 232 119.156 119.156 120.314 -1.158 25485 24852 1 19 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.028 0.086 25485 24853 1 19 . 1 1 232 232 LYS C C 232 180.574 180.574 178.935 1.639 25485 24854 1 19 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.524 0.036 25485 24855 1 19 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.669 0.128 25485 24856 1 19 . 1 1 232 232 LYS H H 232 8.607 8.607 8.368 0.239 25485 24857 1 19 . 1 1 233 233 GLY N N 233 106.425 106.425 107.738 -1.313 25485 24858 1 19 . 1 1 233 233 GLY C C 233 176.098 176.098 175.817 0.281 25485 24859 1 19 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.572 1.065 25485 24860 1 19 . 1 1 233 233 GLY H H 233 8.075 8.075 7.591 0.484 25485 24861 1 19 . 1 1 234 234 ILE N N 234 125.119 125.119 121.751 3.368 25485 24862 1 19 . 1 1 234 234 ILE C C 234 178.231 178.231 177.207 1.024 25485 24863 1 19 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.240 -1.647 25485 24864 1 19 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.057 -0.511 25485 24865 1 19 . 1 1 234 234 ILE H H 234 8.539 8.539 7.482 1.057 25485 24866 1 19 . 1 1 235 235 GLN N N 235 122.877 122.877 118.650 4.227 25485 24867 1 19 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.011 0.346 25485 24868 1 19 . 1 1 235 235 GLN C C 235 180.105 180.105 178.239 1.866 25485 24869 1 19 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.519 -1.632 25485 24870 1 19 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.689 -1.151 25485 24871 1 19 . 1 1 235 235 GLN H H 235 8.296 8.296 8.710 -0.414 25485 24872 1 19 . 1 1 236 236 LYS N N 236 123.678 123.678 117.888 5.790 25485 24873 1 19 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.250 -0.168 25485 24874 1 19 . 1 1 236 236 LYS C C 236 178.169 178.169 177.582 0.587 25485 24875 1 19 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.478 0.897 25485 24876 1 19 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.848 0.130 25485 24877 1 19 . 1 1 236 236 LYS H H 236 8.024 8.024 7.535 0.489 25485 24878 1 19 . 1 1 237 237 LEU N N 237 116.873 116.873 119.243 -2.370 25485 24879 1 19 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.376 -0.389 25485 24880 1 19 . 1 1 237 237 LEU C C 237 177.893 177.893 177.812 0.081 25485 24881 1 19 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.470 0.969 25485 24882 1 19 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.916 0.697 25485 24883 1 19 . 1 1 237 237 LEU H H 237 6.888 6.888 7.618 -0.730 25485 24884 1 19 . 1 1 238 238 TYR N N 238 112.237 112.237 117.875 -5.638 25485 24885 1 19 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.488 0.163 25485 24886 1 19 . 1 1 238 238 TYR C C 238 176.082 176.082 176.790 -0.708 25485 24887 1 19 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.444 -0.808 25485 24888 1 19 . 1 1 238 238 TYR CB C 238 41.398 41.398 40.242 1.157 25485 24889 1 19 . 1 1 238 238 TYR H H 238 7.445 7.445 8.856 -1.411 25485 24890 1 19 . 1 1 239 239 GLY N N 239 110.906 110.906 105.200 5.706 25485 24891 1 19 . 1 1 239 239 GLY C C 239 171.269 171.269 172.600 -1.331 25485 24892 1 19 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.308 -1.422 25485 24893 1 19 . 1 1 239 239 GLY H H 239 8.443 8.443 7.893 0.550 25485 24894 1 19 . 1 1 240 240 LYS N N 240 114.281 114.281 122.840 -8.559 25485 24895 1 19 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.490 0.248 25485 24896 1 19 . 1 1 240 240 LYS C C 240 177.527 177.527 176.673 0.854 25485 24897 1 19 . 1 1 240 240 LYS CA C 240 54.958 54.958 56.068 -1.110 25485 24898 1 19 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.581 0.694 25485 24899 1 19 . 1 1 240 240 LYS H H 240 7.873 7.873 8.450 -0.577 25485 24900 1 19 . 1 1 241 241 ARG N N 241 123.758 123.758 122.558 1.200 25485 24901 1 19 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.477 -0.480 25485 24902 1 19 . 1 1 241 241 ARG C C 241 176.026 176.026 175.287 0.739 25485 24903 1 19 . 1 1 241 241 ARG CA C 241 57.492 57.492 56.378 1.114 25485 24904 1 19 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.991 -0.620 25485 24905 1 19 . 1 1 241 241 ARG H H 241 7.742 7.742 8.502 -0.760 25485 24906 1 19 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.194 0.146 25485 24907 1 19 . 1 1 246 246 LYS C C 246 175.403 175.403 176.971 -1.568 25485 24908 1 19 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.431 0.078 25485 24909 1 19 . 1 1 246 246 LYS CB C 246 32.858 32.858 33.212 -0.354 25485 24910 1 20 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.408 -0.101 25485 24911 1 20 . 1 1 2 2 GLN C C 2 176.492 176.492 176.260 0.232 25485 24912 1 20 . 1 1 2 2 GLN CA C 2 56.749 56.749 55.473 1.276 25485 24913 1 20 . 1 1 2 2 GLN CB C 2 28.654 28.654 27.802 0.852 25485 24914 1 20 . 1 1 3 3 GLU N N 3 121.668 121.668 122.809 -1.141 25485 24915 1 20 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.092 -0.303 25485 24916 1 20 . 1 1 3 3 GLU C C 3 176.278 176.278 177.585 -1.307 25485 24917 1 20 . 1 1 3 3 GLU CA C 3 57.059 57.059 58.827 -1.768 25485 24918 1 20 . 1 1 3 3 GLU CB C 3 29.691 29.691 28.987 0.704 25485 24919 1 20 . 1 1 3 3 GLU H H 3 8.331 8.331 7.951 0.380 25485 24920 1 20 . 1 1 4 4 ALA N N 4 124.493 124.493 122.393 2.100 25485 24921 1 20 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.154 0.356 25485 24922 1 20 . 1 1 4 4 ALA C C 4 178.428 178.428 179.805 -1.377 25485 24923 1 20 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.562 0.115 25485 24924 1 20 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.091 0.618 25485 24925 1 20 . 1 1 4 4 ALA H H 4 8.131 8.131 8.326 -0.195 25485 24926 1 20 . 1 1 5 5 GLY N N 5 108.204 108.204 107.298 0.906 25485 24927 1 20 . 1 1 5 5 GLY C C 5 174.858 174.858 175.302 -0.444 25485 24928 1 20 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.009 1.652 25485 24929 1 20 . 1 1 5 5 GLY H H 5 8.279 8.279 8.032 0.247 25485 24930 1 20 . 1 1 6 6 GLY N N 6 108.820 108.820 107.796 1.024 25485 24931 1 20 . 1 1 6 6 GLY C C 6 174.189 174.189 173.935 0.254 25485 24932 1 20 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.620 -0.207 25485 24933 1 20 . 1 1 6 6 GLY H H 6 8.246 8.246 7.882 0.364 25485 24934 1 20 . 1 1 7 7 MET N N 7 119.938 119.938 120.255 -0.317 25485 24935 1 20 . 1 1 7 7 MET HA H 7 4.659 4.659 4.780 -0.121 25485 24936 1 20 . 1 1 7 7 MET C C 7 176.191 176.191 176.529 -0.338 25485 24937 1 20 . 1 1 7 7 MET CA C 7 54.799 54.799 54.369 0.430 25485 24938 1 20 . 1 1 7 7 MET CB C 7 33.046 33.046 33.925 -0.879 25485 24939 1 20 . 1 1 7 7 MET H H 7 8.005 8.005 7.856 0.149 25485 24940 1 20 . 1 1 8 8 SER N N 8 118.919 118.919 116.590 2.329 25485 24941 1 20 . 1 1 8 8 SER HA H 8 4.239 4.239 4.469 -0.230 25485 24942 1 20 . 1 1 8 8 SER C C 8 174.949 174.949 175.530 -0.581 25485 24943 1 20 . 1 1 8 8 SER CA C 8 58.160 58.160 58.138 0.022 25485 24944 1 20 . 1 1 8 8 SER CB C 8 65.440 65.440 64.050 1.390 25485 24945 1 20 . 1 1 8 8 SER H H 8 8.731 8.731 8.314 0.417 25485 24946 1 20 . 1 1 9 9 GLU N N 9 122.442 122.442 121.701 0.741 25485 24947 1 20 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.089 0.232 25485 24948 1 20 . 1 1 9 9 GLU C C 9 178.604 178.604 178.812 -0.208 25485 24949 1 20 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.533 -0.066 25485 24950 1 20 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.545 -0.369 25485 24951 1 20 . 1 1 9 9 GLU H H 9 8.901 8.901 8.832 0.069 25485 24952 1 20 . 1 1 10 10 LEU N N 10 120.568 120.568 119.142 1.426 25485 24953 1 20 . 1 1 10 10 LEU C C 10 179.307 179.307 178.881 0.426 25485 24954 1 20 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.228 -0.748 25485 24955 1 20 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.761 -0.186 25485 24956 1 20 . 1 1 10 10 LEU H H 10 8.020 8.020 8.255 -0.235 25485 24957 1 20 . 1 1 11 11 GLN N N 11 119.930 119.930 118.028 1.902 25485 24958 1 20 . 1 1 11 11 GLN HA H 11 4.134 4.134 3.965 0.169 25485 24959 1 20 . 1 1 11 11 GLN C C 11 178.330 178.330 178.537 -0.207 25485 24960 1 20 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.468 0.350 25485 24961 1 20 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.277 -0.413 25485 24962 1 20 . 1 1 11 11 GLN H H 11 7.811 7.811 7.605 0.206 25485 24963 1 20 . 1 1 12 12 TRP N N 12 121.031 121.031 121.074 -0.043 25485 24964 1 20 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.353 0.061 25485 24965 1 20 . 1 1 12 12 TRP C C 12 178.874 178.874 177.953 0.921 25485 24966 1 20 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.165 0.342 25485 24967 1 20 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.572 -0.185 25485 24968 1 20 . 1 1 12 12 TRP H H 12 8.205 8.205 7.618 0.587 25485 24969 1 20 . 1 1 13 13 GLU N N 13 121.877 121.877 119.164 2.713 25485 24970 1 20 . 1 1 13 13 GLU C C 13 179.425 179.425 178.858 0.567 25485 24971 1 20 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.596 0.441 25485 24972 1 20 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.381 -0.459 25485 24973 1 20 . 1 1 13 13 GLU H H 13 8.434 8.434 8.232 0.202 25485 24974 1 20 . 1 1 14 14 GLN N N 14 120.449 120.449 118.771 1.678 25485 24975 1 20 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.951 0.287 25485 24976 1 20 . 1 1 14 14 GLN C C 14 179.210 179.210 177.738 1.472 25485 24977 1 20 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.635 0.247 25485 24978 1 20 . 1 1 14 14 GLN CB C 14 27.750 27.750 27.997 -0.247 25485 24979 1 20 . 1 1 14 14 GLN H H 14 8.124 8.124 7.865 0.259 25485 24980 1 20 . 1 1 15 15 ALA N N 15 123.114 123.114 120.538 2.576 25485 24981 1 20 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.517 0.873 25485 24982 1 20 . 1 1 15 15 ALA C C 15 179.352 179.352 179.034 0.318 25485 24983 1 20 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.121 -0.156 25485 24984 1 20 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.701 0.962 25485 24985 1 20 . 1 1 15 15 ALA H H 15 8.344 8.344 7.389 0.955 25485 24986 1 20 . 1 1 16 16 GLN N N 16 117.718 117.718 117.518 0.200 25485 24987 1 20 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.889 -0.107 25485 24988 1 20 . 1 1 16 16 GLN C C 16 177.719 177.719 178.211 -0.492 25485 24989 1 20 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.998 1.283 25485 24990 1 20 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.489 0.047 25485 24991 1 20 . 1 1 16 16 GLN H H 16 8.500 8.500 7.592 0.908 25485 24992 1 20 . 1 1 17 17 ASP N N 17 120.040 120.040 120.148 -0.108 25485 24993 1 20 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.373 0.163 25485 24994 1 20 . 1 1 17 17 ASP C C 17 177.630 177.630 178.514 -0.884 25485 24995 1 20 . 1 1 17 17 ASP CA C 17 57.805 57.805 58.295 -0.490 25485 24996 1 20 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.863 1.001 25485 24997 1 20 . 1 1 17 17 ASP H H 17 7.871 7.871 7.490 0.381 25485 24998 1 20 . 1 1 18 18 TYR N N 18 122.465 122.465 119.352 3.113 25485 24999 1 20 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.007 0.183 25485 25000 1 20 . 1 1 18 18 TYR C C 18 178.439 178.439 177.495 0.944 25485 25001 1 20 . 1 1 18 18 TYR CA C 18 61.846 61.846 59.892 1.954 25485 25002 1 20 . 1 1 18 18 TYR CB C 18 39.940 39.940 37.914 2.026 25485 25003 1 20 . 1 1 18 18 TYR H H 18 8.244 8.244 8.374 -0.130 25485 25004 1 20 . 1 1 19 19 LEU N N 19 117.635 117.635 117.335 0.300 25485 25005 1 20 . 1 1 19 19 LEU HA H 19 4.132 4.132 3.416 0.716 25485 25006 1 20 . 1 1 19 19 LEU C C 19 180.940 180.940 178.332 2.608 25485 25007 1 20 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.897 0.608 25485 25008 1 20 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.482 -0.884 25485 25009 1 20 . 1 1 19 19 LEU H H 19 8.713 8.713 7.472 1.241 25485 25010 1 20 . 1 1 20 20 LYS N N 20 124.594 124.594 119.565 5.029 25485 25011 1 20 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.017 0.067 25485 25012 1 20 . 1 1 20 20 LYS C C 20 178.387 178.387 178.305 0.082 25485 25013 1 20 . 1 1 20 20 LYS CA C 20 59.805 59.805 59.135 0.670 25485 25014 1 20 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.410 0.046 25485 25015 1 20 . 1 1 20 20 LYS H H 20 8.815 8.815 7.332 1.483 25485 25016 1 20 . 1 1 21 21 ARG N N 21 117.535 117.535 116.606 0.929 25485 25017 1 20 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.322 -0.603 25485 25018 1 20 . 1 1 21 21 ARG C C 21 178.498 178.498 179.233 -0.735 25485 25019 1 20 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.387 0.857 25485 25020 1 20 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.176 0.265 25485 25021 1 20 . 1 1 21 21 ARG H H 21 7.810 7.810 7.450 0.360 25485 25022 1 20 . 1 1 22 22 PHE N N 22 112.113 112.113 118.180 -6.067 25485 25023 1 20 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.129 0.782 25485 25024 1 20 . 1 1 22 22 PHE C C 22 174.875 174.875 175.753 -0.878 25485 25025 1 20 . 1 1 22 22 PHE CA C 22 57.475 57.475 59.690 -2.215 25485 25026 1 20 . 1 1 22 22 PHE CB C 22 39.169 39.169 38.168 1.001 25485 25027 1 20 . 1 1 22 22 PHE H H 22 8.010 8.010 7.641 0.369 25485 25028 1 20 . 1 1 23 23 TYR N N 23 116.187 116.187 116.106 0.081 25485 25029 1 20 . 1 1 23 23 TYR C C 23 173.455 173.455 176.533 -3.078 25485 25030 1 20 . 1 1 23 23 TYR CA C 23 58.427 58.427 58.795 -0.368 25485 25031 1 20 . 1 1 23 23 TYR CB C 23 39.529 39.529 40.037 -0.508 25485 25032 1 20 . 1 1 23 23 TYR H H 23 7.680 7.680 7.311 0.369 25485 25033 1 20 . 1 1 24 24 LEU N N 24 115.570 115.570 114.961 0.609 25485 25034 1 20 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.683 -0.533 25485 25035 1 20 . 1 1 24 24 LEU C C 24 176.661 176.661 174.905 1.756 25485 25036 1 20 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.954 0.198 25485 25037 1 20 . 1 1 24 24 LEU CB C 24 36.863 36.863 44.982 -8.119 25485 25038 1 20 . 1 1 24 24 LEU H H 24 7.238 7.238 7.886 -0.648 25485 25039 1 20 . 1 1 25 25 TYR N N 25 119.901 119.901 119.478 0.423 25485 25040 1 20 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.683 -0.324 25485 25041 1 20 . 1 1 25 25 TYR C C 25 173.784 173.784 173.495 0.289 25485 25042 1 20 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.832 0.415 25485 25043 1 20 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.292 -0.213 25485 25044 1 20 . 1 1 25 25 TYR H H 25 7.845 7.845 8.158 -0.313 25485 25045 1 20 . 1 1 26 26 ASP N N 26 129.338 129.338 125.929 3.409 25485 25046 1 20 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.093 -0.642 25485 25047 1 20 . 1 1 26 26 ASP C C 26 175.282 175.282 176.749 -1.467 25485 25048 1 20 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.845 -1.412 25485 25049 1 20 . 1 1 26 26 ASP CB C 26 41.249 41.249 43.262 -2.013 25485 25050 1 20 . 1 1 26 26 ASP H H 26 8.108 8.108 8.550 -0.442 25485 25051 1 20 . 1 1 27 27 SER C C 27 175.204 175.204 176.194 -0.990 25485 25052 1 20 . 1 1 27 27 SER CA C 27 59.424 59.424 59.801 -0.377 25485 25053 1 20 . 1 1 27 27 SER CB C 27 63.535 63.535 63.621 -0.086 25485 25054 1 20 . 1 1 28 28 GLU N N 28 122.058 122.058 121.622 0.436 25485 25055 1 20 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.217 0.108 25485 25056 1 20 . 1 1 28 28 GLU C C 28 177.073 177.073 177.315 -0.242 25485 25057 1 20 . 1 1 28 28 GLU CA C 28 57.212 57.212 57.686 -0.474 25485 25058 1 20 . 1 1 28 28 GLU CB C 28 29.570 29.570 28.980 0.590 25485 25059 1 20 . 1 1 28 28 GLU H H 28 8.255 8.255 8.684 -0.429 25485 25060 1 20 . 1 1 29 29 THR N N 29 114.161 114.161 113.683 0.478 25485 25061 1 20 . 1 1 29 29 THR HA H 29 4.260 4.260 4.214 0.046 25485 25062 1 20 . 1 1 29 29 THR C C 29 174.591 174.591 175.186 -0.595 25485 25063 1 20 . 1 1 29 29 THR CA C 29 61.976 61.976 62.521 -0.545 25485 25064 1 20 . 1 1 29 29 THR CB C 29 69.385 69.385 68.574 0.811 25485 25065 1 20 . 1 1 29 29 THR H H 29 7.498 7.498 7.493 0.005 25485 25066 1 20 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.116 0.102 25485 25067 1 20 . 1 1 30 30 LYS H H 30 8.218 8.218 7.574 0.644 25485 25068 1 20 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.488 -0.064 25485 25069 1 20 . 1 1 31 31 ASN CB C 31 39.133 39.133 38.161 0.972 25485 25070 1 20 . 1 1 32 32 ALA N N 32 126.484 126.484 122.793 3.691 25485 25071 1 20 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.169 0.127 25485 25072 1 20 . 1 1 32 32 ALA C C 32 178.012 178.012 178.822 -0.810 25485 25073 1 20 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.977 -1.217 25485 25074 1 20 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.088 -0.318 25485 25075 1 20 . 1 1 32 32 ALA H H 32 8.411 8.411 8.717 -0.306 25485 25076 1 20 . 1 1 33 33 ASN N N 33 116.885 116.885 116.575 0.310 25485 25077 1 20 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.493 0.205 25485 25078 1 20 . 1 1 33 33 ASN C C 33 176.240 176.240 177.639 -1.399 25485 25079 1 20 . 1 1 33 33 ASN CA C 33 54.187 54.187 56.330 -2.143 25485 25080 1 20 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.164 0.421 25485 25081 1 20 . 1 1 33 33 ASN H H 33 8.309 8.309 8.562 -0.253 25485 25082 1 20 . 1 1 34 34 SER N N 34 116.836 116.836 116.375 0.461 25485 25083 1 20 . 1 1 34 34 SER HA H 34 4.544 4.544 4.307 0.237 25485 25084 1 20 . 1 1 34 34 SER C C 34 175.253 175.253 176.352 -1.099 25485 25085 1 20 . 1 1 34 34 SER CA C 34 59.583 59.583 60.704 -1.121 25485 25086 1 20 . 1 1 34 34 SER CB C 34 63.919 63.919 63.089 0.830 25485 25087 1 20 . 1 1 34 34 SER H H 34 8.115 8.115 7.776 0.339 25485 25088 1 20 . 1 1 35 35 LEU N N 35 125.355 125.355 124.016 1.339 25485 25089 1 20 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.019 -0.443 25485 25090 1 20 . 1 1 35 35 LEU C C 35 177.973 177.973 178.572 -0.599 25485 25091 1 20 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.157 0.340 25485 25092 1 20 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.923 -1.231 25485 25093 1 20 . 1 1 35 35 LEU H H 35 8.312 8.312 7.541 0.771 25485 25094 1 20 . 1 1 36 36 GLU N N 36 119.201 119.201 118.109 1.092 25485 25095 1 20 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.971 -0.057 25485 25096 1 20 . 1 1 36 36 GLU C C 36 178.141 178.141 178.768 -0.627 25485 25097 1 20 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.574 0.085 25485 25098 1 20 . 1 1 36 36 GLU CB C 36 29.313 29.313 29.174 0.139 25485 25099 1 20 . 1 1 36 36 GLU H H 36 8.225 8.225 7.857 0.368 25485 25100 1 20 . 1 1 37 37 ALA N N 37 120.746 120.746 122.538 -1.792 25485 25101 1 20 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.052 0.027 25485 25102 1 20 . 1 1 37 37 ALA C C 37 181.485 181.485 179.957 1.528 25485 25103 1 20 . 1 1 37 37 ALA CA C 37 55.459 55.459 55.127 0.332 25485 25104 1 20 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.167 -0.000 25485 25105 1 20 . 1 1 37 37 ALA H H 37 7.917 7.917 7.591 0.326 25485 25106 1 20 . 1 1 38 38 LYS N N 38 119.326 119.326 118.512 0.814 25485 25107 1 20 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.127 0.204 25485 25108 1 20 . 1 1 38 38 LYS C C 38 177.946 177.946 179.011 -1.065 25485 25109 1 20 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.946 -1.242 25485 25110 1 20 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.553 -0.753 25485 25111 1 20 . 1 1 38 38 LYS H H 38 8.216 8.216 8.006 0.210 25485 25112 1 20 . 1 1 39 39 LEU N N 39 122.736 122.736 120.864 1.872 25485 25113 1 20 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.975 -0.034 25485 25114 1 20 . 1 1 39 39 LEU C C 39 178.819 178.819 178.599 0.220 25485 25115 1 20 . 1 1 39 39 LEU CA C 39 58.081 58.081 57.927 0.154 25485 25116 1 20 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.531 -0.903 25485 25117 1 20 . 1 1 39 39 LEU H H 39 8.666 8.666 8.342 0.324 25485 25118 1 20 . 1 1 40 40 LYS N N 40 118.411 118.411 118.839 -0.428 25485 25119 1 20 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.911 0.727 25485 25120 1 20 . 1 1 40 40 LYS C C 40 179.329 179.329 178.403 0.926 25485 25121 1 20 . 1 1 40 40 LYS CA C 40 60.133 60.133 60.234 -0.101 25485 25122 1 20 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.340 -0.555 25485 25123 1 20 . 1 1 40 40 LYS H H 40 8.227 8.227 7.898 0.329 25485 25124 1 20 . 1 1 41 41 GLU N N 41 121.329 121.329 117.926 3.403 25485 25125 1 20 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.119 -0.026 25485 25126 1 20 . 1 1 41 41 GLU C C 41 178.989 178.989 178.984 0.005 25485 25127 1 20 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.276 0.484 25485 25128 1 20 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.884 0.952 25485 25129 1 20 . 1 1 41 41 GLU H H 41 7.718 7.718 7.753 -0.035 25485 25130 1 20 . 1 1 42 42 MET N N 42 123.817 123.817 118.562 5.255 25485 25131 1 20 . 1 1 42 42 MET HA H 42 4.107 4.107 4.435 -0.328 25485 25132 1 20 . 1 1 42 42 MET C C 42 177.719 177.719 178.060 -0.341 25485 25133 1 20 . 1 1 42 42 MET CA C 42 59.912 59.912 59.102 0.810 25485 25134 1 20 . 1 1 42 42 MET CB C 42 30.506 30.506 32.474 -1.968 25485 25135 1 20 . 1 1 42 42 MET H H 42 7.657 7.657 7.425 0.233 25485 25136 1 20 . 1 1 43 43 GLN N N 43 119.998 119.998 118.172 1.826 25485 25137 1 20 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.118 -0.313 25485 25138 1 20 . 1 1 43 43 GLN C C 43 177.604 177.604 178.924 -1.320 25485 25139 1 20 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.913 1.052 25485 25140 1 20 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.761 -1.206 25485 25141 1 20 . 1 1 43 43 GLN H H 43 8.910 8.910 7.711 1.199 25485 25142 1 20 . 1 1 44 44 LYS N N 44 119.165 119.165 119.867 -0.702 25485 25143 1 20 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.263 -0.208 25485 25144 1 20 . 1 1 44 44 LYS C C 44 179.991 179.991 178.610 1.381 25485 25145 1 20 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.551 1.010 25485 25146 1 20 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.094 0.204 25485 25147 1 20 . 1 1 44 44 LYS H H 44 8.507 8.507 7.667 0.840 25485 25148 1 20 . 1 1 45 45 PHE N N 45 123.602 123.602 120.780 2.822 25485 25149 1 20 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.310 -0.409 25485 25150 1 20 . 1 1 45 45 PHE C C 45 177.606 177.606 177.343 0.263 25485 25151 1 20 . 1 1 45 45 PHE CA C 45 63.034 63.034 61.151 1.883 25485 25152 1 20 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.331 0.535 25485 25153 1 20 . 1 1 45 45 PHE H H 45 8.445 8.445 7.864 0.581 25485 25154 1 20 . 1 1 46 46 PHE N N 46 112.715 112.715 116.443 -3.728 25485 25155 1 20 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.456 0.141 25485 25156 1 20 . 1 1 46 46 PHE C C 46 175.285 175.285 177.314 -2.029 25485 25157 1 20 . 1 1 46 46 PHE CA C 46 60.675 60.675 60.627 0.048 25485 25158 1 20 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.678 -1.219 25485 25159 1 20 . 1 1 46 46 PHE H H 46 8.272 8.272 8.609 -0.337 25485 25160 1 20 . 1 1 47 47 GLY N N 47 110.438 110.438 107.519 2.919 25485 25161 1 20 . 1 1 47 47 GLY C C 47 174.935 174.935 174.275 0.660 25485 25162 1 20 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.394 1.617 25485 25163 1 20 . 1 1 47 47 GLY H H 47 7.926 7.926 8.438 -0.512 25485 25164 1 20 . 1 1 48 48 LEU N N 48 121.830 121.830 119.144 2.686 25485 25165 1 20 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.677 0.247 25485 25166 1 20 . 1 1 48 48 LEU C C 48 174.009 174.009 176.008 -1.999 25485 25167 1 20 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.488 -1.653 25485 25168 1 20 . 1 1 48 48 LEU CB C 48 41.463 41.463 41.052 0.411 25485 25169 1 20 . 1 1 48 48 LEU H H 48 8.762 8.762 7.652 1.110 25485 25170 1 20 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.415 -0.177 25485 25171 1 20 . 1 1 49 49 PRO C C 49 176.874 176.874 176.799 0.075 25485 25172 1 20 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.749 -0.231 25485 25173 1 20 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.896 -0.817 25485 25174 1 20 . 1 1 50 50 ILE N N 50 126.859 126.859 118.328 8.531 25485 25175 1 20 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.050 0.051 25485 25176 1 20 . 1 1 50 50 ILE C C 50 176.540 176.540 175.639 0.901 25485 25177 1 20 . 1 1 50 50 ILE CA C 50 60.956 60.956 62.034 -1.078 25485 25178 1 20 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.099 -0.706 25485 25179 1 20 . 1 1 50 50 ILE H H 50 8.548 8.548 7.863 0.685 25485 25180 1 20 . 1 1 51 51 THR N N 51 116.443 116.443 117.937 -1.494 25485 25181 1 20 . 1 1 51 51 THR HA H 51 4.584 4.584 4.512 0.072 25485 25182 1 20 . 1 1 51 51 THR C C 51 176.672 176.672 175.320 1.352 25485 25183 1 20 . 1 1 51 51 THR CA C 51 60.979 60.979 60.886 0.093 25485 25184 1 20 . 