data_25158 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25158 _Entry.PDB_ID 2MTE 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 25158 _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 THR N N 2 116.700 116.700 113.917 2.783 25158 2 1 1 . 1 1 2 2 THR HA H 2 4.313 4.313 4.421 -0.108 25158 3 1 1 . 1 1 2 2 THR C C 2 173.968 173.968 173.291 0.677 25158 4 1 1 . 1 1 2 2 THR CA C 2 62.326 62.326 61.608 0.718 25158 5 1 1 . 1 1 2 2 THR CB C 2 70.154 70.154 69.933 0.221 25158 6 1 1 . 1 1 2 2 THR H H 2 8.657 8.657 8.077 0.580 25158 7 1 1 . 1 1 3 3 LYS N N 3 125.500 125.500 123.878 1.622 25158 8 1 1 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.126 -0.061 25158 9 1 1 . 1 1 3 3 LYS C C 3 174.926 174.926 175.215 -0.289 25158 10 1 1 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.613 0.226 25158 11 1 1 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.355 1.422 25158 12 1 1 . 1 1 3 3 LYS H H 3 8.318 8.318 8.428 -0.110 25158 13 1 1 . 1 1 4 4 LEU N N 4 127.473 127.473 125.101 2.372 25158 14 1 1 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.307 0.176 25158 15 1 1 . 1 1 4 4 LEU C C 4 174.734 174.734 175.907 -1.173 25158 16 1 1 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.798 -0.539 25158 17 1 1 . 1 1 4 4 LEU CB C 4 40.929 40.929 44.324 -3.395 25158 18 1 1 . 1 1 4 4 LEU H H 4 7.726 7.726 7.968 -0.242 25158 19 1 1 . 1 1 5 5 TYR N N 5 123.074 123.074 125.037 -1.963 25158 20 1 1 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.438 -0.815 25158 21 1 1 . 1 1 5 5 TYR C C 5 175.406 175.406 176.648 -1.242 25158 22 1 1 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.870 2.942 25158 23 1 1 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.235 2.875 25158 24 1 1 . 1 1 5 5 TYR H H 5 7.816 7.816 8.771 -0.955 25158 25 1 1 . 1 1 6 6 GLY N N 6 108.614 108.614 113.929 -5.315 25158 26 1 1 . 1 1 6 6 GLY C C 6 172.585 172.585 173.548 -0.963 25158 27 1 1 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.739 0.648 25158 28 1 1 . 1 1 6 6 GLY H H 6 8.915 8.915 8.128 0.787 25158 29 1 1 . 1 1 7 7 ASP N N 7 118.023 118.023 124.203 -6.180 25158 30 1 1 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.941 0.043 25158 31 1 1 . 1 1 7 7 ASP C C 7 177.806 177.806 177.665 0.141 25158 32 1 1 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.426 -1.234 25158 33 1 1 . 1 1 7 7 ASP CB C 7 39.150 39.150 40.371 -1.222 25158 34 1 1 . 1 1 7 7 ASP H H 7 7.976 7.976 7.951 0.025 25158 35 1 1 . 1 1 8 8 VAL N N 8 120.293 120.293 121.178 -0.885 25158 36 1 1 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.127 -0.144 25158 37 1 1 . 1 1 8 8 VAL C C 8 175.717 175.717 176.785 -1.068 25158 38 1 1 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.169 0.277 25158 39 1 1 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.688 -0.417 25158 40 1 1 . 1 1 8 8 VAL H H 8 8.156 8.156 8.264 -0.108 25158 41 1 1 . 1 1 9 9 ASN N N 9 115.226 115.226 117.545 -2.319 25158 42 1 1 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.575 0.414 25158 43 1 1 . 1 1 9 9 ASN C C 9 174.626 174.626 175.349 -0.723 25158 44 1 1 . 1 1 9 9 ASN CA C 9 50.950 50.950 53.422 -2.473 25158 45 1 1 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.436 -0.735 25158 46 1 1 . 1 1 9 9 ASN H H 9 8.008 8.008 8.066 -0.058 25158 47 1 1 . 1 1 10 10 ASP N N 10 115.600 115.600 117.417 -1.817 25158 48 1 1 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.475 -0.039 25158 49 1 1 . 1 1 10 10 ASP C C 10 175.125 175.125 175.359 -0.234 25158 50 1 1 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.470 0.765 25158 51 1 1 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.721 0.479 25158 52 1 1 . 1 1 10 10 ASP H H 10 7.374 7.374 8.263 -0.889 25158 53 1 1 . 1 1 11 11 ASP N N 11 118.402 118.402 117.231 1.171 25158 54 1 1 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.668 0.149 25158 55 1 1 . 1 1 11 11 ASP C C 11 178.299 178.299 176.930 1.369 25158 56 1 1 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.109 -0.288 25158 57 1 1 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.594 -0.480 25158 58 1 1 . 1 1 11 11 ASP H H 11 8.801 8.801 8.592 0.209 25158 59 1 1 . 1 1 12 12 GLY N N 12 112.353 112.353 109.416 2.937 25158 60 1 1 . 1 1 12 12 GLY C C 12 173.284 173.284 173.977 -0.693 25158 61 1 1 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.289 0.335 25158 62 1 1 . 1 1 12 12 GLY H H 12 10.293 10.293 8.722 1.571 25158 63 1 1 . 1 1 13 13 LYS N N 13 118.118 118.118 119.001 -0.883 25158 64 1 1 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.498 0.161 25158 65 1 1 . 1 1 13 13 LYS C C 13 175.595 175.595 174.640 0.955 25158 66 1 1 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.592 -1.834 25158 67 1 1 . 1 1 13 13 LYS CB C 13 36.339 36.339 36.248 0.091 25158 68 1 1 . 1 1 13 13 LYS H H 13 7.848 7.848 8.828 -0.980 25158 69 1 1 . 1 1 14 14 VAL N N 14 126.591 126.591 123.601 2.990 25158 70 1 1 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.073 0.682 25158 71 1 1 . 1 1 14 14 VAL C C 14 175.052 175.052 174.940 0.112 25158 72 1 1 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.658 -0.588 25158 73 1 1 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.312 0.143 25158 74 1 1 . 1 1 14 14 VAL H H 14 9.109 9.109 8.505 0.604 25158 75 1 1 . 1 1 15 15 ASN N N 15 126.287 126.287 126.010 0.277 25158 76 1 1 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.945 -0.130 25158 77 1 1 . 1 1 15 15 ASN C C 15 176.340 176.340 176.031 0.309 25158 78 1 1 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.454 0.821 25158 79 1 1 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.648 -2.429 25158 80 1 1 . 1 1 15 15 ASN H H 15 10.071 10.071 9.156 0.915 25158 81 1 1 . 1 1 16 16 SER N N 16 113.168 113.168 115.796 -2.628 25158 82 1 1 . 1 1 16 16 SER HA H 16 4.047 4.047 4.250 -0.203 25158 83 1 1 . 1 1 16 16 SER C C 16 176.197 176.197 175.589 0.608 25158 84 1 1 . 1 1 16 16 SER CA C 16 62.681 62.681 61.205 1.476 25158 85 1 1 . 1 1 16 16 SER CB C 16 62.681 62.681 63.088 -0.407 25158 86 1 1 . 1 1 16 16 SER H H 16 8.825 8.825 8.861 -0.036 25158 87 1 1 . 1 1 17 17 THR N N 17 119.391 119.391 116.434 2.957 25158 88 1 1 . 1 1 17 17 THR HA H 17 3.983 3.983 4.052 -0.069 25158 89 1 1 . 1 1 17 17 THR C C 17 177.149 177.149 176.314 0.835 25158 90 1 1 . 1 1 17 17 THR CA C 17 66.791 66.791 66.319 0.472 25158 91 1 1 . 1 1 17 17 THR CB C 17 67.757 67.757 68.356 -0.599 25158 92 1 1 . 1 1 17 17 THR H H 17 7.946 7.946 8.273 -0.327 25158 93 1 1 . 1 1 18 18 ASP N N 18 120.318 120.318 121.592 -1.274 25158 94 1 1 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.457 -0.087 25158 95 1 1 . 1 1 18 18 ASP C C 18 177.168 177.168 177.676 -0.508 25158 96 1 1 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.639 1.274 25158 97 1 1 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.275 1.887 25158 98 1 1 . 1 1 18 18 ASP H H 18 7.995 7.995 7.868 0.127 25158 99 1 1 . 1 1 19 19 ALA N N 19 120.191 120.191 123.229 -3.038 25158 100 1 1 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.060 -0.012 25158 101 1 1 . 1 1 19 19 ALA C C 19 179.549 179.549 178.922 0.627 25158 102 1 1 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.278 0.135 25158 103 1 1 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.654 -1.341 25158 104 1 1 . 1 1 19 19 ALA H H 19 7.085 7.085 7.475 -0.390 25158 105 1 1 . 1 1 20 20 VAL N N 20 120.613 120.613 118.638 1.975 25158 106 1 1 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.642 -0.031 25158 107 1 1 . 1 1 20 20 VAL C C 20 178.153 178.153 177.538 0.615 25158 108 1 1 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.326 1.441 25158 109 1 1 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.712 0.156 25158 110 1 1 . 1 1 20 20 VAL H H 20 7.835 7.835 7.478 0.357 25158 111 1 1 . 1 1 21 21 ALA N N 21 121.767 121.767 122.440 -0.673 25158 112 1 1 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.069 -0.007 25158 113 1 1 . 1 1 21 21 ALA C C 21 179.298 179.298 179.470 -0.172 25158 114 1 1 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.255 -0.011 25158 115 1 1 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.227 -0.438 25158 116 1 1 . 1 1 21 21 ALA H H 21 7.804 7.804 7.923 -0.119 25158 117 1 1 . 1 1 22 22 LEU N N 22 117.555 117.555 119.689 -2.134 25158 118 1 1 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.056 0.089 25158 119 1 1 . 1 1 22 22 LEU C C 22 177.914 177.914 178.461 -0.547 25158 120 1 1 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.396 0.297 25158 121 1 1 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.748 -0.233 25158 122 1 1 . 1 1 22 22 LEU H H 22 8.619 8.619 7.841 0.778 25158 123 1 1 . 1 1 23 23 LYS N N 23 120.335 120.335 118.627 1.708 25158 124 1 1 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.977 -0.058 25158 125 1 1 . 1 1 23 23 LYS C C 23 177.731 177.731 178.864 -1.133 25158 126 1 1 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.798 0.539 25158 127 1 1 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.202 -0.104 25158 128 1 1 . 1 1 23 23 LYS H H 23 8.230 8.230 7.847 0.383 25158 129 1 1 . 1 1 24 24 ARG N N 24 116.831 116.831 118.243 -1.412 25158 130 1 1 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.063 -0.104 25158 131 1 1 . 1 1 24 24 ARG C C 24 178.616 178.616 178.471 0.145 25158 132 1 1 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.028 0.929 25158 133 1 1 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.012 -0.449 25158 134 1 1 . 1 1 24 24 ARG H H 24 7.927 7.927 7.462 0.465 25158 135 1 1 . 1 1 25 25 TYR N N 25 120.960 120.960 121.508 -0.548 25158 136 1 1 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.249 -0.039 25158 137 1 1 . 1 1 25 25 TYR C C 25 179.465 179.465 178.529 0.936 25158 138 1 1 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.667 0.178 25158 139 1 1 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.446 0.619 25158 140 1 1 . 1 1 25 25 TYR H H 25 8.321 8.321 7.602 0.719 25158 141 1 1 . 1 1 26 26 VAL N N 26 120.405 120.405 120.168 0.237 25158 142 1 1 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.698 0.076 25158 143 1 1 . 1 1 26 26 VAL C C 26 177.826 177.826 177.315 0.511 25158 144 1 1 . 1 1 26 26 VAL CA C 26 65.440 65.440 66.582 -1.142 25158 145 1 1 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.323 0.234 25158 146 1 1 . 1 1 26 26 VAL H H 26 8.803 8.803 8.469 0.334 25158 147 1 1 . 1 1 27 27 LEU N N 27 119.247 119.247 117.166 2.081 25158 148 1 1 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.153 0.123 25158 149 1 1 . 1 1 27 27 LEU C C 27 176.753 176.753 176.383 0.370 25158 150 1 1 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.999 0.676 25158 151 1 1 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.892 -0.299 25158 152 1 1 . 1 1 27 27 LEU H H 27 7.898 7.898 7.342 0.556 25158 153 1 1 . 1 1 28 28 ARG N N 28 116.082 116.082 117.168 -1.086 25158 154 1 1 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.829 0.285 25158 155 1 1 . 1 1 28 28 ARG C C 28 176.521 176.521 176.209 0.312 25158 156 1 1 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.009 -0.855 25158 157 1 1 . 1 1 28 28 ARG CB C 28 27.471 27.471 26.907 0.564 25158 158 1 1 . 1 1 28 28 ARG H H 28 7.993 7.993 7.896 0.097 25158 159 1 1 . 1 1 29 29 SER N N 29 113.579 113.579 115.097 -1.518 25158 160 1 1 . 1 1 29 29 SER HA H 29 4.305 4.305 4.397 -0.092 25158 161 1 1 . 1 1 29 29 SER C C 29 175.368 175.368 175.354 0.014 25158 162 1 1 . 1 1 29 29 SER CA C 29 59.699 59.699 59.297 0.402 25158 163 1 1 . 1 1 29 29 SER CB C 29 63.908 63.908 63.927 -0.019 25158 164 1 1 . 1 1 29 29 SER H H 29 8.094 8.094 7.903 0.191 25158 165 1 1 . 1 1 30 30 GLY N N 30 109.920 109.920 109.197 0.723 25158 166 1 1 . 1 1 30 30 GLY C C 30 174.115 174.115 173.741 0.374 25158 167 1 1 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.656 1.115 25158 168 1 1 . 1 1 30 30 GLY H H 30 8.577 8.577 8.330 0.247 25158 169 1 1 . 1 1 31 31 ILE N N 31 119.084 119.084 120.458 -1.374 25158 170 1 1 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.356 0.002 25158 171 1 1 . 1 1 31 31 ILE C C 31 174.392 174.392 175.095 -0.703 25158 172 1 1 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.388 -0.142 25158 173 1 1 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.374 0.204 25158 174 1 1 . 1 1 31 31 ILE H H 31 7.387 7.387 7.778 -0.391 25158 175 1 1 . 1 1 32 32 SER N N 32 120.582 120.582 124.464 -3.882 25158 176 1 1 . 1 1 32 32 SER HA H 32 4.845 4.845 4.707 0.138 25158 177 1 1 . 1 1 32 32 SER C C 32 173.891 173.891 174.232 -0.341 25158 178 1 1 . 1 1 32 32 SER CA C 32 57.603 57.603 57.993 -0.390 25158 179 1 1 . 1 1 32 32 SER CB C 32 63.849 63.849 63.043 0.806 25158 180 1 1 . 1 1 32 32 SER H H 32 8.339 8.339 8.575 -0.236 25158 181 1 1 . 1 1 33 33 ILE N N 33 116.629 116.629 120.872 -4.243 25158 182 1 1 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.582 0.051 25158 183 1 1 . 1 1 33 33 ILE C C 33 174.195 174.195 174.306 -0.111 25158 184 1 1 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.389 -0.277 25158 185 1 1 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.388 2.194 25158 186 1 1 . 1 1 33 33 ILE H H 33 7.873 7.873 7.854 0.019 25158 187 1 1 . 1 1 34 34 ASN N N 34 118.342 118.342 120.548 -2.206 25158 188 1 1 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.885 -0.149 25158 189 1 1 . 1 1 34 34 ASN C C 34 176.217 176.217 176.217 0.000 25158 190 1 1 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.560 -0.374 25158 191 1 1 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.228 -1.729 25158 192 1 1 . 1 1 34 34 ASN H H 34 8.839 8.839 8.277 0.562 25158 193 1 1 . 1 1 35 35 THR N N 35 116.120 116.120 116.166 -0.046 25158 194 1 1 . 1 1 35 35 THR HA H 35 3.559 3.559 3.761 -0.202 25158 195 1 1 . 1 1 35 35 THR C C 35 177.347 177.347 175.898 1.449 25158 196 1 1 . 1 1 35 35 THR CA C 35 64.686 64.686 66.524 -1.838 25158 197 1 1 . 1 1 35 35 THR CB C 35 67.758 67.758 68.790 -1.032 25158 198 1 1 . 1 1 35 35 THR H H 35 7.939 7.939 7.762 0.177 25158 199 1 1 . 1 1 36 36 ASP N N 36 123.528 123.528 120.687 2.841 25158 200 1 1 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.451 -0.031 25158 201 1 1 . 1 1 36 36 ASP C C 36 177.752 177.752 177.459 0.293 25158 202 1 1 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.230 -0.156 25158 203 1 1 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.712 -0.814 25158 204 1 1 . 1 1 36 36 ASP H H 36 7.980 7.980 8.753 -0.773 25158 205 1 1 . 1 1 37 37 ASN N N 37 115.690 115.690 116.798 -1.108 25158 206 1 1 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.601 -0.335 25158 207 1 1 . 1 1 37 37 ASN C C 37 175.589 175.589 176.981 -1.392 25158 208 1 1 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.834 -2.274 25158 209 1 1 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.906 -0.942 25158 210 1 1 . 1 1 37 37 ASN H H 37 7.251 7.251 7.656 -0.405 25158 211 1 1 . 1 1 38 38 ALA N N 38 119.560 119.560 122.675 -3.115 25158 212 1 1 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.031 0.049 25158 213 1 1 . 1 1 38 38 ALA C C 38 173.638 173.638 177.435 -3.797 25158 214 1 1 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.100 -1.880 25158 215 1 1 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.774 4.097 25158 216 1 1 . 1 1 38 38 ALA H H 38 7.142 7.142 7.935 -0.793 25158 217 1 1 . 1 1 39 39 ASP N N 39 115.003 115.003 119.201 -4.198 25158 218 1 1 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.654 0.286 25158 219 1 1 . 1 1 39 39 ASP C C 39 177.163 177.163 176.950 0.213 25158 220 1 1 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.955 -2.784 25158 221 1 1 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.930 -0.984 25158 222 1 1 . 1 1 39 39 ASP H H 39 7.096 7.096 7.804 -0.708 25158 223 1 1 . 1 1 40 40 LEU N N 40 123.245 123.245 125.373 -2.128 25158 224 1 1 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.102 -0.031 25158 225 1 1 . 1 1 40 40 LEU C C 40 175.865 175.865 177.620 -1.755 25158 226 1 1 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.365 0.228 25158 227 1 1 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.440 -0.511 25158 228 1 1 . 1 1 40 40 LEU H H 40 8.572 8.572 8.038 0.534 25158 229 1 1 . 1 1 41 41 ASN N N 41 112.723 112.723 114.253 -1.530 25158 230 1 1 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.884 0.115 25158 231 1 1 . 1 1 41 41 ASN C C 41 173.846 173.846 175.414 -1.568 25158 232 1 1 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.072 -0.839 25158 233 1 1 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.385 -1.990 25158 234 1 1 . 1 1 41 41 ASN H H 41 8.004 8.004 7.953 0.051 25158 235 1 1 . 1 1 42 42 GLU N N 42 115.798 115.798 115.233 0.565 25158 236 1 1 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.224 -0.272 25158 237 1 1 . 1 1 42 42 GLU C C 42 175.172 175.172 175.438 -0.266 25158 238 1 1 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.434 -0.083 25158 239 1 1 . 1 1 42 42 GLU CB C 42 28.221 28.221 26.955 1.266 25158 240 1 1 . 1 1 42 42 GLU H H 42 7.642 7.642 8.585 -0.943 25158 241 1 1 . 1 1 43 43 ASP N N 43 117.453 117.453 117.107 0.346 25158 242 1 1 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.504 0.335 25158 243 1 1 . 1 1 43 43 ASP C C 43 178.129 178.129 177.386 0.743 25158 244 1 1 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.764 -1.126 25158 245 1 1 . 1 1 43 43 ASP CB C 43 41.214 41.214 40.976 0.238 25158 246 1 1 . 1 1 43 43 ASP H H 43 8.473 8.473 8.839 -0.366 25158 247 1 1 . 1 1 44 44 GLY N N 44 112.490 112.490 107.537 4.953 25158 248 1 1 . 1 1 44 44 GLY C C 44 173.717 173.717 173.635 0.082 25158 249 1 1 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.829 0.488 25158 250 1 1 . 1 1 44 44 GLY H H 44 10.139 10.139 8.630 1.509 25158 251 1 1 . 1 1 45 45 ARG N N 45 118.154 118.154 118.291 -0.137 25158 252 1 1 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.743 0.045 25158 253 1 1 . 1 1 45 45 ARG C C 45 175.602 175.602 174.051 1.551 25158 254 1 1 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.131 -0.299 25158 255 1 1 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.867 0.798 25158 256 1 1 . 1 1 45 45 ARG H H 45 7.994 7.994 8.701 -0.707 25158 257 1 1 . 1 1 46 46 VAL N N 46 126.392 126.392 123.093 3.299 25158 258 1 1 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.538 0.252 25158 259 1 1 . 1 1 46 46 VAL C C 46 174.644 174.644 175.506 -0.862 25158 260 1 1 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.422 -0.693 25158 261 1 1 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.256 1.410 25158 262 1 1 . 1 1 46 46 VAL H H 46 9.115 9.115 8.631 0.484 25158 263 1 1 . 1 1 47 47 ASN N N 47 126.737 126.737 125.124 1.613 25158 264 1 1 . 1 1 47 47 ASN HA H 47 4.875 4.875 5.041 -0.166 25158 265 1 1 . 1 1 47 47 ASN C C 47 176.467 176.467 176.325 0.142 25158 266 1 1 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.098 0.942 25158 267 1 1 . 1 1 47 47 ASN CB C 47 39.187 39.187 40.183 -0.996 25158 268 1 1 . 1 1 47 47 ASN H H 47 10.077 10.077 8.996 1.081 25158 269 1 1 . 1 1 48 48 SER N N 48 113.409 113.409 116.216 -2.807 25158 270 1 1 . 1 1 48 48 SER HA H 48 4.086 4.086 4.199 -0.113 25158 271 1 1 . 1 1 48 48 SER C C 48 176.671 176.671 176.146 0.525 25158 272 1 1 . 1 1 48 48 SER CA C 48 62.375 62.375 62.395 -0.021 25158 273 1 1 . 1 1 48 48 SER CB C 48 62.375 62.375 62.325 0.050 25158 274 1 1 . 1 1 48 48 SER H H 48 8.936 8.936 8.727 0.209 25158 275 1 1 . 1 1 49 49 THR N N 49 121.885 121.885 119.461 2.424 25158 276 1 1 . 1 1 49 49 THR HA H 49 4.112 4.112 3.981 0.131 25158 277 1 1 . 1 1 49 49 THR C C 49 177.320 177.320 176.470 0.850 25158 278 1 1 . 1 1 49 49 THR CA C 49 66.713 66.713 66.736 -0.023 25158 279 1 1 . 1 1 49 49 THR CB C 49 67.787 67.787 68.347 -0.560 25158 280 1 1 . 1 1 49 49 THR H H 49 8.124 8.124 8.208 -0.084 25158 281 1 1 . 1 1 50 50 ASP N N 50 120.401 120.401 121.996 -1.595 25158 282 1 1 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.355 0.015 25158 283 1 1 . 1 1 50 50 ASP C C 50 177.033 177.033 178.363 -1.330 25158 284 1 1 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.541 1.279 25158 285 1 1 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.416 1.292 25158 286 1 1 . 1 1 50 50 ASP H H 50 7.560 7.560 7.884 -0.324 25158 287 1 1 . 1 1 51 51 LEU N N 51 118.174 118.174 121.737 -3.563 25158 288 1 1 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.026 0.162 25158 289 1 1 . 1 1 51 51 LEU C C 51 177.441 177.441 178.739 -1.298 25158 290 1 1 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.076 0.061 25158 291 1 1 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.184 0.664 25158 292 1 1 . 1 1 51 51 LEU H H 51 7.134 7.134 7.529 -0.395 25158 293 1 1 . 1 1 52 52 GLY N N 52 105.596 105.596 106.924 -1.328 25158 294 1 1 . 1 1 52 52 GLY C C 52 176.764 176.764 176.278 0.486 25158 295 1 1 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.390 0.252 25158 296 1 1 . 1 1 52 52 GLY H H 52 8.034 8.034 8.138 -0.104 25158 297 1 1 . 1 1 53 53 ILE N N 53 122.043 122.043 122.983 -0.940 25158 298 1 1 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.630 -0.181 25158 299 1 1 . 1 1 53 53 ILE C C 53 177.112 177.112 177.653 -0.541 25158 300 1 1 . 1 1 53 53 ILE CA C 53 65.388 65.388 65.025 0.364 25158 301 1 1 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.872 0.386 25158 302 1 1 . 1 1 53 53 ILE H H 53 7.611 7.611 7.801 -0.190 25158 303 1 1 . 1 1 54 54 LEU N N 54 120.787 120.787 121.388 -0.601 25158 304 1 1 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.912 0.029 25158 305 1 1 . 1 1 54 54 LEU C C 54 175.340 175.340 178.576 -3.236 25158 306 1 1 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.616 -0.421 25158 307 1 1 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.935 -0.714 25158 308 1 1 . 1 1 54 54 LEU H H 54 8.323 8.323 8.351 -0.028 25158 309 1 1 . 1 1 55 55 LYS N N 55 116.833 116.833 119.085 -2.252 25158 310 1 1 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.993 -0.109 25158 311 1 1 . 1 1 55 55 LYS C C 55 179.067 179.067 179.192 -0.125 25158 312 1 1 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.713 0.938 25158 313 1 1 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.319 -0.310 25158 314 1 1 . 1 1 55 55 LYS H H 55 8.356 8.356 8.076 0.280 25158 315 1 1 . 1 1 56 56 ARG N N 56 117.092 117.092 119.008 -1.916 25158 316 1 1 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.991 -0.075 25158 317 1 1 . 1 1 56 56 ARG C C 56 178.223 178.223 178.391 -0.168 25158 318 1 1 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.571 0.780 25158 319 1 1 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.254 0.526 25158 320 1 1 . 1 1 56 56 ARG H H 56 7.543 7.543 8.293 -0.750 25158 321 1 1 . 1 1 57 57 TYR N N 57 122.187 122.187 121.298 0.889 25158 322 1 1 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.505 -0.113 25158 323 1 1 . 1 1 57 57 TYR C C 57 180.009 180.009 178.550 1.459 25158 324 1 1 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.270 0.308 25158 325 1 1 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.505 0.331 25158 326 1 1 . 1 1 57 57 TYR H H 57 8.592 8.592 8.214 0.378 25158 327 1 1 . 1 1 58 58 ILE N N 58 122.825 122.825 116.297 6.528 25158 328 1 1 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.840 -0.160 25158 329 1 1 . 1 1 58 58 ILE C C 58 178.186 178.186 176.176 2.010 25158 330 1 1 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.089 1.679 25158 331 1 1 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.109 -0.389 25158 332 1 1 . 1 1 58 58 ILE H H 58 8.779 8.779 7.448 1.331 25158 333 1 1 . 1 1 59 59 LEU N N 59 118.552 118.552 118.704 -0.152 25158 334 1 1 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.324 -0.101 25158 335 1 1 . 1 1 59 59 LEU C C 59 175.937 175.937 175.950 -0.013 25158 336 1 1 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.057 1.455 25158 337 1 1 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.639 0.787 25158 338 1 1 . 1 1 59 59 LEU H H 59 7.539 7.539 7.465 0.074 25158 339 1 1 . 1 1 60 60 LYS N N 60 113.650 113.650 117.576 -3.926 25158 340 1 1 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.824 0.171 25158 341 1 1 . 1 1 60 60 LYS C C 60 176.535 176.535 176.036 0.499 25158 342 1 1 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.651 -0.360 25158 343 1 1 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.605 -1.334 25158 344 1 1 . 1 1 60 60 LYS H H 60 7.815 7.815 7.480 0.335 25158 345 1 1 . 1 1 61 61 GLU N N 61 117.535 117.535 115.895 1.640 25158 346 1 1 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.351 -0.207 25158 347 1 1 . 1 1 61 61 GLU C C 61 176.992 176.992 176.321 0.671 25158 348 1 1 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.442 0.247 25158 349 1 1 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.502 -0.810 25158 350 1 1 . 1 1 61 61 GLU H H 61 8.438 8.438 8.178 0.260 25158 351 1 1 . 1 1 62 62 ILE N N 62 112.102 112.102 115.011 -2.909 25158 352 1 1 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.482 -0.099 25158 353 1 1 . 1 1 62 62 ILE C C 62 175.425 175.425 174.443 0.982 25158 354 1 1 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.306 -0.380 25158 355 1 1 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.771 0.977 25158 356 1 1 . 1 1 62 62 ILE H H 62 6.867 6.867 7.342 -0.475 25158 357 1 1 . 1 1 63 63 ASP N N 63 119.719 119.719 124.749 -5.030 25158 358 1 1 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.824 -0.150 25158 359 1 1 . 1 1 63 63 ASP C C 63 176.202 176.202 176.537 -0.335 25158 360 1 1 . 1 1 63 63 ASP CA C 63 54.818 54.818 55.082 -0.264 25158 361 1 1 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.589 -0.372 25158 362 1 1 . 1 1 63 63 ASP H H 63 8.561 8.561 8.785 -0.224 25158 363 1 1 . 1 1 64 64 THR N N 64 113.289 113.289 118.698 -5.409 25158 364 1 1 . 1 1 64 64 THR HA H 64 4.712 4.712 4.289 0.423 25158 365 1 1 . 1 1 64 64 THR C C 64 170.854 170.854 173.262 -2.408 25158 366 1 1 . 1 1 64 64 THR CA C 64 61.269 61.269 63.005 -1.736 25158 367 1 1 . 1 1 64 64 THR CB C 64 71.993 71.993 68.874 3.119 25158 368 1 1 . 1 1 64 64 THR H H 64 7.410 7.410 7.918 -0.508 25158 369 1 1 . 1 1 65 65 LEU N N 65 121.012 121.012 127.436 -6.424 25158 370 1 1 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.803 -0.574 25158 371 1 1 . 1 1 65 65 LEU C C 65 174.763 174.763 175.153 -0.390 25158 372 1 1 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.159 -0.524 25158 373 1 1 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.138 0.382 25158 374 1 1 . 1 1 65 65 LEU H H 65 7.877 7.877 8.382 -0.505 25158 375 1 1 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.509 -0.517 25158 376 1 1 . 1 1 66 66 PRO C C 66 174.419 174.419 174.849 -0.430 25158 377 1 1 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.394 -0.084 25158 378 1 1 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.104 3.122 25158 379 1 1 . 1 1 67 67 TYR N N 67 122.616 122.616 120.585 2.031 25158 380 1 1 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.478 0.178 25158 381 1 1 . 1 1 67 67 TYR C C 67 174.446 174.446 175.650 -1.204 25158 382 1 1 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.318 -0.306 25158 383 1 1 . 1 1 67 67 TYR CB C 67 41.081 41.081 40.361 0.720 25158 384 1 1 . 1 1 67 67 TYR H H 67 8.662 8.662 8.244 0.418 25158 385 1 1 . 1 1 68 68 LYS N N 68 126.223 126.223 126.566 -0.343 25158 386 1 1 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.164 0.104 25158 387 1 1 . 1 1 68 68 LYS C C 68 174.748 174.748 174.721 0.027 25158 388 1 1 . 1 1 68 68 LYS CA C 68 55.603 55.603 54.882 0.721 25158 389 1 1 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.814 0.956 25158 390 1 1 . 1 1 68 68 LYS H H 68 8.112 8.112 7.634 0.478 25158 391 1 2 . 1 1 2 2 THR N N 2 116.700 116.700 115.847 0.853 25158 392 1 2 . 1 1 2 2 THR HA H 2 4.313 4.313 4.360 -0.047 25158 393 1 2 . 1 1 2 2 THR C C 2 173.968 173.968 174.934 -0.966 25158 394 1 2 . 1 1 2 2 THR CA C 2 62.326 62.326 60.825 1.501 25158 395 1 2 . 1 1 2 2 THR CB C 2 70.154 70.154 70.029 0.124 25158 396 1 2 . 1 1 2 2 THR H H 2 8.657 8.657 8.270 0.387 25158 397 1 2 . 1 1 3 3 LYS N N 3 125.500 125.500 124.620 0.880 25158 398 1 2 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.264 -0.199 25158 399 1 2 . 1 1 3 3 LYS C C 3 174.926 174.926 175.427 -0.501 25158 400 1 2 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.593 0.246 25158 401 1 2 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.126 1.651 25158 402 1 2 . 1 1 3 3 LYS H H 3 8.318 8.318 8.387 -0.069 25158 403 1 2 . 1 1 4 4 LEU N N 4 127.473 127.473 126.313 1.160 25158 404 1 2 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.495 -0.012 25158 405 1 2 . 1 1 4 4 LEU C C 4 174.734 174.734 175.077 -0.343 25158 406 1 2 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.587 -0.329 25158 407 1 2 . 1 1 4 4 LEU CB C 4 40.929 40.929 43.924 -2.995 25158 408 1 2 . 1 1 4 4 LEU H H 4 7.726 7.726 8.064 -0.338 25158 409 1 2 . 1 1 5 5 TYR N N 5 123.074 123.074 124.385 -1.311 25158 410 1 2 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.114 -0.491 25158 411 1 2 . 1 1 5 5 TYR C C 5 175.406 175.406 177.325 -1.919 25158 412 1 2 . 1 1 5 5 TYR CA C 5 61.812 61.812 59.511 2.301 25158 413 1 2 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.448 1.662 25158 414 1 2 . 1 1 5 5 TYR H H 5 7.816 7.816 8.710 -0.894 25158 415 1 2 . 1 1 6 6 GLY N N 6 108.614 108.614 114.122 -5.508 25158 416 1 2 . 