1 1 51 51 THR CB C 51 71.505 71.505 70.530 0.975 25485 25185 1 20 . 1 1 51 51 THR H H 51 8.001 8.001 7.822 0.179 25485 25186 1 20 . 1 1 52 52 GLY N N 52 112.719 112.719 110.295 2.424 25485 25187 1 20 . 1 1 52 52 GLY C C 52 170.609 170.609 174.677 -4.068 25485 25188 1 20 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.801 0.945 25485 25189 1 20 . 1 1 52 52 GLY H H 52 9.499 9.499 8.482 1.017 25485 25190 1 20 . 1 1 53 53 MET N N 53 116.621 116.621 119.931 -3.310 25485 25191 1 20 . 1 1 53 53 MET HA H 53 4.023 4.023 4.593 -0.570 25485 25192 1 20 . 1 1 53 53 MET C C 53 174.695 174.695 174.920 -0.225 25485 25193 1 20 . 1 1 53 53 MET CA C 53 53.460 53.460 54.554 -1.094 25485 25194 1 20 . 1 1 53 53 MET CB C 53 35.408 35.408 33.901 1.508 25485 25195 1 20 . 1 1 53 53 MET H H 53 7.993 7.993 7.657 0.336 25485 25196 1 20 . 1 1 54 54 LEU N N 54 122.679 122.679 123.875 -1.196 25485 25197 1 20 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.405 -0.654 25485 25198 1 20 . 1 1 54 54 LEU C C 54 174.784 174.784 174.432 0.352 25485 25199 1 20 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.365 -0.064 25485 25200 1 20 . 1 1 54 54 LEU CB C 54 42.010 42.010 42.887 -0.877 25485 25201 1 20 . 1 1 54 54 LEU H H 54 7.940 7.940 8.441 -0.501 25485 25202 1 20 . 1 1 55 55 ASN N N 55 115.797 115.797 119.060 -3.263 25485 25203 1 20 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.663 0.086 25485 25204 1 20 . 1 1 55 55 ASN C C 55 175.459 175.459 174.852 0.607 25485 25205 1 20 . 1 1 55 55 ASN CA C 55 51.843 51.843 54.185 -2.342 25485 25206 1 20 . 1 1 55 55 ASN CB C 55 40.357 40.357 39.123 1.234 25485 25207 1 20 . 1 1 55 55 ASN H H 55 6.543 6.543 8.424 -1.881 25485 25208 1 20 . 1 1 56 56 SER N N 56 121.507 121.507 115.271 6.236 25485 25209 1 20 . 1 1 56 56 SER HA H 56 4.638 4.638 4.484 0.154 25485 25210 1 20 . 1 1 56 56 SER C C 56 175.727 175.727 175.615 0.112 25485 25211 1 20 . 1 1 56 56 SER CA C 56 57.932 57.932 59.641 -1.709 25485 25212 1 20 . 1 1 56 56 SER CB C 56 63.786 63.786 63.899 -0.113 25485 25213 1 20 . 1 1 56 56 SER H H 56 8.213 8.213 8.001 0.212 25485 25214 1 20 . 1 1 57 57 ARG N N 57 122.951 122.951 120.583 2.368 25485 25215 1 20 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.419 -0.218 25485 25216 1 20 . 1 1 57 57 ARG C C 57 178.560 178.560 178.303 0.257 25485 25217 1 20 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.665 -0.233 25485 25218 1 20 . 1 1 57 57 ARG CB C 57 29.105 29.105 30.056 -0.951 25485 25219 1 20 . 1 1 57 57 ARG H H 57 7.895 7.895 8.454 -0.559 25485 25220 1 20 . 1 1 58 58 VAL N N 58 118.778 118.778 119.854 -1.076 25485 25221 1 20 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.528 -0.197 25485 25222 1 20 . 1 1 58 58 VAL C C 58 177.370 177.370 177.403 -0.033 25485 25223 1 20 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.610 -0.228 25485 25224 1 20 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.529 0.680 25485 25225 1 20 . 1 1 58 58 VAL H H 58 7.583 7.583 7.901 -0.318 25485 25226 1 20 . 1 1 59 59 ILE N N 59 119.159 119.159 118.028 1.131 25485 25227 1 20 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.617 -0.204 25485 25228 1 20 . 1 1 59 59 ILE C C 59 177.067 177.067 177.755 -0.688 25485 25229 1 20 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.149 0.484 25485 25230 1 20 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.797 -0.101 25485 25231 1 20 . 1 1 59 59 ILE H H 59 7.323 7.323 8.010 -0.687 25485 25232 1 20 . 1 1 60 60 GLU N N 60 119.367 119.367 119.957 -0.590 25485 25233 1 20 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.959 -0.221 25485 25234 1 20 . 1 1 60 60 GLU C C 60 179.978 179.978 179.271 0.707 25485 25235 1 20 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.986 -0.728 25485 25236 1 20 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.639 -0.251 25485 25237 1 20 . 1 1 60 60 GLU H H 60 7.879 7.879 7.467 0.412 25485 25238 1 20 . 1 1 61 61 ILE N N 61 118.816 118.816 114.981 3.835 25485 25239 1 20 . 1 1 61 61 ILE HA H 61 3.439 3.439 4.000 -0.561 25485 25240 1 20 . 1 1 61 61 ILE C C 61 179.033 179.033 177.051 1.982 25485 25241 1 20 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.068 0.770 25485 25242 1 20 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.953 -1.054 25485 25243 1 20 . 1 1 61 61 ILE H H 61 7.246 7.246 7.679 -0.433 25485 25244 1 20 . 1 1 62 62 MET N N 62 119.986 119.986 117.178 2.808 25485 25245 1 20 . 1 1 62 62 MET HA H 62 3.444 3.444 4.329 -0.885 25485 25246 1 20 . 1 1 62 62 MET C C 62 176.185 176.185 177.897 -1.712 25485 25247 1 20 . 1 1 62 62 MET CA C 62 59.014 59.014 57.816 1.198 25485 25248 1 20 . 1 1 62 62 MET CB C 62 31.250 31.250 32.893 -1.643 25485 25249 1 20 . 1 1 62 62 MET H H 62 7.835 7.835 7.381 0.454 25485 25250 1 20 . 1 1 63 63 GLN N N 63 116.163 116.163 115.158 1.005 25485 25251 1 20 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.610 -0.332 25485 25252 1 20 . 1 1 63 63 GLN C C 63 176.727 176.727 176.987 -0.260 25485 25253 1 20 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.383 -0.245 25485 25254 1 20 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.680 -0.614 25485 25255 1 20 . 1 1 63 63 GLN H H 63 7.454 7.454 7.654 -0.200 25485 25256 1 20 . 1 1 64 64 LYS N N 64 121.430 121.430 122.131 -0.701 25485 25257 1 20 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.443 0.100 25485 25258 1 20 . 1 1 64 64 LYS C C 64 174.724 174.724 174.926 -0.202 25485 25259 1 20 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.891 0.626 25485 25260 1 20 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.405 -0.808 25485 25261 1 20 . 1 1 64 64 LYS H H 64 7.483 7.483 7.848 -0.365 25485 25262 1 20 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.531 -2.095 25485 25263 1 20 . 1 1 65 65 PRO C C 65 176.158 176.158 176.266 -0.108 25485 25264 1 20 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.161 -0.273 25485 25265 1 20 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.251 -0.418 25485 25266 1 20 . 1 1 66 66 ARG N N 66 112.697 112.697 122.472 -9.775 25485 25267 1 20 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.530 -0.122 25485 25268 1 20 . 1 1 66 66 ARG C C 66 174.478 174.478 174.079 0.399 25485 25269 1 20 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.596 -1.960 25485 25270 1 20 . 1 1 66 66 ARG CB C 66 34.673 34.673 32.023 2.650 25485 25271 1 20 . 1 1 66 66 ARG H H 66 8.146 8.146 8.622 -0.476 25485 25272 1 20 . 1 1 67 67 CYS N N 67 121.740 121.740 116.141 5.599 25485 25273 1 20 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.844 -0.404 25485 25274 1 20 . 1 1 67 67 CYS C C 67 175.659 175.659 175.324 0.335 25485 25275 1 20 . 1 1 67 67 CYS CA C 67 59.195 59.195 56.472 2.723 25485 25276 1 20 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.865 -1.659 25485 25277 1 20 . 1 1 67 67 CYS H H 67 7.757 7.757 7.934 -0.177 25485 25278 1 20 . 1 1 68 68 GLY N N 68 116.217 116.217 110.071 6.146 25485 25279 1 20 . 1 1 68 68 GLY C C 68 172.210 172.210 173.673 -1.463 25485 25280 1 20 . 1 1 68 68 GLY CA C 68 46.559 46.559 44.886 1.673 25485 25281 1 20 . 1 1 68 68 GLY H H 68 9.704 9.704 9.326 0.378 25485 25282 1 20 . 1 1 69 69 VAL N N 69 126.372 126.372 118.884 7.488 25485 25283 1 20 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.428 -0.597 25485 25284 1 20 . 1 1 69 69 VAL C C 69 173.538 173.538 173.881 -0.343 25485 25285 1 20 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.372 2.996 25485 25286 1 20 . 1 1 69 69 VAL CB C 69 32.523 32.523 33.175 -0.652 25485 25287 1 20 . 1 1 69 69 VAL H H 69 9.113 9.113 7.332 1.781 25485 25288 1 20 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.690 0.260 25485 25289 1 20 . 1 1 70 70 PRO C C 70 175.019 175.019 176.360 -1.341 25485 25290 1 20 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.500 0.848 25485 25291 1 20 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.811 -0.453 25485 25292 1 20 . 1 1 71 71 ASP N N 71 118.986 118.986 118.977 0.009 25485 25293 1 20 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.897 -0.464 25485 25294 1 20 . 1 1 71 71 ASP C C 71 175.166 175.166 175.113 0.053 25485 25295 1 20 . 1 1 71 71 ASP CA C 71 55.368 55.368 53.832 1.536 25485 25296 1 20 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.138 -1.274 25485 25297 1 20 . 1 1 71 71 ASP H H 71 8.054 8.054 8.264 -0.210 25485 25298 1 20 . 1 1 72 72 VAL N N 72 112.953 112.953 115.020 -2.067 25485 25299 1 20 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.438 -0.142 25485 25300 1 20 . 1 1 72 72 VAL C C 72 174.330 174.330 174.762 -0.432 25485 25301 1 20 . 1 1 72 72 VAL CA C 72 59.645 59.645 61.626 -1.981 25485 25302 1 20 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.601 0.271 25485 25303 1 20 . 1 1 72 72 VAL H H 72 6.430 6.430 7.835 -1.405 25485 25304 1 20 . 1 1 73 73 ALA N N 73 125.869 125.869 129.744 -3.875 25485 25305 1 20 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.674 -0.369 25485 25306 1 20 . 1 1 73 73 ALA C C 73 177.382 177.382 175.947 1.435 25485 25307 1 20 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.574 0.475 25485 25308 1 20 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.780 -0.829 25485 25309 1 20 . 1 1 73 73 ALA H H 73 8.177 8.177 8.246 -0.069 25485 25310 1 20 . 1 1 74 74 GLU N N 74 120.724 120.724 118.151 2.573 25485 25311 1 20 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.427 -0.324 25485 25312 1 20 . 1 1 74 74 GLU C C 74 176.246 176.246 174.904 1.342 25485 25313 1 20 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.132 0.660 25485 25314 1 20 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.960 -2.175 25485 25315 1 20 . 1 1 74 74 GLU H H 74 8.381 8.381 8.320 0.061 25485 25316 1 20 . 1 1 75 75 TYR N N 75 121.473 121.473 120.643 0.830 25485 25317 1 20 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.298 0.147 25485 25318 1 20 . 1 1 75 75 TYR C C 75 175.633 175.633 175.722 -0.089 25485 25319 1 20 . 1 1 75 75 TYR CA C 75 58.327 58.327 59.095 -0.768 25485 25320 1 20 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.875 -0.462 25485 25321 1 20 . 1 1 75 75 TYR H H 75 8.065 8.065 8.257 -0.192 25485 25322 1 20 . 1 1 76 76 SER N N 76 117.860 117.860 118.205 -0.345 25485 25323 1 20 . 1 1 76 76 SER HA H 76 3.886 3.886 4.492 -0.606 25485 25324 1 20 . 1 1 76 76 SER C C 76 173.859 173.859 173.266 0.593 25485 25325 1 20 . 1 1 76 76 SER CA C 76 58.250 58.250 57.645 0.605 25485 25326 1 20 . 1 1 76 76 SER CB C 76 64.117 64.117 64.307 -0.190 25485 25327 1 20 . 1 1 76 76 SER H H 76 7.748 7.748 8.042 -0.294 25485 25328 1 20 . 1 1 77 77 LEU N N 77 123.789 123.789 122.640 1.149 25485 25329 1 20 . 1 1 77 77 LEU HA H 77 4.146 4.146 4.546 -0.400 25485 25330 1 20 . 1 1 77 77 LEU C C 77 176.451 176.451 175.701 0.750 25485 25331 1 20 . 1 1 77 77 LEU CA C 77 55.464 55.464 54.405 1.059 25485 25332 1 20 . 1 1 77 77 LEU CB C 77 41.957 41.957 39.620 2.337 25485 25333 1 20 . 1 1 77 77 LEU H H 77 7.979 7.979 8.505 -0.526 25485 25334 1 20 . 1 1 78 78 PHE N N 78 119.275 119.275 121.366 -2.091 25485 25335 1 20 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.439 0.437 25485 25336 1 20 . 1 1 78 78 PHE C C 78 173.844 173.844 175.259 -1.415 25485 25337 1 20 . 1 1 78 78 PHE CA C 78 55.372 55.372 55.819 -0.447 25485 25338 1 20 . 1 1 78 78 PHE CB C 78 39.164 39.164 38.631 0.533 25485 25339 1 20 . 1 1 78 78 PHE H H 78 7.827 7.827 7.714 0.113 25485 25340 1 20 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.402 -0.046 25485 25341 1 20 . 1 1 79 79 PRO C C 79 176.433 176.433 175.863 0.570 25485 25342 1 20 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.306 1.544 25485 25343 1 20 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.534 -0.842 25485 25344 1 20 . 1 1 80 80 ASN N N 80 118.057 118.057 119.213 -1.156 25485 25345 1 20 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.490 0.157 25485 25346 1 20 . 1 1 80 80 ASN C C 80 174.305 174.305 174.656 -0.351 25485 25347 1 20 . 1 1 80 80 ASN CA C 80 52.860 52.860 54.066 -1.206 25485 25348 1 20 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.142 1.441 25485 25349 1 20 . 1 1 80 80 ASN H H 80 8.068 8.068 8.487 -0.419 25485 25350 1 20 . 1 1 81 81 SER HA H 81 4.565 4.565 4.203 0.362 25485 25351 1 20 . 1 1 81 81 SER CA C 81 56.800 56.800 58.345 -1.545 25485 25352 1 20 . 1 1 81 81 SER CB C 81 63.128 63.128 62.250 0.878 25485 25353 1 20 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.391 0.070 25485 25354 1 20 . 1 1 82 82 PRO C C 82 174.589 174.589 176.485 -1.896 25485 25355 1 20 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.635 -0.989 25485 25356 1 20 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.069 -0.815 25485 25357 1 20 . 1 1 83 83 LYS N N 83 114.578 114.578 118.054 -3.476 25485 25358 1 20 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.422 -0.269 25485 25359 1 20 . 1 1 83 83 LYS C C 83 175.308 175.308 176.330 -1.022 25485 25360 1 20 . 1 1 83 83 LYS CA C 83 54.407 54.407 54.773 -0.366 25485 25361 1 20 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.354 1.064 25485 25362 1 20 . 1 1 83 83 LYS H H 83 7.356 7.356 7.621 -0.265 25485 25363 1 20 . 1 1 84 84 TRP N N 84 122.455 122.455 123.493 -1.038 25485 25364 1 20 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.557 -0.537 25485 25365 1 20 . 1 1 84 84 TRP C C 84 177.636 177.636 177.406 0.230 25485 25366 1 20 . 1 1 84 84 TRP CA C 84 57.471 57.471 59.199 -1.728 25485 25367 1 20 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.565 0.753 25485 25368 1 20 . 1 1 84 84 TRP H H 84 8.050 8.050 8.492 -0.442 25485 25369 1 20 . 1 1 85 85 THR N N 85 113.501 113.501 118.049 -4.548 25485 25370 1 20 . 1 1 85 85 THR HA H 85 4.573 4.573 4.471 0.102 25485 25371 1 20 . 1 1 85 85 THR C C 85 174.757 174.757 175.301 -0.544 25485 25372 1 20 . 1 1 85 85 THR CA C 85 62.130 62.130 61.886 0.244 25485 25373 1 20 . 1 1 85 85 THR CB C 85 69.107 69.107 69.341 -0.234 25485 25374 1 20 . 1 1 85 85 THR H H 85 8.861 8.861 8.774 0.087 25485 25375 1 20 . 1 1 86 86 SER N N 86 117.270 117.270 119.142 -1.872 25485 25376 1 20 . 1 1 86 86 SER HA H 86 4.741 4.741 4.426 0.315 25485 25377 1 20 . 1 1 86 86 SER C C 86 173.457 173.457 174.908 -1.451 25485 25378 1 20 . 1 1 86 86 SER CA C 86 56.739 56.739 59.069 -2.330 25485 25379 1 20 . 1 1 86 86 SER CB C 86 64.717 64.717 64.130 0.587 25485 25380 1 20 . 1 1 86 86 SER H H 86 7.743 7.743 8.478 -0.735 25485 25381 1 20 . 1 1 87 87 LYS N N 87 120.329 120.329 118.664 1.665 25485 25382 1 20 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.024 0.205 25485 25383 1 20 . 1 1 87 87 LYS CA C 87 57.592 57.592 56.412 1.180 25485 25384 1 20 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.930 -0.807 25485 25385 1 20 . 1 1 87 87 LYS H H 87 8.285 8.285 8.304 -0.019 25485 25386 1 20 . 1 1 88 88 VAL N N 88 117.531 117.531 115.143 2.388 25485 25387 1 20 . 1 1 88 88 VAL HA H 88 4.655 4.655 3.892 0.763 25485 25388 1 20 . 1 1 88 88 VAL C C 88 174.868 174.868 173.419 1.449 25485 25389 1 20 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.861 -0.766 25485 25390 1 20 . 1 1 88 88 VAL CB C 88 33.695 33.695 34.588 -0.893 25485 25391 1 20 . 1 1 88 88 VAL H H 88 7.428 7.428 7.059 0.369 25485 25392 1 20 . 1 1 89 89 VAL N N 89 131.452 131.452 124.659 6.793 25485 25393 1 20 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.140 0.019 25485 25394 1 20 . 1 1 89 89 VAL C C 89 175.758 175.758 175.199 0.559 25485 25395 1 20 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.563 0.158 25485 25396 1 20 . 1 1 89 89 VAL CB C 89 34.173 34.173 33.697 0.476 25485 25397 1 20 . 1 1 89 89 VAL H H 89 8.603 8.603 8.442 0.161 25485 25398 1 20 . 1 1 90 90 THR N N 90 118.206 118.206 115.755 2.451 25485 25399 1 20 . 1 1 90 90 THR HA H 90 5.649 5.649 5.576 0.073 25485 25400 1 20 . 1 1 90 90 THR C C 90 174.579 174.579 173.879 0.700 25485 25401 1 20 . 1 1 90 90 THR CA C 90 58.959 58.959 59.447 -0.488 25485 25402 1 20 . 1 1 90 90 THR CB C 90 72.288 72.288 72.858 -0.570 25485 25403 1 20 . 1 1 90 90 THR H H 90 9.021 9.021 7.817 1.204 25485 25404 1 20 . 1 1 91 91 TYR N N 91 118.117 118.117 115.288 2.829 25485 25405 1 20 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.556 0.142 25485 25406 1 20 . 1 1 91 91 TYR C C 91 171.233 171.233 172.669 -1.436 25485 25407 1 20 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.940 -0.508 25485 25408 1 20 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.023 1.237 25485 25409 1 20 . 1 1 91 91 TYR H H 91 8.555 8.555 8.069 0.486 25485 25410 1 20 . 1 1 92 92 ARG N N 92 120.252 120.252 120.077 0.175 25485 25411 1 20 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.641 0.056 25485 25412 1 20 . 1 1 92 92 ARG C C 92 173.932 173.932 174.422 -0.490 25485 25413 1 20 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.466 0.375 25485 25414 1 20 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.681 0.005 25485 25415 1 20 . 1 1 92 92 ARG H H 92 8.520 8.520 8.769 -0.249 25485 25416 1 20 . 1 1 93 93 ILE N N 93 128.305 128.305 126.559 1.746 25485 25417 1 20 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.327 0.305 25485 25418 1 20 . 1 1 93 93 ILE C C 93 175.468 175.468 176.564 -1.096 25485 25419 1 20 . 1 1 93 93 ILE CA C 93 61.228 61.228 60.016 1.212 25485 25420 1 20 . 1 1 93 93 ILE CB C 93 37.225 37.225 36.972 0.253 25485 25421 1 20 . 1 1 93 93 ILE H H 93 8.886 8.886 8.707 0.179 25485 25422 1 20 . 1 1 94 94 VAL N N 94 126.647 126.647 127.968 -1.321 25485 25423 1 20 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.111 -0.115 25485 25424 1 20 . 1 1 94 94 VAL C C 94 175.670 175.670 176.277 -0.607 25485 25425 1 20 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.884 -0.470 25485 25426 1 20 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.559 0.460 25485 25427 1 20 . 1 1 94 94 VAL H H 94 9.517 9.517 8.843 0.674 25485 25428 1 20 . 1 1 95 95 SER N N 95 113.398 113.398 112.709 0.689 25485 25429 1 20 . 1 1 95 95 SER HA H 95 4.701 4.701 4.683 0.018 25485 25430 1 20 . 1 1 95 95 SER C C 95 170.684 170.684 172.538 -1.854 25485 25431 1 20 . 1 1 95 95 SER CA C 95 56.945 56.945 57.219 -0.274 25485 25432 1 20 . 1 1 95 95 SER CB C 95 65.276 65.276 64.951 0.325 25485 25433 1 20 . 1 1 95 95 SER H H 95 7.463 7.463 7.675 -0.212 25485 25434 1 20 . 1 1 96 96 TYR N N 96 116.512 116.512 118.357 -1.845 25485 25435 1 20 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.688 -0.424 25485 25436 1 20 . 1 1 96 96 TYR C C 96 174.856 174.856 173.551 1.305 25485 25437 1 20 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.287 2.350 25485 25438 1 20 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.945 1.218 25485 25439 1 20 . 1 1 96 96 TYR H H 96 8.240 8.240 8.005 0.235 25485 25440 1 20 . 1 1 97 97 THR CA C 97 57.798 57.798 59.389 -1.591 25485 25441 1 20 . 1 1 97 97 THR CB C 97 67.420 67.420 69.851 -2.431 25485 25442 1 20 . 1 1 98 98 ARG N N 98 128.156 128.156 126.181 1.975 25485 25443 1 20 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.042 0.283 25485 25444 1 20 . 1 1 98 98 ARG C C 98 177.625 177.625 176.764 0.861 25485 25445 1 20 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.234 -1.020 25485 25446 1 20 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.515 -0.035 25485 25447 1 20 . 1 1 98 98 ARG H H 98 8.914 8.914 8.645 0.269 25485 25448 1 20 . 1 1 99 99 ASP N N 99 120.592 120.592 119.811 0.781 25485 25449 1 20 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.457 -0.076 25485 25450 1 20 . 1 1 99 99 ASP C C 99 175.679 175.679 176.173 -0.494 25485 25451 1 20 . 1 1 99 99 ASP CA C 99 56.436 56.436 56.513 -0.077 25485 25452 1 20 . 1 1 99 99 ASP CB C 99 42.370 42.370 42.058 0.312 25485 25453 1 20 . 1 1 99 99 ASP H H 99 8.708 8.708 7.571 1.137 25485 25454 1 20 . 1 1 100 100 LEU N N 100 116.829 116.829 117.399 -0.570 25485 25455 1 20 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.647 0.309 25485 25456 1 20 . 1 1 100 100 LEU C C 100 173.335 173.335 173.764 -0.429 25485 25457 1 20 . 1 1 100 100 LEU CA C 100 51.037 51.037 52.010 -0.973 25485 25458 1 20 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.819 1.448 25485 25459 1 20 . 1 1 100 100 LEU H H 100 6.916 6.916 7.641 -0.725 25485 25460 1 20 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.129 0.046 25485 25461 1 20 . 1 1 102 102 HIS C C 102 177.649 177.649 177.548 0.101 25485 25462 1 20 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.211 -0.538 25485 25463 1 20 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.014 -1.579 25485 25464 1 20 . 1 1 103 103 ILE N N 103 115.170 115.170 117.959 -2.789 25485 25465 1 20 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.839 0.334 25485 25466 1 20 . 1 1 103 103 ILE C C 103 177.214 177.214 177.151 0.063 25485 25467 1 20 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.295 -1.130 25485 25468 1 20 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.881 -0.116 25485 25469 1 20 . 1 1 103 103 ILE H H 103 8.234 8.234 8.124 0.110 25485 25470 1 20 . 1 1 104 104 THR N N 104 119.374 119.374 117.274 2.100 25485 25471 1 20 . 1 1 104 104 THR HA H 104 4.045 4.045 4.018 0.027 25485 25472 1 20 . 1 1 104 104 THR C C 104 175.612 175.612 176.481 -0.869 25485 25473 1 20 . 1 1 104 104 THR CA C 104 66.568 66.568 67.227 -0.659 25485 25474 1 20 . 1 1 104 104 THR CB C 104 68.077 68.077 68.559 -0.482 25485 25475 1 20 . 1 1 104 104 THR H H 104 6.947 6.947 7.671 -0.724 25485 25476 1 20 . 1 1 105 105 VAL N N 105 123.263 123.263 121.509 1.754 25485 25477 1 20 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.099 0.339 25485 25478 1 20 . 1 1 105 105 VAL C C 105 177.322 177.322 177.042 0.280 25485 25479 1 20 . 1 1 105 105 VAL CA C 105 67.947 67.947 67.652 0.295 25485 25480 1 20 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.506 -0.237 25485 25481 1 20 . 1 1 105 105 VAL H H 105 7.407 7.407 8.125 -0.718 25485 25482 1 20 . 1 1 106 106 ASP N N 106 119.972 119.972 119.509 0.463 25485 25483 1 20 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.408 -0.086 25485 25484 1 20 . 1 1 106 106 ASP C C 106 179.747 179.747 178.488 1.259 25485 25485 1 20 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.477 0.758 25485 25486 1 20 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.802 -0.440 25485 25487 1 20 . 1 1 106 106 ASP H H 106 8.627 8.627 8.006 0.621 25485 25488 1 20 . 1 1 107 107 ARG N N 107 121.033 121.033 118.327 2.706 25485 25489 1 20 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.100 0.078 25485 25490 1 20 . 1 1 107 107 ARG C C 107 179.485 179.485 178.581 0.904 25485 25491 1 20 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.952 0.628 25485 25492 1 20 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.732 0.476 25485 25493 1 20 . 1 1 107 107 ARG H H 107 8.356 8.356 7.754 0.602 25485 25494 1 20 . 1 1 108 108 LEU N N 108 121.463 121.463 121.262 0.201 25485 25495 1 20 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.145 0.160 25485 25496 1 20 . 1 1 108 108 LEU C C 108 178.852 178.852 178.967 -0.115 25485 25497 1 20 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.652 0.230 25485 25498 1 20 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.454 -0.139 25485 25499 1 20 . 1 1 108 108 LEU H H 108 8.790 8.790 7.838 0.952 25485 25500 1 20 . 1 1 109 109 VAL N N 109 120.233 120.233 116.257 3.976 25485 25501 1 20 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.615 -0.215 25485 25502 1 20 . 1 1 109 109 VAL C C 109 177.019 177.019 177.603 -0.584 25485 25503 1 20 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.989 1.057 25485 25504 1 20 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.227 -0.038 25485 25505 1 20 . 1 1 109 109 VAL H H 109 8.787 8.787 8.301 0.486 25485 25506 1 20 . 1 1 110 110 SER N N 110 112.862 112.862 116.073 -3.211 25485 25507 1 20 . 1 1 110 110 SER HA H 110 4.300 4.300 3.946 0.354 25485 25508 1 20 . 1 1 110 110 SER C C 110 176.770 176.770 176.768 0.002 25485 25509 1 20 . 1 1 110 110 SER CA C 110 61.744 61.744 61.461 0.283 25485 25510 1 20 . 1 1 110 110 SER CB C 110 62.742 62.742 62.872 -0.130 25485 25511 1 20 . 1 1 110 110 SER H H 110 7.605 7.605 7.858 -0.253 25485 25512 1 20 . 1 1 111 111 LYS N N 111 122.319 122.319 122.003 0.316 25485 25513 1 20 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.036 0.025 25485 25514 1 20 . 1 1 111 111 LYS C C 111 178.309 178.309 178.479 -0.170 25485 25515 1 20 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.224 0.590 25485 25516 1 20 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.544 -0.035 25485 25517 1 20 . 