1 1 6 6 GLY C C 6 172.585 172.585 172.776 -0.191 25158 417 1 2 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.934 0.453 25158 418 1 2 . 1 1 6 6 GLY H H 6 8.915 8.915 8.428 0.487 25158 419 1 2 . 1 1 7 7 ASP N N 7 118.023 118.023 120.082 -2.059 25158 420 1 2 . 1 1 7 7 ASP HA H 7 4.984 4.984 5.311 -0.327 25158 421 1 2 . 1 1 7 7 ASP C C 7 177.806 177.806 177.050 0.756 25158 422 1 2 . 1 1 7 7 ASP CA C 7 52.192 52.192 52.125 0.067 25158 423 1 2 . 1 1 7 7 ASP CB C 7 39.150 39.150 41.249 -2.099 25158 424 1 2 . 1 1 7 7 ASP H H 7 7.976 7.976 7.604 0.372 25158 425 1 2 . 1 1 8 8 VAL N N 8 120.293 120.293 118.715 1.578 25158 426 1 2 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.330 -0.347 25158 427 1 2 . 1 1 8 8 VAL C C 8 175.717 175.717 176.819 -1.102 25158 428 1 2 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.682 -0.236 25158 429 1 2 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.937 -0.666 25158 430 1 2 . 1 1 8 8 VAL H H 8 8.156 8.156 8.587 -0.431 25158 431 1 2 . 1 1 9 9 ASN N N 9 115.226 115.226 116.094 -0.868 25158 432 1 2 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.576 0.413 25158 433 1 2 . 1 1 9 9 ASN C C 9 174.626 174.626 175.232 -0.606 25158 434 1 2 . 1 1 9 9 ASN CA C 9 50.950 50.950 53.413 -2.463 25158 435 1 2 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.285 -0.584 25158 436 1 2 . 1 1 9 9 ASN H H 9 8.008 8.008 8.151 -0.143 25158 437 1 2 . 1 1 10 10 ASP N N 10 115.600 115.600 117.803 -2.203 25158 438 1 2 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.489 -0.053 25158 439 1 2 . 1 1 10 10 ASP C C 10 175.125 175.125 175.199 -0.074 25158 440 1 2 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.396 0.839 25158 441 1 2 . 1 1 10 10 ASP CB C 10 40.200 40.200 38.708 1.492 25158 442 1 2 . 1 1 10 10 ASP H H 10 7.374 7.374 8.351 -0.977 25158 443 1 2 . 1 1 11 11 ASP N N 11 118.402 118.402 117.140 1.262 25158 444 1 2 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.636 0.181 25158 445 1 2 . 1 1 11 11 ASP C C 11 178.299 178.299 177.320 0.979 25158 446 1 2 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.272 -0.451 25158 447 1 2 . 1 1 11 11 ASP CB C 11 41.114 41.114 42.109 -0.995 25158 448 1 2 . 1 1 11 11 ASP H H 11 8.801 8.801 8.807 -0.006 25158 449 1 2 . 1 1 12 12 GLY N N 12 112.353 112.353 107.938 4.415 25158 450 1 2 . 1 1 12 12 GLY C C 12 173.284 173.284 173.782 -0.498 25158 451 1 2 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.293 0.331 25158 452 1 2 . 1 1 12 12 GLY H H 12 10.293 10.293 9.030 1.263 25158 453 1 2 . 1 1 13 13 LYS N N 13 118.118 118.118 119.122 -1.004 25158 454 1 2 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.499 0.160 25158 455 1 2 . 1 1 13 13 LYS C C 13 175.595 175.595 174.825 0.770 25158 456 1 2 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.342 -1.584 25158 457 1 2 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.567 0.772 25158 458 1 2 . 1 1 13 13 LYS H H 13 7.848 7.848 8.367 -0.519 25158 459 1 2 . 1 1 14 14 VAL N N 14 126.591 126.591 124.390 2.201 25158 460 1 2 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.451 0.304 25158 461 1 2 . 1 1 14 14 VAL C C 14 175.052 175.052 175.347 -0.295 25158 462 1 2 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.376 -0.305 25158 463 1 2 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.532 0.923 25158 464 1 2 . 1 1 14 14 VAL H H 14 9.109 9.109 8.563 0.546 25158 465 1 2 . 1 1 15 15 ASN N N 15 126.287 126.287 126.653 -0.366 25158 466 1 2 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.939 -0.124 25158 467 1 2 . 1 1 15 15 ASN C C 15 176.340 176.340 176.614 -0.274 25158 468 1 2 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.538 0.737 25158 469 1 2 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.898 -2.678 25158 470 1 2 . 1 1 15 15 ASN H H 15 10.071 10.071 9.464 0.607 25158 471 1 2 . 1 1 16 16 SER N N 16 113.168 113.168 116.523 -3.355 25158 472 1 2 . 1 1 16 16 SER HA H 16 4.047 4.047 4.244 -0.197 25158 473 1 2 . 1 1 16 16 SER C C 16 176.197 176.197 176.307 -0.110 25158 474 1 2 . 1 1 16 16 SER CA C 16 62.681 62.681 61.914 0.767 25158 475 1 2 . 1 1 16 16 SER CB C 16 62.681 62.681 63.133 -0.452 25158 476 1 2 . 1 1 16 16 SER H H 16 8.825 8.825 8.877 -0.052 25158 477 1 2 . 1 1 17 17 THR N N 17 119.391 119.391 117.883 1.508 25158 478 1 2 . 1 1 17 17 THR HA H 17 3.983 3.983 4.054 -0.071 25158 479 1 2 . 1 1 17 17 THR C C 17 177.149 177.149 176.277 0.872 25158 480 1 2 . 1 1 17 17 THR CA C 17 66.791 66.791 66.144 0.646 25158 481 1 2 . 1 1 17 17 THR CB C 17 67.757 67.757 68.348 -0.591 25158 482 1 2 . 1 1 17 17 THR H H 17 7.946 7.946 8.274 -0.328 25158 483 1 2 . 1 1 18 18 ASP N N 18 120.318 120.318 121.269 -0.951 25158 484 1 2 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.342 0.028 25158 485 1 2 . 1 1 18 18 ASP C C 18 177.168 177.168 178.065 -0.897 25158 486 1 2 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.614 1.300 25158 487 1 2 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.521 1.641 25158 488 1 2 . 1 1 18 18 ASP H H 18 7.995 7.995 7.934 0.061 25158 489 1 2 . 1 1 19 19 ALA N N 19 120.191 120.191 123.347 -3.156 25158 490 1 2 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.080 -0.032 25158 491 1 2 . 1 1 19 19 ALA C C 19 179.549 179.549 179.231 0.318 25158 492 1 2 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.222 0.191 25158 493 1 2 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.425 -1.113 25158 494 1 2 . 1 1 19 19 ALA H H 19 7.085 7.085 7.529 -0.444 25158 495 1 2 . 1 1 20 20 VAL N N 20 120.613 120.613 118.668 1.945 25158 496 1 2 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.797 -0.186 25158 497 1 2 . 1 1 20 20 VAL C C 20 178.153 178.153 177.518 0.635 25158 498 1 2 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.001 1.766 25158 499 1 2 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.275 0.593 25158 500 1 2 . 1 1 20 20 VAL H H 20 7.835 7.835 7.543 0.292 25158 501 1 2 . 1 1 21 21 ALA N N 21 121.767 121.767 122.962 -1.195 25158 502 1 2 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.113 -0.051 25158 503 1 2 . 1 1 21 21 ALA C C 21 179.298 179.298 179.639 -0.341 25158 504 1 2 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.212 0.032 25158 505 1 2 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.283 -0.494 25158 506 1 2 . 1 1 21 21 ALA H H 21 7.804 7.804 8.181 -0.377 25158 507 1 2 . 1 1 22 22 LEU N N 22 117.555 117.555 119.991 -2.436 25158 508 1 2 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.064 0.082 25158 509 1 2 . 1 1 22 22 LEU C C 22 177.914 177.914 178.338 -0.424 25158 510 1 2 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.670 0.023 25158 511 1 2 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.716 -0.201 25158 512 1 2 . 1 1 22 22 LEU H H 22 8.619 8.619 8.039 0.580 25158 513 1 2 . 1 1 23 23 LYS N N 23 120.335 120.335 119.263 1.072 25158 514 1 2 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.931 -0.012 25158 515 1 2 . 1 1 23 23 LYS C C 23 177.731 177.731 178.959 -1.228 25158 516 1 2 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.844 0.493 25158 517 1 2 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.200 -0.102 25158 518 1 2 . 1 1 23 23 LYS H H 23 8.230 8.230 7.698 0.532 25158 519 1 2 . 1 1 24 24 ARG N N 24 116.831 116.831 117.814 -0.983 25158 520 1 2 . 1 1 24 24 ARG HA H 24 3.959 3.959 3.998 -0.039 25158 521 1 2 . 1 1 24 24 ARG C C 24 178.616 178.616 178.582 0.034 25158 522 1 2 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.418 0.539 25158 523 1 2 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.175 -0.612 25158 524 1 2 . 1 1 24 24 ARG H H 24 7.927 7.927 7.731 0.196 25158 525 1 2 . 1 1 25 25 TYR N N 25 120.960 120.960 120.896 0.064 25158 526 1 2 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.310 -0.100 25158 527 1 2 . 1 1 25 25 TYR C C 25 179.465 179.465 178.518 0.947 25158 528 1 2 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.296 0.549 25158 529 1 2 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.494 0.571 25158 530 1 2 . 1 1 25 25 TYR H H 25 8.321 8.321 7.643 0.678 25158 531 1 2 . 1 1 26 26 VAL N N 26 120.405 120.405 119.104 1.301 25158 532 1 2 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.751 0.023 25158 533 1 2 . 1 1 26 26 VAL C C 26 177.826 177.826 177.209 0.617 25158 534 1 2 . 1 1 26 26 VAL CA C 26 65.440 65.440 66.238 -0.798 25158 535 1 2 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.748 -0.191 25158 536 1 2 . 1 1 26 26 VAL H H 26 8.803 8.803 8.237 0.566 25158 537 1 2 . 1 1 27 27 LEU N N 27 119.247 119.247 117.412 1.835 25158 538 1 2 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.290 -0.014 25158 539 1 2 . 1 1 27 27 LEU C C 27 176.753 176.753 176.257 0.496 25158 540 1 2 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.719 0.956 25158 541 1 2 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.319 -0.726 25158 542 1 2 . 1 1 27 27 LEU H H 27 7.898 7.898 7.563 0.335 25158 543 1 2 . 1 1 28 28 ARG N N 28 116.082 116.082 117.746 -1.664 25158 544 1 2 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.907 0.207 25158 545 1 2 . 1 1 28 28 ARG C C 28 176.521 176.521 175.868 0.653 25158 546 1 2 . 1 1 28 28 ARG CA C 28 56.154 56.154 56.907 -0.753 25158 547 1 2 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.042 0.429 25158 548 1 2 . 1 1 28 28 ARG H H 28 7.993 7.993 7.625 0.368 25158 549 1 2 . 1 1 29 29 SER N N 29 113.579 113.579 114.973 -1.394 25158 550 1 2 . 1 1 29 29 SER HA H 29 4.305 4.305 4.540 -0.235 25158 551 1 2 . 1 1 29 29 SER C C 29 175.368 175.368 174.705 0.663 25158 552 1 2 . 1 1 29 29 SER CA C 29 59.699 59.699 57.384 2.315 25158 553 1 2 . 1 1 29 29 SER CB C 29 63.908 63.908 63.347 0.561 25158 554 1 2 . 1 1 29 29 SER H H 29 8.094 8.094 7.758 0.336 25158 555 1 2 . 1 1 30 30 GLY N N 30 109.920 109.920 108.812 1.108 25158 556 1 2 . 1 1 30 30 GLY C C 30 174.115 174.115 174.162 -0.047 25158 557 1 2 . 1 1 30 30 GLY CA C 30 45.771 45.771 45.503 0.268 25158 558 1 2 . 1 1 30 30 GLY H H 30 8.577 8.577 8.160 0.417 25158 559 1 2 . 1 1 31 31 ILE N N 31 119.084 119.084 119.035 0.049 25158 560 1 2 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.361 -0.003 25158 561 1 2 . 1 1 31 31 ILE C C 31 174.392 174.392 174.855 -0.463 25158 562 1 2 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.326 -0.080 25158 563 1 2 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.772 -0.193 25158 564 1 2 . 1 1 31 31 ILE H H 31 7.387 7.387 7.772 -0.385 25158 565 1 2 . 1 1 32 32 SER N N 32 120.582 120.582 124.094 -3.512 25158 566 1 2 . 1 1 32 32 SER HA H 32 4.845 4.845 4.892 -0.047 25158 567 1 2 . 1 1 32 32 SER C C 32 173.891 173.891 173.915 -0.024 25158 568 1 2 . 1 1 32 32 SER CA C 32 57.603 57.603 57.717 -0.114 25158 569 1 2 . 1 1 32 32 SER CB C 32 63.849 63.849 63.769 0.080 25158 570 1 2 . 1 1 32 32 SER H H 32 8.339 8.339 8.570 -0.231 25158 571 1 2 . 1 1 33 33 ILE N N 33 116.629 116.629 120.886 -4.257 25158 572 1 2 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.466 0.167 25158 573 1 2 . 1 1 33 33 ILE C C 33 174.195 174.195 173.682 0.513 25158 574 1 2 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.410 -0.298 25158 575 1 2 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.317 2.265 25158 576 1 2 . 1 1 33 33 ILE H H 33 7.873 7.873 8.075 -0.202 25158 577 1 2 . 1 1 34 34 ASN N N 34 118.342 118.342 119.491 -1.149 25158 578 1 2 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.866 -0.130 25158 579 1 2 . 1 1 34 34 ASN C C 34 176.217 176.217 175.826 0.391 25158 580 1 2 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.249 -0.063 25158 581 1 2 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.712 -2.213 25158 582 1 2 . 1 1 34 34 ASN H H 34 8.839 8.839 8.142 0.697 25158 583 1 2 . 1 1 35 35 THR N N 35 116.120 116.120 118.316 -2.196 25158 584 1 2 . 1 1 35 35 THR HA H 35 3.559 3.559 3.960 -0.401 25158 585 1 2 . 1 1 35 35 THR C C 35 177.347 177.347 176.382 0.965 25158 586 1 2 . 1 1 35 35 THR CA C 35 64.686 64.686 65.206 -0.520 25158 587 1 2 . 1 1 35 35 THR CB C 35 67.758 67.758 68.933 -1.175 25158 588 1 2 . 1 1 35 35 THR H H 35 7.939 7.939 8.443 -0.504 25158 589 1 2 . 1 1 36 36 ASP N N 36 123.528 123.528 120.931 2.597 25158 590 1 2 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.380 0.040 25158 591 1 2 . 1 1 36 36 ASP C C 36 177.752 177.752 177.053 0.699 25158 592 1 2 . 1 1 36 36 ASP CA C 36 57.074 57.074 56.963 0.111 25158 593 1 2 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.798 -0.900 25158 594 1 2 . 1 1 36 36 ASP H H 36 7.980 7.980 8.083 -0.103 25158 595 1 2 . 1 1 37 37 ASN N N 37 115.690 115.690 116.965 -1.275 25158 596 1 2 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.442 -0.176 25158 597 1 2 . 1 1 37 37 ASN C C 37 175.589 175.589 176.900 -1.311 25158 598 1 2 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.672 -2.112 25158 599 1 2 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.649 -0.686 25158 600 1 2 . 1 1 37 37 ASN H H 37 7.251 7.251 7.626 -0.375 25158 601 1 2 . 1 1 38 38 ALA N N 38 119.560 119.560 123.201 -3.641 25158 602 1 2 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.061 0.019 25158 603 1 2 . 1 1 38 38 ALA C C 38 173.638 173.638 178.149 -4.511 25158 604 1 2 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.034 -1.814 25158 605 1 2 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.762 4.109 25158 606 1 2 . 1 1 38 38 ALA H H 38 7.142 7.142 7.643 -0.501 25158 607 1 2 . 1 1 39 39 ASP N N 39 115.003 115.003 119.774 -4.771 25158 608 1 2 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.762 0.178 25158 609 1 2 . 1 1 39 39 ASP C C 39 177.163 177.163 177.061 0.102 25158 610 1 2 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.950 -2.779 25158 611 1 2 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.963 -1.017 25158 612 1 2 . 1 1 39 39 ASP H H 39 7.096 7.096 8.000 -0.904 25158 613 1 2 . 1 1 40 40 LEU N N 40 123.245 123.245 124.371 -1.126 25158 614 1 2 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.499 -0.428 25158 615 1 2 . 1 1 40 40 LEU C C 40 175.865 175.865 177.648 -1.783 25158 616 1 2 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.071 0.522 25158 617 1 2 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.329 -0.400 25158 618 1 2 . 1 1 40 40 LEU H H 40 8.572 8.572 8.021 0.551 25158 619 1 2 . 1 1 41 41 ASN N N 41 112.723 112.723 114.140 -1.417 25158 620 1 2 . 1 1 41 41 ASN HA H 41 4.999 4.999 5.051 -0.052 25158 621 1 2 . 1 1 41 41 ASN C C 41 173.846 173.846 175.314 -1.468 25158 622 1 2 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.026 -0.793 25158 623 1 2 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.199 -1.804 25158 624 1 2 . 1 1 41 41 ASN H H 41 8.004 8.004 7.893 0.111 25158 625 1 2 . 