1 1 111 111 LYS H H 111 8.156 8.156 7.961 0.195 25485 25518 1 20 . 1 1 112 112 ALA N N 112 124.147 124.147 121.340 2.807 25485 25519 1 20 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.256 -0.157 25485 25520 1 20 . 1 1 112 112 ALA C C 112 179.445 179.445 178.864 0.581 25485 25521 1 20 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.133 1.093 25485 25522 1 20 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.175 0.799 25485 25523 1 20 . 1 1 112 112 ALA H H 112 8.278 8.278 7.468 0.810 25485 25524 1 20 . 1 1 113 113 LEU N N 113 116.195 116.195 120.436 -4.241 25485 25525 1 20 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.076 -0.325 25485 25526 1 20 . 1 1 113 113 LEU C C 113 179.537 179.537 177.867 1.670 25485 25527 1 20 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.791 -0.047 25485 25528 1 20 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.821 -1.266 25485 25529 1 20 . 1 1 113 113 LEU H H 113 8.021 8.021 8.428 -0.407 25485 25530 1 20 . 1 1 114 114 ASN N N 114 116.570 116.570 117.531 -0.961 25485 25531 1 20 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.544 0.002 25485 25532 1 20 . 1 1 114 114 ASN C C 114 177.136 177.136 177.475 -0.339 25485 25533 1 20 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.604 -0.840 25485 25534 1 20 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.489 0.134 25485 25535 1 20 . 1 1 114 114 ASN H H 114 8.212 8.212 8.253 -0.041 25485 25536 1 20 . 1 1 115 115 MET N N 115 122.055 122.055 118.953 3.102 25485 25537 1 20 . 1 1 115 115 MET HA H 115 4.010 4.010 4.065 -0.055 25485 25538 1 20 . 1 1 115 115 MET C C 115 177.681 177.681 177.840 -0.159 25485 25539 1 20 . 1 1 115 115 MET CA C 115 59.445 59.445 59.204 0.241 25485 25540 1 20 . 1 1 115 115 MET CB C 115 31.616 31.616 32.249 -0.634 25485 25541 1 20 . 1 1 115 115 MET H H 115 7.937 7.937 7.861 0.076 25485 25542 1 20 . 1 1 116 116 TRP N N 116 117.115 117.115 118.379 -1.264 25485 25543 1 20 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.286 0.232 25485 25544 1 20 . 1 1 116 116 TRP C C 116 179.054 179.054 179.381 -0.327 25485 25545 1 20 . 1 1 116 116 TRP CA C 116 59.511 59.511 58.937 0.575 25485 25546 1 20 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.281 1.592 25485 25547 1 20 . 1 1 116 116 TRP H H 116 6.783 6.783 7.339 -0.556 25485 25548 1 20 . 1 1 117 117 GLY N N 117 104.511 104.511 106.660 -2.149 25485 25549 1 20 . 1 1 117 117 GLY C C 117 175.035 175.035 176.358 -1.323 25485 25550 1 20 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.546 0.451 25485 25551 1 20 . 1 1 117 117 GLY H H 117 9.302 9.302 8.238 1.064 25485 25552 1 20 . 1 1 118 118 LYS N N 118 118.580 118.580 119.946 -1.366 25485 25553 1 20 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.138 0.069 25485 25554 1 20 . 1 1 118 118 LYS C C 118 177.235 177.235 177.484 -0.249 25485 25555 1 20 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.354 0.537 25485 25556 1 20 . 1 1 118 118 LYS CB C 118 31.905 31.905 31.540 0.365 25485 25557 1 20 . 1 1 118 118 LYS H H 118 7.940 7.940 8.098 -0.158 25485 25558 1 20 . 1 1 119 119 GLU N N 119 113.749 113.749 116.212 -2.463 25485 25559 1 20 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.446 0.392 25485 25560 1 20 . 1 1 119 119 GLU C C 119 178.024 178.024 175.746 2.278 25485 25561 1 20 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.992 -0.717 25485 25562 1 20 . 1 1 119 119 GLU CB C 119 30.686 30.686 30.887 -0.201 25485 25563 1 20 . 1 1 119 119 GLU H H 119 7.763 7.763 7.567 0.196 25485 25564 1 20 . 1 1 120 120 ILE N N 120 111.144 111.144 113.417 -2.273 25485 25565 1 20 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.663 0.708 25485 25566 1 20 . 1 1 120 120 ILE C C 120 174.033 174.033 173.511 0.522 25485 25567 1 20 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.243 1.211 25485 25568 1 20 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.796 2.133 25485 25569 1 20 . 1 1 120 120 ILE H H 120 7.518 7.518 7.487 0.031 25485 25570 1 20 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.379 0.283 25485 25571 1 20 . 1 1 121 121 PRO C C 121 174.784 174.784 176.605 -1.821 25485 25572 1 20 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.148 -1.133 25485 25573 1 20 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.641 -2.256 25485 25574 1 20 . 1 1 122 122 LEU N N 122 121.531 121.531 120.272 1.259 25485 25575 1 20 . 1 1 122 122 LEU HA H 122 4.339 4.339 3.577 0.762 25485 25576 1 20 . 1 1 122 122 LEU C C 122 173.977 173.977 176.002 -2.025 25485 25577 1 20 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.776 -1.218 25485 25578 1 20 . 1 1 122 122 LEU CB C 122 45.399 45.399 41.736 3.663 25485 25579 1 20 . 1 1 122 122 LEU H H 122 6.847 6.847 7.415 -0.568 25485 25580 1 20 . 1 1 123 123 HIS N N 123 121.054 121.054 110.980 10.074 25485 25581 1 20 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.518 0.089 25485 25582 1 20 . 1 1 123 123 HIS C C 123 172.820 172.820 173.186 -0.366 25485 25583 1 20 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.318 -0.809 25485 25584 1 20 . 1 1 123 123 HIS CB C 123 33.110 33.110 30.246 2.864 25485 25585 1 20 . 1 1 123 123 HIS H H 123 7.760 7.760 7.439 0.321 25485 25586 1 20 . 1 1 124 124 PHE N N 124 120.465 120.465 123.854 -3.389 25485 25587 1 20 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.303 0.531 25485 25588 1 20 . 1 1 124 124 PHE C C 124 175.677 175.677 175.267 0.410 25485 25589 1 20 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.885 0.407 25485 25590 1 20 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.137 0.685 25485 25591 1 20 . 1 1 124 124 PHE H H 124 8.306 8.306 8.697 -0.391 25485 25592 1 20 . 1 1 125 125 ARG N N 125 124.008 124.008 125.236 -1.228 25485 25593 1 20 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.840 -0.129 25485 25594 1 20 . 1 1 125 125 ARG C C 125 172.901 172.901 174.819 -1.918 25485 25595 1 20 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.564 -0.290 25485 25596 1 20 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.291 -0.469 25485 25597 1 20 . 1 1 125 125 ARG H H 125 8.426 8.426 9.047 -0.621 25485 25598 1 20 . 1 1 126 126 LYS N N 126 130.004 130.004 123.863 6.141 25485 25599 1 20 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.086 -0.703 25485 25600 1 20 . 1 1 126 126 LYS C C 126 176.126 176.126 175.703 0.423 25485 25601 1 20 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.495 0.686 25485 25602 1 20 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.854 -0.827 25485 25603 1 20 . 1 1 126 126 LYS H H 126 8.481 8.481 8.525 -0.044 25485 25604 1 20 . 1 1 127 127 VAL N N 127 125.288 125.288 118.560 6.728 25485 25605 1 20 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.100 0.405 25485 25606 1 20 . 1 1 127 127 VAL C C 127 175.565 175.565 174.857 0.708 25485 25607 1 20 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.855 -1.906 25485 25608 1 20 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.028 2.334 25485 25609 1 20 . 1 1 127 127 VAL H H 127 8.721 8.721 8.082 0.639 25485 25610 1 20 . 1 1 128 128 VAL N N 128 117.467 117.467 120.082 -2.615 25485 25611 1 20 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.007 0.322 25485 25612 1 20 . 1 1 128 128 VAL C C 128 174.622 174.622 174.902 -0.280 25485 25613 1 20 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.134 0.984 25485 25614 1 20 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.226 0.284 25485 25615 1 20 . 1 1 128 128 VAL H H 128 8.406 8.406 8.056 0.350 25485 25616 1 20 . 1 1 129 129 TRP N N 129 119.986 119.986 120.325 -0.339 25485 25617 1 20 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.796 -0.080 25485 25618 1 20 . 1 1 129 129 TRP C C 129 174.536 174.536 176.047 -1.511 25485 25619 1 20 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.937 -1.020 25485 25620 1 20 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.625 2.389 25485 25621 1 20 . 1 1 129 129 TRP H H 129 7.435 7.435 7.142 0.293 25485 25622 1 20 . 1 1 130 130 GLY N N 130 109.900 109.900 112.739 -2.839 25485 25623 1 20 . 1 1 130 130 GLY C C 130 173.187 173.187 173.141 0.046 25485 25624 1 20 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.425 0.055 25485 25625 1 20 . 1 1 130 130 GLY H H 130 8.006 8.006 8.230 -0.224 25485 25626 1 20 . 1 1 131 131 THR N N 131 116.142 116.142 115.900 0.242 25485 25627 1 20 . 1 1 131 131 THR HA H 131 4.162 4.162 4.418 -0.256 25485 25628 1 20 . 1 1 131 131 THR C C 131 172.766 172.766 174.047 -1.281 25485 25629 1 20 . 1 1 131 131 THR CA C 131 63.212 63.212 61.496 1.716 25485 25630 1 20 . 1 1 131 131 THR CB C 131 69.308 69.308 70.016 -0.709 25485 25631 1 20 . 1 1 131 131 THR H H 131 8.233 8.233 8.276 -0.043 25485 25632 1 20 . 1 1 132 132 ALA N N 132 129.807 129.807 125.212 4.595 25485 25633 1 20 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.482 0.034 25485 25634 1 20 . 1 1 132 132 ALA C C 132 175.358 175.358 176.519 -1.161 25485 25635 1 20 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.656 -1.290 25485 25636 1 20 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.512 1.286 25485 25637 1 20 . 1 1 132 132 ALA H H 132 7.962 7.962 8.415 -0.453 25485 25638 1 20 . 1 1 133 133 ASP N N 133 122.896 122.896 119.136 3.760 25485 25639 1 20 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.608 -0.187 25485 25640 1 20 . 1 1 133 133 ASP C C 133 177.314 177.314 176.701 0.613 25485 25641 1 20 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.259 1.660 25485 25642 1 20 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.680 -1.209 25485 25643 1 20 . 1 1 133 133 ASP H H 133 8.251 8.251 8.195 0.056 25485 25644 1 20 . 1 1 134 134 ILE N N 134 125.472 125.472 121.057 4.415 25485 25645 1 20 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.523 -0.380 25485 25646 1 20 . 1 1 134 134 ILE C C 134 174.201 174.201 174.776 -0.575 25485 25647 1 20 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.135 0.136 25485 25648 1 20 . 1 1 134 134 ILE CB C 134 38.710 38.710 39.157 -0.447 25485 25649 1 20 . 1 1 134 134 ILE H H 134 8.802 8.802 7.644 1.158 25485 25650 1 20 . 1 1 135 135 MET N N 135 127.265 127.265 127.005 0.260 25485 25651 1 20 . 1 1 135 135 MET HA H 135 5.192 5.192 5.374 -0.182 25485 25652 1 20 . 1 1 135 135 MET C C 135 176.206 176.206 175.828 0.378 25485 25653 1 20 . 1 1 135 135 MET CA C 135 53.626 53.626 52.346 1.280 25485 25654 1 20 . 1 1 135 135 MET CB C 135 32.639 32.639 34.014 -1.375 25485 25655 1 20 . 1 1 135 135 MET H H 135 7.418 7.418 8.312 -0.894 25485 25656 1 20 . 1 1 136 136 ILE N N 136 125.440 125.440 124.221 1.219 25485 25657 1 20 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.878 0.711 25485 25658 1 20 . 1 1 136 136 ILE C C 136 175.190 175.190 175.862 -0.672 25485 25659 1 20 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.899 1.209 25485 25660 1 20 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.596 4.344 25485 25661 1 20 . 1 1 136 136 ILE H H 136 9.124 9.124 9.084 0.040 25485 25662 1 20 . 1 1 137 137 GLY N N 137 112.211 112.211 114.438 -2.227 25485 25663 1 20 . 1 1 137 137 GLY C C 137 170.855 170.855 171.789 -0.934 25485 25664 1 20 . 1 1 137 137 GLY CA C 137 45.405 45.405 43.962 1.443 25485 25665 1 20 . 1 1 137 137 GLY H H 137 8.594 8.594 8.073 0.521 25485 25666 1 20 . 1 1 138 138 PHE N N 138 119.463 119.463 118.677 0.786 25485 25667 1 20 . 1 1 138 138 PHE HA H 138 5.496 5.496 4.979 0.516 25485 25668 1 20 . 1 1 138 138 PHE C C 138 175.186 175.186 175.575 -0.389 25485 25669 1 20 . 1 1 138 138 PHE CA C 138 55.995 55.995 56.818 -0.823 25485 25670 1 20 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.319 0.123 25485 25671 1 20 . 1 1 138 138 PHE H H 138 7.857 7.857 8.566 -0.709 25485 25672 1 20 . 1 1 139 139 ALA N N 139 123.914 123.914 125.064 -1.150 25485 25673 1 20 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.653 0.078 25485 25674 1 20 . 1 1 139 139 ALA C C 139 174.613 174.613 175.194 -0.581 25485 25675 1 20 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.331 -1.296 25485 25676 1 20 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.856 1.616 25485 25677 1 20 . 1 1 139 139 ALA H H 139 8.955 8.955 8.330 0.625 25485 25678 1 20 . 1 1 140 140 ARG N N 140 118.339 118.339 120.478 -2.139 25485 25679 1 20 . 1 1 140 140 ARG HA H 140 5.106 5.106 5.034 0.072 25485 25680 1 20 . 1 1 140 140 ARG C C 140 176.201 176.201 178.354 -2.153 25485 25681 1 20 . 1 1 140 140 ARG CA C 140 54.166 54.166 55.077 -0.910 25485 25682 1 20 . 1 1 140 140 ARG CB C 140 33.469 33.469 33.164 0.305 25485 25683 1 20 . 1 1 140 140 ARG H H 140 8.546 8.546 8.512 0.034 25485 25684 1 20 . 1 1 141 141 GLY N N 141 108.916 108.916 108.954 -0.038 25485 25685 1 20 . 1 1 141 141 GLY C C 141 175.595 175.595 175.109 0.486 25485 25686 1 20 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.332 -1.042 25485 25687 1 20 . 1 1 141 141 GLY H H 141 8.989 8.989 9.148 -0.159 25485 25688 1 20 . 1 1 142 142 ALA N N 142 121.448 121.448 121.808 -0.360 25485 25689 1 20 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.348 0.060 25485 25690 1 20 . 1 1 142 142 ALA C C 142 177.027 177.027 177.852 -0.825 25485 25691 1 20 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.614 0.663 25485 25692 1 20 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.046 -0.082 25485 25693 1 20 . 1 1 142 142 ALA H H 142 8.642 8.642 8.219 0.423 25485 25694 1 20 . 1 1 143 143 HIS N N 143 120.356 120.356 115.282 5.074 25485 25695 1 20 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.489 0.668 25485 25696 1 20 . 1 1 143 143 HIS C C 143 174.303 174.303 176.297 -1.994 25485 25697 1 20 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.202 -0.749 25485 25698 1 20 . 1 1 143 143 HIS CB C 143 27.791 27.791 30.070 -2.279 25485 25699 1 20 . 1 1 143 143 HIS H H 143 8.990 8.990 8.098 0.892 25485 25700 1 20 . 1 1 144 144 GLY N N 144 112.517 112.517 108.036 4.481 25485 25701 1 20 . 1 1 144 144 GLY C C 144 173.758 173.758 172.916 0.842 25485 25702 1 20 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.728 1.367 25485 25703 1 20 . 1 1 144 144 GLY H H 144 5.175 5.175 7.376 -2.201 25485 25704 1 20 . 1 1 145 145 ASP N N 145 117.762 117.762 118.694 -0.932 25485 25705 1 20 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.714 -0.016 25485 25706 1 20 . 1 1 145 145 ASP C C 145 175.851 175.851 174.957 0.894 25485 25707 1 20 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.817 -0.858 25485 25708 1 20 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.078 -0.279 25485 25709 1 20 . 1 1 145 145 ASP H H 145 7.096 7.096 7.529 -0.433 25485 25710 1 20 . 1 1 146 146 SER N N 146 125.540 125.540 115.660 9.880 25485 25711 1 20 . 1 1 146 146 SER HA H 146 4.204 4.204 4.377 -0.173 25485 25712 1 20 . 1 1 146 146 SER C C 146 172.319 172.319 173.986 -1.667 25485 25713 1 20 . 1 1 146 146 SER CA C 146 58.862 58.862 58.764 0.098 25485 25714 1 20 . 1 1 146 146 SER CB C 146 62.933 62.933 63.713 -0.780 25485 25715 1 20 . 1 1 146 146 SER H H 146 8.261 8.261 8.241 0.020 25485 25716 1 20 . 1 1 147 147 TYR N N 147 120.757 120.757 118.885 1.872 25485 25717 1 20 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.256 0.566 25485 25718 1 20 . 1 1 147 147 TYR C C 147 170.372 170.372 173.478 -3.106 25485 25719 1 20 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.768 -4.500 25485 25720 1 20 . 1 1 147 147 TYR CB C 147 38.296 38.296 38.346 -0.050 25485 25721 1 20 . 1 1 147 147 TYR H H 147 7.450 7.450 8.484 -1.034 25485 25722 1 20 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.481 0.391 25485 25723 1 20 . 1 1 148 148 PRO C C 148 179.009 179.009 175.930 3.079 25485 25724 1 20 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.522 0.853 25485 25725 1 20 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.392 -1.484 25485 25726 1 20 . 1 1 149 149 PHE N N 149 120.514 120.514 121.097 -0.583 25485 25727 1 20 . 1 1 149 149 PHE C C 149 176.813 176.813 175.648 1.165 25485 25728 1 20 . 1 1 149 149 PHE CA C 149 58.453 58.453 58.751 -0.298 25485 25729 1 20 . 1 1 149 149 PHE CB C 149 38.573 38.573 39.889 -1.316 25485 25730 1 20 . 1 1 149 149 PHE H H 149 8.024 8.024 8.496 -0.472 25485 25731 1 20 . 1 1 150 150 ASP N N 150 115.555 115.555 117.175 -1.620 25485 25732 1 20 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.414 0.425 25485 25733 1 20 . 1 1 150 150 ASP C C 150 177.007 177.007 176.428 0.579 25485 25734 1 20 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.433 -0.562 25485 25735 1 20 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.475 2.461 25485 25736 1 20 . 1 1 150 150 ASP H H 150 7.511 7.511 8.436 -0.925 25485 25737 1 20 . 1 1 151 151 GLY N N 151 110.650 110.650 109.607 1.043 25485 25738 1 20 . 1 1 151 151 GLY C C 151 170.281 170.281 172.070 -1.789 25485 25739 1 20 . 1 1 151 151 GLY CA C 151 44.398 44.398 45.252 -0.854 25485 25740 1 20 . 1 1 151 151 GLY H H 151 9.080 9.080 8.166 0.914 25485 25741 1 20 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.184 -0.128 25485 25742 1 20 . 1 1 152 152 PRO C C 152 178.300 178.300 176.727 1.573 25485 25743 1 20 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.350 0.500 25485 25744 1 20 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.893 -0.633 25485 25745 1 20 . 1 1 153 153 GLY N N 153 118.783 118.783 113.448 5.335 25485 25746 1 20 . 1 1 153 153 GLY C C 153 174.098 174.098 173.661 0.437 25485 25747 1 20 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.461 -0.855 25485 25748 1 20 . 1 1 153 153 GLY H H 153 11.431 11.431 8.139 3.292 25485 25749 1 20 . 1 1 154 154 ASN N N 154 120.679 120.679 119.987 0.692 25485 25750 1 20 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.395 -0.151 25485 25751 1 20 . 1 1 154 154 ASN C C 154 174.636 174.636 175.057 -0.421 25485 25752 1 20 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.425 2.243 25485 25753 1 20 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.263 -1.292 25485 25754 1 20 . 1 1 154 154 ASN H H 154 9.247 9.247 8.520 0.727 25485 25755 1 20 . 1 1 155 155 THR N N 155 118.252 118.252 111.295 6.957 25485 25756 1 20 . 1 1 155 155 THR HA H 155 5.577 5.577 4.279 1.298 25485 25757 1 20 . 1 1 155 155 THR C C 155 176.596 176.596 174.141 2.455 25485 25758 1 20 . 1 1 155 155 THR CA C 155 61.731 61.731 62.996 -1.265 25485 25759 1 20 . 1 1 155 155 THR CB C 155 71.325 71.325 68.947 2.378 25485 25760 1 20 . 1 1 155 155 THR H H 155 9.501 9.501 8.638 0.863 25485 25761 1 20 . 1 1 156 156 LEU N N 156 122.598 122.598 123.302 -0.704 25485 25762 1 20 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.456 0.415 25485 25763 1 20 . 1 1 156 156 LEU C C 156 175.655 175.655 175.569 0.086 25485 25764 1 20 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.401 -0.863 25485 25765 1 20 . 1 1 156 156 LEU CB C 156 44.511 44.511 42.878 1.633 25485 25766 1 20 . 1 1 156 156 LEU H H 156 8.492 8.492 8.272 0.220 25485 25767 1 20 . 1 1 157 157 ALA N N 157 115.389 115.389 115.131 0.258 25485 25768 1 20 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.936 0.099 25485 25769 1 20 . 1 1 157 157 ALA C C 157 175.739 175.739 175.094 0.645 25485 25770 1 20 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.597 -0.658 25485 25771 1 20 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.570 1.884 25485 25772 1 20 . 1 1 157 157 ALA H H 157 7.567 7.567 7.826 -0.259 25485 25773 1 20 . 1 1 158 158 HIS N N 158 111.900 111.900 118.162 -6.262 25485 25774 1 20 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.783 -0.178 25485 25775 1 20 . 1 1 158 158 HIS C C 158 170.186 170.186 172.496 -2.310 25485 25776 1 20 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.290 1.785 25485 25777 1 20 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.832 -1.647 25485 25778 1 20 . 1 1 158 158 HIS H H 158 8.757 8.757 8.134 0.623 25485 25779 1 20 . 1 1 159 159 ALA N N 159 118.286 118.286 126.065 -7.779 25485 25780 1 20 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.008 0.646 25485 25781 1 20 . 1 1 159 159 ALA C C 159 174.036 174.036 175.555 -1.519 25485 25782 1 20 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.425 0.708 25485 25783 1 20 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.549 2.487 25485 25784 1 20 . 1 1 159 159 ALA H H 159 6.110 6.110 8.241 -2.131 25485 25785 1 20 . 1 1 160 160 PHE N N 160 117.937 117.937 119.335 -1.398 25485 25786 1 20 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.686 -0.183 25485 25787 1 20 . 1 1 160 160 PHE C C 160 174.455 174.455 174.978 -0.523 25485 25788 1 20 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.472 1.341 25485 25789 1 20 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.496 0.698 25485 25790 1 20 . 1 1 160 160 PHE H H 160 7.912 7.912 8.095 -0.183 25485 25791 1 20 . 1 1 161 161 ALA N N 161 123.531 123.531 123.179 0.352 25485 25792 1 20 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.600 -0.109 25485 25793 1 20 . 1 1 161 161 ALA C C 161 175.503 175.503 175.902 -0.399 25485 25794 1 20 . 1 1 161 161 ALA CA C 161 50.633 50.633 48.861 1.772 25485 25795 1 20 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.001 -2.445 25485 25796 1 20 . 1 1 161 161 ALA H H 161 8.107 8.107 8.360 -0.253 25485 25797 1 20 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.586 -0.676 25485 25798 1 20 . 1 1 162 162 PRO C C 162 173.465 173.465 175.577 -2.112 25485 25799 1 20 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.333 1.924 25485 25800 1 20 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.017 2.225 25485 25801 1 20 . 1 1 163 163 GLY N N 163 107.206 107.206 110.481 -3.275 25485 25802 1 20 . 1 1 163 163 GLY C C 163 172.092 172.092 172.511 -0.419 25485 25803 1 20 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.594 -0.601 25485 25804 1 20 . 1 1 163 163 GLY H H 163 5.997 5.997 7.986 -1.989 25485 25805 1 20 . 1 1 165 165 GLY N N 165 103.110 103.110 107.840 -4.730 25485 25806 1 20 . 1 1 165 165 GLY C C 165 177.158 177.158 175.771 1.387 25485 25807 1 20 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.919 -1.676 25485 25808 1 20 . 1 1 165 165 GLY H H 165 9.145 9.145 8.378 0.767 25485 25809 1 20 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.294 -0.115 25485 25810 1 20 . 1 1 166 166 LEU C C 166 176.437 176.437 177.257 -0.820 25485 25811 1 20 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.626 0.574 25485 25812 1 20 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.402 -0.568 25485 25813 1 20 . 1 1 167 167 GLY N N 167 103.318 103.318 104.667 -1.349 25485 25814 1 20 . 1 1 167 167 GLY C C 167 174.803 174.803 174.527 0.276 25485 25815 1 20 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.842 2.391 25485 25816 1 20 . 1 1 167 167 GLY H H 167 7.768 7.768 7.395 0.373 25485 25817 1 20 . 1 1 168 168 GLY N N 168 121.051 121.051 109.214 11.837 25485 25818 1 20 . 1 1 168 168 GLY C C 168 172.122 172.122 173.915 -1.793 25485 25819 1 20 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.054 1.548 25485 25820 1 20 . 1 1 168 168 GLY H H 168 7.698 7.698 8.587 -0.889 25485 25821 1 20 . 1 1 169 169 ASP N N 169 123.641 123.641 120.821 2.820 25485 25822 1 20 . 1 1 169 169 ASP C C 169 173.942 173.942 173.801 0.141 25485 25823 1 20 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.309 2.533 25485 25824 1 20 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.801 -2.931 25485 25825 1 20 . 1 1 169 169 ASP H H 169 8.595 8.595 7.988 0.607 25485 25826 1 20 . 1 1 170 170 ALA N N 170 119.366 119.366 120.670 -1.304 25485 25827 1 20 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.353 0.377 25485 25828 1 20 . 1 1 170 170 ALA C C 170 174.593 174.593 175.149 -0.556 25485 25829 1 20 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.760 0.364 25485 25830 1 20 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.172 1.163 25485 25831 1 20 . 1 1 170 170 ALA H H 170 8.324 8.324 8.479 -0.155 25485 25832 1 20 . 1 1 171 171 HIS N N 171 120.239 120.239 121.224 -0.985 25485 25833 1 20 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.127 0.621 25485 25834 1 20 . 1 1 171 171 HIS C C 171 172.949 172.949 173.881 -0.932 25485 25835 1 20 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.585 -2.861 25485 25836 1 20 . 1 1 171 171 HIS CB C 171 34.541 34.541 32.982 1.559 25485 25837 1 20 . 1 1 171 171 HIS H H 171 8.499 8.499 7.748 0.751 25485 25838 1 20 . 