1 1 42 42 GLU N N 42 115.798 115.798 116.133 -0.335 25158 626 1 2 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.327 -0.375 25158 627 1 2 . 1 1 42 42 GLU C C 42 175.172 175.172 175.723 -0.551 25158 628 1 2 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.599 -0.248 25158 629 1 2 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.119 1.102 25158 630 1 2 . 1 1 42 42 GLU H H 42 7.642 7.642 8.594 -0.952 25158 631 1 2 . 1 1 43 43 ASP N N 43 117.453 117.453 117.380 0.073 25158 632 1 2 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.546 0.293 25158 633 1 2 . 1 1 43 43 ASP C C 43 178.129 178.129 177.429 0.700 25158 634 1 2 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.730 -1.091 25158 635 1 2 . 1 1 43 43 ASP CB C 43 41.214 41.214 40.948 0.266 25158 636 1 2 . 1 1 43 43 ASP H H 43 8.473 8.473 8.599 -0.126 25158 637 1 2 . 1 1 44 44 GLY N N 44 112.490 112.490 107.498 4.992 25158 638 1 2 . 1 1 44 44 GLY C C 44 173.717 173.717 173.627 0.090 25158 639 1 2 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.819 0.498 25158 640 1 2 . 1 1 44 44 GLY H H 44 10.139 10.139 8.347 1.792 25158 641 1 2 . 1 1 45 45 ARG N N 45 118.154 118.154 117.834 0.320 25158 642 1 2 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.719 0.069 25158 643 1 2 . 1 1 45 45 ARG C C 45 175.602 175.602 173.893 1.709 25158 644 1 2 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.312 -0.480 25158 645 1 2 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.791 0.873 25158 646 1 2 . 1 1 45 45 ARG H H 45 7.994 7.994 8.400 -0.406 25158 647 1 2 . 1 1 46 46 VAL N N 46 126.392 126.392 122.399 3.993 25158 648 1 2 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.467 0.323 25158 649 1 2 . 1 1 46 46 VAL C C 46 174.644 174.644 175.577 -0.933 25158 650 1 2 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.911 -0.182 25158 651 1 2 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.583 1.083 25158 652 1 2 . 1 1 46 46 VAL H H 46 9.115 9.115 8.568 0.547 25158 653 1 2 . 1 1 47 47 ASN N N 47 126.737 126.737 126.426 0.311 25158 654 1 2 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.887 -0.012 25158 655 1 2 . 1 1 47 47 ASN C C 47 176.467 176.467 176.101 0.366 25158 656 1 2 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.612 0.428 25158 657 1 2 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.409 -0.222 25158 658 1 2 . 1 1 47 47 ASN H H 47 10.077 10.077 7.788 2.289 25158 659 1 2 . 1 1 48 48 SER N N 48 113.409 113.409 113.929 -0.520 25158 660 1 2 . 1 1 48 48 SER HA H 48 4.086 4.086 4.195 -0.109 25158 661 1 2 . 1 1 48 48 SER C C 48 176.671 176.671 176.058 0.613 25158 662 1 2 . 1 1 48 48 SER CA C 48 62.375 62.375 61.489 0.886 25158 663 1 2 . 1 1 48 48 SER CB C 48 62.375 62.375 62.990 -0.615 25158 664 1 2 . 1 1 48 48 SER H H 48 8.936 8.936 8.728 0.208 25158 665 1 2 . 1 1 49 49 THR N N 49 121.885 121.885 118.442 3.443 25158 666 1 2 . 1 1 49 49 THR HA H 49 4.112 4.112 3.922 0.190 25158 667 1 2 . 1 1 49 49 THR C C 49 177.320 177.320 176.486 0.834 25158 668 1 2 . 1 1 49 49 THR CA C 49 66.713 66.713 66.463 0.250 25158 669 1 2 . 1 1 49 49 THR CB C 49 67.787 67.787 68.576 -0.789 25158 670 1 2 . 1 1 49 49 THR H H 49 8.124 8.124 7.691 0.433 25158 671 1 2 . 1 1 50 50 ASP N N 50 120.401 120.401 122.544 -2.143 25158 672 1 2 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.402 -0.032 25158 673 1 2 . 1 1 50 50 ASP C C 50 177.033 177.033 178.352 -1.319 25158 674 1 2 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.533 1.287 25158 675 1 2 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.263 1.445 25158 676 1 2 . 1 1 50 50 ASP H H 50 7.560 7.560 7.951 -0.391 25158 677 1 2 . 1 1 51 51 LEU N N 51 118.174 118.174 119.735 -1.561 25158 678 1 2 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.059 0.129 25158 679 1 2 . 1 1 51 51 LEU C C 51 177.441 177.441 178.647 -1.206 25158 680 1 2 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.171 -0.034 25158 681 1 2 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.822 0.025 25158 682 1 2 . 1 1 51 51 LEU H H 51 7.134 7.134 7.661 -0.527 25158 683 1 2 . 1 1 52 52 GLY N N 52 105.596 105.596 106.492 -0.896 25158 684 1 2 . 1 1 52 52 GLY C C 52 176.764 176.764 175.972 0.792 25158 685 1 2 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.782 0.859 25158 686 1 2 . 1 1 52 52 GLY H H 52 8.034 8.034 7.383 0.651 25158 687 1 2 . 1 1 53 53 ILE N N 53 122.043 122.043 122.997 -0.954 25158 688 1 2 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.713 -0.264 25158 689 1 2 . 1 1 53 53 ILE C C 53 177.112 177.112 177.570 -0.458 25158 690 1 2 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.838 0.550 25158 691 1 2 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.853 0.405 25158 692 1 2 . 1 1 53 53 ILE H H 53 7.611 7.611 7.776 -0.165 25158 693 1 2 . 1 1 54 54 LEU N N 54 120.787 120.787 120.724 0.063 25158 694 1 2 . 1 1 54 54 LEU HA H 54 3.941 3.941 4.044 -0.103 25158 695 1 2 . 1 1 54 54 LEU C C 54 175.340 175.340 178.806 -3.466 25158 696 1 2 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.358 -0.162 25158 697 1 2 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.005 0.216 25158 698 1 2 . 1 1 54 54 LEU H H 54 8.323 8.323 8.432 -0.109 25158 699 1 2 . 1 1 55 55 LYS N N 55 116.833 116.833 119.012 -2.179 25158 700 1 2 . 1 1 55 55 LYS HA H 55 3.884 3.884 4.030 -0.146 25158 701 1 2 . 1 1 55 55 LYS C C 55 179.067 179.067 179.097 -0.030 25158 702 1 2 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.549 1.102 25158 703 1 2 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.399 -0.390 25158 704 1 2 . 1 1 55 55 LYS H H 55 8.356 8.356 7.581 0.775 25158 705 1 2 . 1 1 56 56 ARG N N 56 117.092 117.092 119.396 -2.304 25158 706 1 2 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.991 -0.075 25158 707 1 2 . 1 1 56 56 ARG C C 56 178.223 178.223 178.513 -0.290 25158 708 1 2 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.554 0.797 25158 709 1 2 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.186 0.594 25158 710 1 2 . 1 1 56 56 ARG H H 56 7.543 7.543 8.117 -0.574 25158 711 1 2 . 1 1 57 57 TYR N N 57 122.187 122.187 121.141 1.046 25158 712 1 2 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.545 -0.153 25158 713 1 2 . 1 1 57 57 TYR C C 57 180.009 180.009 178.678 1.331 25158 714 1 2 . 1 1 57 57 TYR CA C 57 61.579 61.579 60.842 0.737 25158 715 1 2 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.488 0.348 25158 716 1 2 . 1 1 57 57 TYR H H 57 8.592 8.592 8.084 0.508 25158 717 1 2 . 1 1 58 58 ILE N N 58 122.825 122.825 118.226 4.599 25158 718 1 2 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.753 -0.073 25158 719 1 2 . 1 1 58 58 ILE C C 58 178.186 178.186 177.130 1.056 25158 720 1 2 . 1 1 58 58 ILE CA C 58 64.768 64.768 64.024 0.744 25158 721 1 2 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.200 -0.480 25158 722 1 2 . 1 1 58 58 ILE H H 58 8.779 8.779 7.567 1.212 25158 723 1 2 . 1 1 59 59 LEU N N 59 118.552 118.552 118.763 -0.211 25158 724 1 2 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.291 -0.068 25158 725 1 2 . 1 1 59 59 LEU C C 59 175.937 175.937 175.841 0.096 25158 726 1 2 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.638 0.874 25158 727 1 2 . 1 1 59 59 LEU CB C 59 42.426 42.426 42.151 0.275 25158 728 1 2 . 1 1 59 59 LEU H H 59 7.539 7.539 7.650 -0.111 25158 729 1 2 . 1 1 60 60 LYS N N 60 113.650 113.650 118.095 -4.445 25158 730 1 2 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.830 0.165 25158 731 1 2 . 1 1 60 60 LYS C C 60 176.535 176.535 176.370 0.165 25158 732 1 2 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.372 -0.081 25158 733 1 2 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.315 -2.044 25158 734 1 2 . 1 1 60 60 LYS H H 60 7.815 7.815 7.270 0.545 25158 735 1 2 . 1 1 61 61 GLU N N 61 117.535 117.535 115.620 1.915 25158 736 1 2 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.357 -0.213 25158 737 1 2 . 1 1 61 61 GLU C C 61 176.992 176.992 176.621 0.371 25158 738 1 2 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.555 0.134 25158 739 1 2 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.024 -0.332 25158 740 1 2 . 1 1 61 61 GLU H H 61 8.438 8.438 8.281 0.157 25158 741 1 2 . 1 1 62 62 ILE N N 62 112.102 112.102 116.548 -4.446 25158 742 1 2 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.558 -0.175 25158 743 1 2 . 1 1 62 62 ILE C C 62 175.425 175.425 175.068 0.357 25158 744 1 2 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.194 -0.268 25158 745 1 2 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.041 1.707 25158 746 1 2 . 1 1 62 62 ILE H H 62 6.867 6.867 7.342 -0.475 25158 747 1 2 . 1 1 63 63 ASP N N 63 119.719 119.719 124.490 -4.771 25158 748 1 2 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.880 -0.206 25158 749 1 2 . 1 1 63 63 ASP C C 63 176.202 176.202 176.121 0.081 25158 750 1 2 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.616 0.202 25158 751 1 2 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.395 -0.178 25158 752 1 2 . 1 1 63 63 ASP H H 63 8.561 8.561 8.816 -0.255 25158 753 1 2 . 1 1 64 64 THR N N 64 113.289 113.289 118.603 -5.314 25158 754 1 2 . 1 1 64 64 THR HA H 64 4.712 4.712 4.413 0.299 25158 755 1 2 . 1 1 64 64 THR C C 64 170.854 170.854 173.746 -2.892 25158 756 1 2 . 1 1 64 64 THR CA C 64 61.269 61.269 63.181 -1.912 25158 757 1 2 . 1 1 64 64 THR CB C 64 71.993 71.993 69.325 2.668 25158 758 1 2 . 1 1 64 64 THR H H 64 7.410 7.410 8.054 -0.644 25158 759 1 2 . 1 1 65 65 LEU N N 65 121.012 121.012 126.798 -5.786 25158 760 1 2 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.713 -0.484 25158 761 1 2 . 1 1 65 65 LEU C C 65 174.763 174.763 174.831 -0.068 25158 762 1 2 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.052 -0.417 25158 763 1 2 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.963 0.557 25158 764 1 2 . 1 1 65 65 LEU H H 65 7.877 7.877 8.350 -0.473 25158 765 1 2 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.338 -0.346 25158 766 1 2 . 1 1 66 66 PRO C C 66 174.419 174.419 175.268 -0.849 25158 767 1 2 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.214 0.096 25158 768 1 2 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.193 3.033 25158 769 1 2 . 1 1 67 67 TYR N N 67 122.616 122.616 121.675 0.941 25158 770 1 2 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.291 0.365 25158 771 1 2 . 1 1 67 67 TYR C C 67 174.446 174.446 175.259 -0.813 25158 772 1 2 . 1 1 67 67 TYR CA C 67 58.011 58.011 59.321 -1.310 25158 773 1 2 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.374 1.707 25158 774 1 2 . 1 1 67 67 TYR H H 67 8.662 8.662 8.197 0.465 25158 775 1 2 . 1 1 68 68 LYS N N 68 126.223 126.223 127.143 -0.920 25158 776 1 2 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.305 -0.037 25158 777 1 2 . 1 1 68 68 LYS C C 68 174.748 174.748 174.790 -0.042 25158 778 1 2 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.001 0.602 25158 779 1 2 . 1 1 68 68 LYS CB C 68 32.770 32.770 32.770 0.000 25158 780 1 2 . 1 1 68 68 LYS H H 68 8.112 8.112 8.107 0.005 25158 781 1 3 . 1 1 2 2 THR N N 2 116.700 116.700 115.802 0.898 25158 782 1 3 . 1 1 2 2 THR HA H 2 4.313 4.313 4.338 -0.025 25158 783 1 3 . 1 1 2 2 THR C C 2 173.968 173.968 174.162 -0.194 25158 784 1 3 . 1 1 2 2 THR CA C 2 62.326 62.326 61.309 1.018 25158 785 1 3 . 1 1 2 2 THR CB C 2 70.154 70.154 69.819 0.335 25158 786 1 3 . 1 1 2 2 THR H H 2 8.657 8.657 8.033 0.624 25158 787 1 3 . 1 1 3 3 LYS N N 3 125.500 125.500 124.225 1.275 25158 788 1 3 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.321 -0.256 25158 789 1 3 . 1 1 3 3 LYS C C 3 174.926 174.926 175.486 -0.560 25158 790 1 3 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.828 0.012 25158 791 1 3 . 1 1 3 3 LYS CB C 3 32.777 32.777 32.188 0.589 25158 792 1 3 . 1 1 3 3 LYS H H 3 8.318 8.318 8.317 0.001 25158 793 1 3 . 1 1 4 4 LEU N N 4 127.473 127.473 126.660 0.813 25158 794 1 3 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.433 0.050 25158 795 1 3 . 1 1 4 4 LEU C C 4 174.734 174.734 175.213 -0.479 25158 796 1 3 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.614 -0.355 25158 797 1 3 . 1 1 4 4 LEU CB C 4 40.929 40.929 45.032 -4.103 25158 798 1 3 . 1 1 4 4 LEU H H 4 7.726 7.726 8.111 -0.385 25158 799 1 3 . 1 1 5 5 TYR N N 5 123.074 123.074 125.269 -2.195 25158 800 1 3 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.165 -0.542 25158 801 1 3 . 1 1 5 5 TYR C C 5 175.406 175.406 177.147 -1.741 25158 802 1 3 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.554 3.258 25158 803 1 3 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.929 2.181 25158 804 1 3 . 1 1 5 5 TYR H H 5 7.816 7.816 8.542 -0.726 25158 805 1 3 . 1 1 6 6 GLY N N 6 108.614 108.614 114.041 -5.427 25158 806 1 3 . 1 1 6 6 GLY C C 6 172.585 172.585 172.584 0.001 25158 807 1 3 . 1 1 6 6 GLY CA C 6 45.387 45.387 45.020 0.367 25158 808 1 3 . 1 1 6 6 GLY H H 6 8.915 8.915 8.358 0.557 25158 809 1 3 . 1 1 7 7 ASP N N 7 118.023 118.023 118.856 -0.833 25158 810 1 3 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.999 -0.015 25158 811 1 3 . 1 1 7 7 ASP C C 7 177.806 177.806 176.323 1.483 25158 812 1 3 . 1 1 7 7 ASP CA C 7 52.192 52.192 52.226 -0.034 25158 813 1 3 . 1 1 7 7 ASP CB C 7 39.150 39.150 41.515 -2.365 25158 814 1 3 . 1 1 7 7 ASP H H 7 7.976 7.976 7.649 0.327 25158 815 1 3 . 1 1 8 8 VAL N N 8 120.293 120.293 119.026 1.267 25158 816 1 3 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.011 -0.028 25158 817 1 3 . 1 1 8 8 VAL C C 8 175.717 175.717 176.902 -1.185 25158 818 1 3 . 1 1 8 8 VAL CA C 8 63.446 63.446 64.109 -0.663 25158 819 1 3 . 1 1 8 8 VAL CB C 8 31.271 31.271 32.132 -0.861 25158 820 1 3 . 1 1 8 8 VAL H H 8 8.156 8.156 7.970 0.186 25158 821 1 3 . 1 1 9 9 ASN N N 9 115.226 115.226 115.757 -0.531 25158 822 1 3 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.548 0.441 25158 823 1 3 . 1 1 9 9 ASN C C 9 174.626 174.626 175.370 -0.744 25158 824 1 3 . 1 1 9 9 ASN CA C 9 50.950 50.950 53.062 -2.112 25158 825 1 3 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.269 -0.568 25158 826 1 3 . 1 1 9 9 ASN H H 9 8.008 8.008 7.887 0.121 25158 827 1 3 . 1 1 10 10 ASP N N 10 115.600 115.600 118.909 -3.309 25158 828 1 3 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.580 -0.144 25158 829 1 3 . 1 1 10 10 ASP C C 10 175.125 175.125 175.583 -0.458 25158 830 1 3 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.078 1.157 25158 831 1 3 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.490 0.710 25158 832 1 3 . 1 1 10 10 ASP H H 10 7.374 7.374 8.030 -0.656 25158 833 1 3 . 1 1 11 11 ASP N N 11 118.402 118.402 118.168 0.234 25158 834 1 3 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.690 0.127 25158 835 1 3 . 1 1 11 11 ASP C C 11 178.299 178.299 177.378 0.921 25158 836 1 3 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.963 -1.142 25158 837 1 3 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.850 -0.736 25158 838 1 3 . 1 1 11 11 ASP H H 11 8.801 8.801 8.984 -0.183 25158 839 1 3 . 1 1 12 12 GLY N N 12 112.353 112.353 108.500 3.853 25158 840 1 3 . 1 1 12 12 GLY C C 12 173.284 173.284 173.639 -0.355 25158 841 1 3 . 1 1 12 12 GLY CA C 12 45.624 45.624 44.945 0.679 25158 842 1 3 . 1 1 12 12 GLY H H 12 10.293 10.293 8.414 1.879 25158 843 1 3 . 1 1 13 13 LYS N N 13 118.118 118.118 119.304 -1.186 25158 844 1 3 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.481 0.178 25158 845 1 3 . 1 1 13 13 LYS C C 13 175.595 175.595 174.539 1.056 25158 846 1 3 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.363 -1.605 25158 847 1 3 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.537 0.802 25158 848 1 3 . 1 1 13 13 LYS H H 13 7.848 7.848 8.103 -0.255 25158 849 1 3 . 1 1 14 14 VAL N N 14 126.591 126.591 124.604 1.987 25158 850 1 3 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.605 0.150 25158 851 1 3 . 1 1 14 14 VAL C C 14 175.052 175.052 175.379 -0.327 25158 852 1 3 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.250 -0.180 25158 853 1 3 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.268 0.187 25158 854 1 3 . 1 1 14 14 VAL H H 14 9.109 9.109 8.639 0.470 25158 855 1 3 . 1 1 15 15 ASN N N 15 126.287 126.287 126.001 0.286 25158 856 1 3 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.966 -0.151 25158 857 1 3 . 1 1 15 15 ASN C C 15 176.340 176.340 176.396 -0.056 25158 858 1 3 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.360 0.915 25158 859 1 3 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.713 -2.493 25158 860 1 3 . 1 1 15 15 ASN H H 15 10.071 10.071 9.524 0.547 25158 861 1 3 . 1 1 16 16 SER N N 16 113.168 113.168 116.432 -3.264 25158 862 1 3 . 1 1 16 16 SER HA H 16 4.047 4.047 4.235 -0.188 25158 863 1 3 . 1 1 16 16 SER C C 16 176.197 176.197 176.030 0.167 25158 864 1 3 . 1 1 16 16 SER CA C 16 62.681 62.681 61.649 1.032 25158 865 1 3 . 1 1 16 16 SER CB C 16 62.681 62.681 63.081 -0.400 25158 866 1 3 . 1 1 16 16 SER H H 16 8.825 8.825 8.895 -0.070 25158 867 1 3 . 1 1 17 17 THR N N 17 119.391 119.391 116.906 2.485 25158 868 1 3 . 1 1 17 17 THR HA H 17 3.983 3.983 4.095 -0.112 25158 869 1 3 . 1 1 17 17 THR C C 17 177.149 177.149 176.172 0.977 25158 870 1 3 . 1 1 17 17 THR CA C 17 66.791 66.791 66.334 0.457 25158 871 1 3 . 1 1 17 17 THR CB C 17 67.757 67.757 68.425 -0.668 25158 872 1 3 . 1 1 17 17 THR H H 17 7.946 7.946 8.265 -0.319 25158 873 1 3 . 1 1 18 18 ASP N N 18 120.318 120.318 121.197 -0.879 25158 874 1 3 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.494 -0.124 25158 875 1 3 . 1 1 18 18 ASP C C 18 177.168 177.168 177.728 -0.560 25158 876 1 3 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.281 1.633 25158 877 1 3 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.333 1.829 25158 878 1 3 . 1 1 18 18 ASP H H 18 7.995 7.995 7.912 0.083 25158 879 1 3 . 1 1 19 19 ALA N N 19 120.191 120.191 123.259 -3.068 25158 880 1 3 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.056 -0.008 25158 881 1 3 . 1 1 19 19 ALA C C 19 179.549 179.549 179.244 0.305 25158 882 1 3 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.269 0.144 25158 883 1 3 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.362 -1.049 25158 884 1 3 . 1 1 19 19 ALA H H 19 7.085 7.085 7.519 -0.434 25158 885 1 3 . 1 1 20 20 VAL N N 20 120.613 120.613 118.319 2.294 25158 886 1 3 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.798 -0.187 25158 887 1 3 . 1 1 20 20 VAL C C 20 178.153 178.153 177.385 0.768 25158 888 1 3 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.084 1.683 25158 889 1 3 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.268 0.600 25158 890 1 3 . 1 1 20 20 VAL H H 20 7.835 7.835 7.502 0.333 25158 891 1 3 . 1 1 21 21 ALA N N 21 121.767 121.767 123.313 -1.546 25158 892 1 3 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.126 -0.064 25158 893 1 3 . 1 1 21 21 ALA C C 21 179.298 179.298 179.610 -0.312 25158 894 1 3 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.217 0.027 25158 895 1 3 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.301 -0.512 25158 896 1 3 . 1 1 21 21 ALA H H 21 7.804 7.804 7.664 0.140 25158 897 1 3 . 1 1 22 22 LEU N N 22 117.555 117.555 119.575 -2.020 25158 898 1 3 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.077 0.069 25158 899 1 3 . 1 1 22 22 LEU C C 22 177.914 177.914 178.443 -0.529 25158 900 1 3 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.628 0.065 25158 901 1 3 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.743 -0.229 25158 902 1 3 . 1 1 22 22 LEU H H 22 8.619 8.619 8.320 0.299 25158 903 1 3 . 1 1 23 23 LYS N N 23 120.335 120.335 119.509 0.826 25158 904 1 3 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.943 -0.024 25158 905 1 3 . 1 1 23 23 LYS C C 23 177.731 177.731 179.118 -1.387 25158 906 1 3 . 1 1 23 23 LYS CA C 23 60.337 60.337 60.157 0.180 25158 907 1 3 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.207 -0.109 25158 908 1 3 . 1 1 23 23 LYS H H 23 8.230 8.230 7.820 0.410 25158 909 1 3 . 1 1 24 24 ARG N N 24 116.831 116.831 118.598 -1.767 25158 910 1 3 . 1 1 24 24 ARG HA H 24 3.959 3.959 3.994 -0.035 25158 911 1 3 . 1 1 24 24 ARG C C 24 178.616 178.616 178.581 0.035 25158 912 1 3 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.406 0.551 25158 913 1 3 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.177 -0.614 25158 914 1 3 . 1 1 24 24 ARG H H 24 7.927 7.927 7.689 0.238 25158 915 1 3 . 1 1 25 25 TYR N N 25 120.960 120.960 121.319 -0.359 25158 916 1 3 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.246 -0.036 25158 917 1 3 . 1 1 25 25 TYR C C 25 179.465 179.465 178.305 1.160 25158 918 1 3 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.221 0.624 25158 919 1 3 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.327 0.738 25158 920 1 3 . 1 1 25 25 TYR H H 25 8.321 8.321 7.642 0.679 25158 921 1 3 . 1 1 26 26 VAL N N 26 120.405 120.405 117.841 2.564 25158 922 1 3 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.694 0.080 25158 923 1 3 . 1 1 26 26 VAL C C 26 177.826 177.826 177.010 0.816 25158 924 1 3 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.422 0.018 25158 925 1 3 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.488 0.069 25158 926 1 3 . 1 1 26 26 VAL H H 26 8.803 8.803 7.922 0.881 25158 927 1 3 . 1 1 27 27 LEU N N 27 119.247 119.247 117.906 1.341 25158 928 1 3 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.373 -0.097 25158 929 1 3 . 1 1 27 27 LEU C C 27 176.753 176.753 175.962 0.791 25158 930 1 3 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.043 1.632 25158 931 1 3 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.817 -0.224 25158 932 1 3 . 1 1 27 27 LEU H H 27 7.898 7.898 7.364 0.534 25158 933 1 3 . 1 1 28 28 ARG N N 28 116.082 116.082 117.306 -1.224 25158 934 1 3 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.829 0.285 25158 935 1 3 . 1 1 28 28 ARG C C 28 176.521 176.521 176.257 0.264 25158 936 1 3 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.046 -0.892 25158 937 1 3 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.059 0.412 25158 938 1 3 . 1 1 28 28 ARG H H 28 7.993 7.993 7.747 0.246 25158 939 1 3 . 1 1 29 29 SER N N 29 113.579 113.579 116.035 -2.456 25158 940 1 3 . 1 1 29 29 SER HA H 29 4.305 4.305 4.369 -0.064 25158 941 1 3 . 1 1 29 29 SER C C 29 175.368 175.368 175.736 -0.368 25158 942 1 3 . 1 1 29 29 SER CA C 29 59.699 59.699 60.041 -0.342 25158 943 1 3 . 1 1 29 29 SER CB C 29 63.908 63.908 64.001 -0.094 25158 944 1 3 . 1 1 29 29 SER H H 29 8.094 8.094 8.299 -0.205 25158 945 1 3 . 1 1 30 30 GLY N N 30 109.920 109.920 110.013 -0.093 25158 946 1 3 . 1 1 30 30 GLY C C 30 174.115 174.115 173.692 0.423 25158 947 1 3 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.610 1.161 25158 948 1 3 . 1 1 30 30 GLY H H 30 8.577 8.577 8.420 0.157 25158 949 1 3 . 1 1 31 31 ILE N N 31 119.084 119.084 119.794 -0.710 25158 950 1 3 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.377 -0.019 25158 951 1 3 . 1 1 31 31 ILE C C 31 174.392 174.392 174.768 -0.376 25158 952 1 3 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.302 -0.056 25158 953 1 3 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.599 -0.020 25158 954 1 3 . 1 1 31 31 ILE H H 31 7.387 7.387 7.903 -0.516 25158 955 1 3 . 1 1 32 32 SER N N 32 120.582 120.582 124.045 -3.463 25158 956 1 3 . 1 1 32 32 SER HA H 32 4.845 4.845 4.591 0.254 25158 957 1 3 . 1 1 32 32 SER C C 32 173.891 173.891 173.651 0.240 25158 958 1 3 . 1 1 32 32 SER CA C 32 57.603 57.603 59.034 -1.431 25158 959 1 3 . 1 1 32 32 SER CB C 32 63.849 63.849 63.855 -0.006 25158 960 1 3 . 1 1 32 32 SER H H 32 8.339 8.339 8.630 -0.291 25158 961 1 3 . 1 1 33 33 ILE N N 33 116.629 116.629 117.463 -0.834 25158 962 1 3 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.407 0.226 25158 963 1 3 . 1 1 33 33 ILE C C 33 174.195 174.195 173.860 0.335 25158 964 1 3 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.257 -0.145 25158 965 1 3 . 1 1 33 33 ILE CB C 33 42.582 42.582 41.187 1.395 25158 966 1 3 . 1 1 33 33 ILE H H 33 7.873 7.873 7.597 0.276 25158 967 1 3 . 1 1 34 34 ASN N N 34 118.342 118.342 120.137 -1.795 25158 968 1 3 . 1 1 34 34 ASN HA H 34 4.736 4.736 5.018 -0.282 25158 969 1 3 . 1 1 34 34 ASN C C 34 176.217 176.217 176.152 0.065 25158 970 1 3 . 1 1 34 34 ASN CA C 34 52.186 52.186 51.945 0.241 25158 971 1 3 . 1 1 34 34 ASN CB C 34 36.499 36.499 39.002 -2.503 25158 972 1 3 . 1 1 34 34 ASN H H 34 8.839 8.839 8.224 0.615 25158 973 1 3 . 1 1 35 35 THR N N 35 116.120 116.120 117.668 -1.548 25158 974 1 3 . 1 1 35 35 THR HA H 35 3.559 3.559 4.093 -0.534 25158 975 1 3 . 1 1 35 35 THR C C 35 177.347 177.347 176.348 0.999 25158 976 1 3 . 1 1 35 35 THR CA C 35 64.686 64.686 65.668 -0.982 25158 977 1 3 . 1 1 35 35 THR CB C 35 67.758 67.758 68.969 -1.210 25158 978 1 3 . 1 1 35 35 THR H H 35 7.939 7.939 8.480 -0.541 25158 979 1 3 . 1 1 36 36 ASP N N 36 123.528 123.528 121.650 1.878 25158 980 1 3 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.340 0.080 25158 981 1 3 . 1 1 36 36 ASP C C 36 177.752 177.752 177.781 -0.029 25158 982 1 3 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.689 -0.615 25158 983 1 3 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.711 -0.813 25158 984 1 3 . 1 1 36 36 ASP H H 36 7.980 7.980 8.415 -0.435 25158 985 1 3 . 1 1 37 37 ASN N N 37 115.690 115.690 116.659 -0.969 25158 986 1 3 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.521 -0.255 25158 987 1 3 . 1 1 37 37 ASN C C 37 175.589 175.589 177.080 -1.491 25158 988 1 3 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.891 -2.331 25158 989 1 3 . 1 1 37 37 ASN CB C 37 37.963 37.963 37.859 0.104 25158 990 1 3 . 1 1 37 37 ASN H H 37 7.251 7.251 8.329 -1.078 25158 991 1 3 . 1 1 38 38 ALA N N 38 119.560 119.560 122.731 -3.171 25158 992 1 3 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.062 0.018 25158 993 1 3 . 1 1 38 38 ALA C C 38 173.638 173.638 177.324 -3.686 25158 994 1 3 . 1 1 38 38 ALA CA C 38 52.220 52.220 53.977 -1.757 25158 995 1 3 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.783 4.088 25158 996 1 3 . 1 1 38 38 ALA H H 38 7.142 7.142 8.158 -1.016 25158 997 1 3 . 1 1 39 39 ASP N N 39 115.003 115.003 119.794 -4.791 25158 998 1 3 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.724 0.216 25158 999 1 3 . 1 1 39 39 ASP C C 39 177.163 177.163 176.837 0.326 25158 1000 1 3 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.491 -2.320 25158 1001 1 3 . 1 1 39 39 ASP CB C 39 38.946 38.946 40.100 -1.155 25158 1002 1 3 . 1 1 39 39 ASP H H 39 7.096 7.096 7.883 -0.787 25158 1003 1 3 . 1 1 40 40 LEU N N 40 123.245 123.245 124.259 -1.014 25158 1004 1 3 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.242 -0.171 25158 1005 1 3 . 1 1 40 40 LEU C C 40 175.865 175.865 177.830 -1.965 25158 1006 1 3 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.221 0.371 25158 1007 1 3 . 1 1 40 40 LEU CB C 40 41.929 41.929 41.951 -0.022 25158 1008 1 3 . 1 1 40 40 LEU H H 40 8.572 8.572 7.875 0.697 25158 1009 1 3 . 1 1 41 41 ASN N N 41 112.723 112.723 114.253 -1.530 25158 1010 1 3 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.945 0.054 25158 1011 1 3 . 1 1 41 41 ASN C C 41 173.846 173.846 175.346 -1.500 25158 1012 1 3 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.018 -0.785 25158 1013 1 3 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.325 -1.930 25158 1014 1 3 . 1 1 41 41 ASN H H 41 8.004 8.004 7.911 0.093 25158 1015 1 3 . 1 1 42 42 GLU N N 42 115.798 115.798 115.046 0.752 25158 1016 1 3 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.304 -0.352 25158 1017 1 3 . 1 1 42 42 GLU C C 42 175.172 175.172 175.827 -0.655 25158 1018 1 3 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.557 -0.206 25158 1019 1 3 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.281 0.940 25158 1020 1 3 . 1 1 42 42 GLU H H 42 7.642 7.642 8.481 -0.839 25158 1021 1 3 . 1 1 43 43 ASP N N 43 117.453 117.453 116.754 0.699 25158 1022 1 3 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.519 0.320 25158 1023 1 3 . 1 1 43 43 ASP C C 43 178.129 178.129 177.483 0.646 25158 1024 1 3 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.284 -1.646 25158 1025 1 3 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.244 -0.030 25158 1026 1 3 . 1 1 43 43 ASP H H 43 8.473 8.473 8.504 -0.031 25158 1027 1 3 . 1 1 44 44 GLY N N 44 112.490 112.490 109.372 3.118 25158 1028 1 3 . 1 1 44 44 GLY C C 44 173.717 173.717 173.463 0.254 25158 1029 1 3 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.964 0.353 25158 1030 1 3 . 1 1 44 44 GLY H H 44 10.139 10.139 8.683 1.456 25158 1031 1 3 . 1 1 45 45 ARG N N 45 118.154 118.154 118.168 -0.014 25158 1032 1 3 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.684 0.104 25158 1033 1 3 . 1 1 45 45 ARG C C 45 175.602 175.602 174.602 1.000 25158 1034 1 3 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.123 -0.291 25158 1035 1 3 . 1 1 45 45 ARG CB C 45 33.664 33.664 33.034 0.630 25158 1036 1 3 . 1 1 45 45 ARG H H 45 7.994 7.994 8.384 -0.390 25158 1037 1 3 . 1 1 46 46 VAL N N 46 126.392 126.392 122.619 3.773 25158 1038 1 3 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.544 0.246 25158 1039 1 3 . 1 1 46 46 VAL C C 46 174.644 174.644 175.373 -0.729 25158 1040 1 3 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.426 -0.697 25158 1041 1 3 . 1 1 46 46 VAL CB C 46 31.666 31.666 31.097 0.569 25158 1042 1 3 . 