1 1 172 172 PHE N N 172 121.125 121.125 121.801 -0.676 25485 25839 1 20 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.588 -0.060 25485 25840 1 20 . 1 1 172 172 PHE C C 172 173.875 173.875 174.094 -0.219 25485 25841 1 20 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.685 0.235 25485 25842 1 20 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.458 0.445 25485 25843 1 20 . 1 1 172 172 PHE H H 172 8.445 8.445 8.173 0.272 25485 25844 1 20 . 1 1 173 173 ASP N N 173 124.014 124.014 123.228 0.786 25485 25845 1 20 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.133 -0.219 25485 25846 1 20 . 1 1 173 173 ASP C C 173 178.613 178.613 177.578 1.035 25485 25847 1 20 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.334 1.464 25485 25848 1 20 . 1 1 173 173 ASP CB C 173 40.743 40.743 40.740 0.003 25485 25849 1 20 . 1 1 173 173 ASP H H 173 7.927 7.927 8.725 -0.798 25485 25850 1 20 . 1 1 174 174 GLU N N 174 132.469 132.469 126.644 5.825 25485 25851 1 20 . 1 1 174 174 GLU C C 174 176.442 176.442 177.359 -0.917 25485 25852 1 20 . 1 1 174 174 GLU CA C 174 57.184 57.184 59.104 -1.920 25485 25853 1 20 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.743 0.542 25485 25854 1 20 . 1 1 174 174 GLU H H 174 9.528 9.528 8.547 0.981 25485 25855 1 20 . 1 1 175 175 ASP N N 175 117.394 117.394 117.662 -0.268 25485 25856 1 20 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.671 0.122 25485 25857 1 20 . 1 1 175 175 ASP C C 175 176.645 176.645 176.663 -0.018 25485 25858 1 20 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.305 0.626 25485 25859 1 20 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.708 -1.567 25485 25860 1 20 . 1 1 175 175 ASP H H 175 8.768 8.768 8.372 0.396 25485 25861 1 20 . 1 1 176 176 GLU N N 176 116.493 116.493 118.897 -2.404 25485 25862 1 20 . 1 1 176 176 GLU C C 176 175.038 175.038 176.058 -1.020 25485 25863 1 20 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.467 -1.802 25485 25864 1 20 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.379 -4.156 25485 25865 1 20 . 1 1 176 176 GLU H H 176 7.159 7.159 8.031 -0.872 25485 25866 1 20 . 1 1 177 177 ARG N N 177 122.186 122.186 119.132 3.054 25485 25867 1 20 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.321 0.368 25485 25868 1 20 . 1 1 177 177 ARG C C 177 174.482 174.482 174.692 -0.210 25485 25869 1 20 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.191 -1.504 25485 25870 1 20 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.922 -1.838 25485 25871 1 20 . 1 1 177 177 ARG H H 177 7.560 7.560 8.209 -0.649 25485 25872 1 20 . 1 1 178 178 TRP N N 178 129.179 129.179 126.090 3.089 25485 25873 1 20 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.345 -0.245 25485 25874 1 20 . 1 1 178 178 TRP C C 178 176.298 176.298 176.493 -0.195 25485 25875 1 20 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.244 0.569 25485 25876 1 20 . 1 1 178 178 TRP CB C 178 31.197 31.197 32.069 -0.872 25485 25877 1 20 . 1 1 178 178 TRP H H 178 8.807 8.807 8.327 0.480 25485 25878 1 20 . 1 1 179 179 THR N N 179 112.792 112.792 114.205 -1.413 25485 25879 1 20 . 1 1 179 179 THR HA H 179 4.985 4.985 4.628 0.357 25485 25880 1 20 . 1 1 179 179 THR C C 179 172.765 172.765 171.990 0.775 25485 25881 1 20 . 1 1 179 179 THR CA C 179 59.106 59.106 61.342 -2.236 25485 25882 1 20 . 1 1 179 179 THR CB C 179 71.786 71.786 70.131 1.655 25485 25883 1 20 . 1 1 179 179 THR H H 179 8.974 8.974 8.818 0.156 25485 25884 1 20 . 1 1 180 180 ASP N N 180 122.074 122.074 124.810 -2.736 25485 25885 1 20 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.012 -0.549 25485 25886 1 20 . 1 1 180 180 ASP C C 180 176.366 176.366 178.471 -2.105 25485 25887 1 20 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.107 -2.064 25485 25888 1 20 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.210 -0.482 25485 25889 1 20 . 1 1 180 180 ASP H H 180 8.485 8.485 8.852 -0.367 25485 25890 1 20 . 1 1 181 181 GLY N N 181 110.123 110.123 108.582 1.541 25485 25891 1 20 . 1 1 181 181 GLY C C 181 174.325 174.325 175.333 -1.008 25485 25892 1 20 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.577 1.084 25485 25893 1 20 . 1 1 181 181 GLY H H 181 8.569 8.569 8.655 -0.086 25485 25894 1 20 . 1 1 182 182 SER N N 182 115.562 115.562 115.356 0.206 25485 25895 1 20 . 1 1 182 182 SER HA H 182 4.519 4.519 4.566 -0.047 25485 25896 1 20 . 1 1 182 182 SER C C 182 173.783 173.783 173.814 -0.031 25485 25897 1 20 . 1 1 182 182 SER CA C 182 57.965 57.965 57.803 0.162 25485 25898 1 20 . 1 1 182 182 SER CB C 182 64.166 64.166 64.025 0.141 25485 25899 1 20 . 1 1 182 182 SER H H 182 8.160 8.160 7.782 0.378 25485 25900 1 20 . 1 1 183 183 SER N N 183 117.153 117.153 115.210 1.943 25485 25901 1 20 . 1 1 183 183 SER HA H 183 4.275 4.275 4.375 -0.100 25485 25902 1 20 . 1 1 183 183 SER C C 183 173.333 173.333 174.593 -1.260 25485 25903 1 20 . 1 1 183 183 SER CA C 183 59.902 59.902 59.058 0.844 25485 25904 1 20 . 1 1 183 183 SER CB C 183 64.941 64.941 62.137 2.804 25485 25905 1 20 . 1 1 183 183 SER H H 183 7.796 7.796 7.742 0.054 25485 25906 1 20 . 1 1 184 184 LEU N N 184 122.351 122.351 119.458 2.893 25485 25907 1 20 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.540 -0.148 25485 25908 1 20 . 1 1 184 184 LEU C C 184 176.250 176.250 176.718 -0.468 25485 25909 1 20 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.227 0.348 25485 25910 1 20 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.644 -0.563 25485 25911 1 20 . 1 1 184 184 LEU H H 184 8.092 8.092 8.340 -0.248 25485 25912 1 20 . 1 1 185 185 GLY N N 185 108.871 108.871 106.440 2.431 25485 25913 1 20 . 1 1 185 185 GLY C C 185 172.375 172.375 174.044 -1.669 25485 25914 1 20 . 1 1 185 185 GLY CA C 185 44.380 44.380 43.789 0.591 25485 25915 1 20 . 1 1 185 185 GLY H H 185 7.960 7.960 7.588 0.372 25485 25916 1 20 . 1 1 186 186 ILE N N 186 123.096 123.096 122.023 1.073 25485 25917 1 20 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.136 -0.295 25485 25918 1 20 . 1 1 186 186 ILE C C 186 175.350 175.350 176.002 -0.652 25485 25919 1 20 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.038 -0.638 25485 25920 1 20 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.164 0.292 25485 25921 1 20 . 1 1 186 186 ILE H H 186 8.893 8.893 8.069 0.824 25485 25922 1 20 . 1 1 187 187 ASN N N 187 127.167 127.167 126.956 0.211 25485 25923 1 20 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.993 -0.640 25485 25924 1 20 . 1 1 187 187 ASN C C 187 175.849 175.849 177.065 -1.216 25485 25925 1 20 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.219 1.495 25485 25926 1 20 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.472 0.658 25485 25927 1 20 . 1 1 187 187 ASN H H 187 8.580 8.580 8.292 0.288 25485 25928 1 20 . 1 1 188 188 PHE N N 188 129.985 129.985 126.930 3.055 25485 25929 1 20 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.362 0.211 25485 25930 1 20 . 1 1 188 188 PHE C C 188 175.578 175.578 177.678 -2.100 25485 25931 1 20 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.304 -0.576 25485 25932 1 20 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.543 -0.111 25485 25933 1 20 . 1 1 188 188 PHE H H 188 9.361 9.361 8.436 0.925 25485 25934 1 20 . 1 1 189 189 LEU N N 189 119.113 119.113 119.432 -0.319 25485 25935 1 20 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.147 -0.346 25485 25936 1 20 . 1 1 189 189 LEU C C 189 179.601 179.601 178.400 1.201 25485 25937 1 20 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.141 0.368 25485 25938 1 20 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.038 -1.161 25485 25939 1 20 . 1 1 189 189 LEU H H 189 8.562 8.562 8.186 0.376 25485 25940 1 20 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.973 -0.056 25485 25941 1 20 . 1 1 190 190 TYR C C 190 177.621 177.621 176.941 0.680 25485 25942 1 20 . 1 1 190 190 TYR CA C 190 60.808 60.808 61.152 -0.344 25485 25943 1 20 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.868 1.901 25485 25944 1 20 . 1 1 191 191 ALA N N 191 120.352 120.352 121.282 -0.930 25485 25945 1 20 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.018 0.297 25485 25946 1 20 . 1 1 191 191 ALA C C 191 180.252 180.252 178.859 1.393 25485 25947 1 20 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.726 0.456 25485 25948 1 20 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.467 0.675 25485 25949 1 20 . 1 1 191 191 ALA H H 191 7.993 7.993 9.040 -1.047 25485 25950 1 20 . 1 1 192 192 ALA N N 192 121.409 121.409 121.568 -0.159 25485 25951 1 20 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.011 0.046 25485 25952 1 20 . 1 1 192 192 ALA C C 192 178.575 178.575 179.685 -1.110 25485 25953 1 20 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.481 -0.296 25485 25954 1 20 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.029 -1.831 25485 25955 1 20 . 1 1 192 192 ALA H H 192 9.297 9.297 8.439 0.858 25485 25956 1 20 . 1 1 193 193 THR N N 193 116.996 116.996 115.049 1.947 25485 25957 1 20 . 1 1 193 193 THR HA H 193 3.833 3.833 4.046 -0.213 25485 25958 1 20 . 1 1 193 193 THR CA C 193 69.138 69.138 67.492 1.646 25485 25959 1 20 . 1 1 193 193 THR CB C 193 67.365 67.365 68.375 -1.010 25485 25960 1 20 . 1 1 193 193 THR H H 193 8.226 8.226 7.672 0.554 25485 25961 1 20 . 1 1 194 194 HIS N N 194 120.296 120.296 121.788 -1.492 25485 25962 1 20 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.213 0.023 25485 25963 1 20 . 1 1 194 194 HIS C C 194 175.962 175.962 176.596 -0.634 25485 25964 1 20 . 1 1 194 194 HIS CA C 194 59.747 59.747 59.453 0.294 25485 25965 1 20 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.883 -1.964 25485 25966 1 20 . 1 1 194 194 HIS H H 194 7.782 7.782 7.474 0.308 25485 25967 1 20 . 1 1 195 195 ALA N N 195 121.290 121.290 122.163 -0.873 25485 25968 1 20 . 1 1 195 195 ALA HA H 195 4.156 4.156 4.031 0.125 25485 25969 1 20 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.761 1.203 25485 25970 1 20 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.726 -0.016 25485 25971 1 20 . 1 1 195 195 ALA H H 195 8.690 8.690 8.414 0.276 25485 25972 1 20 . 1 1 196 196 LEU N N 196 114.899 114.899 118.071 -3.172 25485 25973 1 20 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.210 -0.040 25485 25974 1 20 . 1 1 196 196 LEU C C 196 177.946 177.946 179.764 -1.818 25485 25975 1 20 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.330 -1.102 25485 25976 1 20 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.072 -1.296 25485 25977 1 20 . 1 1 196 196 LEU H H 196 8.715 8.715 8.859 -0.144 25485 25978 1 20 . 1 1 197 197 GLY N N 197 107.901 107.901 104.649 3.252 25485 25979 1 20 . 1 1 197 197 GLY C C 197 178.641 178.641 175.434 3.207 25485 25980 1 20 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.594 0.973 25485 25981 1 20 . 1 1 197 197 GLY H H 197 7.546 7.546 8.132 -0.586 25485 25982 1 20 . 1 1 198 198 HIS N N 198 122.017 122.017 119.894 2.123 25485 25983 1 20 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.490 0.367 25485 25984 1 20 . 1 1 198 198 HIS C C 198 179.874 179.874 178.297 1.577 25485 25985 1 20 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.547 0.975 25485 25986 1 20 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.496 -1.950 25485 25987 1 20 . 1 1 198 198 HIS H H 198 7.196 7.196 7.475 -0.279 25485 25988 1 20 . 1 1 199 199 SER N N 199 118.486 118.486 114.124 4.362 25485 25989 1 20 . 1 1 199 199 SER HA H 199 4.490 4.490 4.456 0.034 25485 25990 1 20 . 1 1 199 199 SER C C 199 174.493 174.493 175.001 -0.508 25485 25991 1 20 . 1 1 199 199 SER CA C 199 58.173 58.173 60.165 -1.992 25485 25992 1 20 . 1 1 199 199 SER CB C 199 63.589 63.589 63.598 -0.009 25485 25993 1 20 . 1 1 199 199 SER H H 199 7.884 7.884 7.647 0.237 25485 25994 1 20 . 1 1 200 200 LEU N N 200 114.686 114.686 117.833 -3.147 25485 25995 1 20 . 1 1 200 200 LEU C C 200 177.720 177.720 177.484 0.236 25485 25996 1 20 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.335 0.502 25485 25997 1 20 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.549 0.808 25485 25998 1 20 . 1 1 200 200 LEU H H 200 7.108 7.108 6.996 0.112 25485 25999 1 20 . 1 1 201 201 GLY N N 201 108.363 108.363 106.736 1.627 25485 26000 1 20 . 1 1 201 201 GLY C C 201 174.008 174.008 175.019 -1.011 25485 26001 1 20 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.620 -1.206 25485 26002 1 20 . 1 1 201 201 GLY H H 201 8.195 8.195 7.578 0.617 25485 26003 1 20 . 1 1 202 202 MET N N 202 119.635 119.635 120.873 -1.238 25485 26004 1 20 . 1 1 202 202 MET HA H 202 4.473 4.473 4.247 0.226 25485 26005 1 20 . 1 1 202 202 MET C C 202 176.593 176.593 175.847 0.746 25485 26006 1 20 . 1 1 202 202 MET CA C 202 54.500 54.500 56.774 -2.274 25485 26007 1 20 . 1 1 202 202 MET CB C 202 32.161 32.161 32.531 -0.370 25485 26008 1 20 . 1 1 202 202 MET H H 202 8.182 8.182 7.264 0.918 25485 26009 1 20 . 1 1 203 203 GLY N N 203 109.749 109.749 110.682 -0.933 25485 26010 1 20 . 1 1 203 203 GLY C C 203 174.042 174.042 173.887 0.155 25485 26011 1 20 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.064 -0.060 25485 26012 1 20 . 1 1 203 203 GLY H H 203 8.405 8.405 8.337 0.068 25485 26013 1 20 . 1 1 204 204 HIS N N 204 115.732 115.732 117.475 -1.743 25485 26014 1 20 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.384 1.016 25485 26015 1 20 . 1 1 204 204 HIS C C 204 174.430 174.430 174.528 -0.098 25485 26016 1 20 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.670 -1.856 25485 26017 1 20 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.579 -0.753 25485 26018 1 20 . 1 1 204 204 HIS H H 204 8.364 8.364 8.690 -0.326 25485 26019 1 20 . 1 1 205 205 SER N N 205 115.484 115.484 114.701 0.783 25485 26020 1 20 . 1 1 205 205 SER HA H 205 4.766 4.766 4.723 0.043 25485 26021 1 20 . 1 1 205 205 SER C C 205 173.611 173.611 174.427 -0.816 25485 26022 1 20 . 1 1 205 205 SER CA C 205 54.729 54.729 57.142 -2.413 25485 26023 1 20 . 1 1 205 205 SER CB C 205 65.855 65.855 65.960 -0.105 25485 26024 1 20 . 1 1 205 205 SER H H 205 7.231 7.231 8.189 -0.958 25485 26025 1 20 . 1 1 206 206 SER N N 206 119.263 119.263 118.924 0.339 25485 26026 1 20 . 1 1 206 206 SER HA H 206 3.701 3.701 4.717 -1.016 25485 26027 1 20 . 1 1 206 206 SER C C 206 173.635 173.635 173.857 -0.222 25485 26028 1 20 . 1 1 206 206 SER CA C 206 63.846 63.846 59.144 4.702 25485 26029 1 20 . 1 1 206 206 SER CB C 206 63.764 63.764 64.004 -0.240 25485 26030 1 20 . 1 1 206 206 SER H H 206 8.289 8.289 8.641 -0.352 25485 26031 1 20 . 1 1 207 207 ASP N N 207 126.646 126.646 122.550 4.096 25485 26032 1 20 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.664 0.265 25485 26033 1 20 . 1 1 207 207 ASP C C 207 174.614 174.614 175.409 -0.795 25485 26034 1 20 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.736 -1.464 25485 26035 1 20 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.264 -0.976 25485 26036 1 20 . 1 1 207 207 ASP H H 207 8.541 8.541 8.030 0.511 25485 26037 1 20 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.193 0.594 25485 26038 1 20 . 1 1 208 208 PRO C C 208 177.467 177.467 175.646 1.821 25485 26039 1 20 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.323 -0.487 25485 26040 1 20 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.115 -0.519 25485 26041 1 20 . 1 1 209 209 ASN N N 209 116.020 116.020 114.130 1.890 25485 26042 1 20 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.760 -0.119 25485 26043 1 20 . 1 1 209 209 ASN C C 209 174.695 174.695 173.777 0.918 25485 26044 1 20 . 1 1 209 209 ASN CA C 209 53.220 53.220 52.141 1.079 25485 26045 1 20 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.578 0.532 25485 26046 1 20 . 1 1 209 209 ASN H H 209 8.350 8.350 7.758 0.592 25485 26047 1 20 . 1 1 210 210 ALA N N 210 124.892 124.892 122.886 2.006 25485 26048 1 20 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.468 -0.373 25485 26049 1 20 . 1 1 210 210 ALA C C 210 179.495 179.495 178.162 1.333 25485 26050 1 20 . 1 1 210 210 ALA CA C 210 52.054 52.054 51.119 0.935 25485 26051 1 20 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.975 -1.776 25485 26052 1 20 . 1 1 210 210 ALA H H 210 8.193 8.193 7.085 1.108 25485 26053 1 20 . 1 1 211 211 VAL N N 211 130.402 130.402 121.515 8.887 25485 26054 1 20 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.746 0.517 25485 26055 1 20 . 1 1 211 211 VAL C C 211 179.408 179.408 176.799 2.609 25485 26056 1 20 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.560 -0.508 25485 26057 1 20 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.349 -1.366 25485 26058 1 20 . 1 1 211 211 VAL H H 211 11.592 11.592 8.842 2.750 25485 26059 1 20 . 1 1 212 212 MET N N 212 113.285 113.285 114.870 -1.585 25485 26060 1 20 . 1 1 212 212 MET C C 212 176.996 176.996 175.141 1.855 25485 26061 1 20 . 1 1 212 212 MET CA C 212 53.614 53.614 54.302 -0.688 25485 26062 1 20 . 1 1 212 212 MET CB C 212 26.975 26.975 30.969 -3.994 25485 26063 1 20 . 1 1 212 212 MET H H 212 7.724 7.724 7.525 0.199 25485 26064 1 20 . 1 1 213 213 TYR N N 213 129.919 129.919 124.191 5.728 25485 26065 1 20 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.610 1.086 25485 26066 1 20 . 1 1 213 213 TYR C C 213 178.411 178.411 175.341 3.070 25485 26067 1 20 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.002 0.129 25485 26068 1 20 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.698 0.469 25485 26069 1 20 . 1 1 213 213 TYR H H 213 7.902 7.902 7.342 0.560 25485 26070 1 20 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.385 -0.910 25485 26071 1 20 . 1 1 214 214 PRO C C 214 177.694 177.694 176.671 1.023 25485 26072 1 20 . 1 1 214 214 PRO CA C 214 66.028 66.028 63.930 2.098 25485 26073 1 20 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.811 1.012 25485 26074 1 20 . 1 1 215 215 THR N N 215 104.450 104.450 114.714 -10.264 25485 26075 1 20 . 1 1 215 215 THR HA H 215 4.444 4.444 4.431 0.013 25485 26076 1 20 . 1 1 215 215 THR C C 215 173.429 173.429 173.471 -0.042 25485 26077 1 20 . 1 1 215 215 THR CA C 215 60.528 60.528 61.140 -0.612 25485 26078 1 20 . 1 1 215 215 THR CB C 215 69.614 69.614 66.670 2.944 25485 26079 1 20 . 1 1 215 215 THR H H 215 6.407 6.407 7.483 -1.076 25485 26080 1 20 . 1 1 216 216 TYR N N 216 124.618 124.618 125.212 -0.594 25485 26081 1 20 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.366 -0.134 25485 26082 1 20 . 1 1 216 216 TYR C C 216 175.669 175.669 174.946 0.723 25485 26083 1 20 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.972 -0.385 25485 26084 1 20 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.758 2.133 25485 26085 1 20 . 1 1 216 216 TYR H H 216 8.331 8.331 7.778 0.553 25485 26086 1 20 . 1 1 217 217 GLY N N 217 116.089 116.089 115.578 0.511 25485 26087 1 20 . 1 1 217 217 GLY C C 217 173.560 173.560 173.290 0.270 25485 26088 1 20 . 1 1 217 217 GLY CA C 217 45.318 45.318 44.877 0.441 25485 26089 1 20 . 1 1 217 217 GLY H H 217 7.695 7.695 8.218 -0.523 25485 26090 1 20 . 1 1 218 218 ASN N N 218 120.167 120.167 119.394 0.773 25485 26091 1 20 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.497 0.169 25485 26092 1 20 . 1 1 218 218 ASN C C 218 175.343 175.343 176.390 -1.047 25485 26093 1 20 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.928 -0.313 25485 26094 1 20 . 1 1 218 218 ASN CB C 218 38.546 38.546 38.626 -0.080 25485 26095 1 20 . 1 1 218 218 ASN H H 218 8.237 8.237 8.358 -0.121 25485 26096 1 20 . 1 1 219 219 GLY N N 219 109.322 109.322 108.799 0.523 25485 26097 1 20 . 1 1 219 219 GLY C C 219 172.842 172.842 173.489 -0.647 25485 26098 1 20 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.933 -0.215 25485 26099 1 20 . 1 1 219 219 GLY H H 219 8.027 8.027 8.332 -0.304 25485 26100 1 20 . 1 1 220 220 ASP N N 220 123.006 123.006 124.754 -1.748 25485 26101 1 20 . 1 1 220 220 ASP H H 220 8.273 8.273 8.400 -0.127 25485 26102 1 20 . 1 1 221 221 PRO C C 221 177.138 177.138 176.828 0.310 25485 26103 1 20 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.749 -5.686 25485 26104 1 20 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.928 -1.232 25485 26105 1 20 . 1 1 222 222 GLN N N 222 116.718 116.718 119.107 -2.389 25485 26106 1 20 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.225 0.111 25485 26107 1 20 . 1 1 222 222 GLN C C 222 176.321 176.321 176.626 -0.305 25485 26108 1 20 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.267 -1.124 25485 26109 1 20 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.663 0.834 25485 26110 1 20 . 1 1 222 222 GLN H H 222 8.240 8.240 8.563 -0.323 25485 26111 1 20 . 1 1 223 223 ASN N N 223 118.368 118.368 114.930 3.438 25485 26112 1 20 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.820 0.096 25485 26113 1 20 . 1 1 223 223 ASN C C 223 173.271 173.271 173.980 -0.709 25485 26114 1 20 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.222 -0.626 25485 26115 1 20 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.725 -0.510 25485 26116 1 20 . 1 1 223 223 ASN H H 223 7.946 7.946 8.293 -0.347 25485 26117 1 20 . 1 1 224 224 PHE N N 224 118.429 118.429 118.341 0.088 25485 26118 1 20 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.256 0.195 25485 26119 1 20 . 1 1 224 224 PHE C C 224 172.897 172.897 173.822 -0.925 25485 26120 1 20 . 1 1 224 224 PHE CA C 224 58.409 58.409 57.804 0.605 25485 26121 1 20 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.561 1.140 25485 26122 1 20 . 1 1 224 224 PHE H H 224 6.992 6.992 7.909 -0.917 25485 26123 1 20 . 1 1 225 225 LYS N N 225 121.714 121.714 125.888 -4.174 25485 26124 1 20 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.807 0.623 25485 26125 1 20 . 1 1 225 225 LYS C C 225 174.664 174.664 174.902 -0.238 25485 26126 1 20 . 1 1 225 225 LYS CA C 225 54.312 54.312 53.958 0.354 25485 26127 1 20 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.712 0.015 25485 26128 1 20 . 1 1 225 225 LYS H H 225 7.709 7.709 8.094 -0.385 25485 26129 1 20 . 1 1 226 226 LEU N N 226 119.026 119.026 121.017 -1.991 25485 26130 1 20 . 1 1 226 226 LEU HA H 226 4.140 4.140 3.978 0.162 25485 26131 1 20 . 1 1 226 226 LEU C C 226 177.495 177.495 177.117 0.378 25485 26132 1 20 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.518 0.081 25485 26133 1 20 . 1 1 226 226 LEU CB C 226 41.281 41.281 41.584 -0.303 25485 26134 1 20 . 1 1 226 226 LEU H H 226 8.015 8.015 8.281 -0.266 25485 26135 1 20 . 1 1 227 227 SER N N 227 120.320 120.320 116.096 4.224 25485 26136 1 20 . 1 1 227 227 SER HA H 227 4.600 4.600 4.652 -0.052 25485 26137 1 20 . 1 1 227 227 SER C C 227 175.492 175.492 175.514 -0.022 25485 26138 1 20 . 1 1 227 227 SER CA C 227 57.239 57.239 57.641 -0.402 25485 26139 1 20 . 1 1 227 227 SER CB C 227 66.278 66.278 64.873 1.405 25485 26140 1 20 . 1 1 227 227 SER H H 227 9.654 9.654 8.238 1.416 25485 26141 1 20 . 1 1 228 228 GLN N N 228 127.511 127.511 124.110 3.401 25485 26142 1 20 . 1 1 228 228 GLN HA H 228 4.694 4.694 4.002 0.692 25485 26143 1 20 . 1 1 228 228 GLN H H 228 8.248 8.248 8.859 -0.611 25485 26144 1 20 . 1 1 229 229 ASP N N 229 124.358 124.358 118.037 6.321 25485 26145 1 20 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.320 0.054 25485 26146 1 20 . 1 1 229 229 ASP C C 229 178.793 178.793 178.051 0.742 25485 26147 1 20 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.854 0.288 25485 26148 1 20 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.249 2.993 25485 26149 1 20 . 1 1 229 229 ASP H H 229 8.138 8.138 8.754 -0.616 25485 26150 1 20 . 1 1 230 230 ASP N N 230 119.694 119.694 119.681 0.013 25485 26151 1 20 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.446 -0.024 25485 26152 1 20 . 1 1 230 230 ASP C C 230 177.736 177.736 177.938 -0.202 25485 26153 1 20 . 1 1 230 230 ASP CA C 230 57.922 57.922 56.587 1.335 25485 26154 1 20 . 1 1 230 230 ASP CB C 230 43.236 43.236 40.862 2.374 25485 26155 1 20 . 1 1 230 230 ASP H H 230 7.393 7.393 8.160 -0.767 25485 26156 1 20 . 1 1 231 231 ILE N N 231 120.364 120.364 120.257 0.107 25485 26157 1 20 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.758 -0.093 25485 26158 1 20 . 1 1 231 231 ILE C C 231 177.631 177.631 177.961 -0.330 25485 26159 1 20 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.190 0.309 25485 26160 1 20 . 1 1 231 231 ILE CB C 231 38.513 38.513 38.060 0.453 25485 26161 1 20 . 1 1 231 231 ILE H H 231 8.115 8.115 7.906 0.209 25485 26162 1 20 . 1 1 232 232 LYS N N 232 119.156 119.156 120.629 -1.473 25485 26163 1 20 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.108 0.006 25485 26164 1 20 . 