1 1 46 46 VAL H H 46 9.115 9.115 8.595 0.520 25158 1043 1 3 . 1 1 47 47 ASN N N 47 126.737 126.737 126.685 0.052 25158 1044 1 3 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.950 -0.075 25158 1045 1 3 . 1 1 47 47 ASN C C 47 176.467 176.467 175.806 0.661 25158 1046 1 3 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.598 0.442 25158 1047 1 3 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.442 -0.255 25158 1048 1 3 . 1 1 47 47 ASN H H 47 10.077 10.077 8.928 1.149 25158 1049 1 3 . 1 1 48 48 SER N N 48 113.409 113.409 114.053 -0.644 25158 1050 1 3 . 1 1 48 48 SER HA H 48 4.086 4.086 4.203 -0.117 25158 1051 1 3 . 1 1 48 48 SER C C 48 176.671 176.671 176.039 0.632 25158 1052 1 3 . 1 1 48 48 SER CA C 48 62.375 62.375 61.592 0.783 25158 1053 1 3 . 1 1 48 48 SER CB C 48 62.375 62.375 62.725 -0.350 25158 1054 1 3 . 1 1 48 48 SER H H 48 8.936 8.936 8.774 0.162 25158 1055 1 3 . 1 1 49 49 THR N N 49 121.885 121.885 117.551 4.334 25158 1056 1 3 . 1 1 49 49 THR HA H 49 4.112 4.112 3.973 0.139 25158 1057 1 3 . 1 1 49 49 THR C C 49 177.320 177.320 176.365 0.955 25158 1058 1 3 . 1 1 49 49 THR CA C 49 66.713 66.713 66.487 0.226 25158 1059 1 3 . 1 1 49 49 THR CB C 49 67.787 67.787 68.179 -0.392 25158 1060 1 3 . 1 1 49 49 THR H H 49 8.124 8.124 7.757 0.367 25158 1061 1 3 . 1 1 50 50 ASP N N 50 120.401 120.401 122.458 -2.057 25158 1062 1 3 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.369 0.001 25158 1063 1 3 . 1 1 50 50 ASP C C 50 177.033 177.033 178.435 -1.402 25158 1064 1 3 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.615 1.205 25158 1065 1 3 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.287 1.421 25158 1066 1 3 . 1 1 50 50 ASP H H 50 7.560 7.560 7.763 -0.203 25158 1067 1 3 . 1 1 51 51 LEU N N 51 118.174 118.174 119.989 -1.815 25158 1068 1 3 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.049 0.139 25158 1069 1 3 . 1 1 51 51 LEU C C 51 177.441 177.441 178.701 -1.260 25158 1070 1 3 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.948 0.189 25158 1071 1 3 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.824 0.023 25158 1072 1 3 . 1 1 51 51 LEU H H 51 7.134 7.134 7.614 -0.480 25158 1073 1 3 . 1 1 52 52 GLY N N 52 105.596 105.596 106.855 -1.259 25158 1074 1 3 . 1 1 52 52 GLY C C 52 176.764 176.764 175.844 0.920 25158 1075 1 3 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.754 0.888 25158 1076 1 3 . 1 1 52 52 GLY H H 52 8.034 8.034 7.412 0.622 25158 1077 1 3 . 1 1 53 53 ILE N N 53 122.043 122.043 123.310 -1.267 25158 1078 1 3 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.490 -0.041 25158 1079 1 3 . 1 1 53 53 ILE C C 53 177.112 177.112 177.476 -0.364 25158 1080 1 3 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.957 0.431 25158 1081 1 3 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.790 0.468 25158 1082 1 3 . 1 1 53 53 ILE H H 53 7.611 7.611 8.052 -0.441 25158 1083 1 3 . 1 1 54 54 LEU N N 54 120.787 120.787 120.609 0.178 25158 1084 1 3 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.958 -0.017 25158 1085 1 3 . 1 1 54 54 LEU C C 54 175.340 175.340 178.367 -3.027 25158 1086 1 3 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.728 -0.533 25158 1087 1 3 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.640 -0.419 25158 1088 1 3 . 1 1 54 54 LEU H H 54 8.323 8.323 8.398 -0.075 25158 1089 1 3 . 1 1 55 55 LYS N N 55 116.833 116.833 118.734 -1.901 25158 1090 1 3 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.946 -0.062 25158 1091 1 3 . 1 1 55 55 LYS C C 55 179.067 179.067 179.275 -0.208 25158 1092 1 3 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.978 0.673 25158 1093 1 3 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.220 -0.211 25158 1094 1 3 . 1 1 55 55 LYS H H 55 8.356 8.356 7.522 0.834 25158 1095 1 3 . 1 1 56 56 ARG N N 56 117.092 117.092 119.525 -2.433 25158 1096 1 3 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.990 -0.074 25158 1097 1 3 . 1 1 56 56 ARG C C 56 178.223 178.223 178.473 -0.250 25158 1098 1 3 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.622 0.729 25158 1099 1 3 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.275 0.505 25158 1100 1 3 . 1 1 56 56 ARG H H 56 7.543 7.543 8.198 -0.655 25158 1101 1 3 . 1 1 57 57 TYR N N 57 122.187 122.187 121.605 0.582 25158 1102 1 3 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.589 -0.197 25158 1103 1 3 . 1 1 57 57 TYR C C 57 180.009 180.009 178.713 1.296 25158 1104 1 3 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.161 0.418 25158 1105 1 3 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.661 0.175 25158 1106 1 3 . 1 1 57 57 TYR H H 57 8.592 8.592 8.364 0.228 25158 1107 1 3 . 1 1 58 58 ILE N N 58 122.825 122.825 117.056 5.769 25158 1108 1 3 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.836 -0.156 25158 1109 1 3 . 1 1 58 58 ILE C C 58 178.186 178.186 176.412 1.774 25158 1110 1 3 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.768 1.000 25158 1111 1 3 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.147 -0.427 25158 1112 1 3 . 1 1 58 58 ILE H H 58 8.779 8.779 7.922 0.857 25158 1113 1 3 . 1 1 59 59 LEU N N 59 118.552 118.552 117.965 0.587 25158 1114 1 3 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.322 -0.099 25158 1115 1 3 . 1 1 59 59 LEU C C 59 175.937 175.937 176.151 -0.214 25158 1116 1 3 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.203 1.309 25158 1117 1 3 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.594 0.832 25158 1118 1 3 . 1 1 59 59 LEU H H 59 7.539 7.539 7.554 -0.015 25158 1119 1 3 . 1 1 60 60 LYS N N 60 113.650 113.650 115.998 -2.348 25158 1120 1 3 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.846 0.149 25158 1121 1 3 . 1 1 60 60 LYS C C 60 176.535 176.535 175.956 0.579 25158 1122 1 3 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.528 -0.237 25158 1123 1 3 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.114 -0.843 25158 1124 1 3 . 1 1 60 60 LYS H H 60 7.815 7.815 7.448 0.367 25158 1125 1 3 . 1 1 61 61 GLU N N 61 117.535 117.535 116.215 1.320 25158 1126 1 3 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.367 -0.223 25158 1127 1 3 . 1 1 61 61 GLU C C 61 176.992 176.992 176.442 0.550 25158 1128 1 3 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.627 0.062 25158 1129 1 3 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.363 -0.672 25158 1130 1 3 . 1 1 61 61 GLU H H 61 8.438 8.438 8.208 0.230 25158 1131 1 3 . 1 1 62 62 ILE N N 62 112.102 112.102 116.277 -4.175 25158 1132 1 3 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.551 -0.168 25158 1133 1 3 . 1 1 62 62 ILE C C 62 175.425 175.425 174.908 0.517 25158 1134 1 3 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.121 -0.195 25158 1135 1 3 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.419 1.329 25158 1136 1 3 . 1 1 62 62 ILE H H 62 6.867 6.867 7.362 -0.495 25158 1137 1 3 . 1 1 63 63 ASP N N 63 119.719 119.719 123.209 -3.490 25158 1138 1 3 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.831 -0.157 25158 1139 1 3 . 1 1 63 63 ASP C C 63 176.202 176.202 176.418 -0.216 25158 1140 1 3 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.966 -0.148 25158 1141 1 3 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.018 0.199 25158 1142 1 3 . 1 1 63 63 ASP H H 63 8.561 8.561 8.765 -0.204 25158 1143 1 3 . 1 1 64 64 THR N N 64 113.289 113.289 116.203 -2.914 25158 1144 1 3 . 1 1 64 64 THR HA H 64 4.712 4.712 4.362 0.350 25158 1145 1 3 . 1 1 64 64 THR C C 64 170.854 170.854 173.552 -2.698 25158 1146 1 3 . 1 1 64 64 THR CA C 64 61.269 61.269 62.942 -1.673 25158 1147 1 3 . 1 1 64 64 THR CB C 64 71.993 71.993 68.409 3.584 25158 1148 1 3 . 1 1 64 64 THR H H 64 7.410 7.410 7.927 -0.517 25158 1149 1 3 . 1 1 65 65 LEU N N 65 121.012 121.012 127.833 -6.821 25158 1150 1 3 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.727 -0.498 25158 1151 1 3 . 1 1 65 65 LEU C C 65 174.763 174.763 175.022 -0.259 25158 1152 1 3 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.979 -0.344 25158 1153 1 3 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.956 0.564 25158 1154 1 3 . 1 1 65 65 LEU H H 65 7.877 7.877 8.333 -0.456 25158 1155 1 3 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.035 -0.043 25158 1156 1 3 . 1 1 66 66 PRO C C 66 174.419 174.419 175.038 -0.619 25158 1157 1 3 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.150 0.160 25158 1158 1 3 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.506 2.720 25158 1159 1 3 . 1 1 67 67 TYR N N 67 122.616 122.616 121.446 1.170 25158 1160 1 3 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.336 0.320 25158 1161 1 3 . 1 1 67 67 TYR C C 67 174.446 174.446 174.660 -0.214 25158 1162 1 3 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.467 -0.456 25158 1163 1 3 . 1 1 67 67 TYR CB C 67 41.081 41.081 38.670 2.411 25158 1164 1 3 . 1 1 67 67 TYR H H 67 8.662 8.662 8.105 0.557 25158 1165 1 3 . 1 1 68 68 LYS N N 68 126.223 126.223 130.184 -3.961 25158 1166 1 3 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.326 -0.058 25158 1167 1 3 . 1 1 68 68 LYS C C 68 174.748 174.748 175.131 -0.383 25158 1168 1 3 . 1 1 68 68 LYS CA C 68 55.603 55.603 54.448 1.155 25158 1169 1 3 . 1 1 68 68 LYS CB C 68 32.770 32.770 33.034 -0.264 25158 1170 1 3 . 1 1 68 68 LYS H H 68 8.112 8.112 8.175 -0.063 25158 1171 1 4 . 1 1 2 2 THR N N 2 116.700 116.700 116.666 0.034 25158 1172 1 4 . 1 1 2 2 THR HA H 2 4.313 4.313 4.503 -0.190 25158 1173 1 4 . 1 1 2 2 THR C C 2 173.968 173.968 174.171 -0.203 25158 1174 1 4 . 1 1 2 2 THR CA C 2 62.326 62.326 61.561 0.765 25158 1175 1 4 . 1 1 2 2 THR CB C 2 70.154 70.154 70.030 0.124 25158 1176 1 4 . 1 1 2 2 THR H H 2 8.657 8.657 8.393 0.265 25158 1177 1 4 . 1 1 3 3 LYS N N 3 125.500 125.500 126.837 -1.337 25158 1178 1 4 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.259 -0.194 25158 1179 1 4 . 1 1 3 3 LYS C C 3 174.926 174.926 175.446 -0.520 25158 1180 1 4 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.635 0.204 25158 1181 1 4 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.813 0.964 25158 1182 1 4 . 1 1 3 3 LYS H H 3 8.318 8.318 8.499 -0.181 25158 1183 1 4 . 1 1 4 4 LEU N N 4 127.473 127.473 125.955 1.518 25158 1184 1 4 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.367 0.116 25158 1185 1 4 . 1 1 4 4 LEU C C 4 174.734 174.734 175.498 -0.764 25158 1186 1 4 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.376 -0.117 25158 1187 1 4 . 1 1 4 4 LEU CB C 4 40.929 40.929 44.676 -3.747 25158 1188 1 4 . 1 1 4 4 LEU H H 4 7.726 7.726 7.988 -0.262 25158 1189 1 4 . 1 1 5 5 TYR N N 5 123.074 123.074 124.962 -1.888 25158 1190 1 4 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.355 -0.732 25158 1191 1 4 . 1 1 5 5 TYR C C 5 175.406 175.406 176.713 -1.307 25158 1192 1 4 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.995 2.817 25158 1193 1 4 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.256 2.854 25158 1194 1 4 . 1 1 5 5 TYR H H 5 7.816 7.816 8.613 -0.797 25158 1195 1 4 . 1 1 6 6 GLY N N 6 108.614 108.614 113.896 -5.282 25158 1196 1 4 . 1 1 6 6 GLY C C 6 172.585 172.585 173.722 -1.137 25158 1197 1 4 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.659 0.728 25158 1198 1 4 . 1 1 6 6 GLY H H 6 8.915 8.915 8.281 0.634 25158 1199 1 4 . 1 1 7 7 ASP N N 7 118.023 118.023 123.746 -5.723 25158 1200 1 4 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.736 0.248 25158 1201 1 4 . 1 1 7 7 ASP C C 7 177.806 177.806 177.210 0.596 25158 1202 1 4 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.163 -0.971 25158 1203 1 4 . 1 1 7 7 ASP CB C 7 39.150 39.150 40.054 -0.904 25158 1204 1 4 . 1 1 7 7 ASP H H 7 7.976 7.976 8.144 -0.168 25158 1205 1 4 . 1 1 8 8 VAL N N 8 120.293 120.293 120.124 0.169 25158 1206 1 4 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.174 -0.191 25158 1207 1 4 . 1 1 8 8 VAL C C 8 175.717 175.717 176.600 -0.883 25158 1208 1 4 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.263 0.183 25158 1209 1 4 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.768 -0.497 25158 1210 1 4 . 1 1 8 8 VAL H H 8 8.156 8.156 7.842 0.314 25158 1211 1 4 . 1 1 9 9 ASN N N 9 115.226 115.226 116.026 -0.800 25158 1212 1 4 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.619 0.370 25158 1213 1 4 . 1 1 9 9 ASN C C 9 174.626 174.626 174.998 -0.372 25158 1214 1 4 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.896 -1.946 25158 1215 1 4 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.618 -0.917 25158 1216 1 4 . 1 1 9 9 ASN H H 9 8.008 8.008 7.846 0.162 25158 1217 1 4 . 1 1 10 10 ASP N N 10 115.600 115.600 117.168 -1.568 25158 1218 1 4 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.528 -0.092 25158 1219 1 4 . 1 1 10 10 ASP C C 10 175.125 175.125 175.993 -0.868 25158 1220 1 4 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.416 0.820 25158 1221 1 4 . 1 1 10 10 ASP CB C 10 40.200 40.200 38.489 1.711 25158 1222 1 4 . 1 1 10 10 ASP H H 10 7.374 7.374 8.524 -1.150 25158 1223 1 4 . 1 1 11 11 ASP N N 11 118.402 118.402 117.325 1.077 25158 1224 1 4 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.616 0.201 25158 1225 1 4 . 1 1 11 11 ASP C C 11 178.299 178.299 176.907 1.392 25158 1226 1 4 . 1 1 11 11 ASP CA C 11 52.821 52.821 52.916 -0.095 25158 1227 1 4 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.422 -0.308 25158 1228 1 4 . 1 1 11 11 ASP H H 11 8.801 8.801 9.003 -0.202 25158 1229 1 4 . 1 1 12 12 GLY N N 12 112.353 112.353 107.204 5.149 25158 1230 1 4 . 1 1 12 12 GLY C C 12 173.284 173.284 173.742 -0.458 25158 1231 1 4 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.217 0.407 25158 1232 1 4 . 1 1 12 12 GLY H H 12 10.293 10.293 8.519 1.774 25158 1233 1 4 . 1 1 13 13 LYS N N 13 118.118 118.118 117.771 0.347 25158 1234 1 4 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.551 0.108 25158 1235 1 4 . 1 1 13 13 LYS C C 13 175.595 175.595 174.602 0.993 25158 1236 1 4 . 1 1 13 13 LYS CA C 13 53.758 53.758 54.587 -0.829 25158 1237 1 4 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.455 0.884 25158 1238 1 4 . 1 1 13 13 LYS H H 13 7.848 7.848 8.868 -1.020 25158 1239 1 4 . 1 1 14 14 VAL N N 14 126.591 126.591 122.059 4.532 25158 1240 1 4 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.691 0.064 25158 1241 1 4 . 1 1 14 14 VAL C C 14 175.052 175.052 174.902 0.150 25158 1242 1 4 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.434 0.635 25158 1243 1 4 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.652 -0.197 25158 1244 1 4 . 1 1 14 14 VAL H H 14 9.109 9.109 8.614 0.495 25158 1245 1 4 . 1 1 15 15 ASN N N 15 126.287 126.287 125.713 0.574 25158 1246 1 4 . 1 1 15 15 ASN HA H 15 4.815 4.815 5.087 -0.272 25158 1247 1 4 . 1 1 15 15 ASN C C 15 176.340 176.340 175.817 0.523 25158 1248 1 4 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.676 0.599 25158 1249 1 4 . 1 1 15 15 ASN CB C 15 39.220 39.220 40.325 -1.105 25158 1250 1 4 . 1 1 15 15 ASN H H 15 10.071 10.071 9.130 0.941 25158 1251 1 4 . 1 1 16 16 SER N N 16 113.168 113.168 114.986 -1.818 25158 1252 1 4 . 1 1 16 16 SER HA H 16 4.047 4.047 4.332 -0.285 25158 1253 1 4 . 1 1 16 16 SER C C 16 176.197 176.197 176.114 0.083 25158 1254 1 4 . 1 1 16 16 SER CA C 16 62.681 62.681 61.350 1.331 25158 1255 1 4 . 1 1 16 16 SER CB C 16 62.681 62.681 63.039 -0.358 25158 1256 1 4 . 1 1 16 16 SER H H 16 8.825 8.825 8.594 0.231 25158 1257 1 4 . 1 1 17 17 THR N N 17 119.391 119.391 117.891 1.500 25158 1258 1 4 . 1 1 17 17 THR HA H 17 3.983 3.983 4.040 -0.057 25158 1259 1 4 . 1 1 17 17 THR C C 17 177.149 177.149 176.450 0.699 25158 1260 1 4 . 1 1 17 17 THR CA C 17 66.791 66.791 66.397 0.394 25158 1261 1 4 . 1 1 17 17 THR CB C 17 67.757 67.757 68.347 -0.589 25158 1262 1 4 . 1 1 17 17 THR H H 17 7.946 7.946 8.282 -0.336 25158 1263 1 4 . 1 1 18 18 ASP N N 18 120.318 120.318 120.655 -0.337 25158 1264 1 4 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.406 -0.036 25158 1265 1 4 . 1 1 18 18 ASP C C 18 177.168 177.168 177.764 -0.596 25158 1266 1 4 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.128 1.786 25158 1267 1 4 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.223 1.939 25158 1268 1 4 . 1 1 18 18 ASP H H 18 7.995 7.995 7.755 0.240 25158 1269 1 4 . 1 1 19 19 ALA N N 19 120.191 120.191 123.419 -3.228 25158 1270 1 4 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.104 -0.056 25158 1271 1 4 . 1 1 19 19 ALA C C 19 179.549 179.549 179.032 0.517 25158 1272 1 4 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.158 0.255 25158 1273 1 4 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.619 -1.306 25158 1274 1 4 . 1 1 19 19 ALA H H 19 7.085 7.085 7.560 -0.475 25158 1275 1 4 . 1 1 20 20 VAL N N 20 120.613 120.613 118.704 1.909 25158 1276 1 4 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.626 -0.015 25158 1277 1 4 . 1 1 20 20 VAL C C 20 178.153 178.153 177.448 0.705 25158 1278 1 4 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.677 1.090 25158 1279 1 4 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.744 0.124 25158 1280 1 4 . 1 1 20 20 VAL H H 20 7.835 7.835 7.618 0.217 25158 1281 1 4 . 1 1 21 21 ALA N N 21 121.767 121.767 121.907 -0.140 25158 1282 1 4 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.126 -0.064 25158 1283 1 4 . 1 1 21 21 ALA C C 21 179.298 179.298 179.373 -0.075 25158 1284 1 4 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.122 0.122 25158 1285 1 4 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.320 -0.530 25158 1286 1 4 . 1 1 21 21 ALA H H 21 7.804 7.804 7.739 0.065 25158 1287 1 4 . 1 1 22 22 LEU N N 22 117.555 117.555 119.696 -2.141 25158 1288 1 4 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.077 0.069 25158 1289 1 4 . 1 1 22 22 LEU C C 22 177.914 177.914 178.397 -0.483 25158 1290 1 4 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.433 0.260 25158 1291 1 4 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.746 -0.231 25158 1292 1 4 . 1 1 22 22 LEU H H 22 8.619 8.619 7.733 0.886 25158 1293 1 4 . 1 1 23 23 LYS N N 23 120.335 120.335 119.066 1.269 25158 1294 1 4 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.934 -0.015 25158 1295 1 4 . 1 1 23 23 LYS C C 23 177.731 177.731 178.945 -1.214 25158 1296 1 4 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.982 0.355 25158 1297 1 4 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.337 -0.239 25158 1298 1 4 . 1 1 23 23 LYS H H 23 8.230 8.230 8.025 0.205 25158 1299 1 4 . 1 1 24 24 ARG N N 24 116.831 116.831 118.833 -2.002 25158 1300 1 4 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.026 -0.067 25158 1301 1 4 . 1 1 24 24 ARG C C 24 178.616 178.616 178.528 0.088 25158 1302 1 4 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.459 0.498 25158 1303 1 4 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.162 -0.599 25158 1304 1 4 . 1 1 24 24 ARG H H 24 7.927 7.927 7.564 0.363 25158 1305 1 4 . 1 1 25 25 TYR N N 25 120.960 120.960 121.752 -0.792 25158 1306 1 4 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.234 -0.024 25158 1307 1 4 . 1 1 25 25 TYR C C 25 179.465 179.465 178.514 0.951 25158 1308 1 4 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.216 0.629 25158 1309 1 4 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.356 0.709 25158 1310 1 4 . 1 1 25 25 TYR H H 25 8.321 8.321 7.660 0.661 25158 1311 1 4 . 1 1 26 26 VAL N N 26 120.405 120.405 117.233 3.172 25158 1312 1 4 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.939 -0.165 25158 1313 1 4 . 1 1 26 26 VAL C C 26 177.826 177.826 176.912 0.914 25158 1314 1 4 . 1 1 26 26 VAL CA C 26 65.440 65.440 64.892 0.548 25158 1315 1 4 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.962 -0.405 25158 1316 1 4 . 1 1 26 26 VAL H H 26 8.803 8.803 7.992 0.811 25158 1317 1 4 . 1 1 27 27 LEU N N 27 119.247 119.247 118.814 0.433 25158 1318 1 4 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.444 -0.168 25158 1319 1 4 . 1 1 27 27 LEU C C 27 176.753 176.753 175.999 0.754 25158 1320 1 4 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.016 1.659 25158 1321 1 4 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.665 -0.072 25158 1322 1 4 . 1 1 27 27 LEU H H 27 7.898 7.898 7.464 0.434 25158 1323 1 4 . 1 1 28 28 ARG N N 28 116.082 116.082 117.181 -1.099 25158 1324 1 4 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.801 0.313 25158 1325 1 4 . 1 1 28 28 ARG C C 28 176.521 176.521 176.006 0.515 25158 1326 1 4 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.181 -1.027 25158 1327 1 4 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.969 -0.498 25158 1328 1 4 . 1 1 28 28 ARG H H 28 7.993 7.993 7.646 0.347 25158 1329 1 4 . 1 1 29 29 SER N N 29 113.579 113.579 114.987 -1.408 25158 1330 1 4 . 1 1 29 29 SER HA H 29 4.305 4.305 4.335 -0.030 25158 1331 1 4 . 1 1 29 29 SER C C 29 175.368 175.368 175.594 -0.226 25158 1332 1 4 . 1 1 29 29 SER CA C 29 59.699 59.699 60.130 -0.430 25158 1333 1 4 . 1 1 29 29 SER CB C 29 63.908 63.908 63.907 0.001 25158 1334 1 4 . 1 1 29 29 SER H H 29 8.094 8.094 8.159 -0.065 25158 1335 1 4 . 1 1 30 30 GLY N N 30 109.920 109.920 109.700 0.220 25158 1336 1 4 . 1 1 30 30 GLY C C 30 174.115 174.115 173.839 0.276 25158 1337 1 4 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.754 1.017 25158 1338 1 4 . 1 1 30 30 GLY H H 30 8.577 8.577 8.292 0.285 25158 1339 1 4 . 1 1 31 31 ILE N N 31 119.084 119.084 120.190 -1.106 25158 1340 1 4 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.320 0.038 25158 1341 1 4 . 1 1 31 31 ILE C C 31 174.392 174.392 175.061 -0.669 25158 1342 1 4 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.274 -0.028 25158 1343 1 4 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.441 0.138 25158 1344 1 4 . 1 1 31 31 ILE H H 31 7.387 7.387 7.562 -0.175 25158 1345 1 4 . 1 1 32 32 SER N N 32 120.582 120.582 124.293 -3.711 25158 1346 1 4 . 1 1 32 32 SER HA H 32 4.845 4.845 4.648 0.197 25158 1347 1 4 . 1 1 32 32 SER C C 32 173.891 173.891 174.280 -0.389 25158 1348 1 4 . 1 1 32 32 SER CA C 32 57.603 57.603 58.669 -1.066 25158 1349 1 4 . 1 1 32 32 SER CB C 32 63.849 63.849 63.238 0.611 25158 1350 1 4 . 1 1 32 32 SER H H 32 8.339 8.339 8.589 -0.250 25158 1351 1 4 . 1 1 33 33 ILE N N 33 116.629 116.629 120.163 -3.534 25158 1352 1 4 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.572 0.061 25158 1353 1 4 . 1 1 33 33 ILE C C 33 174.195 174.195 174.003 0.192 25158 1354 1 4 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.313 -0.201 25158 1355 1 4 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.687 1.895 25158 1356 1 4 . 1 1 33 33 ILE H H 33 7.873 7.873 7.926 -0.053 25158 1357 1 4 . 1 1 34 34 ASN N N 34 118.342 118.342 120.771 -2.429 25158 1358 1 4 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.855 -0.119 25158 1359 1 4 . 1 1 34 34 ASN C C 34 176.217 176.217 176.238 -0.021 25158 1360 1 4 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.883 -0.697 25158 1361 1 4 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.909 -2.410 25158 1362 1 4 . 1 1 34 34 ASN H H 34 8.839 8.839 8.301 0.538 25158 1363 1 4 . 1 1 35 35 THR N N 35 116.120 116.120 118.623 -2.503 25158 1364 1 4 . 1 1 35 35 THR HA H 35 3.559 3.559 3.942 -0.383 25158 1365 1 4 . 1 1 35 35 THR C C 35 177.347 177.347 176.059 1.288 25158 1366 1 4 . 1 1 35 35 THR CA C 35 64.686 64.686 65.807 -1.121 25158 1367 1 4 . 1 1 35 35 THR CB C 35 67.758 67.758 68.697 -0.938 25158 1368 1 4 . 1 1 35 35 THR H H 35 7.939 7.939 8.171 -0.232 25158 1369 1 4 . 1 1 36 36 ASP N N 36 123.528 123.528 122.084 1.444 25158 1370 1 4 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.412 0.008 25158 1371 1 4 . 1 1 36 36 ASP C C 36 177.752 177.752 177.522 0.230 25158 1372 1 4 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.296 -0.222 25158 1373 1 4 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.596 -0.698 25158 1374 1 4 . 1 1 36 36 ASP H H 36 7.980 7.980 8.828 -0.848 25158 1375 1 4 . 1 1 37 37 ASN N N 37 115.690 115.690 116.550 -0.860 25158 1376 1 4 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.534 -0.268 25158 1377 1 4 . 1 1 37 37 ASN C C 37 175.589 175.589 176.983 -1.394 25158 1378 1 4 . 1 1 37 37 ASN CA C 37 52.560 52.560 55.153 -2.593 25158 1379 1 4 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.083 -0.120 25158 1380 1 4 . 1 1 37 37 ASN H H 37 7.251 7.251 8.285 -1.034 25158 1381 1 4 . 1 1 38 38 ALA N N 38 119.560 119.560 122.983 -3.423 25158 1382 1 4 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.026 0.054 25158 1383 1 4 . 1 1 38 38 ALA C C 38 173.638 173.638 177.304 -3.666 25158 1384 1 4 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.034 -1.814 25158 1385 1 4 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.721 4.150 25158 1386 1 4 . 1 1 38 38 ALA H H 38 7.142 7.142 8.305 -1.163 25158 1387 1 4 . 1 1 39 39 ASP N N 39 115.003 115.003 119.123 -4.120 25158 1388 1 4 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.661 0.279 25158 1389 1 4 . 1 1 39 39 ASP C C 39 177.163 177.163 176.586 0.577 25158 1390 1 4 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.664 -2.493 25158 1391 1 4 . 1 1 39 39 ASP CB C 39 38.946 38.946 40.483 -1.538 25158 1392 1 4 . 1 1 39 39 ASP H H 39 7.096 7.096 7.863 -0.767 25158 1393 1 4 . 1 1 40 40 LEU N N 40 123.245 123.245 124.653 -1.408 25158 1394 1 4 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.238 -0.167 25158 1395 1 4 . 1 1 40 40 LEU C C 40 175.865 175.865 177.964 -2.099 25158 1396 1 4 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.057 0.535 25158 1397 1 4 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.162 -0.233 25158 1398 1 4 . 1 1 40 40 LEU H H 40 8.572 8.572 8.067 0.505 25158 1399 1 4 . 1 1 41 41 ASN N N 41 112.723 112.723 114.231 -1.508 25158 1400 1 4 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.933 0.066 25158 1401 1 4 . 1 1 41 41 ASN C C 41 173.846 173.846 175.447 -1.601 25158 1402 1 4 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.716 -1.483 25158 1403 1 4 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.066 -1.671 25158 1404 1 4 . 1 1 41 41 ASN H H 41 8.004 8.004 8.194 -0.190 25158 1405 1 4 . 1 1 42 42 GLU N N 42 115.798 115.798 116.776 -0.978 25158 1406 1 4 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.262 -0.310 25158 1407 1 4 . 1 1 42 42 GLU C C 42 175.172 175.172 175.921 -0.749 25158 1408 1 4 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.588 -0.237 25158 1409 1 4 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.048 1.173 25158 1410 1 4 . 1 1 42 42 GLU H H 42 7.642 7.642 8.635 -0.993 25158 1411 1 4 . 1 1 43 43 ASP N N 43 117.453 117.453 118.082 -0.629 25158 1412 1 4 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.557 0.282 25158 1413 1 4 . 1 1 43 43 ASP C C 43 178.129 178.129 177.749 0.380 25158 1414 1 4 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.228 -1.590 25158 1415 1 4 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.194 0.020 25158 1416 1 4 . 1 1 43 43 ASP H H 43 8.473 8.473 8.971 -0.498 25158 1417 1 4 . 1 1 44 44 GLY N N 44 112.490 112.490 107.214 5.276 25158 1418 1 4 . 1 1 44 44 GLY C C 44 173.717 173.717 173.665 0.052 25158 1419 1 4 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.897 0.420 25158 1420 1 4 . 1 1 44 44 GLY H H 44 10.139 10.139 8.325 1.814 25158 1421 1 4 . 1 1 45 45 ARG N N 45 118.154 118.154 116.575 1.579 25158 1422 1 4 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.626 0.162 25158 1423 1 4 . 1 1 45 45 ARG C C 45 175.602 175.602 173.689 1.913 25158 1424 1 4 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.525 -0.693 25158 1425 1 4 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.334 1.330 25158 1426 1 4 . 1 1 45 45 ARG H H 45 7.994 7.994 8.504 -0.510 25158 1427 1 4 . 1 1 46 46 VAL N N 46 126.392 126.392 122.428 3.964 25158 1428 1 4 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.325 0.465 25158 1429 1 4 . 1 1 46 46 VAL C C 46 174.644 174.644 175.389 -0.745 25158 1430 1 4 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.731 -0.002 25158 1431 1 4 . 1 1 46 46 VAL CB C 46 31.666 31.666 29.642 2.024 25158 1432 1 4 . 1 1 46 46 VAL H H 46 9.115 9.115 8.502 0.613 25158 1433 1 4 . 1 1 47 47 ASN N N 47 126.737 126.737 127.297 -0.560 25158 1434 1 4 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.956 -0.081 25158 1435 1 4 . 1 1 47 47 ASN C C 47 176.467 176.467 175.986 0.481 25158 1436 1 4 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.686 0.354 25158 1437 1 4 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.483 -0.296 25158 1438 1 4 . 1 1 47 47 ASN H H 47 10.077 10.077 9.187 0.890 25158 1439 1 4 . 1 1 48 48 SER N N 48 113.409 113.409 114.236 -0.827 25158 1440 1 4 . 1 1 48 48 SER HA H 48 4.086 4.086 4.220 -0.134 25158 1441 1 4 . 1 1 48 48 SER C C 48 176.671 176.671 176.205 0.466 25158 1442 1 4 . 1 1 48 48 SER CA C 48 62.375 62.375 61.635 0.740 25158 1443 1 4 . 1 1 48 48 SER CB C 48 62.375 62.375 62.659 -0.284 25158 1444 1 4 . 1 1 48 48 SER H H 48 8.936 8.936 8.810 0.126 25158 1445 1 4 . 1 1 49 49 THR N N 49 121.885 121.885 118.469 3.416 25158 1446 1 4 . 1 1 49 49 THR HA H 49 4.112 4.112 3.899 0.213 25158 1447 1 4 . 1 1 49 49 THR C C 49 177.320 177.320 176.489 0.831 25158 1448 1 4 . 1 1 49 49 THR CA C 49 66.713 66.713 66.673 0.040 25158 1449 1 4 . 1 1 49 49 THR CB C 49 67.787 67.787 68.325 -0.538 25158 1450 1 4 . 1 1 49 49 THR H H 49 8.124 8.124 7.610 0.514 25158 1451 1 4 . 