1 1 232 232 LYS C C 232 180.574 180.574 179.139 1.435 25485 26165 1 20 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.518 0.042 25485 26166 1 20 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.682 0.115 25485 26167 1 20 . 1 1 232 232 LYS H H 232 8.607 8.607 8.430 0.177 25485 26168 1 20 . 1 1 233 233 GLY N N 233 106.425 106.425 108.113 -1.688 25485 26169 1 20 . 1 1 233 233 GLY C C 233 176.098 176.098 175.842 0.256 25485 26170 1 20 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.735 0.902 25485 26171 1 20 . 1 1 233 233 GLY H H 233 8.075 8.075 7.673 0.402 25485 26172 1 20 . 1 1 234 234 ILE N N 234 125.119 125.119 121.775 3.344 25485 26173 1 20 . 1 1 234 234 ILE C C 234 178.231 178.231 177.357 0.874 25485 26174 1 20 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.385 -1.792 25485 26175 1 20 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.171 -0.625 25485 26176 1 20 . 1 1 234 234 ILE H H 234 8.539 8.539 7.461 1.078 25485 26177 1 20 . 1 1 235 235 GLN N N 235 122.877 122.877 119.332 3.545 25485 26178 1 20 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.017 0.340 25485 26179 1 20 . 1 1 235 235 GLN C C 235 180.105 180.105 178.487 1.618 25485 26180 1 20 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.534 -1.647 25485 26181 1 20 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.776 -1.238 25485 26182 1 20 . 1 1 235 235 GLN H H 235 8.296 8.296 8.707 -0.411 25485 26183 1 20 . 1 1 236 236 LYS N N 236 123.678 123.678 118.627 5.051 25485 26184 1 20 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.258 -0.176 25485 26185 1 20 . 1 1 236 236 LYS C C 236 178.169 178.169 177.634 0.535 25485 26186 1 20 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.619 0.757 25485 26187 1 20 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.937 0.041 25485 26188 1 20 . 1 1 236 236 LYS H H 236 8.024 8.024 7.980 0.044 25485 26189 1 20 . 1 1 237 237 LEU N N 237 116.873 116.873 118.750 -1.877 25485 26190 1 20 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.288 -0.301 25485 26191 1 20 . 1 1 237 237 LEU C C 237 177.893 177.893 177.677 0.216 25485 26192 1 20 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.755 0.684 25485 26193 1 20 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.691 0.922 25485 26194 1 20 . 1 1 237 237 LEU H H 237 6.888 6.888 7.250 -0.362 25485 26195 1 20 . 1 1 238 238 TYR N N 238 112.237 112.237 117.284 -5.047 25485 26196 1 20 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.586 0.065 25485 26197 1 20 . 1 1 238 238 TYR C C 238 176.082 176.082 176.218 -0.136 25485 26198 1 20 . 1 1 238 238 TYR CA C 238 59.636 59.636 59.641 -0.005 25485 26199 1 20 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.720 1.678 25485 26200 1 20 . 1 1 238 238 TYR H H 238 7.445 7.445 8.600 -1.155 25485 26201 1 20 . 1 1 239 239 GLY N N 239 110.906 110.906 106.720 4.186 25485 26202 1 20 . 1 1 239 239 GLY C C 239 171.269 171.269 173.014 -1.745 25485 26203 1 20 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.062 -1.176 25485 26204 1 20 . 1 1 239 239 GLY H H 239 8.443 8.443 8.013 0.430 25485 26205 1 20 . 1 1 240 240 LYS N N 240 114.281 114.281 122.100 -7.819 25485 26206 1 20 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.543 0.195 25485 26207 1 20 . 1 1 240 240 LYS C C 240 177.527 177.527 176.570 0.957 25485 26208 1 20 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.464 -0.506 25485 26209 1 20 . 1 1 240 240 LYS CB C 240 34.275 34.275 34.093 0.182 25485 26210 1 20 . 1 1 240 240 LYS H H 240 7.873 7.873 8.306 -0.433 25485 26211 1 20 . 1 1 241 241 ARG N N 241 123.758 123.758 120.668 3.090 25485 26212 1 20 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.501 -0.504 25485 26213 1 20 . 1 1 241 241 ARG C C 241 176.026 176.026 175.489 0.537 25485 26214 1 20 . 1 1 241 241 ARG CA C 241 57.492 57.492 56.533 0.959 25485 26215 1 20 . 1 1 241 241 ARG CB C 241 30.371 30.371 30.903 -0.532 25485 26216 1 20 . 1 1 241 241 ARG H H 241 7.742 7.742 8.416 -0.674 25485 26217 1 20 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.301 0.039 25485 26218 1 20 . 1 1 246 246 LYS C C 246 175.403 175.403 175.841 -0.438 25485 26219 1 20 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.683 -0.174 25485 26220 1 20 . 1 1 246 246 LYS CB C 246 32.858 32.858 32.804 0.054 25485 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 217 3.204 -0.712 3.131 25485 2 1 1 "Average Difference" HA 249 0.384 -0.013 0.385 25485 3 1 1 "Average Difference" C 230 1.142 0.106 1.139 25485 4 1 1 "Average Difference" CA 235 1.328 0.009 1.330 25485 5 1 1 "Average Difference" CB 211 1.337 0.023 1.340 25485 6 1 1 "Average Difference" HN 218 0.691 -0.049 0.691 25485 7 1 2 "Average Difference" N 217 3.258 -0.646 3.201 25485 8 1 2 "Average Difference" HA 249 0.388 0.002 0.388 25485 9 1 2 "Average Difference" C 230 1.180 0.088 1.180 25485 10 1 2 "Average Difference" CA 235 1.346 0.020 1.349 25485 11 1 2 "Average Difference" CB 211 1.329 0.035 1.331 25485 12 1 2 "Average Difference" HN 218 0.696 -0.059 0.696 25485 13 1 3 "Average Difference" N 217 3.236 -0.666 3.174 25485 14 1 3 "Average Difference" HA 249 0.385 -0.023 0.385 25485 15 1 3 "Average Difference" C 230 1.185 0.071 1.186 25485 16 1 3 "Average Difference" CA 235 1.304 -0.037 1.307 25485 17 1 3 "Average Difference" CB 211 1.290 0.029 1.293 25485 18 1 3 "Average Difference" HN 218 0.695 -0.087 0.691 25485 19 1 4 "Average Difference" N 217 3.394 -0.706 3.328 25485 20 1 4 "Average Difference" HA 249 0.403 -0.029 0.402 25485 21 1 4 "Average Difference" C 230 1.198 0.117 1.195 25485 22 1 4 "Average Difference" CA 235 1.334 0.005 1.336 25485 23 1 4 "Average Difference" CB 211 1.329 -0.010 1.332 25485 24 1 4 "Average Difference" HN 218 0.709 -0.065 0.708 25485 25 1 5 "Average Difference" N 217 3.310 -0.712 3.240 25485 26 1 5 "Average Difference" HA 249 0.399 -0.005 0.399 25485 27 1 5 "Average Difference" C 230 1.211 0.045 1.213 25485 28 1 5 "Average Difference" CA 235 1.258 0.001 1.261 25485 29 1 5 "Average Difference" CB 211 1.418 0.082 1.419 25485 30 1 5 "Average Difference" HN 218 0.701 -0.061 0.700 25485 31 1 6 "Average Difference" N 217 3.239 -0.689 3.172 25485 32 1 6 "Average Difference" HA 249 0.404 -0.017 0.405 25485 33 1 6 "Average Difference" C 230 1.224 0.094 1.223 25485 34 1 6 "Average Difference" CA 235 1.269 -0.032 1.271 25485 35 1 6 "Average Difference" CB 211 1.336 0.050 1.338 25485 36 1 6 "Average Difference" HN 218 0.697 -0.078 0.694 25485 37 1 7 "Average Difference" N 217 3.410 -0.579 3.368 25485 38 1 7 "Average Difference" HA 249 0.413 -0.021 0.413 25485 39 1 7 "Average Difference" C 230 1.163 0.128 1.158 25485 40 1 7 "Average Difference" CA 235 1.283 -0.018 1.286 25485 41 1 7 "Average Difference" CB 211 1.323 -0.042 1.325 25485 42 1 7 "Average Difference" HN 218 0.699 -0.072 0.697 25485 43 1 8 "Average Difference" N 217 3.262 -0.746 3.183 25485 44 1 8 "Average Difference" HA 249 0.410 -0.013 0.411 25485 45 1 8 "Average Difference" C 230 1.229 0.104 1.227 25485 46 1 8 "Average Difference" CA 235 1.280 -0.040 1.283 25485 47 1 8 "Average Difference" CB 211 1.350 0.022 1.353 25485 48 1 8 "Average Difference" HN 218 0.699 -0.083 0.696 25485 49 1 9 "Average Difference" N 217 3.286 -0.841 3.184 25485 50 1 9 "Average Difference" HA 249 0.415 -0.035 0.414 25485 51 1 9 "Average Difference" C 230 1.184 0.114 1.181 25485 52 1 9 "Average Difference" CA 235 1.269 -0.003 1.272 25485 53 1 9 "Average Difference" CB 211 1.327 -0.025 1.330 25485 54 1 9 "Average Difference" HN 218 0.696 -0.078 0.693 25485 55 1 10 "Average Difference" N 217 3.264 -0.717 3.191 25485 56 1 10 "Average Difference" HA 249 0.395 -0.008 0.396 25485 57 1 10 "Average Difference" C 230 1.182 0.094 1.181 25485 58 1 10 "Average Difference" CA 235 1.237 0.021 1.240 25485 59 1 10 "Average Difference" CB 211 1.371 0.088 1.372 25485 60 1 10 "Average Difference" HN 218 0.711 -0.038 0.711 25485 61 1 11 "Average Difference" N 217 3.347 -0.652 3.291 25485 62 1 11 "Average Difference" HA 249 0.414 -0.013 0.415 25485 63 1 11 "Average Difference" C 230 1.175 0.075 1.175 25485 64 1 11 "Average Difference" CA 235 1.270 -0.063 1.271 25485 65 1 11 "Average Difference" CB 211 1.311 -0.024 1.314 25485 66 1 11 "Average Difference" HN 218 0.683 -0.082 0.680 25485 67 1 12 "Average Difference" N 217 3.525 -0.592 3.483 25485 68 1 12 "Average Difference" HA 249 0.417 -0.004 0.418 25485 69 1 12 "Average Difference" C 230 1.156 0.118 1.152 25485 70 1 12 "Average Difference" CA 235 1.334 0.012 1.337 25485 71 1 12 "Average Difference" CB 211 1.288 -0.030 1.290 25485 72 1 12 "Average Difference" HN 218 0.691 -0.058 0.690 25485 73 1 13 "Average Difference" N 217 3.281 -0.675 3.218 25485 74 1 13 "Average Difference" HA 249 0.411 -0.020 0.412 25485 75 1 13 "Average Difference" C 230 1.215 0.128 1.211 25485 76 1 13 "Average Difference" CA 235 1.325 0.007 1.328 25485 77 1 13 "Average Difference" CB 211 1.449 0.022 1.453 25485 78 1 13 "Average Difference" HN 218 0.707 -0.093 0.702 25485 79 1 14 "Average Difference" N 217 3.269 -0.754 3.188 25485 80 1 14 "Average Difference" HA 249 0.393 -0.028 0.393 25485 81 1 14 "Average Difference" C 230 1.161 0.093 1.159 25485 82 1 14 "Average Difference" CA 235 1.264 0.006 1.267 25485 83 1 14 "Average Difference" CB 211 1.394 0.036 1.397 25485 84 1 14 "Average Difference" HN 218 0.697 -0.074 0.694 25485 85 1 15 "Average Difference" N 217 3.249 -0.551 3.209 25485 86 1 15 "Average Difference" HA 249 0.400 -0.016 0.401 25485 87 1 15 "Average Difference" C 230 1.180 0.113 1.177 25485 88 1 15 "Average Difference" CA 235 1.280 0.001 1.283 25485 89 1 15 "Average Difference" CB 211 1.277 0.017 1.280 25485 90 1 15 "Average Difference" HN 218 0.689 -0.067 0.688 25485 91 1 16 "Average Difference" N 217 3.324 -0.673 3.263 25485 92 1 16 "Average Difference" HA 249 0.417 -0.007 0.418 25485 93 1 16 "Average Difference" C 230 1.201 0.110 1.199 25485 94 1 16 "Average Difference" CA 235 1.297 -0.017 1.299 25485 95 1 16 "Average Difference" CB 211 1.328 0.027 1.331 25485 96 1 16 "Average Difference" HN 218 0.686 -0.051 0.686 25485 97 1 17 "Average Difference" N 217 3.357 -0.734 3.283 25485 98 1 17 "Average Difference" HA 249 0.399 -0.008 0.400 25485 99 1 17 "Average Difference" C 230 1.164 0.120 1.160 25485 100 1 17 "Average Difference" CA 235 1.309 -0.020 1.312 25485 101 1 17 "Average Difference" CB 211 1.372 0.033 1.375 25485 102 1 17 "Average Difference" HN 218 0.700 -0.062 0.699 25485 103 1 18 "Average Difference" N 217 3.416 -0.648 3.362 25485 104 1 18 "Average Difference" HA 249 0.404 -0.016 0.405 25485 105 1 18 "Average Difference" C 230 1.198 0.060 1.199 25485 106 1 18 "Average Difference" CA 235 1.285 -0.038 1.287 25485 107 1 18 "Average Difference" CB 211 1.358 0.027 1.361 25485 108 1 18 "Average Difference" HN 218 0.693 -0.077 0.690 25485 109 1 19 "Average Difference" N 217 3.266 -0.673 3.204 25485 110 1 19 "Average Difference" HA 249 0.405 -0.007 0.405 25485 111 1 19 "Average Difference" C 230 1.191 0.098 1.189 25485 112 1 19 "Average Difference" CA 235 1.261 -0.018 1.263 25485 113 1 19 "Average Difference" CB 211 1.478 0.033 1.481 25485 114 1 19 "Average Difference" HN 218 0.692 -0.047 0.692 25485 115 1 20 "Average Difference" N 217 3.311 -0.708 3.242 25485 116 1 20 "Average Difference" HA 249 0.398 -0.033 0.397 25485 117 1 20 "Average Difference" C 230 1.148 0.124 1.144 25485 118 1 20 "Average Difference" CA 235 1.250 0.026 1.252 25485 119 1 20 "Average Difference" CB 211 1.405 0.003 1.409 25485 120 1 20 "Average Difference" HN 218 0.699 -0.076 0.696 25485 stop_ save_ save_delta_chem_shifts_average _Entity_delta_chem_shifts.Sf_category delta_chem_shifts _Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average _Entity_delta_chem_shifts.Model_type average _Entity_delta_chem_shifts.Entry_ID 25485 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 GLN HA H 2 4.307 4.307 4.409 -0.102 25485 2 1 . 1 1 2 2 GLN C C 2 176.492 176.492 175.928 0.564 25485 3 1 . 1 1 2 2 GLN CA C 2 56.749 56.749 56.274 0.475 25485 4 1 . 1 1 2 2 GLN CB C 2 28.654 28.654 28.919 -0.265 25485 5 1 . 1 1 3 3 GLU N N 3 121.668 121.668 121.965 -0.297 25485 6 1 . 1 1 3 3 GLU HA H 3 3.789 3.789 4.304 -0.515 25485 7 1 . 1 1 3 3 GLU C C 3 176.278 176.278 177.800 -1.522 25485 8 1 . 1 1 3 3 GLU CA C 3 57.059 57.059 57.633 -0.574 25485 9 1 . 1 1 3 3 GLU CB C 3 29.691 29.691 29.725 -0.034 25485 10 1 . 1 1 3 3 GLU H H 3 8.331 8.331 8.652 -0.321 25485 11 1 . 1 1 4 4 ALA N N 4 124.493 124.493 123.139 1.354 25485 12 1 . 1 1 4 4 ALA HA H 4 4.510 4.510 4.166 0.344 25485 13 1 . 1 1 4 4 ALA C C 4 178.428 178.428 179.786 -1.359 25485 14 1 . 1 1 4 4 ALA CA C 4 54.677 54.677 54.688 -0.011 25485 15 1 . 1 1 4 4 ALA CB C 4 18.709 18.709 18.083 0.626 25485 16 1 . 1 1 4 4 ALA H H 4 8.131 8.131 8.366 -0.235 25485 17 1 . 1 1 5 5 GLY N N 5 108.204 108.204 107.441 0.763 25485 18 1 . 1 1 5 5 GLY C C 5 174.858 174.858 175.523 -0.665 25485 19 1 . 1 1 5 5 GLY CA C 5 47.661 47.661 46.079 1.581 25485 20 1 . 1 1 5 5 GLY H H 5 8.279 8.279 8.495 -0.216 25485 21 1 . 1 1 6 6 GLY N N 6 108.820 108.820 108.131 0.689 25485 22 1 . 1 1 6 6 GLY C C 6 174.189 174.189 174.106 0.083 25485 23 1 . 1 1 6 6 GLY CA C 6 44.413 44.413 44.282 0.131 25485 24 1 . 1 1 6 6 GLY H H 6 8.246 8.246 7.777 0.469 25485 25 1 . 1 1 7 7 MET N N 7 119.938 119.938 119.925 0.013 25485 26 1 . 1 1 7 7 MET HA H 7 4.659 4.659 4.605 0.054 25485 27 1 . 1 1 7 7 MET C C 7 176.191 176.191 175.953 0.238 25485 28 1 . 1 1 7 7 MET CA C 7 54.799 54.799 55.272 -0.473 25485 29 1 . 1 1 7 7 MET CB C 7 33.046 33.046 33.826 -0.780 25485 30 1 . 1 1 7 7 MET H H 7 8.005 8.005 7.713 0.292 25485 31 1 . 1 1 8 8 SER N N 8 118.919 118.919 116.090 2.829 25485 32 1 . 1 1 8 8 SER HA H 8 4.239 4.239 4.644 -0.405 25485 33 1 . 1 1 8 8 SER C C 8 174.949 174.949 175.356 -0.407 25485 34 1 . 1 1 8 8 SER CA C 8 58.160 58.160 57.500 0.660 25485 35 1 . 1 1 8 8 SER CB C 8 65.440 65.440 64.660 0.780 25485 36 1 . 1 1 8 8 SER H H 8 8.731 8.731 8.325 0.406 25485 37 1 . 1 1 9 9 GLU N N 9 122.442 122.442 122.043 0.399 25485 38 1 . 1 1 9 9 GLU HA H 9 4.321 4.321 4.130 0.191 25485 39 1 . 1 1 9 9 GLU C C 9 178.604 178.604 178.685 -0.081 25485 40 1 . 1 1 9 9 GLU CA C 9 59.467 59.467 59.519 -0.052 25485 41 1 . 1 1 9 9 GLU CB C 9 29.176 29.176 29.439 -0.263 25485 42 1 . 1 1 9 9 GLU H H 9 8.901 8.901 8.933 -0.032 25485 43 1 . 1 1 10 10 LEU N N 10 120.568 120.568 118.992 1.576 25485 44 1 . 1 1 10 10 LEU C C 10 179.307 179.307 178.989 0.318 25485 45 1 . 1 1 10 10 LEU CA C 10 57.480 57.480 58.074 -0.594 25485 46 1 . 1 1 10 10 LEU CB C 10 41.575 41.575 41.569 0.006 25485 47 1 . 1 1 10 10 LEU H H 10 8.020 8.020 8.115 -0.095 25485 48 1 . 1 1 11 11 GLN N N 11 119.930 119.930 118.632 1.298 25485 49 1 . 1 1 11 11 GLN HA H 11 4.134 4.134 4.059 0.075 25485 50 1 . 1 1 11 11 GLN C C 11 178.330 178.330 178.512 -0.182 25485 51 1 . 1 1 11 11 GLN CA C 11 58.818 58.818 58.954 -0.136 25485 52 1 . 1 1 11 11 GLN CB C 11 27.864 27.864 28.428 -0.564 25485 53 1 . 1 1 11 11 GLN H H 11 7.811 7.811 7.722 0.089 25485 54 1 . 1 1 12 12 TRP N N 12 121.031 121.031 120.907 0.124 25485 55 1 . 1 1 12 12 TRP HA H 12 4.414 4.414 4.387 0.027 25485 56 1 . 1 1 12 12 TRP C C 12 178.874 178.874 178.092 0.782 25485 57 1 . 1 1 12 12 TRP CA C 12 60.507 60.507 60.262 0.245 25485 58 1 . 1 1 12 12 TRP CB C 12 29.387 29.387 29.714 -0.327 25485 59 1 . 1 1 12 12 TRP H H 12 8.205 8.205 7.892 0.313 25485 60 1 . 1 1 13 13 GLU N N 13 121.877 121.877 119.545 2.332 25485 61 1 . 1 1 13 13 GLU C C 13 179.425 179.425 178.961 0.464 25485 62 1 . 1 1 13 13 GLU CA C 13 60.037 60.037 59.672 0.365 25485 63 1 . 1 1 13 13 GLU CB C 13 28.922 28.922 29.520 -0.598 25485 64 1 . 1 1 13 13 GLU H H 13 8.434 8.434 8.387 0.047 25485 65 1 . 1 1 14 14 GLN N N 14 120.449 120.449 118.852 1.597 25485 66 1 . 1 1 14 14 GLN HA H 14 4.238 4.238 3.939 0.299 25485 67 1 . 1 1 14 14 GLN C C 14 179.210 179.210 178.144 1.066 25485 68 1 . 1 1 14 14 GLN CA C 14 58.882 58.882 58.650 0.232 25485 69 1 . 1 1 14 14 GLN CB C 14 27.750 27.750 28.363 -0.613 25485 70 1 . 1 1 14 14 GLN H H 14 8.124 8.124 8.176 -0.052 25485 71 1 . 1 1 15 15 ALA N N 15 123.114 123.114 121.098 2.016 25485 72 1 . 1 1 15 15 ALA HA H 15 4.390 4.390 3.911 0.479 25485 73 1 . 1 1 15 15 ALA C C 15 179.352 179.352 179.314 0.038 25485 74 1 . 1 1 15 15 ALA CA C 15 54.965 54.965 55.291 -0.326 25485 75 1 . 1 1 15 15 ALA CB C 15 18.663 18.663 17.936 0.727 25485 76 1 . 1 1 15 15 ALA H H 15 8.344 8.344 7.580 0.764 25485 77 1 . 1 1 16 16 GLN N N 16 117.718 117.718 117.559 0.159 25485 78 1 . 1 1 16 16 GLN HA H 16 3.782 3.782 3.973 -0.191 25485 79 1 . 1 1 16 16 GLN C C 16 177.719 177.719 178.057 -0.338 25485 80 1 . 1 1 16 16 GLN CA C 16 60.281 60.281 58.848 1.433 25485 81 1 . 1 1 16 16 GLN CB C 16 28.536 28.536 28.591 -0.055 25485 82 1 . 1 1 16 16 GLN H H 16 8.500 8.500 7.640 0.860 25485 83 1 . 1 1 17 17 ASP N N 17 120.040 120.040 120.046 -0.006 25485 84 1 . 1 1 17 17 ASP HA H 17 4.536 4.536 4.387 0.149 25485 85 1 . 1 1 17 17 ASP C C 17 177.630 177.630 178.619 -0.989 25485 86 1 . 1 1 17 17 ASP CA C 17 57.805 57.805 57.435 0.370 25485 87 1 . 1 1 17 17 ASP CB C 17 41.864 41.864 40.723 1.141 25485 88 1 . 1 1 17 17 ASP H H 17 7.871 7.871 7.801 0.070 25485 89 1 . 1 1 18 18 TYR N N 18 122.465 122.465 119.506 2.959 25485 90 1 . 1 1 18 18 TYR HA H 18 4.190 4.190 4.174 0.016 25485 91 1 . 1 1 18 18 TYR C C 18 178.439 178.439 177.803 0.636 25485 92 1 . 1 1 18 18 TYR CA C 18 61.846 61.846 60.520 1.326 25485 93 1 . 1 1 18 18 TYR CB C 18 39.940 39.940 38.234 1.706 25485 94 1 . 1 1 18 18 TYR H H 18 8.244 8.244 8.319 -0.075 25485 95 1 . 1 1 19 19 LEU N N 19 117.635 117.635 118.279 -0.644 25485 96 1 . 1 1 19 19 LEU HA H 19 4.132 4.132 4.016 0.116 25485 97 1 . 1 1 19 19 LEU C C 19 180.940 180.940 178.225 2.715 25485 98 1 . 1 1 19 19 LEU CA C 19 57.505 57.505 56.927 0.578 25485 99 1 . 1 1 19 19 LEU CB C 19 40.598 40.598 41.519 -0.921 25485 100 1 . 1 1 19 19 LEU H H 19 8.713 8.713 7.772 0.941 25485 101 1 . 1 1 20 20 LYS N N 20 124.594 124.594 118.160 6.434 25485 102 1 . 1 1 20 20 LYS HA H 20 4.084 4.084 4.159 -0.075 25485 103 1 . 1 1 20 20 LYS C C 20 178.387 178.387 178.348 0.039 25485 104 1 . 1 1 20 20 LYS CA C 20 59.805 59.805 58.994 0.811 25485 105 1 . 1 1 20 20 LYS CB C 20 32.456 32.456 32.352 0.105 25485 106 1 . 1 1 20 20 LYS H H 20 8.815 8.815 7.637 1.178 25485 107 1 . 1 1 21 21 ARG N N 21 117.535 117.535 117.661 -0.126 25485 108 1 . 1 1 21 21 ARG HA H 21 3.719 3.719 4.186 -0.467 25485 109 1 . 1 1 21 21 ARG C C 21 178.498 178.498 178.362 0.136 25485 110 1 . 1 1 21 21 ARG CA C 21 59.244 59.244 58.183 1.061 25485 111 1 . 1 1 21 21 ARG CB C 21 29.441 29.441 29.385 0.056 25485 112 1 . 1 1 21 21 ARG H H 21 7.810 7.810 7.414 0.396 25485 113 1 . 1 1 22 22 PHE N N 22 112.113 112.113 119.898 -7.785 25485 114 1 . 1 1 22 22 PHE HA H 22 4.911 4.911 4.143 0.768 25485 115 1 . 1 1 22 22 PHE C C 22 174.875 174.875 175.222 -0.347 25485 116 1 . 1 1 22 22 PHE CA C 22 57.475 57.475 60.600 -3.125 25485 117 1 . 1 1 22 22 PHE CB C 22 39.169 39.169 39.207 -0.038 25485 118 1 . 1 1 22 22 PHE H H 22 8.010 8.010 7.623 0.387 25485 119 1 . 1 1 23 23 TYR N N 23 116.187 116.187 116.204 -0.017 25485 120 1 . 1 1 23 23 TYR C C 23 173.455 173.455 175.685 -2.230 25485 121 1 . 1 1 23 23 TYR CA C 23 58.427 58.427 57.305 1.122 25485 122 1 . 1 1 23 23 TYR CB C 23 39.529 39.529 38.214 1.315 25485 123 1 . 1 1 23 23 TYR H H 23 7.680 7.680 7.468 0.212 25485 124 1 . 1 1 24 24 LEU N N 24 115.570 115.570 116.123 -0.553 25485 125 1 . 1 1 24 24 LEU HA H 24 4.150 4.150 4.098 0.052 25485 126 1 . 1 1 24 24 LEU C C 24 176.661 176.661 175.498 1.163 25485 127 1 . 1 1 24 24 LEU CA C 24 56.152 56.152 55.883 0.269 25485 128 1 . 1 1 24 24 LEU CB C 24 36.863 36.863 42.338 -5.475 25485 129 1 . 1 1 24 24 LEU H H 24 7.238 7.238 7.662 -0.424 25485 130 1 . 1 1 25 25 TYR N N 25 119.901 119.901 120.901 -1.000 25485 131 1 . 1 1 25 25 TYR HA H 25 4.359 4.359 4.682 -0.323 25485 132 1 . 1 1 25 25 TYR C C 25 173.784 173.784 174.120 -0.336 25485 133 1 . 1 1 25 25 TYR CA C 25 58.247 58.247 57.480 0.767 25485 134 1 . 1 1 25 25 TYR CB C 25 39.079 39.079 39.003 0.076 25485 135 1 . 1 1 25 25 TYR H H 25 7.845 7.845 8.320 -0.475 25485 136 1 . 1 1 26 26 ASP N N 26 129.338 129.338 127.118 2.220 25485 137 1 . 1 1 26 26 ASP HA H 26 4.451 4.451 5.012 -0.561 25485 138 1 . 1 1 26 26 ASP C C 26 175.282 175.282 176.149 -0.868 25485 139 1 . 1 1 26 26 ASP CA C 26 52.433 52.433 53.682 -1.249 25485 140 1 . 1 1 26 26 ASP CB C 26 41.249 41.249 41.860 -0.611 25485 141 1 . 1 1 26 26 ASP H H 26 8.108 8.108 8.333 -0.225 25485 142 1 . 1 1 27 27 SER C C 27 175.204 175.204 176.118 -0.914 25485 143 1 . 1 1 27 27 SER CA C 27 59.424 59.424 60.054 -0.630 25485 144 1 . 1 1 27 27 SER CB C 27 63.535 63.535 63.609 -0.074 25485 145 1 . 1 1 28 28 GLU N N 28 122.058 122.058 121.449 0.609 25485 146 1 . 1 1 28 28 GLU HA H 28 4.325 4.325 4.180 0.145 25485 147 1 . 1 1 28 28 GLU C C 28 177.073 177.073 177.209 -0.136 25485 148 1 . 1 1 28 28 GLU CA C 28 57.212 57.212 58.449 -1.237 25485 149 1 . 1 1 28 28 GLU CB C 28 29.570 29.570 29.252 0.318 25485 150 1 . 1 1 28 28 GLU H H 28 8.255 8.255 8.673 -0.418 25485 151 1 . 1 1 29 29 THR N N 29 114.161 114.161 112.447 1.714 25485 152 1 . 1 1 29 29 THR HA H 29 4.260 4.260 4.270 -0.010 25485 153 1 . 1 1 29 29 THR C C 29 174.591 174.591 174.381 0.210 25485 154 1 . 1 1 29 29 THR CA C 29 61.976 61.976 62.685 -0.709 25485 155 1 . 1 1 29 29 THR CB C 29 69.385 69.385 68.863 0.522 25485 156 1 . 1 1 29 29 THR H H 29 7.498 7.498 7.615 -0.117 25485 157 1 . 1 1 30 30 LYS HA H 30 4.218 4.218 4.114 0.104 25485 158 1 . 1 1 30 30 LYS H H 30 8.218 8.218 7.629 0.589 25485 159 1 . 1 1 31 31 ASN HA H 31 4.424 4.424 4.639 -0.215 25485 160 1 . 1 1 31 31 ASN CB C 31 39.133 39.133 40.129 -0.996 25485 161 1 . 1 1 32 32 ALA N N 32 126.484 126.484 123.519 2.965 25485 162 1 . 1 1 32 32 ALA HA H 32 4.296 4.296 4.192 0.104 25485 163 1 . 1 1 32 32 ALA C C 32 178.012 178.012 178.559 -0.547 25485 164 1 . 1 1 32 32 ALA CA C 32 53.760 53.760 54.734 -0.974 25485 165 1 . 1 1 32 32 ALA CB C 32 18.770 18.770 19.098 -0.328 25485 166 1 . 1 1 32 32 ALA H H 32 8.411 8.411 8.644 -0.233 25485 167 1 . 1 1 33 33 ASN N N 33 116.885 116.885 115.974 0.911 25485 168 1 . 1 1 33 33 ASN HA H 33 4.698 4.698 4.602 0.096 25485 169 1 . 1 1 33 33 ASN C C 33 176.240 176.240 177.204 -0.964 25485 170 1 . 1 1 33 33 ASN CA C 33 54.187 54.187 55.469 -1.282 25485 171 1 . 1 1 33 33 ASN CB C 33 38.585 38.585 38.290 0.295 25485 172 1 . 1 1 33 33 ASN H H 33 8.309 8.309 8.429 -0.120 25485 173 1 . 1 1 34 34 SER N N 34 116.836 116.836 115.872 0.964 25485 174 1 . 1 1 34 34 SER HA H 34 4.544 4.544 4.316 0.228 25485 175 1 . 1 1 34 34 SER C C 34 175.253 175.253 175.987 -0.734 25485 176 1 . 1 1 34 34 SER CA C 34 59.583 59.583 60.615 -1.032 25485 177 1 . 1 1 34 34 SER CB C 34 63.919 63.919 62.921 0.998 25485 178 1 . 1 1 34 34 SER H H 34 8.115 8.115 8.088 0.027 25485 179 1 . 1 1 35 35 LEU N N 35 125.355 125.355 123.233 2.122 25485 180 1 . 1 1 35 35 LEU HA H 35 3.576 3.576 4.066 -0.490 25485 181 1 . 1 1 35 35 LEU C C 35 177.973 177.973 177.990 -0.017 25485 182 1 . 1 1 35 35 LEU CA C 35 58.497 58.497 58.245 0.252 25485 183 1 . 1 1 35 35 LEU CB C 35 40.692 40.692 41.670 -0.978 25485 184 1 . 1 1 35 35 LEU H H 35 8.312 8.312 7.727 0.585 25485 185 1 . 1 1 36 36 GLU N N 36 119.201 119.201 118.918 0.283 25485 186 1 . 1 1 36 36 GLU HA H 36 3.914 3.914 3.949 -0.035 25485 187 1 . 1 1 36 36 GLU C C 36 178.141 178.141 178.739 -0.598 25485 188 1 . 1 1 36 36 GLU CA C 36 59.659 59.659 59.482 0.177 25485 189 1 . 1 1 36 36 GLU CB C 36 29.313 29.313 28.929 0.384 25485 190 1 . 1 1 36 36 GLU H H 36 8.225 8.225 7.929 0.296 25485 191 1 . 1 1 37 37 ALA N N 37 120.746 120.746 122.301 -1.555 25485 192 1 . 1 1 37 37 ALA HA H 37 4.079 4.079 4.045 0.034 25485 193 1 . 1 1 37 37 ALA C C 37 181.485 181.485 179.683 1.802 25485 194 1 . 1 1 37 37 ALA CA C 37 55.459 55.459 54.991 0.468 25485 195 1 . 1 1 37 37 ALA CB C 37 18.167 18.167 18.274 -0.107 25485 196 1 . 1 1 37 37 ALA H H 37 7.917 7.917 7.689 0.228 25485 197 1 . 1 1 38 38 LYS N N 38 119.326 119.326 119.282 0.044 25485 198 1 . 1 1 38 38 LYS HA H 38 4.331 4.331 4.119 0.212 25485 199 1 . 1 1 38 38 LYS C C 38 177.946 177.946 178.940 -0.994 25485 200 1 . 1 1 38 38 LYS CA C 38 57.704 57.704 58.831 -1.127 25485 201 1 . 1 1 38 38 LYS CB C 38 31.800 31.800 32.303 -0.503 25485 202 1 . 1 1 38 38 LYS H H 38 8.216 8.216 8.054 0.162 25485 203 1 . 1 1 39 39 LEU N N 39 122.736 122.736 119.870 2.866 25485 204 1 . 1 1 39 39 LEU HA H 39 3.941 3.941 3.983 -0.042 25485 205 1 . 1 1 39 39 LEU C C 39 178.819 178.819 178.800 0.019 25485 206 1 . 1 1 39 39 LEU CA C 39 58.081 58.081 58.047 0.034 25485 207 1 . 1 1 39 39 LEU CB C 39 40.628 40.628 41.403 -0.775 25485 208 1 . 1 1 39 39 LEU H H 39 8.666 8.666 8.392 0.274 25485 209 1 . 1 1 40 40 LYS N N 40 118.411 118.411 119.418 -1.007 25485 210 1 . 1 1 40 40 LYS HA H 40 4.638 4.638 3.990 0.648 25485 211 1 . 1 1 40 40 LYS C C 40 179.329 179.329 178.654 0.675 25485 212 1 . 1 1 40 40 LYS CA C 40 60.133 60.133 59.956 0.177 25485 213 1 . 1 1 40 40 LYS CB C 40 31.785 31.785 32.297 -0.512 25485 214 1 . 1 1 40 40 LYS H H 40 8.227 8.227 7.859 0.368 25485 215 1 . 1 1 41 41 GLU N N 41 121.329 121.329 118.328 3.001 25485 216 1 . 1 1 41 41 GLU HA H 41 4.093 4.093 4.113 -0.020 25485 217 1 . 1 1 41 41 GLU C C 41 178.989 178.989 179.012 -0.023 25485 218 1 . 1 1 41 41 GLU CA C 41 59.760 59.760 59.042 0.718 25485 219 1 . 1 1 41 41 GLU CB C 41 29.836 29.836 28.987 0.849 25485 220 1 . 1 1 41 41 GLU H H 41 7.718 7.718 7.755 -0.037 25485 221 1 . 1 1 42 42 MET N N 42 123.817 123.817 120.133 3.684 25485 222 1 . 1 1 42 42 MET HA H 42 4.107 4.107 4.352 -0.245 25485 223 1 . 1 1 42 42 MET C C 42 177.719 177.719 178.026 -0.307 25485 224 1 . 1 1 42 42 MET CA C 42 59.912 59.912 58.686 1.226 25485 225 1 . 1 1 42 42 MET CB C 42 30.506 30.506 32.606 -2.100 25485 226 1 . 1 1 42 42 MET H H 42 7.657 7.657 7.681 -0.024 25485 227 1 . 1 1 43 43 GLN N N 43 119.998 119.998 118.455 1.543 25485 228 1 . 1 1 43 43 GLN HA H 43 3.805 3.805 4.013 -0.208 25485 229 1 . 1 1 43 43 GLN C C 43 177.604 177.604 178.844 -1.240 25485 230 1 . 1 1 43 43 GLN CA C 43 59.965 59.965 58.990 0.975 25485 231 1 . 1 1 43 43 GLN CB C 43 26.555 26.555 27.945 -1.390 25485 232 1 . 1 1 43 43 GLN H H 43 8.910 8.910 8.015 0.895 25485 233 1 . 1 1 44 44 LYS N N 44 119.165 119.165 119.026 0.139 25485 234 1 . 1 1 44 44 LYS HA H 44 4.055 4.055 4.230 -0.175 25485 235 1 . 1 1 44 44 LYS C C 44 179.991 179.991 178.870 1.121 25485 236 1 . 1 1 44 44 LYS CA C 44 59.561 59.561 58.294 1.267 25485 237 1 . 1 1 44 44 LYS CB C 44 32.298 32.298 32.046 0.252 25485 238 1 . 1 1 44 44 LYS H H 44 8.507 8.507 7.639 0.868 25485 239 1 . 1 1 45 45 PHE N N 45 123.602 123.602 120.209 3.393 25485 240 1 . 1 1 45 45 PHE HA H 45 3.901 3.901 4.335 -0.434 25485 241 1 . 1 1 45 45 PHE C C 45 177.606 177.606 176.724 0.882 25485 242 1 . 1 1 45 45 PHE CA C 45 63.034 63.034 60.754 2.280 25485 243 1 . 1 1 45 45 PHE CB C 45 39.866 39.866 39.359 0.507 25485 244 1 . 1 1 45 45 PHE H H 45 8.445 8.445 7.693 0.752 25485 245 1 . 1 1 46 46 PHE N N 46 112.715 112.715 115.786 -3.071 25485 246 1 . 1 1 46 46 PHE HA H 46 4.597 4.597 4.437 0.160 25485 247 1 . 1 1 46 46 PHE C C 46 175.285 175.285 177.120 -1.835 25485 248 1 . 1 1 46 46 PHE CA C 46 60.675 60.675 59.881 0.794 25485 249 1 . 1 1 46 46 PHE CB C 46 39.459 39.459 40.289 -0.830 25485 250 1 . 1 1 46 46 PHE H H 46 8.272 8.272 8.296 -0.024 25485 251 1 . 1 1 47 47 GLY N N 47 110.438 110.438 107.087 3.351 25485 252 1 . 1 1 47 47 GLY C C 47 174.935 174.935 174.437 0.498 25485 253 1 . 1 1 47 47 GLY CA C 47 47.011 47.011 45.257 1.755 25485 254 1 . 1 1 47 47 GLY H H 47 7.926 7.926 8.330 -0.404 25485 255 1 . 1 1 48 48 LEU N N 48 121.830 121.830 119.315 2.514 25485 256 1 . 1 1 48 48 LEU HA H 48 4.924 4.924 4.673 0.251 25485 257 1 . 1 1 48 48 LEU C C 48 174.009 174.009 175.956 -1.947 25485 258 1 . 1 1 48 48 LEU CA C 48 51.835 51.835 53.555 -1.720 25485 259 1 . 1 1 48 48 LEU CB C 48 41.463 41.463 40.909 0.554 25485 260 1 . 1 1 48 48 LEU H H 48 8.762 8.762 7.612 1.150 25485 261 1 . 1 1 49 49 PRO HA H 49 4.238 4.238 4.387 -0.149 25485 262 1 . 1 1 49 49 PRO C C 49 176.874 176.874 176.837 0.037 25485 263 1 . 1 1 49 49 PRO CA C 49 63.518 63.518 63.821 -0.303 25485 264 1 . 1 1 49 49 PRO CB C 49 31.079 31.079 31.892 -0.813 25485 265 1 . 1 1 50 50 ILE N N 50 126.859 126.859 117.739 9.120 25485 266 1 . 1 1 50 50 ILE HA H 50 4.101 4.101 4.028 0.073 25485 267 1 . 1 1 50 50 ILE C C 50 176.540 176.540 175.507 1.033 25485 268 1 . 1 1 50 50 ILE CA C 50 60.956 60.956 61.996 -1.040 25485 269 1 . 1 1 50 50 ILE CB C 50 36.393 36.393 37.134 -0.741 25485 270 1 . 1 1 50 50 ILE H H 50 8.548 8.548 7.867 0.681 25485 271 1 . 1 1 51 51 THR N N 51 116.443 116.443 119.020 -2.577 25485 272 1 . 1 1 51 51 THR HA H 51 4.584 4.584 4.502 0.082 25485 273 1 . 1 1 51 51 THR C C 51 176.672 176.672 175.341 1.331 25485 274 1 . 1 1 51 51 THR CA C 51 60.979 60.979 60.532 0.448 25485 275 1 . 1 1 51 51 THR CB C 51 71.505 71.505 70.450 1.055 25485 276 1 . 1 1 51 51 THR H H 51 8.001 8.001 7.829 0.172 25485 277 1 . 1 1 52 52 GLY N N 52 112.719 112.719 111.006 1.713 25485 278 1 . 1 1 52 52 GLY C C 52 170.609 170.609 174.126 -3.517 25485 279 1 . 1 1 52 52 GLY CA C 52 46.746 46.746 45.854 0.892 25485 280 1 . 1 1 52 52 GLY H H 52 9.499 9.499 8.714 0.785 25485 281 1 . 1 1 53 53 MET N N 53 116.621 116.621 118.438 -1.817 25485 282 1 . 1 1 53 53 MET HA H 53 4.023 4.023 4.643 -0.620 25485 283 1 . 1 1 53 53 MET C C 53 174.695 174.695 174.495 0.200 25485 284 1 . 1 1 53 53 MET CA C 53 53.460 53.460 54.521 -1.060 25485 285 1 . 1 1 53 53 MET CB C 53 35.408 35.408 35.238 0.170 25485 286 1 . 1 1 53 53 MET H H 53 7.993 7.993 7.457 0.536 25485 287 1 . 1 1 54 54 LEU N N 54 122.679 122.679 122.011 0.668 25485 288 1 . 1 1 54 54 LEU HA H 54 3.751 3.751 4.425 -0.674 25485 289 1 . 1 1 54 54 LEU C C 54 174.784 174.784 174.423 0.361 25485 290 1 . 1 1 54 54 LEU CA C 54 55.301 55.301 55.468 -0.167 25485 291 1 . 1 1 54 54 LEU CB C 54 42.010 42.010 43.098 -1.088 25485 292 1 . 1 1 54 54 LEU H H 54 7.940 7.940 8.361 -0.421 25485 293 1 . 1 1 55 55 ASN N N 55 115.797 115.797 118.720 -2.923 25485 294 1 . 1 1 55 55 ASN HA H 55 4.749 4.749 4.644 0.105 25485 295 1 . 1 1 55 55 ASN C C 55 175.459 175.459 174.698 0.761 25485 296 1 . 1 1 55 55 ASN CA C 55 51.843 51.843 53.645 -1.802 25485 297 1 . 1 1 55 55 ASN CB C 55 40.357 40.357 38.753 1.604 25485 298 1 . 1 1 55 55 ASN H H 55 6.543 6.543 8.325 -1.782 25485 299 1 . 1 1 56 56 SER N N 56 121.507 121.507 116.020 5.487 25485 300 1 . 1 1 56 56 SER HA H 56 4.638 4.638 4.436 0.202 25485 301 1 . 1 1 56 56 SER C C 56 175.727 175.727 175.747 -0.020 25485 302 1 . 1 1 56 56 SER CA C 56 57.932 57.932 59.634 -1.702 25485 303 1 . 1 1 56 56 SER CB C 56 63.786 63.786 63.688 0.098 25485 304 1 . 1 1 56 56 SER H H 56 8.213 8.213 8.058 0.155 25485 305 1 . 1 1 57 57 ARG N N 57 122.951 122.951 121.330 1.621 25485 306 1 . 1 1 57 57 ARG HA H 57 4.201 4.201 4.390 -0.189 25485 307 1 . 1 1 57 57 ARG C C 57 178.560 178.560 178.177 0.383 25485 308 1 . 1 1 57 57 ARG CA C 57 58.432 58.432 58.517 -0.085 25485 309 1 . 1 1 57 57 ARG CB C 57 29.105 29.105 29.846 -0.741 25485 310 1 . 1 1 57 57 ARG H H 57 7.895 7.895 8.531 -0.636 25485 311 1 . 1 1 58 58 VAL N N 58 118.778 118.778 120.178 -1.400 25485 312 1 . 1 1 58 58 VAL HA H 58 3.331 3.331 3.561 -0.229 25485 313 1 . 1 1 58 58 VAL C C 58 177.370 177.370 177.705 -0.335 25485 314 1 . 1 1 58 58 VAL CA C 58 66.382 66.382 66.107 0.275 25485 315 1 . 1 1 58 58 VAL CB C 58 32.209 32.209 31.338 0.871 25485 316 1 . 1 1 58 58 VAL H H 58 7.583 7.583 7.941 -0.358 25485 317 1 . 1 1 59 59 ILE N N 59 119.159 119.159 117.771 1.388 25485 318 1 . 1 1 59 59 ILE HA H 59 3.413 3.413 3.649 -0.236 25485 319 1 . 1 1 59 59 ILE C C 59 177.067 177.067 177.724 -0.657 25485 320 1 . 1 1 59 59 ILE CA C 59 63.633 63.633 63.091 0.542 25485 321 1 . 1 1 59 59 ILE CB C 59 36.696 36.696 36.827 -0.131 25485 322 1 . 1 1 59 59 ILE H H 59 7.323 7.323 7.944 -0.621 25485 323 1 . 1 1 60 60 GLU N N 60 119.367 119.367 120.136 -0.769 25485 324 1 . 1 1 60 60 GLU HA H 60 3.738 3.738 3.963 -0.225 25485 325 1 . 1 1 60 60 GLU C C 60 179.978 179.978 179.124 0.854 25485 326 1 . 1 1 60 60 GLU CA C 60 59.258 59.258 59.760 -0.502 25485 327 1 . 1 1 60 60 GLU CB C 60 29.388 29.388 29.412 -0.024 25485 328 1 . 1 1 60 60 GLU H H 60 7.879 7.879 7.520 0.359 25485 329 1 . 1 1 61 61 ILE N N 61 118.816 118.816 116.717 2.099 25485 330 1 . 1 1 61 61 ILE HA H 61 3.439 3.439 3.871 -0.432 25485 331 1 . 1 1 61 61 ILE C C 61 179.033 179.033 176.873 2.160 25485 332 1 . 1 1 61 61 ILE CA C 61 64.838 64.838 64.187 0.651 25485 333 1 . 1 1 61 61 ILE CB C 61 36.899 36.899 37.971 -1.072 25485 334 1 . 1 1 61 61 ILE H H 61 7.246 7.246 7.435 -0.189 25485 335 1 . 1 1 62 62 MET N N 62 119.986 119.986 116.006 3.980 25485 336 1 . 1 1 62 62 MET HA H 62 3.444 3.444 4.185 -0.742 25485 337 1 . 1 1 62 62 MET C C 62 176.185 176.185 177.775 -1.590 25485 338 1 . 1 1 62 62 MET CA C 62 59.014 59.014 57.302 1.712 25485 339 1 . 1 1 62 62 MET CB C 62 31.250 31.250 32.298 -1.048 25485 340 1 . 1 1 62 62 MET H H 62 7.835 7.835 7.294 0.541 25485 341 1 . 1 1 63 63 GLN N N 63 116.163 116.163 115.523 0.640 25485 342 1 . 1 1 63 63 GLN HA H 63 4.278 4.278 4.226 0.052 25485 343 1 . 1 1 63 63 GLN C C 63 176.727 176.727 176.585 0.142 25485 344 1 . 1 1 63 63 GLN CA C 63 56.138 56.138 56.521 -0.383 25485 345 1 . 1 1 63 63 GLN CB C 63 29.066 29.066 29.346 -0.280 25485 346 1 . 1 1 63 63 GLN H H 63 7.454 7.454 7.561 -0.107 25485 347 1 . 1 1 64 64 LYS N N 64 121.430 121.430 121.518 -0.088 25485 348 1 . 1 1 64 64 LYS HA H 64 4.543 4.543 4.497 0.046 25485 349 1 . 1 1 64 64 LYS C C 64 174.724 174.724 174.720 0.004 25485 350 1 . 1 1 64 64 LYS CA C 64 55.517 55.517 54.162 1.355 25485 351 1 . 1 1 64 64 LYS CB C 64 31.597 31.597 32.628 -1.031 25485 352 1 . 1 1 64 64 LYS H H 64 7.483 7.483 7.571 -0.088 25485 353 1 . 1 1 65 65 PRO HA H 65 2.436 2.436 4.477 -2.041 25485 354 1 . 1 1 65 65 PRO C C 65 176.158 176.158 176.053 0.105 25485 355 1 . 1 1 65 65 PRO CA C 65 62.888 62.888 63.124 -0.236 25485 356 1 . 1 1 65 65 PRO CB C 65 31.833 31.833 32.409 -0.576 25485 357 1 . 1 1 66 66 ARG N N 66 112.697 112.697 120.734 -8.037 25485 358 1 . 1 1 66 66 ARG HA H 66 4.408 4.408 4.611 -0.203 25485 359 1 . 1 1 66 66 ARG C C 66 174.478 174.478 174.486 -0.008 25485 360 1 . 1 1 66 66 ARG CA C 66 54.636 54.636 56.179 -1.543 25485 361 1 . 1 1 66 66 ARG CB C 66 34.673 34.673 31.643 3.030 25485 362 1 . 1 1 66 66 ARG H H 66 8.146 8.146 8.579 -0.433 25485 363 1 . 1 1 67 67 CYS N N 67 121.740 121.740 117.133 4.607 25485 364 1 . 1 1 67 67 CYS HA H 67 4.440 4.440 4.677 -0.237 25485 365 1 . 1 1 67 67 CYS C C 67 175.659 175.659 175.483 0.176 25485 366 1 . 1 1 67 67 CYS CA C 67 59.195 59.195 57.567 1.628 25485 367 1 . 1 1 67 67 CYS CB C 67 30.206 30.206 31.193 -0.987 25485 368 1 . 1 1 67 67 CYS H H 67 7.757 7.757 8.120 -0.363 25485 369 1 . 1 1 68 68 GLY N N 68 116.217 116.217 111.953 4.264 25485 370 1 . 1 1 68 68 GLY C C 68 172.210 172.210 173.461 -1.251 25485 371 1 . 1 1 68 68 GLY CA C 68 46.559 46.559 45.002 1.557 25485 372 1 . 1 1 68 68 GLY H H 68 9.704 9.704 9.186 0.518 25485 373 1 . 1 1 69 69 VAL N N 69 126.372 126.372 120.078 6.294 25485 374 1 . 1 1 69 69 VAL HA H 69 3.831 3.831 4.316 -0.485 25485 375 1 . 1 1 69 69 VAL C C 69 173.538 173.538 174.044 -0.506 25485 376 1 . 1 1 69 69 VAL CA C 69 61.368 61.368 58.200 3.168 25485 377 1 . 1 1 69 69 VAL CB C 69 32.523 32.523 32.819 -0.296 25485 378 1 . 1 1 69 69 VAL H H 69 9.113 9.113 7.402 1.711 25485 379 1 . 1 1 70 70 PRO HA H 70 4.950 4.950 4.422 0.528 25485 380 1 . 1 1 70 70 PRO C C 70 175.019 175.019 176.131 -1.112 25485 381 1 . 1 1 70 70 PRO CA C 70 63.348 63.348 62.416 0.932 25485 382 1 . 1 1 70 70 PRO CB C 70 32.358 32.358 32.719 -0.361 25485 383 1 . 1 1 71 71 ASP N N 71 118.986 118.986 118.715 0.271 25485 384 1 . 1 1 71 71 ASP HA H 71 4.433 4.433 4.722 -0.289 25485 385 1 . 1 1 71 71 ASP C C 71 175.166 175.166 175.583 -0.417 25485 386 1 . 1 1 71 71 ASP CA C 71 55.368 55.368 54.104 1.264 25485 387 1 . 1 1 71 71 ASP CB C 71 39.864 39.864 41.602 -1.738 25485 388 1 . 1 1 71 71 ASP H H 71 8.054 8.054 8.265 -0.211 25485 389 1 . 1 1 72 72 VAL N N 72 112.953 112.953 115.619 -2.666 25485 390 1 . 1 1 72 72 VAL HA H 72 4.296 4.296 4.414 -0.118 25485 391 1 . 1 1 72 72 VAL C C 72 174.330 174.330 174.356 -0.026 25485 392 1 . 1 1 72 72 VAL CA C 72 59.645 59.645 60.844 -1.199 25485 393 1 . 1 1 72 72 VAL CB C 72 33.872 33.872 33.883 -0.010 25485 394 1 . 1 1 72 72 VAL H H 72 6.430 6.430 7.391 -0.961 25485 395 1 . 1 1 73 73 ALA N N 73 125.869 125.869 129.149 -3.280 25485 396 1 . 1 1 73 73 ALA HA H 73 4.305 4.305 4.656 -0.351 25485 397 1 . 1 1 73 73 ALA C C 73 177.382 177.382 176.221 1.161 25485 398 1 . 1 1 73 73 ALA CA C 73 52.049 52.049 51.581 0.468 25485 399 1 . 1 1 73 73 ALA CB C 73 19.951 19.951 20.949 -0.998 25485 400 1 . 1 1 73 73 ALA H H 73 8.177 8.177 8.165 0.012 25485 401 1 . 1 1 74 74 GLU N N 74 120.724 120.724 119.159 1.565 25485 402 1 . 1 1 74 74 GLU HA H 74 4.103 4.103 4.474 -0.371 25485 403 1 . 1 1 74 74 GLU C C 74 176.246 176.246 174.702 1.544 25485 404 1 . 1 1 74 74 GLU CA C 74 56.792 56.792 56.483 0.309 25485 405 1 . 1 1 74 74 GLU CB C 74 29.785 29.785 31.436 -1.651 25485 406 1 . 1 1 74 74 GLU H H 74 8.381 8.381 8.505 -0.123 25485 407 1 . 1 1 75 75 TYR N N 75 121.473 121.473 121.519 -0.046 25485 408 1 . 1 1 75 75 TYR HA H 75 4.445 4.445 4.309 0.136 25485 409 1 . 1 1 75 75 TYR C C 75 175.633 175.633 174.692 0.941 25485 410 1 . 1 1 75 75 TYR CA C 75 58.327 58.327 58.521 -0.194 25485 411 1 . 1 1 75 75 TYR CB C 75 38.413 38.413 38.935 -0.522 25485 412 1 . 1 1 75 75 TYR H H 75 8.065 8.065 8.477 -0.412 25485 413 1 . 1 1 76 76 SER N N 76 117.860 117.860 117.425 0.435 25485 414 1 . 1 1 76 76 SER HA H 76 3.886 3.886 4.355 -0.469 25485 415 1 . 1 1 76 76 SER C C 76 173.859 173.859 174.072 -0.213 25485 416 1 . 1 1 76 76 SER CA C 76 58.250 58.250 58.358 -0.108 25485 417 1 . 1 1 76 76 SER CB C 76 64.117 64.117 63.817 0.300 25485 418 1 . 1 1 76 76 SER H H 76 7.748 7.748 8.323 -0.575 25485 419 1 . 1 1 77 77 LEU N N 77 123.789 123.789 122.157 1.632 25485 420 1 . 1 1 77 77 LEU HA H 77 4.146 4.146 3.992 0.154 25485 421 1 . 1 1 77 77 LEU C C 77 176.451 176.451 176.004 0.447 25485 422 1 . 1 1 77 77 LEU CA C 77 55.464 55.464 55.725 -0.262 25485 423 1 . 1 1 77 77 LEU CB C 77 41.957 41.957 41.099 0.858 25485 424 1 . 1 1 77 77 LEU H H 77 7.979 7.979 8.428 -0.449 25485 425 1 . 1 1 78 78 PHE N N 78 119.275 119.275 117.474 1.801 25485 426 1 . 1 1 78 78 PHE HA H 78 4.876 4.876 4.367 0.509 25485 427 1 . 1 1 78 78 PHE C C 78 173.844 173.844 174.366 -0.522 25485 428 1 . 1 1 78 78 PHE CA C 78 55.372 55.372 56.952 -1.580 25485 429 1 . 1 1 78 78 PHE CB C 78 39.164 39.164 37.469 1.695 25485 430 1 . 1 1 78 78 PHE H H 78 7.827 7.827 7.913 -0.086 25485 431 1 . 1 1 79 79 PRO HA H 79 4.356 4.356 4.377 -0.021 25485 432 1 . 1 1 79 79 PRO C C 79 176.433 176.433 175.943 0.490 25485 433 1 . 1 1 79 79 PRO CA C 79 63.850 63.850 62.448 1.402 25485 434 1 . 1 1 79 79 PRO CB C 79 31.692 31.692 32.463 -0.771 25485 435 1 . 1 1 80 80 ASN N N 80 118.057 118.057 119.718 -1.661 25485 436 1 . 1 1 80 80 ASN HA H 80 4.647 4.647 4.628 0.019 25485 437 1 . 1 1 80 80 ASN C C 80 174.305 174.305 174.807 -0.502 25485 438 1 . 1 1 80 80 ASN CA C 80 52.860 52.860 53.396 -0.536 25485 439 1 . 1 1 80 80 ASN CB C 80 39.583 39.583 38.401 1.182 25485 440 1 . 1 1 80 80 ASN H H 80 8.068 8.068 8.453 -0.385 25485 441 1 . 1 1 81 81 SER HA H 81 4.565 4.565 4.269 0.296 25485 442 1 . 1 1 81 81 SER CA C 81 56.800 56.800 58.427 -1.627 25485 443 1 . 1 1 81 81 SER CB C 81 63.128 63.128 63.241 -0.113 25485 444 1 . 1 1 82 82 PRO HA H 82 4.461 4.461 4.363 0.098 25485 445 1 . 1 1 82 82 PRO C C 82 174.589 174.589 176.395 -1.806 25485 446 1 . 1 1 82 82 PRO CA C 82 63.646 63.646 64.497 -0.851 25485 447 1 . 1 1 82 82 PRO CB C 82 31.254 31.254 32.172 -0.918 25485 448 1 . 1 1 83 83 LYS N N 83 114.578 114.578 118.354 -3.776 25485 449 1 . 1 1 83 83 LYS HA H 83 4.153 4.153 4.497 -0.344 25485 450 1 . 1 1 83 83 LYS C C 83 175.308 175.308 176.511 -1.203 25485 451 1 . 1 1 83 83 LYS CA C 83 54.407 54.407 55.233 -0.826 25485 452 1 . 1 1 83 83 LYS CB C 83 34.418 34.418 33.654 0.764 25485 453 1 . 1 1 83 83 LYS H H 83 7.356 7.356 7.528 -0.172 25485 454 1 . 1 1 84 84 TRP N N 84 122.455 122.455 121.569 0.886 25485 455 1 . 1 1 84 84 TRP HA H 84 4.020 4.020 4.603 -0.583 25485 456 1 . 1 1 84 84 TRP C C 84 177.636 177.636 177.444 0.192 25485 457 1 . 1 1 84 84 TRP CA C 84 57.471 57.471 58.103 -0.632 25485 458 1 . 1 1 84 84 TRP CB C 84 30.318 30.318 29.154 1.164 25485 459 1 . 1 1 84 84 TRP H H 84 8.050 8.050 8.381 -0.331 25485 460 1 . 1 1 85 85 THR N N 85 113.501 113.501 115.907 -2.406 25485 461 1 . 1 1 85 85 THR HA H 85 4.573 4.573 4.451 0.122 25485 462 1 . 1 1 85 85 THR C C 85 174.757 174.757 174.874 -0.117 25485 463 1 . 1 1 85 85 THR CA C 85 62.130 62.130 61.664 0.466 25485 464 1 . 1 1 85 85 THR CB C 85 69.107 69.107 69.540 -0.433 25485 465 1 . 1 1 85 85 THR H H 85 8.861 8.861 8.528 0.333 25485 466 1 . 1 1 86 86 SER N N 86 117.270 117.270 118.277 -1.007 25485 467 1 . 1 1 86 86 SER HA H 86 4.741 4.741 4.518 0.223 25485 468 1 . 1 1 86 86 SER C C 86 173.457 173.457 174.786 -1.329 25485 469 1 . 1 1 86 86 SER CA C 86 56.739 56.739 58.660 -1.921 25485 470 1 . 1 1 86 86 SER CB C 86 64.717 64.717 64.273 0.444 25485 471 1 . 1 1 86 86 SER H H 86 7.743 7.743 8.147 -0.404 25485 472 1 . 1 1 87 87 LYS N N 87 120.329 120.329 119.733 0.596 25485 473 1 . 1 1 87 87 LYS HA H 87 4.229 4.229 4.314 -0.085 25485 474 1 . 1 1 87 87 LYS CA C 87 57.592 57.592 57.172 0.420 25485 475 1 . 1 1 87 87 LYS CB C 87 32.123 32.123 32.751 -0.628 25485 476 1 . 1 1 87 87 LYS H H 87 8.285 8.285 8.407 -0.122 25485 477 1 . 1 1 88 88 VAL N N 88 117.531 117.531 117.399 0.132 25485 478 1 . 1 1 88 88 VAL HA H 88 4.655 4.655 4.694 -0.039 25485 479 1 . 1 1 88 88 VAL C C 88 174.868 174.868 174.003 0.865 25485 480 1 . 1 1 88 88 VAL CA C 88 60.095 60.095 60.557 -0.462 25485 481 1 . 1 1 88 88 VAL CB C 88 33.695 33.695 35.200 -1.505 25485 482 1 . 1 1 88 88 VAL H H 88 7.428 7.428 7.334 0.094 25485 483 1 . 1 1 89 89 VAL N N 89 131.452 131.452 125.879 5.574 25485 484 1 . 1 1 89 89 VAL HA H 89 4.159 4.159 4.227 -0.068 25485 485 1 . 1 1 89 89 VAL C C 89 175.758 175.758 174.824 0.934 25485 486 1 . 1 1 89 89 VAL CA C 89 60.721 60.721 60.325 0.396 25485 487 1 . 1 1 89 89 VAL CB C 89 34.173 34.173 34.086 0.087 25485 488 1 . 1 1 89 89 VAL H H 89 8.603 8.603 8.660 -0.057 25485 489 1 . 1 1 90 90 THR N N 90 118.206 118.206 116.544 1.662 25485 490 1 . 1 1 90 90 THR HA H 90 5.649 5.649 5.412 0.237 25485 491 1 . 1 1 90 90 THR C C 90 174.579 174.579 173.581 0.998 25485 492 1 . 1 1 90 90 THR CA C 90 58.959 58.959 59.328 -0.369 25485 493 1 . 1 1 90 90 THR CB C 90 72.288 72.288 72.299 -0.011 25485 494 1 . 1 1 90 90 THR H H 90 9.021 9.021 8.201 0.820 25485 495 1 . 1 1 91 91 TYR N N 91 118.117 118.117 116.287 1.830 25485 496 1 . 1 1 91 91 TYR HA H 91 5.698 5.698 5.556 0.142 25485 497 1 . 1 1 91 91 TYR C C 91 171.233 171.233 172.816 -1.583 25485 498 1 . 1 1 91 91 TYR CA C 91 55.432 55.432 55.822 -0.390 25485 499 1 . 1 1 91 91 TYR CB C 91 42.260 42.260 41.186 1.074 25485 500 1 . 1 1 91 91 TYR H H 91 8.555 8.555 8.103 0.452 25485 501 1 . 1 1 92 92 ARG N N 92 120.252 120.252 120.042 0.210 25485 502 1 . 1 1 92 92 ARG HA H 92 4.697 4.697 4.631 0.066 25485 503 1 . 1 1 92 92 ARG C C 92 173.932 173.932 174.572 -0.640 25485 504 1 . 1 1 92 92 ARG CA C 92 54.841 54.841 54.556 0.285 25485 505 1 . 1 1 92 92 ARG CB C 92 34.686 34.686 34.755 -0.069 25485 506 1 . 1 1 92 92 ARG H H 92 8.520 8.520 8.845 -0.325 25485 507 1 . 1 1 93 93 ILE N N 93 128.305 128.305 126.796 1.509 25485 508 1 . 1 1 93 93 ILE HA H 93 4.632 4.632 4.354 0.278 25485 509 1 . 1 1 93 93 ILE C C 93 175.468 175.468 176.501 -1.033 25485 510 1 . 1 1 93 93 ILE CA C 93 61.228 61.228 61.005 0.223 25485 511 1 . 1 1 93 93 ILE CB C 93 37.225 37.225 37.254 -0.030 25485 512 1 . 1 1 93 93 ILE H H 93 8.886 8.886 8.769 0.117 25485 513 1 . 1 1 94 94 VAL N N 94 126.647 126.647 127.931 -1.284 25485 514 1 . 1 1 94 94 VAL HA H 94 3.996 3.996 4.100 -0.104 25485 515 1 . 1 1 94 94 VAL C C 94 175.670 175.670 176.328 -0.658 25485 516 1 . 1 1 94 94 VAL CA C 94 63.414 63.414 63.972 -0.558 25485 517 1 . 1 1 94 94 VAL CB C 94 33.019 33.019 32.526 0.493 25485 518 1 . 1 1 94 94 VAL H H 94 9.517 9.517 8.654 0.863 25485 519 1 . 1 1 95 95 SER N N 95 113.398 113.398 112.545 0.853 25485 520 1 . 1 1 95 95 SER HA H 95 4.701 4.701 4.695 0.006 25485 521 1 . 1 1 95 95 SER C C 95 170.684 170.684 172.630 -1.946 25485 522 1 . 1 1 95 95 SER CA C 95 56.945 56.945 57.305 -0.360 25485 523 1 . 1 1 95 95 SER CB C 95 65.276 65.276 64.894 0.382 25485 524 1 . 1 1 95 95 SER H H 95 7.463 7.463 7.636 -0.173 25485 525 1 . 1 1 96 96 TYR N N 96 116.512 116.512 119.266 -2.754 25485 526 1 . 1 1 96 96 TYR HA H 96 4.264 4.264 4.810 -0.546 25485 527 1 . 1 1 96 96 TYR C C 96 174.856 174.856 174.309 0.547 25485 528 1 . 1 1 96 96 TYR CA C 96 58.637 58.637 56.350 2.287 25485 529 1 . 1 1 96 96 TYR CB C 96 41.163 41.163 39.954 1.209 25485 530 1 . 1 1 96 96 TYR H H 96 8.240 8.240 8.147 0.093 25485 531 1 . 1 1 97 97 THR CA C 97 57.798 57.798 60.671 -2.873 25485 532 1 . 1 1 97 97 THR CB C 97 67.420 67.420 69.609 -2.188 25485 533 1 . 1 1 98 98 ARG N N 98 128.156 128.156 124.971 3.185 25485 534 1 . 1 1 98 98 ARG HA H 98 4.325 4.325 4.132 0.193 25485 535 1 . 1 1 98 98 ARG C C 98 177.625 177.625 176.409 1.216 25485 536 1 . 1 1 98 98 ARG CA C 98 57.214 57.214 58.260 -1.046 25485 537 1 . 1 1 98 98 ARG CB C 98 29.480 29.480 29.698 -0.219 25485 538 1 . 1 1 98 98 ARG H H 98 8.914 8.914 8.649 0.265 25485 539 1 . 1 1 99 99 ASP N N 99 120.592 120.592 118.059 2.533 25485 540 1 . 1 1 99 99 ASP HA H 99 4.381 4.381 4.598 -0.217 25485 541 1 . 1 1 99 99 ASP C C 99 175.679 175.679 175.492 0.187 25485 542 1 . 1 1 99 99 ASP CA C 99 56.436 56.436 55.243 1.193 25485 543 1 . 1 1 99 99 ASP CB C 99 42.370 42.370 41.685 0.685 25485 544 1 . 1 1 99 99 ASP H H 99 8.708 8.708 8.016 0.692 25485 545 1 . 1 1 100 100 LEU N N 100 116.829 116.829 118.675 -1.846 25485 546 1 . 1 1 100 100 LEU HA H 100 4.956 4.956 4.686 0.271 25485 547 1 . 1 1 100 100 LEU C C 100 173.335 173.335 174.041 -0.706 25485 548 1 . 1 1 100 100 LEU CA C 100 51.037 51.037 51.968 -0.931 25485 549 1 . 1 1 100 100 LEU CB C 100 46.267 46.267 44.404 1.863 25485 550 1 . 1 1 100 100 LEU H H 100 6.916 6.916 7.396 -0.480 25485 551 1 . 1 1 102 102 HIS HA H 102 4.175 4.175 4.134 0.041 25485 552 1 . 1 1 102 102 HIS C C 102 177.649 177.649 177.478 0.171 25485 553 1 . 1 1 102 102 HIS CA C 102 58.673 58.673 59.286 -0.613 25485 554 1 . 1 1 102 102 HIS CB C 102 28.434 28.434 30.079 -1.645 25485 555 1 . 1 1 103 103 ILE N N 103 115.170 115.170 118.272 -3.102 25485 556 1 . 1 1 103 103 ILE HA H 103 4.173 4.173 3.844 0.329 25485 557 1 . 1 1 103 103 ILE C C 103 177.214 177.214 177.149 0.065 25485 558 1 . 1 1 103 103 ILE CA C 103 63.165 63.165 64.081 -0.916 25485 559 1 . 1 1 103 103 ILE CB C 103 37.765 37.765 37.818 -0.053 25485 560 1 . 1 1 103 103 ILE H H 103 8.234 8.234 8.149 0.085 25485 561 1 . 1 1 104 104 THR N N 104 119.374 119.374 117.260 2.114 25485 562 1 . 1 1 104 104 THR HA H 104 4.045 4.045 4.018 0.027 25485 563 1 . 1 1 104 104 THR C C 104 175.612 175.612 176.545 -0.933 25485 564 1 . 1 1 104 104 THR CA C 104 66.568 66.568 67.037 -0.469 25485 565 1 . 1 1 104 104 THR CB C 104 68.077 68.077 68.589 -0.512 25485 566 1 . 1 1 104 104 THR H H 104 6.947 6.947 7.666 -0.719 25485 567 1 . 1 1 105 105 VAL N N 105 123.263 123.263 121.153 2.110 25485 568 1 . 1 1 105 105 VAL HA H 105 3.438 3.438 3.114 0.324 25485 569 1 . 1 1 105 105 VAL C C 105 177.322 177.322 177.197 0.125 25485 570 1 . 1 1 105 105 VAL CA C 105 67.947 67.947 66.589 1.358 25485 571 1 . 1 1 105 105 VAL CB C 105 31.269 31.269 31.175 0.094 25485 572 1 . 1 1 105 105 VAL H H 105 7.407 7.407 8.116 -0.709 25485 573 1 . 1 1 106 106 ASP N N 106 119.972 119.972 119.712 0.260 25485 574 1 . 1 1 106 106 ASP HA H 106 4.322 4.322 4.447 -0.125 25485 575 1 . 1 1 106 106 ASP C C 106 179.747 179.747 178.349 1.398 25485 576 1 . 1 1 106 106 ASP CA C 106 58.235 58.235 57.432 0.803 25485 577 1 . 1 1 106 106 ASP CB C 106 40.362 40.362 40.932 -0.570 25485 578 1 . 1 1 106 106 ASP H H 106 8.627 8.627 8.012 0.615 25485 579 1 . 1 1 107 107 ARG N N 107 121.033 121.033 118.740 2.293 25485 580 1 . 1 1 107 107 ARG HA H 107 4.178 4.178 4.122 0.056 25485 581 1 . 1 1 107 107 ARG C C 107 179.485 179.485 178.542 0.943 25485 582 1 . 1 1 107 107 ARG CA C 107 59.580 59.580 58.900 0.680 25485 583 1 . 1 1 107 107 ARG CB C 107 30.208 30.208 29.665 0.543 25485 584 1 . 1 1 107 107 ARG H H 107 8.356 8.356 7.902 0.454 25485 585 1 . 1 1 108 108 LEU N N 108 121.463 121.463 120.935 0.528 25485 586 1 . 1 1 108 108 LEU HA H 108 4.305 4.305 4.177 0.128 25485 587 1 . 1 1 108 108 LEU C C 108 178.852 178.852 178.923 -0.071 25485 588 1 . 1 1 108 108 LEU CA C 108 57.882 57.882 57.553 0.329 25485 589 1 . 1 1 108 108 LEU CB C 108 41.315 41.315 41.359 -0.044 25485 590 1 . 1 1 108 108 LEU H H 108 8.790 8.790 7.840 0.950 25485 591 1 . 1 1 109 109 VAL N N 109 120.233 120.233 116.584 3.649 25485 592 1 . 1 1 109 109 VAL HA H 109 3.400 3.400 3.661 -0.261 25485 593 1 . 1 1 109 109 VAL C C 109 177.019 177.019 177.657 -0.638 25485 594 1 . 1 1 109 109 VAL CA C 109 68.046 68.046 66.848 1.198 25485 595 1 . 1 1 109 109 VAL CB C 109 31.189 31.189 31.121 0.068 25485 596 1 . 1 1 109 109 VAL H H 109 8.787 8.787 7.930 0.857 25485 597 1 . 1 1 110 110 SER N N 110 112.862 112.862 115.946 -3.084 25485 598 1 . 1 1 110 110 SER HA H 110 4.300 4.300 4.028 0.272 25485 599 1 . 1 1 110 110 SER C C 110 176.770 176.770 176.790 -0.020 25485 600 1 . 1 1 110 110 SER CA C 110 61.744 61.744 61.628 0.116 25485 601 1 . 1 1 110 110 SER CB C 110 62.742 62.742 62.825 -0.083 25485 602 1 . 1 1 110 110 SER H H 110 7.605 7.605 7.856 -0.251 25485 603 1 . 1 1 111 111 LYS N N 111 122.319 122.319 121.998 0.321 25485 604 1 . 1 1 111 111 LYS HA H 111 4.061 4.061 4.064 -0.003 25485 605 1 . 1 1 111 111 LYS C C 111 178.309 178.309 178.260 0.048 25485 606 1 . 1 1 111 111 LYS CA C 111 59.814 59.814 59.238 0.576 25485 607 1 . 1 1 111 111 LYS CB C 111 32.509 32.509 32.545 -0.036 25485 608 1 . 1 1 111 111 LYS H H 111 8.156 8.156 7.947 0.208 25485 609 1 . 1 1 112 112 ALA N N 112 124.147 124.147 120.562 3.585 25485 610 1 . 1 1 112 112 ALA HA H 112 4.099 4.099 4.376 -0.277 25485 611 1 . 1 1 112 112 ALA C C 112 179.445 179.445 178.973 0.472 25485 612 1 . 1 1 112 112 ALA CA C 112 55.226 55.226 54.133 1.093 25485 613 1 . 1 1 112 112 ALA CB C 112 19.974 19.974 19.295 0.679 25485 614 1 . 1 1 112 112 ALA H H 112 8.278 8.278 7.464 0.813 25485 615 1 . 1 1 113 113 LEU N N 113 116.195 116.195 120.447 -4.252 25485 616 1 . 1 1 113 113 LEU HA H 113 3.751 3.751 4.074 -0.323 25485 617 1 . 1 1 113 113 LEU C C 113 179.537 179.537 177.955 1.582 25485 618 1 . 1 1 113 113 LEU CA C 113 57.744 57.744 57.995 -0.251 25485 619 1 . 1 1 113 113 LEU CB C 113 40.555 40.555 41.935 -1.380 25485 620 1 . 1 1 113 113 LEU H H 113 8.021 8.021 8.541 -0.520 25485 621 1 . 1 1 114 114 ASN N N 114 116.570 116.570 117.610 -1.040 25485 622 1 . 1 1 114 114 ASN HA H 114 4.546 4.546 4.403 0.143 25485 623 1 . 1 1 114 114 ASN C C 114 177.136 177.136 177.376 -0.240 25485 624 1 . 1 1 114 114 ASN CA C 114 55.764 55.764 56.207 -0.443 25485 625 1 . 1 1 114 114 ASN CB C 114 38.623 38.623 38.351 0.272 25485 626 1 . 1 1 114 114 ASN H H 114 8.212 8.212 8.259 -0.047 25485 627 1 . 1 1 115 115 MET N N 115 122.055 122.055 119.277 2.778 25485 628 1 . 1 1 115 115 MET HA H 115 4.010 4.010 4.015 -0.005 25485 629 1 . 1 1 115 115 MET C C 115 177.681 177.681 177.908 -0.227 25485 630 1 . 1 1 115 115 MET CA C 115 59.445 59.445 59.100 0.345 25485 631 1 . 1 1 115 115 MET CB C 115 31.616 31.616 32.281 -0.665 25485 632 1 . 1 1 115 115 MET H H 115 7.937 7.937 7.651 0.286 25485 633 1 . 1 1 116 116 TRP N N 116 117.115 117.115 118.568 -1.453 25485 634 1 . 1 1 116 116 TRP HA H 116 4.518 4.518 4.284 0.234 25485 635 1 . 1 1 116 116 TRP C C 116 179.054 179.054 179.217 -0.163 25485 636 1 . 1 1 116 116 TRP CA C 116 59.511 59.511 59.050 0.461 25485 637 1 . 1 1 116 116 TRP CB C 116 30.873 30.873 29.430 1.443 25485 638 1 . 1 1 116 116 TRP H H 116 6.783 6.783 7.439 -0.656 25485 639 1 . 1 1 117 117 GLY N N 117 104.511 104.511 106.471 -1.960 25485 640 1 . 1 1 117 117 GLY C C 117 175.035 175.035 175.837 -0.802 25485 641 1 . 1 1 117 117 GLY CA C 117 46.997 46.997 46.438 0.559 25485 642 1 . 1 1 117 117 GLY H H 117 9.302 9.302 7.937 1.365 25485 643 1 . 1 1 118 118 LYS N N 118 118.580 118.580 119.852 -1.272 25485 644 1 . 1 1 118 118 LYS HA H 118 4.207 4.207 4.046 0.161 25485 645 1 . 1 1 118 118 LYS C C 118 177.235 177.235 177.345 -0.110 25485 646 1 . 1 1 118 118 LYS CA C 118 57.891 57.891 57.804 0.087 25485 647 1 . 1 1 118 118 LYS CB C 118 31.905 31.905 32.035 -0.130 25485 648 1 . 1 1 118 118 LYS H H 118 7.940 7.940 7.886 0.054 25485 649 1 . 1 1 119 119 GLU N N 119 113.749 113.749 117.003 -3.254 25485 650 1 . 1 1 119 119 GLU HA H 119 4.838 4.838 4.396 0.442 25485 651 1 . 1 1 119 119 GLU C C 119 178.024 178.024 175.482 2.542 25485 652 1 . 1 1 119 119 GLU CA C 119 55.275 55.275 55.902 -0.627 25485 653 1 . 1 1 119 119 GLU CB C 119 30.686 30.686 29.941 0.745 25485 654 1 . 1 1 119 119 GLU H H 119 7.763 7.763 7.549 0.214 25485 655 1 . 1 1 120 120 ILE N N 120 111.144 111.144 112.957 -1.813 25485 656 1 . 1 1 120 120 ILE HA H 120 5.371 5.371 4.682 0.689 25485 657 1 . 1 1 120 120 ILE C C 120 174.033 174.033 173.801 0.232 25485 658 1 . 1 1 120 120 ILE CA C 120 58.454 58.454 57.496 0.958 25485 659 1 . 1 1 120 120 ILE CB C 120 41.929 41.929 39.814 2.115 25485 660 1 . 1 1 120 120 ILE H H 120 7.518 7.518 7.538 -0.020 25485 661 1 . 1 1 121 121 PRO HA H 121 4.662 4.662 4.411 0.251 25485 662 1 . 1 1 121 121 PRO C C 121 174.784 174.784 176.668 -1.884 25485 663 1 . 1 1 121 121 PRO CA C 121 62.015 62.015 63.307 -1.292 25485 664 1 . 1 1 121 121 PRO CB C 121 29.385 29.385 31.083 -1.698 25485 665 1 . 1 1 122 122 LEU N N 122 121.531 121.531 119.202 2.329 25485 666 1 . 1 1 122 122 LEU HA H 122 4.339 4.339 4.303 0.036 25485 667 1 . 1 1 122 122 LEU C C 122 173.977 173.977 176.573 -2.596 25485 668 1 . 1 1 122 122 LEU CA C 122 54.558 54.558 55.172 -0.614 25485 669 1 . 1 1 122 122 LEU CB C 122 45.399 45.399 42.868 2.531 25485 670 1 . 1 1 122 122 LEU H H 122 6.847 6.847 7.521 -0.674 25485 671 1 . 1 1 123 123 HIS N N 123 121.054 121.054 116.323 4.731 25485 672 1 . 1 1 123 123 HIS HA H 123 4.607 4.607 4.709 -0.102 25485 673 1 . 1 1 123 123 HIS C C 123 172.820 172.820 173.436 -0.616 25485 674 1 . 1 1 123 123 HIS CA C 123 54.509 54.509 55.280 -0.771 25485 675 1 . 1 1 123 123 HIS CB C 123 33.110 33.110 32.477 0.633 25485 676 1 . 1 1 123 123 HIS H H 123 7.760 7.760 8.347 -0.587 25485 677 1 . 1 1 124 124 PHE N N 124 120.465 120.465 123.576 -3.111 25485 678 1 . 1 1 124 124 PHE HA H 124 5.834 5.834 5.430 0.404 25485 679 1 . 1 1 124 124 PHE C C 124 175.677 175.677 175.431 0.246 25485 680 1 . 1 1 124 124 PHE CA C 124 56.292 56.292 55.982 0.309 25485 681 1 . 1 1 124 124 PHE CB C 124 41.822 41.822 41.681 0.141 25485 682 1 . 1 1 124 124 PHE H H 124 8.306 8.306 8.604 -0.298 25485 683 1 . 1 1 125 125 ARG N N 125 124.008 124.008 123.520 0.488 25485 684 1 . 1 1 125 125 ARG HA H 125 4.711 4.711 4.837 -0.126 25485 685 1 . 1 1 125 125 ARG C C 125 172.901 172.901 175.254 -2.353 25485 686 1 . 1 1 125 125 ARG CA C 125 54.274 54.274 54.799 -0.525 25485 687 1 . 1 1 125 125 ARG CB C 125 33.822 33.822 34.329 -0.507 25485 688 1 . 1 1 125 125 ARG H H 125 8.426 8.426 8.959 -0.533 25485 689 1 . 1 1 126 126 LYS N N 126 130.004 130.004 124.398 5.606 25485 690 1 . 1 1 126 126 LYS HA H 126 3.383 3.383 4.200 -0.817 25485 691 1 . 1 1 126 126 LYS C C 126 176.126 176.126 175.668 0.458 25485 692 1 . 1 1 126 126 LYS CA C 126 56.181 56.181 55.809 0.372 25485 693 1 . 1 1 126 126 LYS CB C 126 33.027 33.027 33.456 -0.429 25485 694 1 . 1 1 126 126 LYS H H 126 8.481 8.481 8.565 -0.084 25485 695 1 . 1 1 127 127 VAL N N 127 125.288 125.288 120.191 5.097 25485 696 1 . 1 1 127 127 VAL HA H 127 4.505 4.505 4.196 0.309 25485 697 1 . 1 1 127 127 VAL C C 127 175.565 175.565 175.121 0.444 25485 698 1 . 1 1 127 127 VAL CA C 127 59.949 59.949 61.656 -1.707 25485 699 1 . 1 1 127 127 VAL CB C 127 34.362 34.362 32.431 1.931 25485 700 1 . 1 1 127 127 VAL H H 127 8.721 8.721 8.070 0.651 25485 701 1 . 1 1 128 128 VAL N N 128 117.467 117.467 119.786 -2.319 25485 702 1 . 1 1 128 128 VAL HA H 128 4.329 4.329 4.048 0.281 25485 703 1 . 1 1 128 128 VAL C C 128 174.622 174.622 174.874 -0.252 25485 704 1 . 1 1 128 128 VAL CA C 128 62.118 62.118 61.444 0.673 25485 705 1 . 1 1 128 128 VAL CB C 128 32.510 32.510 32.009 0.501 25485 706 1 . 1 1 128 128 VAL H H 128 8.406 8.406 8.028 0.378 25485 707 1 . 1 1 129 129 TRP N N 129 119.986 119.986 121.453 -1.467 25485 708 1 . 1 1 129 129 TRP HA H 129 4.716 4.716 4.860 -0.144 25485 709 1 . 1 1 129 129 TRP C C 129 174.536 174.536 176.361 -1.825 25485 710 1 . 1 1 129 129 TRP CA C 129 55.917 55.917 56.851 -0.934 25485 711 1 . 1 1 129 129 TRP CB C 129 32.014 32.014 29.562 2.452 25485 712 1 . 1 1 129 129 TRP H H 129 7.435 7.435 7.299 0.136 25485 713 1 . 1 1 130 130 GLY N N 130 109.900 109.900 113.097 -3.197 25485 714 1 . 1 1 130 130 GLY C C 130 173.187 173.187 173.753 -0.566 25485 715 1 . 1 1 130 130 GLY CA C 130 44.480 44.480 44.405 0.074 25485 716 1 . 1 1 130 130 GLY H H 130 8.006 8.006 8.332 -0.326 25485 717 1 . 1 1 131 131 THR N N 131 116.142 116.142 114.982 1.160 25485 718 1 . 1 1 131 131 THR HA H 131 4.162 4.162 4.479 -0.317 25485 719 1 . 1 1 131 131 THR C C 131 172.766 172.766 173.563 -0.797 25485 720 1 . 1 1 131 131 THR CA C 131 63.212 63.212 61.382 1.830 25485 721 1 . 1 1 131 131 THR CB C 131 69.308 69.308 70.141 -0.833 25485 722 1 . 1 1 131 131 THR H H 131 8.233 8.233 8.193 0.040 25485 723 1 . 1 1 132 132 ALA N N 132 129.807 129.807 124.400 5.407 25485 724 1 . 1 1 132 132 ALA HA H 132 4.516 4.516 4.553 -0.037 25485 725 1 . 1 1 132 132 ALA C C 132 175.358 175.358 176.427 -1.069 25485 726 1 . 1 1 132 132 ALA CA C 132 49.366 49.366 50.559 -1.193 25485 727 1 . 1 1 132 132 ALA CB C 132 22.798 22.798 21.410 1.388 25485 728 1 . 1 1 132 132 ALA H H 132 7.962 7.962 8.408 -0.446 25485 729 1 . 1 1 133 133 ASP N N 133 122.896 122.896 119.906 2.990 25485 730 1 . 1 1 133 133 ASP HA H 133 4.421 4.421 4.572 -0.151 25485 731 1 . 1 1 133 133 ASP C C 133 177.314 177.314 176.939 0.375 25485 732 1 . 1 1 133 133 ASP CA C 133 57.919 57.919 56.759 1.160 25485 733 1 . 1 1 133 133 ASP CB C 133 40.471 40.471 41.626 -1.155 25485 734 1 . 1 1 133 133 ASP H H 133 8.251 8.251 8.324 -0.073 25485 735 1 . 1 1 134 134 ILE N N 134 125.472 125.472 121.067 4.405 25485 736 1 . 1 1 134 134 ILE HA H 134 4.143 4.143 4.427 -0.284 25485 737 1 . 1 1 134 134 ILE C C 134 174.201 174.201 175.026 -0.825 25485 738 1 . 1 1 134 134 ILE CA C 134 61.271 61.271 61.028 0.243 25485 739 1 . 1 1 134 134 ILE CB C 134 38.710 38.710 38.445 0.265 25485 740 1 . 1 1 134 134 ILE H H 134 8.802 8.802 8.108 0.694 25485 741 1 . 1 1 135 135 MET N N 135 127.265 127.265 126.867 0.398 25485 742 1 . 1 1 135 135 MET HA H 135 5.192 5.192 5.375 -0.183 25485 743 1 . 1 1 135 135 MET C C 135 176.206 176.206 175.654 0.552 25485 744 1 . 1 1 135 135 MET CA C 135 53.626 53.626 52.762 0.864 25485 745 1 . 1 1 135 135 MET CB C 135 32.639 32.639 34.063 -1.424 25485 746 1 . 1 1 135 135 MET H H 135 7.418 7.418 8.531 -1.113 25485 747 1 . 1 1 136 136 ILE N N 136 125.440 125.440 123.943 1.497 25485 748 1 . 1 1 136 136 ILE HA H 136 5.589 5.589 4.935 0.654 25485 749 1 . 1 1 136 136 ILE C C 136 175.190 175.190 175.854 -0.664 25485 750 1 . 1 1 136 136 ILE CA C 136 60.108 60.108 58.898 1.210 25485 751 1 . 1 1 136 136 ILE CB C 136 40.940 40.940 36.665 4.275 25485 752 1 . 1 1 136 136 ILE H H 136 9.124 9.124 8.893 0.231 25485 753 1 . 1 1 137 137 GLY N N 137 112.211 112.211 114.409 -2.198 25485 754 1 . 1 1 137 137 GLY C C 137 170.855 170.855 171.872 -1.017 25485 755 1 . 1 1 137 137 GLY CA C 137 45.405 45.405 44.033 1.372 25485 756 1 . 1 1 137 137 GLY H H 137 8.594 8.594 8.107 0.487 25485 757 1 . 1 1 138 138 PHE N N 138 119.463 119.463 119.049 0.414 25485 758 1 . 1 1 138 138 PHE HA H 138 5.496 5.496 5.196 0.300 25485 759 1 . 1 1 138 138 PHE C C 138 175.186 175.186 175.290 -0.104 25485 760 1 . 1 1 138 138 PHE CA C 138 55.995 55.995 56.417 -0.422 25485 761 1 . 1 1 138 138 PHE CB C 138 41.442 41.442 41.527 -0.085 25485 762 1 . 1 1 138 138 PHE H H 138 7.857 7.857 8.402 -0.544 25485 763 1 . 1 1 139 139 ALA N N 139 123.914 123.914 124.929 -1.015 25485 764 1 . 1 1 139 139 ALA HA H 139 4.731 4.731 4.592 0.139 25485 765 1 . 1 1 139 139 ALA C C 139 174.613 174.613 175.239 -0.626 25485 766 1 . 1 1 139 139 ALA CA C 139 51.035 51.035 52.322 -1.287 25485 767 1 . 1 1 139 139 ALA CB C 139 22.472 22.472 20.829 1.643 25485 768 1 . 1 1 139 139 ALA H H 139 8.955 8.955 8.675 0.280 25485 769 1 . 1 1 140 140 ARG N N 140 118.339 118.339 120.150 -1.811 25485 770 1 . 1 1 140 140 ARG HA H 140 5.106 5.106 4.894 0.212 25485 771 1 . 1 1 140 140 ARG C C 140 176.201 176.201 178.134 -1.933 25485 772 1 . 1 1 140 140 ARG CA C 140 54.166 54.166 54.883 -0.717 25485 773 1 . 1 1 140 140 ARG CB C 140 33.469 33.469 32.679 0.790 25485 774 1 . 1 1 140 140 ARG H H 140 8.546 8.546 8.508 0.038 25485 775 1 . 1 1 141 141 GLY N N 141 108.916 108.916 108.832 0.084 25485 776 1 . 1 1 141 141 GLY C C 141 175.595 175.595 175.144 0.451 25485 777 1 . 1 1 141 141 GLY CA C 141 46.290 46.290 47.245 -0.955 25485 778 1 . 1 1 141 141 GLY H H 141 8.989 8.989 9.148 -0.159 25485 779 1 . 1 1 142 142 ALA N N 142 121.448 121.448 122.093 -0.645 25485 780 1 . 1 1 142 142 ALA HA H 142 4.408 4.408 4.357 0.051 25485 781 1 . 1 1 142 142 ALA C C 142 177.027 177.027 177.697 -0.670 25485 782 1 . 1 1 142 142 ALA CA C 142 53.277 53.277 52.549 0.728 25485 783 1 . 1 1 142 142 ALA CB C 142 17.964 17.964 18.132 -0.168 25485 784 1 . 1 1 142 142 ALA H H 142 8.642 8.642 8.237 0.405 25485 785 1 . 1 1 143 143 HIS N N 143 120.356 120.356 115.415 4.941 25485 786 1 . 1 1 143 143 HIS HA H 143 5.157 5.157 4.492 0.665 25485 787 1 . 1 1 143 143 HIS C C 143 174.303 174.303 176.156 -1.853 25485 788 1 . 1 1 143 143 HIS CA C 143 55.453 55.453 56.052 -0.599 25485 789 1 . 1 1 143 143 HIS CB C 143 27.791 27.791 29.749 -1.958 25485 790 1 . 1 1 143 143 HIS H H 143 8.990 8.990 8.159 0.831 25485 791 1 . 1 1 144 144 GLY N N 144 112.517 112.517 107.640 4.877 25485 792 1 . 1 1 144 144 GLY C C 144 173.758 173.758 173.093 0.665 25485 793 1 . 1 1 144 144 GLY CA C 144 46.095 46.095 44.636 1.459 25485 794 1 . 1 1 144 144 GLY H H 144 5.175 5.175 7.640 -2.465 25485 795 1 . 1 1 145 145 ASP N N 145 117.762 117.762 118.990 -1.228 25485 796 1 . 1 1 145 145 ASP HA H 145 4.698 4.698 4.731 -0.033 25485 797 1 . 1 1 145 145 ASP C C 145 175.851 175.851 175.037 0.814 25485 798 1 . 1 1 145 145 ASP CA C 145 51.959 51.959 52.842 -0.883 25485 799 1 . 1 1 145 145 ASP CB C 145 41.799 41.799 42.728 -0.929 25485 800 1 . 1 1 145 145 ASP H H 145 7.096 7.096 7.563 -0.467 25485 801 1 . 1 1 146 146 SER N N 146 125.540 125.540 115.690 9.850 25485 802 1 . 1 1 146 146 SER HA H 146 4.204 4.204 4.306 -0.102 25485 803 1 . 1 1 146 146 SER C C 146 172.319 172.319 173.812 -1.493 25485 804 1 . 1 1 146 146 SER CA C 146 58.862 58.862 58.564 0.298 25485 805 1 . 1 1 146 146 SER CB C 146 62.933 62.933 63.524 -0.591 25485 806 1 . 1 1 146 146 SER H H 146 8.261 8.261 8.247 0.014 25485 807 1 . 1 1 147 147 TYR N N 147 120.757 120.757 117.511 3.246 25485 808 1 . 1 1 147 147 TYR HA H 147 4.822 4.822 4.251 0.571 25485 809 1 . 1 1 147 147 TYR C C 147 170.372 170.372 173.685 -3.313 25485 810 1 . 1 1 147 147 TYR CA C 147 53.268 53.268 57.145 -3.877 25485 811 1 . 1 1 147 147 TYR CB C 147 38.296 38.296 37.479 0.817 25485 812 1 . 1 1 147 147 TYR H H 147 7.450 7.450 8.326 -0.876 25485 813 1 . 1 1 148 148 PRO HA H 148 4.872 4.872 4.354 0.518 25485 814 1 . 1 1 148 148 PRO C C 148 179.009 179.009 176.425 2.584 25485 815 1 . 1 1 148 148 PRO CA C 148 63.375 63.375 62.304 1.071 25485 816 1 . 1 1 148 148 PRO CB C 148 30.909 30.909 32.240 -1.331 25485 817 1 . 1 1 149 149 PHE N N 149 120.514 120.514 119.392 1.122 25485 818 1 . 1 1 149 149 PHE C C 149 176.813 176.813 175.815 0.998 25485 819 1 . 1 1 149 149 PHE CA C 149 58.453 58.453 59.103 -0.650 25485 820 1 . 1 1 149 149 PHE CB C 149 38.573 38.573 38.776 -0.203 25485 821 1 . 1 1 149 149 PHE H H 149 8.024 8.024 7.865 0.159 25485 822 1 . 1 1 150 150 ASP N N 150 115.555 115.555 116.607 -1.052 25485 823 1 . 1 1 150 150 ASP HA H 150 4.839 4.839 4.353 0.486 25485 824 1 . 1 1 150 150 ASP C C 150 177.007 177.007 176.235 0.772 25485 825 1 . 1 1 150 150 ASP CA C 150 53.871 53.871 54.760 -0.889 25485 826 1 . 1 1 150 150 ASP CB C 150 41.936 41.936 39.433 2.503 25485 827 1 . 1 1 150 150 ASP H H 150 7.511 7.511 8.127 -0.616 25485 828 1 . 1 1 151 151 GLY N N 151 110.650 110.650 109.345 1.305 25485 829 1 . 1 1 151 151 GLY C C 151 170.281 170.281 172.288 -2.007 25485 830 1 . 1 1 151 151 GLY CA C 151 44.398 44.398 44.857 -0.459 25485 831 1 . 1 1 151 151 GLY H H 151 9.080 9.080 8.294 0.786 25485 832 1 . 1 1 152 152 PRO HA H 152 4.056 4.056 4.223 -0.167 25485 833 1 . 1 1 152 152 PRO C C 152 178.300 178.300 176.698 1.602 25485 834 1 . 1 1 152 152 PRO CA C 152 63.850 63.850 63.208 0.642 25485 835 1 . 1 1 152 152 PRO CB C 152 31.260 31.260 31.966 -0.706 25485 836 1 . 1 1 153 153 GLY N N 153 118.783 118.783 113.033 5.750 25485 837 1 . 1 1 153 153 GLY C C 153 174.098 174.098 173.282 0.816 25485 838 1 . 1 1 153 153 GLY CA C 153 43.606 43.606 44.436 -0.830 25485 839 1 . 1 1 153 153 GLY H H 153 11.431 11.431 8.222 3.209 25485 840 1 . 1 1 154 154 ASN N N 154 120.679 120.679 121.958 -1.279 25485 841 1 . 1 1 154 154 ASN HA H 154 4.244 4.244 4.391 -0.147 25485 842 1 . 1 1 154 154 ASN C C 154 174.636 174.636 174.968 -0.332 25485 843 1 . 1 1 154 154 ASN CA C 154 56.668 56.668 54.542 2.126 25485 844 1 . 1 1 154 154 ASN CB C 154 36.971 36.971 38.520 -1.549 25485 845 1 . 1 1 154 154 ASN H H 154 9.247 9.247 8.487 0.760 25485 846 1 . 1 1 155 155 THR N N 155 118.252 118.252 111.523 6.729 25485 847 1 . 1 1 155 155 THR HA H 155 5.577 5.577 4.143 1.434 25485 848 1 . 1 1 155 155 THR C C 155 176.596 176.596 173.127 3.469 25485 849 1 . 1 1 155 155 THR CA C 155 61.731 61.731 62.942 -1.211 25485 850 1 . 1 1 155 155 THR CB C 155 71.325 71.325 68.766 2.559 25485 851 1 . 1 1 155 155 THR H H 155 9.501 9.501 8.470 1.031 25485 852 1 . 1 1 156 156 LEU N N 156 122.598 122.598 123.303 -0.705 25485 853 1 . 1 1 156 156 LEU HA H 156 4.871 4.871 4.576 0.295 25485 854 1 . 1 1 156 156 LEU C C 156 175.655 175.655 175.831 -0.176 25485 855 1 . 1 1 156 156 LEU CA C 156 55.538 55.538 56.120 -0.582 25485 856 1 . 1 1 156 156 LEU CB C 156 44.511 44.511 43.246 1.264 25485 857 1 . 1 1 156 156 LEU H H 156 8.492 8.492 8.366 0.126 25485 858 1 . 1 1 157 157 ALA N N 157 115.389 115.389 115.806 -0.417 25485 859 1 . 1 1 157 157 ALA HA H 157 5.035 5.035 4.598 0.437 25485 860 1 . 1 1 157 157 ALA C C 157 175.739 175.739 175.039 0.700 25485 861 1 . 1 1 157 157 ALA CA C 157 50.939 50.939 51.485 -0.546 25485 862 1 . 1 1 157 157 ALA CB C 157 22.454 22.454 20.752 1.702 25485 863 1 . 1 1 157 157 ALA H H 157 7.567 7.567 7.757 -0.190 25485 864 1 . 1 1 158 158 HIS N N 158 111.900 111.900 118.161 -6.261 25485 865 1 . 1 1 158 158 HIS HA H 158 4.605 4.605 4.822 -0.217 25485 866 1 . 1 1 158 158 HIS C C 158 170.186 170.186 172.399 -2.213 25485 867 1 . 1 1 158 158 HIS CA C 158 56.075 56.075 54.087 1.988 25485 868 1 . 1 1 158 158 HIS CB C 158 30.186 30.186 31.419 -1.233 25485 869 1 . 1 1 158 158 HIS H H 158 8.757 8.757 7.932 0.825 25485 870 1 . 1 1 159 159 ALA N N 159 118.286 118.286 126.167 -7.881 25485 871 1 . 1 1 159 159 ALA HA H 159 4.654 4.654 4.043 0.611 25485 872 1 . 1 1 159 159 ALA C C 159 174.036 174.036 175.306 -1.270 25485 873 1 . 1 1 159 159 ALA CA C 159 51.133 51.133 50.353 0.780 25485 874 1 . 1 1 159 159 ALA CB C 159 24.037 24.037 21.648 2.389 25485 875 1 . 1 1 159 159 ALA H H 159 6.110 6.110 8.199 -2.089 25485 876 1 . 1 1 160 160 PHE N N 160 117.937 117.937 118.564 -0.627 25485 877 1 . 1 1 160 160 PHE HA H 160 4.503 4.503 4.769 -0.266 25485 878 1 . 1 1 160 160 PHE C C 160 174.455 174.455 174.786 -0.331 25485 879 1 . 1 1 160 160 PHE CA C 160 56.813 56.813 55.314 1.499 25485 880 1 . 1 1 160 160 PHE CB C 160 42.194 42.194 41.799 0.395 25485 881 1 . 1 1 160 160 PHE H H 160 7.912 7.912 7.883 0.029 25485 882 1 . 1 1 161 161 ALA N N 161 123.531 123.531 122.648 0.883 25485 883 1 . 1 1 161 161 ALA HA H 161 4.491 4.491 4.699 -0.208 25485 884 1 . 1 1 161 161 ALA C C 161 175.503 175.503 176.049 -0.546 25485 885 1 . 1 1 161 161 ALA CA C 161 50.633 50.633 49.208 1.425 25485 886 1 . 1 1 161 161 ALA CB C 161 16.556 16.556 19.265 -2.708 25485 887 1 . 1 1 161 161 ALA H H 161 8.107 8.107 8.491 -0.384 25485 888 1 . 1 1 162 162 PRO HA H 162 2.910 2.910 3.966 -1.056 25485 889 1 . 1 1 162 162 PRO C C 162 173.465 173.465 175.762 -2.297 25485 890 1 . 1 1 162 162 PRO CA C 162 64.257 64.257 62.665 1.592 25485 891 1 . 1 1 162 162 PRO CB C 162 31.242 31.242 29.690 1.552 25485 892 1 . 1 1 163 163 GLY N N 163 107.206 107.206 110.164 -2.958 25485 893 1 . 1 1 163 163 GLY C C 163 172.092 172.092 173.197 -1.105 25485 894 1 . 1 1 163 163 GLY CA C 163 43.993 43.993 44.472 -0.479 25485 895 1 . 1 1 163 163 GLY H H 163 5.997 5.997 7.872 -1.874 25485 896 1 . 1 1 165 165 GLY N N 165 103.110 103.110 109.318 -6.208 25485 897 1 . 1 1 165 165 GLY C C 165 177.158 177.158 174.828 2.330 25485 898 1 . 1 1 165 165 GLY CA C 165 44.243 44.243 45.545 -1.301 25485 899 1 . 1 1 165 165 GLY H H 165 9.145 9.145 8.171 0.973 25485 900 1 . 1 1 166 166 LEU HA H 166 4.179 4.179 4.271 -0.092 25485 901 1 . 1 1 166 166 LEU C C 166 176.437 176.437 177.379 -0.942 25485 902 1 . 1 1 166 166 LEU CA C 166 56.200 56.200 55.848 0.352 25485 903 1 . 1 1 166 166 LEU CB C 166 41.834 41.834 42.112 -0.278 25485 904 1 . 1 1 167 167 GLY N N 167 103.318 103.318 104.348 -1.030 25485 905 1 . 1 1 167 167 GLY C C 167 174.803 174.803 174.526 0.277 25485 906 1 . 1 1 167 167 GLY CA C 167 47.233 47.233 44.822 2.411 25485 907 1 . 1 1 167 167 GLY H H 167 7.768 7.768 7.464 0.305 25485 908 1 . 1 1 168 168 GLY N N 168 121.051 121.051 108.309 12.742 25485 909 1 . 1 1 168 168 GLY C C 168 172.122 172.122 174.124 -2.002 25485 910 1 . 1 1 168 168 GLY CA C 168 46.602 46.602 45.212 1.390 25485 911 1 . 1 1 168 168 GLY H H 168 7.698 7.698 8.248 -0.550 25485 912 1 . 1 1 169 169 ASP N N 169 123.641 123.641 121.050 2.591 25485 913 1 . 1 1 169 169 ASP C C 169 173.942 173.942 173.881 0.061 25485 914 1 . 1 1 169 169 ASP CA C 169 55.842 55.842 53.698 2.144 25485 915 1 . 1 1 169 169 ASP CB C 169 39.870 39.870 42.395 -2.525 25485 916 1 . 1 1 169 169 ASP H H 169 8.595 8.595 7.802 0.793 25485 917 1 . 1 1 170 170 ALA N N 170 119.366 119.366 121.282 -1.916 25485 918 1 . 1 1 170 170 ALA HA H 170 4.730 4.730 4.379 0.351 25485 919 1 . 1 1 170 170 ALA C C 170 174.593 174.593 175.147 -0.554 25485 920 1 . 1 1 170 170 ALA CA C 170 51.124 51.124 50.743 0.381 25485 921 1 . 1 1 170 170 ALA CB C 170 22.335 22.335 21.294 1.041 25485 922 1 . 1 1 170 170 ALA H H 170 8.324 8.324 8.419 -0.095 25485 923 1 . 1 1 171 171 HIS N N 171 120.239 120.239 120.950 -0.711 25485 924 1 . 1 1 171 171 HIS HA H 171 5.748 5.748 5.313 0.435 25485 925 1 . 1 1 171 171 HIS C C 171 172.949 172.949 173.852 -0.903 25485 926 1 . 1 1 171 171 HIS CA C 171 50.724 50.724 53.260 -2.536 25485 927 1 . 1 1 171 171 HIS CB C 171 34.541 34.541 33.116 1.425 25485 928 1 . 1 1 171 171 HIS H H 171 8.499 8.499 7.740 0.759 25485 929 1 . 1 1 172 172 PHE N N 172 121.125 121.125 120.471 0.654 25485 930 1 . 1 1 172 172 PHE HA H 172 4.528 4.528 4.504 0.024 25485 931 1 . 1 1 172 172 PHE C C 172 173.875 173.875 174.010 -0.135 25485 932 1 . 1 1 172 172 PHE CA C 172 56.920 56.920 56.704 0.216 25485 933 1 . 1 1 172 172 PHE CB C 172 41.903 41.903 41.417 0.486 25485 934 1 . 1 1 172 172 PHE H H 172 8.445 8.445 8.265 0.180 25485 935 1 . 1 1 173 173 ASP N N 173 124.014 124.014 123.040 0.974 25485 936 1 . 1 1 173 173 ASP HA H 173 3.914 3.914 4.794 -0.880 25485 937 1 . 1 1 173 173 ASP C C 173 178.613 178.613 177.831 0.782 25485 938 1 . 1 1 173 173 ASP CA C 173 54.798 54.798 53.526 1.272 25485 939 1 . 1 1 173 173 ASP CB C 173 40.743 40.743 41.083 -0.340 25485 940 1 . 1 1 173 173 ASP H H 173 7.927 7.927 8.672 -0.745 25485 941 1 . 1 1 174 174 GLU N N 174 132.469 132.469 126.864 5.605 25485 942 1 . 1 1 174 174 GLU C C 174 176.442 176.442 177.247 -0.805 25485 943 1 . 1 1 174 174 GLU CA C 174 57.184 57.184 58.898 -1.714 25485 944 1 . 1 1 174 174 GLU CB C 174 30.285 30.285 29.489 0.796 25485 945 1 . 1 1 174 174 GLU H H 174 9.528 9.528 8.639 0.889 25485 946 1 . 1 1 175 175 ASP N N 175 117.394 117.394 118.394 -1.000 25485 947 1 . 1 1 175 175 ASP HA H 175 4.793 4.793 4.672 0.121 25485 948 1 . 1 1 175 175 ASP C C 175 176.645 176.645 176.683 -0.038 25485 949 1 . 1 1 175 175 ASP CA C 175 55.931 55.931 55.461 0.470 25485 950 1 . 1 1 175 175 ASP CB C 175 40.141 40.141 41.580 -1.439 25485 951 1 . 1 1 175 175 ASP H H 175 8.768 8.768 8.596 0.172 25485 952 1 . 1 1 176 176 GLU N N 176 116.493 116.493 118.690 -2.197 25485 953 1 . 1 1 176 176 GLU C C 176 175.038 175.038 175.890 -0.852 25485 954 1 . 1 1 176 176 GLU CA C 176 53.665 53.665 55.533 -1.869 25485 955 1 . 1 1 176 176 GLU CB C 176 26.223 26.223 30.595 -4.372 25485 956 1 . 1 1 176 176 GLU H H 176 7.159 7.159 8.199 -1.040 25485 957 1 . 1 1 177 177 ARG N N 177 122.186 122.186 119.146 3.040 25485 958 1 . 1 1 177 177 ARG HA H 177 4.689 4.689 4.401 0.288 25485 959 1 . 1 1 177 177 ARG C C 177 174.482 174.482 174.483 -0.001 25485 960 1 . 1 1 177 177 ARG CA C 177 53.687 53.687 55.035 -1.348 25485 961 1 . 1 1 177 177 ARG CB C 177 29.084 29.084 30.671 -1.587 25485 962 1 . 1 1 177 177 ARG H H 177 7.560 7.560 8.199 -0.639 25485 963 1 . 1 1 178 178 TRP N N 178 129.179 129.179 124.687 4.492 25485 964 1 . 1 1 178 178 TRP HA H 178 5.100 5.100 5.385 -0.285 25485 965 1 . 1 1 178 178 TRP C C 178 176.298 176.298 176.488 -0.190 25485 966 1 . 1 1 178 178 TRP CA C 178 56.813 56.813 56.038 0.775 25485 967 1 . 1 1 178 178 TRP CB C 178 31.197 31.197 31.971 -0.774 25485 968 1 . 1 1 178 178 TRP H H 178 8.807 8.807 8.512 0.295 25485 969 1 . 1 1 179 179 THR N N 179 112.792 112.792 114.362 -1.570 25485 970 1 . 1 1 179 179 THR HA H 179 4.985 4.985 4.647 0.338 25485 971 1 . 1 1 179 179 THR C C 179 172.765 172.765 172.316 0.449 25485 972 1 . 1 1 179 179 THR CA C 179 59.106 59.106 61.344 -2.238 25485 973 1 . 1 1 179 179 THR CB C 179 71.786 71.786 70.485 1.301 25485 974 1 . 1 1 179 179 THR H H 179 8.974 8.974 8.622 0.352 25485 975 1 . 1 1 180 180 ASP N N 180 122.074 122.074 124.398 -2.324 25485 976 1 . 1 1 180 180 ASP HA H 180 4.463 4.463 5.075 -0.612 25485 977 1 . 1 1 180 180 ASP C C 180 176.366 176.366 178.437 -2.071 25485 978 1 . 1 1 180 180 ASP CA C 180 53.043 53.043 55.330 -2.287 25485 979 1 . 1 1 180 180 ASP CB C 180 41.728 41.728 42.121 -0.393 25485 980 1 . 1 1 180 180 ASP H H 180 8.485 8.485 8.787 -0.302 25485 981 1 . 1 1 181 181 GLY N N 181 110.123 110.123 108.299 1.824 25485 982 1 . 1 1 181 181 GLY C C 181 174.325 174.325 175.482 -1.157 25485 983 1 . 1 1 181 181 GLY CA C 181 47.661 47.661 46.661 1.000 25485 984 1 . 1 1 181 181 GLY H H 181 8.569 8.569 8.567 0.002 25485 985 1 . 1 1 182 182 SER N N 182 115.562 115.562 114.990 0.572 25485 986 1 . 1 1 182 182 SER HA H 182 4.519 4.519 4.543 -0.024 25485 987 1 . 1 1 182 182 SER C C 182 173.783 173.783 174.106 -0.323 25485 988 1 . 1 1 182 182 SER CA C 182 57.965 57.965 57.972 -0.007 25485 989 1 . 1 1 182 182 SER CB C 182 64.166 64.166 64.064 0.102 25485 990 1 . 1 1 182 182 SER H H 182 8.160 8.160 7.734 0.426 25485 991 1 . 1 1 183 183 SER N N 183 117.153 117.153 115.209 1.944 25485 992 1 . 1 1 183 183 SER HA H 183 4.275 4.275 4.293 -0.018 25485 993 1 . 1 1 183 183 SER C C 183 173.333 173.333 174.315 -0.982 25485 994 1 . 1 1 183 183 SER CA C 183 59.902 59.902 59.078 0.824 25485 995 1 . 1 1 183 183 SER CB C 183 64.941 64.941 62.463 2.478 25485 996 1 . 1 1 183 183 SER H H 183 7.796 7.796 7.768 0.028 25485 997 1 . 1 1 184 184 LEU N N 184 122.351 122.351 119.913 2.438 25485 998 1 . 1 1 184 184 LEU HA H 184 4.392 4.392 4.523 -0.131 25485 999 1 . 1 1 184 184 LEU C C 184 176.250 176.250 176.769 -0.519 25485 1000 1 . 1 1 184 184 LEU CA C 184 55.575 55.575 55.671 -0.096 25485 1001 1 . 1 1 184 184 LEU CB C 184 42.081 42.081 42.973 -0.892 25485 1002 1 . 1 1 184 184 LEU H H 184 8.092 8.092 8.045 0.048 25485 1003 1 . 1 1 185 185 GLY N N 185 108.871 108.871 106.760 2.111 25485 1004 1 . 1 1 185 185 GLY C C 185 172.375 172.375 173.838 -1.463 25485 1005 1 . 1 1 185 185 GLY CA C 185 44.380 44.380 44.151 0.229 25485 1006 1 . 1 1 185 185 GLY H H 185 7.960 7.960 7.567 0.393 25485 1007 1 . 1 1 186 186 ILE N N 186 123.096 123.096 122.044 1.052 25485 1008 1 . 1 1 186 186 ILE HA H 186 3.841 3.841 4.134 -0.293 25485 1009 1 . 1 1 186 186 ILE C C 186 175.350 175.350 175.940 -0.590 25485 1010 1 . 1 1 186 186 ILE CA C 186 58.401 58.401 59.064 -0.663 25485 1011 1 . 1 1 186 186 ILE CB C 186 35.456 35.456 35.140 0.316 25485 1012 1 . 1 1 186 186 ILE H H 186 8.893 8.893 8.104 0.789 25485 1013 1 . 1 1 187 187 ASN N N 187 127.167 127.167 126.837 0.330 25485 1014 1 . 1 1 187 187 ASN HA H 187 4.353 4.353 4.946 -0.593 25485 1015 1 . 1 1 187 187 ASN C C 187 175.849 175.849 176.897 -1.048 25485 1016 1 . 1 1 187 187 ASN CA C 187 55.714 55.714 54.097 1.617 25485 1017 1 . 1 1 187 187 ASN CB C 187 39.130 39.130 38.699 0.431 25485 1018 1 . 1 1 187 187 ASN H H 187 8.580 8.580 8.314 0.266 25485 1019 1 . 1 1 188 188 PHE N N 188 129.985 129.985 127.150 2.835 25485 1020 1 . 1 1 188 188 PHE HA H 188 4.573 4.573 4.341 0.232 25485 1021 1 . 1 1 188 188 PHE C C 188 175.578 175.578 177.505 -1.927 25485 1022 1 . 1 1 188 188 PHE CA C 188 61.728 61.728 62.274 -0.546 25485 1023 1 . 1 1 188 188 PHE CB C 188 39.432 39.432 39.523 -0.092 25485 1024 1 . 1 1 188 188 PHE H H 188 9.361 9.361 8.531 0.830 25485 1025 1 . 1 1 189 189 LEU N N 189 119.113 119.113 119.291 -0.178 25485 1026 1 . 1 1 189 189 LEU HA H 189 3.801 3.801 4.122 -0.321 25485 1027 1 . 1 1 189 189 LEU C C 189 179.601 179.601 178.422 1.179 25485 1028 1 . 1 1 189 189 LEU CA C 189 58.509 58.509 58.278 0.231 25485 1029 1 . 1 1 189 189 LEU CB C 189 39.877 39.877 41.203 -1.326 25485 1030 1 . 1 1 189 189 LEU H H 189 8.562 8.562 8.120 0.442 25485 1031 1 . 1 1 190 190 TYR HA H 190 3.917 3.917 3.780 0.137 25485 1032 1 . 1 1 190 190 TYR C C 190 177.621 177.621 177.604 0.017 25485 1033 1 . 1 1 190 190 TYR CA C 190 60.808 60.808 60.772 0.036 25485 1034 1 . 1 1 190 190 TYR CB C 190 39.769 39.769 37.639 2.130 25485 1035 1 . 1 1 191 191 ALA N N 191 120.352 120.352 121.239 -0.887 25485 1036 1 . 1 1 191 191 ALA HA H 191 4.315 4.315 4.064 0.251 25485 1037 1 . 1 1 191 191 ALA C C 191 180.252 180.252 178.872 1.380 25485 1038 1 . 1 1 191 191 ALA CA C 191 55.182 55.182 54.551 0.631 25485 1039 1 . 1 1 191 191 ALA CB C 191 19.142 19.142 18.501 0.641 25485 1040 1 . 1 1 191 191 ALA H H 191 7.993 7.993 8.940 -0.947 25485 1041 1 . 1 1 192 192 ALA N N 192 121.409 121.409 121.464 -0.055 25485 1042 1 . 1 1 192 192 ALA HA H 192 4.057 4.057 4.057 0.000 25485 1043 1 . 1 1 192 192 ALA C C 192 178.575 178.575 179.585 -1.010 25485 1044 1 . 1 1 192 192 ALA CA C 192 55.185 55.185 55.522 -0.337 25485 1045 1 . 1 1 192 192 ALA CB C 192 16.198 16.198 18.134 -1.936 25485 1046 1 . 1 1 192 192 ALA H H 192 9.297 9.297 8.378 0.919 25485 1047 1 . 1 1 193 193 THR N N 193 116.996 116.996 114.510 2.486 25485 1048 1 . 1 1 193 193 THR HA H 193 3.833 3.833 4.093 -0.260 25485 1049 1 . 1 1 193 193 THR CA C 193 69.138 69.138 67.542 1.596 25485 1050 1 . 1 1 193 193 THR CB C 193 67.365 67.365 68.374 -1.010 25485 1051 1 . 1 1 193 193 THR H H 193 8.226 8.226 7.709 0.517 25485 1052 1 . 1 1 194 194 HIS N N 194 120.296 120.296 121.932 -1.636 25485 1053 1 . 1 1 194 194 HIS HA H 194 4.236 4.236 4.207 0.029 25485 1054 1 . 1 1 194 194 HIS C C 194 175.962 175.962 176.769 -0.807 25485 1055 1 . 1 1 194 194 HIS CA C 194 59.747 59.747 58.746 1.001 25485 1056 1 . 1 1 194 194 HIS CB C 194 27.919 27.919 29.925 -2.006 25485 1057 1 . 1 1 194 194 HIS H H 194 7.782 7.782 7.549 0.233 25485 1058 1 . 1 1 195 195 ALA N N 195 121.290 121.290 122.369 -1.079 25485 1059 1 . 1 1 195 195 ALA HA H 195 4.156 4.156 3.973 0.183 25485 1060 1 . 1 1 195 195 ALA CA C 195 55.964 55.964 54.941 1.022 25485 1061 1 . 1 1 195 195 ALA CB C 195 18.710 18.710 18.589 0.121 25485 1062 1 . 1 1 195 195 ALA H H 195 8.690 8.690 8.425 0.265 25485 1063 1 . 1 1 196 196 LEU N N 196 114.899 114.899 118.109 -3.210 25485 1064 1 . 1 1 196 196 LEU HA H 196 4.170 4.170 4.094 0.076 25485 1065 1 . 1 1 196 196 LEU C C 196 177.946 177.946 179.644 -1.698 25485 1066 1 . 1 1 196 196 LEU CA C 196 56.228 56.228 57.432 -1.204 25485 1067 1 . 1 1 196 196 LEU CB C 196 39.776 39.776 41.015 -1.239 25485 1068 1 . 1 1 196 196 LEU H H 196 8.715 8.715 8.862 -0.147 25485 1069 1 . 1 1 197 197 GLY N N 197 107.901 107.901 105.157 2.744 25485 1070 1 . 1 1 197 197 GLY C C 197 178.641 178.641 175.440 3.201 25485 1071 1 . 1 1 197 197 GLY CA C 197 47.567 47.567 46.715 0.852 25485 1072 1 . 1 1 197 197 GLY H H 197 7.546 7.546 8.140 -0.594 25485 1073 1 . 1 1 198 198 HIS N N 198 122.017 122.017 119.700 2.317 25485 1074 1 . 1 1 198 198 HIS HA H 198 4.857 4.857 4.468 0.389 25485 1075 1 . 1 1 198 198 HIS C C 198 179.874 179.874 178.314 1.560 25485 1076 1 . 1 1 198 198 HIS CA C 198 58.522 58.522 57.864 0.658 25485 1077 1 . 1 1 198 198 HIS CB C 198 27.546 27.546 29.447 -1.901 25485 1078 1 . 1 1 198 198 HIS H H 198 7.196 7.196 7.396 -0.200 25485 1079 1 . 1 1 199 199 SER N N 199 118.486 118.486 114.971 3.515 25485 1080 1 . 1 1 199 199 SER HA H 199 4.490 4.490 4.546 -0.056 25485 1081 1 . 1 1 199 199 SER C C 199 174.493 174.493 175.645 -1.151 25485 1082 1 . 1 1 199 199 SER CA C 199 58.173 58.173 60.658 -2.485 25485 1083 1 . 1 1 199 199 SER CB C 199 63.589 63.589 63.114 0.475 25485 1084 1 . 1 1 199 199 SER H H 199 7.884 7.884 7.765 0.119 25485 1085 1 . 1 1 200 200 LEU N N 200 114.686 114.686 117.593 -2.907 25485 1086 1 . 1 1 200 200 LEU C C 200 177.720 177.720 177.302 0.418 25485 1087 1 . 1 1 200 200 LEU CA C 200 54.837 54.837 54.419 0.418 25485 1088 1 . 1 1 200 200 LEU CB C 200 42.357 42.357 41.322 1.035 25485 1089 1 . 1 1 200 200 LEU H H 200 7.108 7.108 7.015 0.093 25485 1090 1 . 1 1 201 201 GLY N N 201 108.363 108.363 106.538 1.825 25485 1091 1 . 1 1 201 201 GLY C C 201 174.008 174.008 174.722 -0.714 25485 1092 1 . 1 1 201 201 GLY CA C 201 44.414 44.414 45.568 -1.154 25485 1093 1 . 1 1 201 201 GLY H H 201 8.195 8.195 7.788 0.407 25485 1094 1 . 1 1 202 202 MET N N 202 119.635 119.635 121.417 -1.782 25485 1095 1 . 1 1 202 202 MET HA H 202 4.473 4.473 4.365 0.108 25485 1096 1 . 1 1 202 202 MET C C 202 176.593 176.593 175.496 1.097 25485 1097 1 . 1 1 202 202 MET CA C 202 54.500 54.500 55.642 -1.143 25485 1098 1 . 1 1 202 202 MET CB C 202 32.161 32.161 33.085 -0.925 25485 1099 1 . 1 1 202 202 MET H H 202 8.182 8.182 7.279 0.903 25485 1100 1 . 1 1 203 203 GLY N N 203 109.749 109.749 111.381 -1.632 25485 1101 1 . 1 1 203 203 GLY C C 203 174.042 174.042 173.656 0.386 25485 1102 1 . 1 1 203 203 GLY CA C 203 43.004 43.004 43.537 -0.533 25485 1103 1 . 1 1 203 203 GLY H H 203 8.405 8.405 8.348 0.057 25485 1104 1 . 1 1 204 204 HIS N N 204 115.732 115.732 118.413 -2.681 25485 1105 1 . 1 1 204 204 HIS HA H 204 5.400 5.400 4.441 0.959 25485 1106 1 . 1 1 204 204 HIS C C 204 174.430 174.430 174.563 -0.133 25485 1107 1 . 1 1 204 204 HIS CA C 204 54.814 54.814 56.620 -1.806 25485 1108 1 . 1 1 204 204 HIS CB C 204 29.826 29.826 30.482 -0.656 25485 1109 1 . 1 1 204 204 HIS H H 204 8.364 8.364 8.612 -0.248 25485 1110 1 . 1 1 205 205 SER N N 205 115.484 115.484 115.166 0.318 25485 1111 1 . 1 1 205 205 SER HA H 205 4.766 4.766 4.703 0.063 25485 1112 1 . 1 1 205 205 SER C C 205 173.611 173.611 174.858 -1.247 25485 1113 1 . 1 1 205 205 SER CA C 205 54.729 54.729 57.165 -2.436 25485 1114 1 . 1 1 205 205 SER CB C 205 65.855 65.855 65.560 0.295 25485 1115 1 . 1 1 205 205 SER H H 205 7.231 7.231 8.320 -1.089 25485 1116 1 . 1 1 206 206 SER N N 206 119.263 119.263 118.387 0.876 25485 1117 1 . 1 1 206 206 SER HA H 206 3.701 3.701 4.778 -1.077 25485 1118 1 . 1 1 206 206 SER C C 206 173.635 173.635 174.424 -0.789 25485 1119 1 . 1 1 206 206 SER CA C 206 63.846 63.846 59.053 4.793 25485 1120 1 . 1 1 206 206 SER CB C 206 63.764 63.764 63.784 -0.020 25485 1121 1 . 1 1 206 206 SER H H 206 8.289 8.289 8.827 -0.538 25485 1122 1 . 1 1 207 207 ASP N N 207 126.646 126.646 123.097 3.549 25485 1123 1 . 1 1 207 207 ASP HA H 207 4.929 4.929 4.678 0.251 25485 1124 1 . 1 1 207 207 ASP C C 207 174.614 174.614 175.486 -0.872 25485 1125 1 . 1 1 207 207 ASP CA C 207 51.272 51.272 52.940 -1.668 25485 1126 1 . 1 1 207 207 ASP CB C 207 41.288 41.288 42.058 -0.770 25485 1127 1 . 1 1 207 207 ASP H H 207 8.541 8.541 8.010 0.531 25485 1128 1 . 1 1 208 208 PRO HA H 208 3.787 3.787 3.524 0.263 25485 1129 1 . 1 1 208 208 PRO C C 208 177.467 177.467 175.646 1.821 25485 1130 1 . 1 1 208 208 PRO CA C 208 62.836 62.836 63.700 -0.864 25485 1131 1 . 1 1 208 208 PRO CB C 208 31.597 31.597 32.004 -0.407 25485 1132 1 . 1 1 209 209 ASN N N 209 116.020 116.020 113.516 2.504 25485 1133 1 . 1 1 209 209 ASN HA H 209 4.641 4.641 4.673 -0.032 25485 1134 1 . 1 1 209 209 ASN C C 209 174.695 174.695 173.816 0.879 25485 1135 1 . 1 1 209 209 ASN CA C 209 53.220 53.220 51.429 1.790 25485 1136 1 . 1 1 209 209 ASN CB C 209 39.110 39.110 38.453 0.657 25485 1137 1 . 1 1 209 209 ASN H H 209 8.350 8.350 7.819 0.531 25485 1138 1 . 1 1 210 210 ALA N N 210 124.892 124.892 122.206 2.686 25485 1139 1 . 1 1 210 210 ALA HA H 210 4.095 4.095 4.458 -0.363 25485 1140 1 . 1 1 210 210 ALA C C 210 179.495 179.495 178.213 1.282 25485 1141 1 . 1 1 210 210 ALA CA C 210 52.054 52.054 50.716 1.338 25485 1142 1 . 1 1 210 210 ALA CB C 210 19.199 19.199 20.743 -1.544 25485 1143 1 . 1 1 210 210 ALA H H 210 8.193 8.193 7.169 1.024 25485 1144 1 . 1 1 211 211 VAL N N 211 130.402 130.402 123.081 7.321 25485 1145 1 . 1 1 211 211 VAL HA H 211 4.263 4.263 3.823 0.440 25485 1146 1 . 1 1 211 211 VAL C C 211 179.408 179.408 176.314 3.094 25485 1147 1 . 1 1 211 211 VAL CA C 211 65.052 65.052 65.103 -0.051 25485 1148 1 . 1 1 211 211 VAL CB C 211 30.983 30.983 32.179 -1.196 25485 1149 1 . 1 1 211 211 VAL H H 211 11.592 11.592 8.775 2.817 25485 1150 1 . 1 1 212 212 MET N N 212 113.285 113.285 114.828 -1.543 25485 1151 1 . 1 1 212 212 MET C C 212 176.996 176.996 175.079 1.917 25485 1152 1 . 1 1 212 212 MET CA C 212 53.614 53.614 53.818 -0.204 25485 1153 1 . 1 1 212 212 MET CB C 212 26.975 26.975 31.613 -4.638 25485 1154 1 . 1 1 212 212 MET H H 212 7.724 7.724 7.614 0.110 25485 1155 1 . 1 1 213 213 TYR N N 213 129.919 129.919 124.224 5.695 25485 1156 1 . 1 1 213 213 TYR HA H 213 5.696 5.696 4.450 1.246 25485 1157 1 . 1 1 213 213 TYR C C 213 178.411 178.411 175.387 3.024 25485 1158 1 . 1 1 213 213 TYR CA C 213 57.131 57.131 57.069 0.062 25485 1159 1 . 1 1 213 213 TYR CB C 213 39.167 39.167 38.482 0.685 25485 1160 1 . 1 1 213 213 TYR H H 213 7.902 7.902 7.335 0.567 25485 1161 1 . 1 1 214 214 PRO HA H 214 3.475 3.475 4.388 -0.913 25485 1162 1 . 1 1 214 214 PRO C C 214 177.694 177.694 176.690 1.004 25485 1163 1 . 1 1 214 214 PRO CA C 214 66.028 66.028 64.105 1.923 25485 1164 1 . 1 1 214 214 PRO CB C 214 32.823 32.823 31.787 1.036 25485 1165 1 . 1 1 215 215 THR N N 215 104.450 104.450 113.264 -8.814 25485 1166 1 . 1 1 215 215 THR HA H 215 4.444 4.444 4.297 0.147 25485 1167 1 . 1 1 215 215 THR C C 215 173.429 173.429 173.617 -0.188 25485 1168 1 . 1 1 215 215 THR CA C 215 60.528 60.528 61.335 -0.807 25485 1169 1 . 1 1 215 215 THR CB C 215 69.614 69.614 67.316 2.298 25485 1170 1 . 1 1 215 215 THR H H 215 6.407 6.407 7.402 -0.995 25485 1171 1 . 1 1 216 216 TYR N N 216 124.618 124.618 124.009 0.609 25485 1172 1 . 1 1 216 216 TYR HA H 216 4.232 4.232 4.326 -0.094 25485 1173 1 . 1 1 216 216 TYR C C 216 175.669 175.669 175.623 0.046 25485 1174 1 . 1 1 216 216 TYR CA C 216 58.587 58.587 58.910 -0.323 25485 1175 1 . 1 1 216 216 TYR CB C 216 40.891 40.891 38.643 2.247 25485 1176 1 . 1 1 216 216 TYR H H 216 8.331 8.331 7.689 0.642 25485 1177 1 . 1 1 217 217 GLY N N 217 116.089 116.089 114.338 1.751 25485 1178 1 . 1 1 217 217 GLY C C 217 173.560 173.560 173.525 0.035 25485 1179 1 . 1 1 217 217 GLY CA C 217 45.318 45.318 45.017 0.301 25485 1180 1 . 1 1 217 217 GLY H H 217 7.695 7.695 8.519 -0.824 25485 1181 1 . 1 1 218 218 ASN N N 218 120.167 120.167 119.231 0.936 25485 1182 1 . 1 1 218 218 ASN HA H 218 4.666 4.666 4.629 0.037 25485 1183 1 . 1 1 218 218 ASN C C 218 175.343 175.343 175.791 -0.448 25485 1184 1 . 1 1 218 218 ASN CA C 218 53.615 53.615 53.714 -0.099 25485 1185 1 . 1 1 218 218 ASN CB C 218 38.546 38.546 39.132 -0.586 25485 1186 1 . 1 1 218 218 ASN H H 218 8.237 8.237 8.343 -0.106 25485 1187 1 . 1 1 219 219 GLY N N 219 109.322 109.322 108.612 0.710 25485 1188 1 . 1 1 219 219 GLY C C 219 172.842 172.842 173.307 -0.465 25485 1189 1 . 1 1 219 219 GLY CA C 219 44.718 44.718 44.881 -0.163 25485 1190 1 . 1 1 219 219 GLY H H 219 8.027 8.027 8.142 -0.115 25485 1191 1 . 1 1 220 220 ASP N N 220 123.006 123.006 122.134 0.872 25485 1192 1 . 1 1 220 220 ASP H H 220 8.273 8.273 8.286 -0.013 25485 1193 1 . 1 1 221 221 PRO C C 221 177.138 177.138 176.951 0.187 25485 1194 1 . 1 1 221 221 PRO CA C 221 57.063 57.063 62.710 -5.647 25485 1195 1 . 1 1 221 221 PRO CB C 221 31.696 31.696 32.823 -1.127 25485 1196 1 . 1 1 222 222 GLN N N 222 116.718 116.718 120.096 -3.378 25485 1197 1 . 1 1 222 222 GLN HA H 222 4.336 4.336 4.246 0.090 25485 1198 1 . 1 1 222 222 GLN C C 222 176.321 176.321 176.706 -0.385 25485 1199 1 . 1 1 222 222 GLN CA C 222 57.143 57.143 58.051 -0.908 25485 1200 1 . 1 1 222 222 GLN CB C 222 29.497 29.497 28.985 0.512 25485 1201 1 . 1 1 222 222 GLN H H 222 8.240 8.240 8.637 -0.397 25485 1202 1 . 1 1 223 223 ASN N N 223 118.368 118.368 115.550 2.818 25485 1203 1 . 1 1 223 223 ASN HA H 223 4.916 4.916 4.802 0.114 25485 1204 1 . 1 1 223 223 ASN C C 223 173.271 173.271 174.397 -1.126 25485 1205 1 . 1 1 223 223 ASN CA C 223 52.596 52.596 53.008 -0.412 25485 1206 1 . 1 1 223 223 ASN CB C 223 39.215 39.215 39.580 -0.365 25485 1207 1 . 1 1 223 223 ASN H H 223 7.946 7.946 8.181 -0.235 25485 1208 1 . 1 1 224 224 PHE N N 224 118.429 118.429 118.957 -0.528 25485 1209 1 . 1 1 224 224 PHE HA H 224 4.451 4.451 4.317 0.134 25485 1210 1 . 1 1 224 224 PHE C C 224 172.897 172.897 173.737 -0.840 25485 1211 1 . 1 1 224 224 PHE CA C 224 58.409 58.409 58.073 0.336 25485 1212 1 . 1 1 224 224 PHE CB C 224 39.701 39.701 38.940 0.761 25485 1213 1 . 1 1 224 224 PHE H H 224 6.992 6.992 7.834 -0.842 25485 1214 1 . 1 1 225 225 LYS N N 225 121.714 121.714 124.268 -2.554 25485 1215 1 . 1 1 225 225 LYS HA H 225 4.430 4.430 3.827 0.603 25485 1216 1 . 1 1 225 225 LYS C C 225 174.664 174.664 174.630 0.034 25485 1217 1 . 1 1 225 225 LYS CA C 225 54.312 54.312 54.059 0.253 25485 1218 1 . 1 1 225 225 LYS CB C 225 34.727 34.727 34.773 -0.046 25485 1219 1 . 1 1 225 225 LYS H H 225 7.709 7.709 7.936 -0.227 25485 1220 1 . 1 1 226 226 LEU N N 226 119.026 119.026 121.245 -2.219 25485 1221 1 . 1 1 226 226 LEU HA H 226 4.140 4.140 4.009 0.131 25485 1222 1 . 1 1 226 226 LEU C C 226 177.495 177.495 176.824 0.672 25485 1223 1 . 1 1 226 226 LEU CA C 226 55.599 55.599 55.195 0.404 25485 1224 1 . 1 1 226 226 LEU CB C 226 41.281 41.281 42.125 -0.844 25485 1225 1 . 1 1 226 226 LEU H H 226 8.015 8.015 8.089 -0.074 25485 1226 1 . 1 1 227 227 SER N N 227 120.320 120.320 115.846 4.474 25485 1227 1 . 1 1 227 227 SER HA H 227 4.600 4.600 4.491 0.109 25485 1228 1 . 1 1 227 227 SER C C 227 175.492 175.492 175.261 0.231 25485 1229 1 . 1 1 227 227 SER CA C 227 57.239 57.239 57.373 -0.134 25485 1230 1 . 1 1 227 227 SER CB C 227 66.278 66.278 64.990 1.288 25485 1231 1 . 1 1 227 227 SER H H 227 9.654 9.654 8.054 1.600 25485 1232 1 . 1 1 228 228 GLN N N 228 127.511 127.511 124.540 2.971 25485 1233 1 . 1 1 228 228 GLN HA H 228 4.694 4.694 3.960 0.734 25485 1234 1 . 1 1 228 228 GLN H H 228 8.248 8.248 8.916 -0.668 25485 1235 1 . 1 1 229 229 ASP N N 229 124.358 124.358 118.549 5.809 25485 1236 1 . 1 1 229 229 ASP HA H 229 4.374 4.374 4.353 0.021 25485 1237 1 . 1 1 229 229 ASP C C 229 178.793 178.793 178.250 0.543 25485 1238 1 . 1 1 229 229 ASP CA C 229 58.142 58.142 57.346 0.796 25485 1239 1 . 1 1 229 229 ASP CB C 229 43.242 43.242 40.420 2.822 25485 1240 1 . 1 1 229 229 ASP H H 229 8.138 8.138 8.510 -0.372 25485 1241 1 . 1 1 230 230 ASP N N 230 119.694 119.694 119.981 -0.287 25485 1242 1 . 1 1 230 230 ASP HA H 230 4.422 4.422 4.494 -0.072 25485 1243 1 . 1 1 230 230 ASP C C 230 177.736 177.736 178.262 -0.527 25485 1244 1 . 1 1 230 230 ASP CA C 230 57.922 57.922 57.236 0.686 25485 1245 1 . 1 1 230 230 ASP CB C 230 43.236 43.236 41.015 2.221 25485 1246 1 . 1 1 230 230 ASP H H 230 7.393 7.393 7.606 -0.213 25485 1247 1 . 1 1 231 231 ILE N N 231 120.364 120.364 119.961 0.403 25485 1248 1 . 1 1 231 231 ILE HA H 231 3.665 3.665 3.755 -0.090 25485 1249 1 . 1 1 231 231 ILE C C 231 177.631 177.631 177.806 -0.175 25485 1250 1 . 1 1 231 231 ILE CA C 231 65.499 65.499 65.164 0.335 25485 1251 1 . 1 1 231 231 ILE CB C 231 38.513 38.513 37.976 0.537 25485 1252 1 . 1 1 231 231 ILE H H 231 8.115 8.115 7.927 0.188 25485 1253 1 . 1 1 232 232 LYS N N 232 119.156 119.156 120.356 -1.200 25485 1254 1 . 1 1 232 232 LYS HA H 232 4.114 4.114 4.089 0.025 25485 1255 1 . 1 1 232 232 LYS C C 232 180.574 180.574 179.109 1.465 25485 1256 1 . 1 1 232 232 LYS CA C 232 59.560 59.560 59.543 0.017 25485 1257 1 . 1 1 232 232 LYS CB C 232 31.797 31.797 31.649 0.148 25485 1258 1 . 1 1 232 232 LYS H H 232 8.607 8.607 8.420 0.187 25485 1259 1 . 1 1 233 233 GLY N N 233 106.425 106.425 108.005 -1.580 25485 1260 1 . 1 1 233 233 GLY C C 233 176.098 176.098 175.855 0.243 25485 1261 1 . 1 1 233 233 GLY CA C 233 47.637 47.637 46.739 0.898 25485 1262 1 . 1 1 233 233 GLY H H 233 8.075 8.075 7.702 0.373 25485 1263 1 . 1 1 234 234 ILE N N 234 125.119 125.119 122.050 3.069 25485 1264 1 . 1 1 234 234 ILE C C 234 178.231 178.231 177.375 0.856 25485 1265 1 . 1 1 234 234 ILE CA C 234 61.593 61.593 63.423 -1.830 25485 1266 1 . 1 1 234 234 ILE CB C 234 37.546 37.546 38.313 -0.767 25485 1267 1 . 1 1 234 234 ILE H H 234 8.539 8.539 7.500 1.039 25485 1268 1 . 1 1 235 235 GLN N N 235 122.877 122.877 119.108 3.769 25485 1269 1 . 1 1 235 235 GLN HA H 235 4.357 4.357 4.079 0.278 25485 1270 1 . 1 1 235 235 GLN C C 235 180.105 180.105 178.384 1.721 25485 1271 1 . 1 1 235 235 GLN CA C 235 57.887 57.887 59.353 -1.466 25485 1272 1 . 1 1 235 235 GLN CB C 235 27.537 27.537 28.691 -1.154 25485 1273 1 . 1 1 235 235 GLN H H 235 8.296 8.296 8.496 -0.200 25485 1274 1 . 1 1 236 236 LYS N N 236 123.678 123.678 118.699 4.979 25485 1275 1 . 1 1 236 236 LYS HA H 236 4.082 4.082 4.289 -0.207 25485 1276 1 . 1 1 236 236 LYS C C 236 178.169 178.169 177.612 0.556 25485 1277 1 . 1 1 236 236 LYS CA C 236 59.376 59.376 58.603 0.773 25485 1278 1 . 1 1 236 236 LYS CB C 236 31.978 31.978 31.905 0.073 25485 1279 1 . 1 1 236 236 LYS H H 236 8.024 8.024 7.749 0.275 25485 1280 1 . 1 1 237 237 LEU N N 237 116.873 116.873 119.054 -2.181 25485 1281 1 . 1 1 237 237 LEU HA H 237 3.987 3.987 4.309 -0.322 25485 1282 1 . 1 1 237 237 LEU C C 237 177.893 177.893 177.774 0.119 25485 1283 1 . 1 1 237 237 LEU CA C 237 57.439 57.439 56.560 0.879 25485 1284 1 . 1 1 237 237 LEU CB C 237 43.613 43.613 42.737 0.876 25485 1285 1 . 1 1 237 237 LEU H H 237 6.888 6.888 7.421 -0.533 25485 1286 1 . 1 1 238 238 TYR N N 238 112.237 112.237 117.205 -4.968 25485 1287 1 . 1 1 238 238 TYR HA H 238 4.651 4.651 4.507 0.144 25485 1288 1 . 1 1 238 238 TYR C C 238 176.082 176.082 176.716 -0.634 25485 1289 1 . 1 1 238 238 TYR CA C 238 59.636 59.636 60.083 -0.447 25485 1290 1 . 1 1 238 238 TYR CB C 238 41.398 41.398 39.904 1.494 25485 1291 1 . 1 1 238 238 TYR H H 238 7.445 7.445 8.594 -1.149 25485 1292 1 . 1 1 239 239 GLY N N 239 110.906 110.906 106.336 4.570 25485 1293 1 . 1 1 239 239 GLY C C 239 171.269 171.269 172.754 -1.485 25485 1294 1 . 1 1 239 239 GLY CA C 239 43.886 43.886 45.133 -1.247 25485 1295 1 . 1 1 239 239 GLY H H 239 8.443 8.443 7.957 0.486 25485 1296 1 . 1 1 240 240 LYS N N 240 114.281 114.281 122.326 -8.045 25485 1297 1 . 1 1 240 240 LYS HA H 240 4.738 4.738 4.542 0.196 25485 1298 1 . 1 1 240 240 LYS C C 240 177.527 177.527 176.298 1.229 25485 1299 1 . 1 1 240 240 LYS CA C 240 54.958 54.958 55.753 -0.795 25485 1300 1 . 1 1 240 240 LYS CB C 240 34.275 34.275 33.805 0.470 25485 1301 1 . 1 1 240 240 LYS H H 240 7.873 7.873 8.357 -0.484 25485 1302 1 . 1 1 241 241 ARG N N 241 123.758 123.758 122.451 1.307 25485 1303 1 . 1 1 241 241 ARG HA H 241 3.997 3.997 4.434 -0.438 25485 1304 1 . 1 1 241 241 ARG C C 241 176.026 176.026 175.321 0.705 25485 1305 1 . 1 1 241 241 ARG CA C 241 57.492 57.492 56.283 1.209 25485 1306 1 . 1 1 241 241 ARG CB C 241 30.371 30.371 31.263 -0.892 25485 1307 1 . 1 1 241 241 ARG H H 241 7.742 7.742 8.534 -0.792 25485 1308 1 . 1 1 246 246 LYS HA H 246 4.340 4.340 4.447 -0.107 25485 1309 1 . 1 1 246 246 LYS C C 246 175.403 175.403 175.839 -0.436 25485 1310 1 . 1 1 246 246 LYS CA C 246 56.509 56.509 56.148 0.361 25485 1311 1 . 1 1 246 246 LYS CB C 246 32.858 32.858 33.379 -0.521 25485 stop_ save_