1 1 50 50 ASP N N 50 120.401 120.401 122.146 -1.745 25158 1452 1 4 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.287 0.083 25158 1453 1 4 . 1 1 50 50 ASP C C 50 177.033 177.033 178.479 -1.446 25158 1454 1 4 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.514 1.306 25158 1455 1 4 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.333 1.375 25158 1456 1 4 . 1 1 50 50 ASP H H 50 7.560 7.560 7.959 -0.399 25158 1457 1 4 . 1 1 51 51 LEU N N 51 118.174 118.174 121.337 -3.163 25158 1458 1 4 . 1 1 51 51 LEU HA H 51 4.188 4.188 3.961 0.227 25158 1459 1 4 . 1 1 51 51 LEU C C 51 177.441 177.441 178.615 -1.174 25158 1460 1 4 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.030 0.107 25158 1461 1 4 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.898 -0.050 25158 1462 1 4 . 1 1 51 51 LEU H H 51 7.134 7.134 7.613 -0.479 25158 1463 1 4 . 1 1 52 52 GLY N N 52 105.596 105.596 106.294 -0.698 25158 1464 1 4 . 1 1 52 52 GLY C C 52 176.764 176.764 175.947 0.817 25158 1465 1 4 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.142 0.500 25158 1466 1 4 . 1 1 52 52 GLY H H 52 8.034 8.034 8.097 -0.063 25158 1467 1 4 . 1 1 53 53 ILE N N 53 122.043 122.043 122.504 -0.461 25158 1468 1 4 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.729 -0.280 25158 1469 1 4 . 1 1 53 53 ILE C C 53 177.112 177.112 177.390 -0.278 25158 1470 1 4 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.381 1.007 25158 1471 1 4 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.942 0.316 25158 1472 1 4 . 1 1 53 53 ILE H H 53 7.611 7.611 7.462 0.149 25158 1473 1 4 . 1 1 54 54 LEU N N 54 120.787 120.787 121.805 -1.018 25158 1474 1 4 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.938 0.003 25158 1475 1 4 . 1 1 54 54 LEU C C 54 175.340 175.340 178.525 -3.185 25158 1476 1 4 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.640 -0.445 25158 1477 1 4 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.836 -0.615 25158 1478 1 4 . 1 1 54 54 LEU H H 54 8.323 8.323 8.111 0.212 25158 1479 1 4 . 1 1 55 55 LYS N N 55 116.833 116.833 118.860 -2.027 25158 1480 1 4 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.950 -0.066 25158 1481 1 4 . 1 1 55 55 LYS C C 55 179.067 179.067 179.051 0.016 25158 1482 1 4 . 1 1 55 55 LYS CA C 55 60.651 60.651 60.123 0.528 25158 1483 1 4 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.361 -0.352 25158 1484 1 4 . 1 1 55 55 LYS H H 55 8.356 8.356 7.735 0.621 25158 1485 1 4 . 1 1 56 56 ARG N N 56 117.092 117.092 118.829 -1.737 25158 1486 1 4 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.991 -0.075 25158 1487 1 4 . 1 1 56 56 ARG C C 56 178.223 178.223 178.647 -0.424 25158 1488 1 4 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.426 0.925 25158 1489 1 4 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.129 0.651 25158 1490 1 4 . 1 1 56 56 ARG H H 56 7.543 7.543 7.562 -0.019 25158 1491 1 4 . 1 1 57 57 TYR N N 57 122.187 122.187 121.808 0.379 25158 1492 1 4 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.540 -0.148 25158 1493 1 4 . 1 1 57 57 TYR C C 57 180.009 180.009 178.658 1.351 25158 1494 1 4 . 1 1 57 57 TYR CA C 57 61.579 61.579 60.993 0.586 25158 1495 1 4 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.514 0.322 25158 1496 1 4 . 1 1 57 57 TYR H H 57 8.592 8.592 8.038 0.554 25158 1497 1 4 . 1 1 58 58 ILE N N 58 122.825 122.825 117.077 5.748 25158 1498 1 4 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.796 -0.116 25158 1499 1 4 . 1 1 58 58 ILE C C 58 178.186 178.186 176.481 1.705 25158 1500 1 4 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.885 0.883 25158 1501 1 4 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.095 -0.375 25158 1502 1 4 . 1 1 58 58 ILE H H 58 8.779 8.779 7.694 1.085 25158 1503 1 4 . 1 1 59 59 LEU N N 59 118.552 118.552 118.219 0.333 25158 1504 1 4 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.344 -0.121 25158 1505 1 4 . 1 1 59 59 LEU C C 59 175.937 175.937 176.039 -0.102 25158 1506 1 4 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.202 1.310 25158 1507 1 4 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.619 0.807 25158 1508 1 4 . 1 1 59 59 LEU H H 59 7.539 7.539 7.652 -0.113 25158 1509 1 4 . 1 1 60 60 LYS N N 60 113.650 113.650 118.023 -4.373 25158 1510 1 4 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.802 0.193 25158 1511 1 4 . 1 1 60 60 LYS C C 60 176.535 176.535 176.241 0.294 25158 1512 1 4 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.556 -0.265 25158 1513 1 4 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.290 -2.019 25158 1514 1 4 . 1 1 60 60 LYS H H 60 7.815 7.815 7.397 0.418 25158 1515 1 4 . 1 1 61 61 GLU N N 61 117.535 117.535 115.882 1.653 25158 1516 1 4 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.342 -0.198 25158 1517 1 4 . 1 1 61 61 GLU C C 61 176.992 176.992 176.762 0.230 25158 1518 1 4 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.750 -0.061 25158 1519 1 4 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.096 -0.404 25158 1520 1 4 . 1 1 61 61 GLU H H 61 8.438 8.438 8.404 0.034 25158 1521 1 4 . 1 1 62 62 ILE N N 62 112.102 112.102 116.304 -4.202 25158 1522 1 4 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.448 -0.065 25158 1523 1 4 . 1 1 62 62 ILE C C 62 175.425 175.425 175.280 0.145 25158 1524 1 4 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.512 -0.586 25158 1525 1 4 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.103 1.645 25158 1526 1 4 . 1 1 62 62 ILE H H 62 6.867 6.867 7.440 -0.573 25158 1527 1 4 . 1 1 63 63 ASP N N 63 119.719 119.719 124.693 -4.974 25158 1528 1 4 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.921 -0.247 25158 1529 1 4 . 1 1 63 63 ASP C C 63 176.202 176.202 176.184 0.018 25158 1530 1 4 . 1 1 63 63 ASP CA C 63 54.818 54.818 55.042 -0.224 25158 1531 1 4 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.950 -0.733 25158 1532 1 4 . 1 1 63 63 ASP H H 63 8.561 8.561 8.846 -0.285 25158 1533 1 4 . 1 1 64 64 THR N N 64 113.289 113.289 118.449 -5.160 25158 1534 1 4 . 1 1 64 64 THR HA H 64 4.712 4.712 4.397 0.315 25158 1535 1 4 . 1 1 64 64 THR C C 64 170.854 170.854 173.473 -2.619 25158 1536 1 4 . 1 1 64 64 THR CA C 64 61.269 61.269 63.179 -1.910 25158 1537 1 4 . 1 1 64 64 THR CB C 64 71.993 71.993 69.432 2.561 25158 1538 1 4 . 1 1 64 64 THR H H 64 7.410 7.410 8.035 -0.625 25158 1539 1 4 . 1 1 65 65 LEU N N 65 121.012 121.012 126.854 -5.842 25158 1540 1 4 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.678 -0.449 25158 1541 1 4 . 1 1 65 65 LEU C C 65 174.763 174.763 174.924 -0.161 25158 1542 1 4 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.181 -0.546 25158 1543 1 4 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.145 0.375 25158 1544 1 4 . 1 1 65 65 LEU H H 65 7.877 7.877 8.388 -0.511 25158 1545 1 4 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.155 -0.163 25158 1546 1 4 . 1 1 66 66 PRO C C 66 174.419 174.419 174.977 -0.558 25158 1547 1 4 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.230 0.080 25158 1548 1 4 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.273 2.953 25158 1549 1 4 . 1 1 67 67 TYR N N 67 122.616 122.616 120.124 2.492 25158 1550 1 4 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.348 0.308 25158 1551 1 4 . 1 1 67 67 TYR C C 67 174.446 174.446 176.010 -1.564 25158 1552 1 4 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.940 -0.929 25158 1553 1 4 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.704 1.377 25158 1554 1 4 . 1 1 67 67 TYR H H 67 8.662 8.662 8.059 0.603 25158 1555 1 4 . 1 1 68 68 LYS N N 68 126.223 126.223 129.055 -2.832 25158 1556 1 4 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.214 0.054 25158 1557 1 4 . 1 1 68 68 LYS C C 68 174.748 174.748 175.112 -0.364 25158 1558 1 4 . 1 1 68 68 LYS CA C 68 55.603 55.603 54.786 0.817 25158 1559 1 4 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.521 1.249 25158 1560 1 4 . 1 1 68 68 LYS H H 68 8.112 8.112 7.905 0.207 25158 1561 1 5 . 1 1 2 2 THR N N 2 116.700 116.700 116.278 0.422 25158 1562 1 5 . 1 1 2 2 THR HA H 2 4.313 4.313 4.207 0.106 25158 1563 1 5 . 1 1 2 2 THR C C 2 173.968 173.968 174.570 -0.602 25158 1564 1 5 . 1 1 2 2 THR CA C 2 62.326 62.326 61.571 0.755 25158 1565 1 5 . 1 1 2 2 THR CB C 2 70.154 70.154 70.163 -0.009 25158 1566 1 5 . 1 1 2 2 THR H H 2 8.657 8.657 8.073 0.584 25158 1567 1 5 . 1 1 3 3 LYS N N 3 125.500 125.500 123.657 1.843 25158 1568 1 5 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.282 -0.217 25158 1569 1 5 . 1 1 3 3 LYS C C 3 174.926 174.926 175.391 -0.465 25158 1570 1 5 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.615 0.224 25158 1571 1 5 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.744 1.033 25158 1572 1 5 . 1 1 3 3 LYS H H 3 8.318 8.318 8.324 -0.006 25158 1573 1 5 . 1 1 4 4 LEU N N 4 127.473 127.473 125.678 1.795 25158 1574 1 5 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.438 0.045 25158 1575 1 5 . 1 1 4 4 LEU C C 4 174.734 174.734 174.790 -0.056 25158 1576 1 5 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.309 -0.050 25158 1577 1 5 . 1 1 4 4 LEU CB C 4 40.929 40.929 44.974 -4.045 25158 1578 1 5 . 1 1 4 4 LEU H H 4 7.726 7.726 7.951 -0.225 25158 1579 1 5 . 1 1 5 5 TYR N N 5 123.074 123.074 124.511 -1.437 25158 1580 1 5 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.434 -0.811 25158 1581 1 5 . 1 1 5 5 TYR C C 5 175.406 175.406 176.370 -0.964 25158 1582 1 5 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.655 3.157 25158 1583 1 5 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.889 2.221 25158 1584 1 5 . 1 1 5 5 TYR H H 5 7.816 7.816 8.492 -0.676 25158 1585 1 5 . 1 1 6 6 GLY N N 6 108.614 108.614 114.107 -5.493 25158 1586 1 5 . 1 1 6 6 GLY C C 6 172.585 172.585 172.573 0.012 25158 1587 1 5 . 1 1 6 6 GLY CA C 6 45.387 45.387 45.064 0.323 25158 1588 1 5 . 1 1 6 6 GLY H H 6 8.915 8.915 8.470 0.445 25158 1589 1 5 . 1 1 7 7 ASP N N 7 118.023 118.023 119.908 -1.885 25158 1590 1 5 . 1 1 7 7 ASP HA H 7 4.984 4.984 5.402 -0.418 25158 1591 1 5 . 1 1 7 7 ASP C C 7 177.806 177.806 177.059 0.747 25158 1592 1 5 . 1 1 7 7 ASP CA C 7 52.192 52.192 52.018 0.174 25158 1593 1 5 . 1 1 7 7 ASP CB C 7 39.150 39.150 41.561 -2.411 25158 1594 1 5 . 1 1 7 7 ASP H H 7 7.976 7.976 7.573 0.403 25158 1595 1 5 . 1 1 8 8 VAL N N 8 120.293 120.293 118.979 1.314 25158 1596 1 5 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.240 -0.257 25158 1597 1 5 . 1 1 8 8 VAL C C 8 175.717 175.717 176.826 -1.109 25158 1598 1 5 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.522 -0.076 25158 1599 1 5 . 1 1 8 8 VAL CB C 8 31.271 31.271 32.145 -0.874 25158 1600 1 5 . 1 1 8 8 VAL H H 8 8.156 8.156 8.331 -0.175 25158 1601 1 5 . 1 1 9 9 ASN N N 9 115.226 115.226 115.725 -0.499 25158 1602 1 5 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.586 0.403 25158 1603 1 5 . 1 1 9 9 ASN C C 9 174.626 174.626 175.066 -0.440 25158 1604 1 5 . 1 1 9 9 ASN CA C 9 50.950 50.950 53.213 -2.263 25158 1605 1 5 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.243 -0.542 25158 1606 1 5 . 1 1 9 9 ASN H H 9 8.008 8.008 8.130 -0.122 25158 1607 1 5 . 1 1 10 10 ASP N N 10 115.600 115.600 117.308 -1.708 25158 1608 1 5 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.508 -0.072 25158 1609 1 5 . 1 1 10 10 ASP C C 10 175.125 175.125 175.067 0.058 25158 1610 1 5 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.430 0.805 25158 1611 1 5 . 1 1 10 10 ASP CB C 10 40.200 40.200 38.762 1.438 25158 1612 1 5 . 1 1 10 10 ASP H H 10 7.374 7.374 8.092 -0.718 25158 1613 1 5 . 1 1 11 11 ASP N N 11 118.402 118.402 115.886 2.516 25158 1614 1 5 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.632 0.185 25158 1615 1 5 . 1 1 11 11 ASP C C 11 178.299 178.299 177.025 1.274 25158 1616 1 5 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.123 -0.302 25158 1617 1 5 . 1 1 11 11 ASP CB C 11 41.114 41.114 42.126 -1.012 25158 1618 1 5 . 1 1 11 11 ASP H H 11 8.801 8.801 8.935 -0.134 25158 1619 1 5 . 1 1 12 12 GLY N N 12 112.353 112.353 107.316 5.037 25158 1620 1 5 . 1 1 12 12 GLY C C 12 173.284 173.284 173.838 -0.554 25158 1621 1 5 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.213 0.411 25158 1622 1 5 . 1 1 12 12 GLY H H 12 10.293 10.293 8.440 1.853 25158 1623 1 5 . 1 1 13 13 LYS N N 13 118.118 118.118 119.013 -0.895 25158 1624 1 5 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.539 0.120 25158 1625 1 5 . 1 1 13 13 LYS C C 13 175.595 175.595 174.775 0.820 25158 1626 1 5 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.217 -1.459 25158 1627 1 5 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.761 0.578 25158 1628 1 5 . 1 1 13 13 LYS H H 13 7.848 7.848 8.704 -0.856 25158 1629 1 5 . 1 1 14 14 VAL N N 14 126.591 126.591 123.335 3.256 25158 1630 1 5 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.547 0.208 25158 1631 1 5 . 1 1 14 14 VAL C C 14 175.052 175.052 174.979 0.073 25158 1632 1 5 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.570 0.500 25158 1633 1 5 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.607 0.848 25158 1634 1 5 . 1 1 14 14 VAL H H 14 9.109 9.109 8.532 0.577 25158 1635 1 5 . 1 1 15 15 ASN N N 15 126.287 126.287 125.802 0.485 25158 1636 1 5 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.927 -0.112 25158 1637 1 5 . 1 1 15 15 ASN C C 15 176.340 176.340 176.507 -0.167 25158 1638 1 5 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.605 0.670 25158 1639 1 5 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.687 -2.467 25158 1640 1 5 . 1 1 15 15 ASN H H 15 10.071 10.071 8.648 1.423 25158 1641 1 5 . 1 1 16 16 SER N N 16 113.168 113.168 116.420 -3.252 25158 1642 1 5 . 1 1 16 16 SER HA H 16 4.047 4.047 4.326 -0.279 25158 1643 1 5 . 1 1 16 16 SER C C 16 176.197 176.197 175.974 0.223 25158 1644 1 5 . 1 1 16 16 SER CA C 16 62.681 62.681 61.461 1.220 25158 1645 1 5 . 1 1 16 16 SER CB C 16 62.681 62.681 63.383 -0.702 25158 1646 1 5 . 1 1 16 16 SER H H 16 8.825 8.825 8.908 -0.083 25158 1647 1 5 . 1 1 17 17 THR N N 17 119.391 119.391 117.612 1.779 25158 1648 1 5 . 1 1 17 17 THR HA H 17 3.983 3.983 4.024 -0.041 25158 1649 1 5 . 1 1 17 17 THR C C 17 177.149 177.149 176.296 0.853 25158 1650 1 5 . 1 1 17 17 THR CA C 17 66.791 66.791 66.677 0.114 25158 1651 1 5 . 1 1 17 17 THR CB C 17 67.757 67.757 68.476 -0.719 25158 1652 1 5 . 1 1 17 17 THR H H 17 7.946 7.946 8.381 -0.435 25158 1653 1 5 . 1 1 18 18 ASP N N 18 120.318 120.318 121.556 -1.238 25158 1654 1 5 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.475 -0.105 25158 1655 1 5 . 1 1 18 18 ASP C C 18 177.168 177.168 177.569 -0.401 25158 1656 1 5 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.646 1.268 25158 1657 1 5 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.457 1.705 25158 1658 1 5 . 1 1 18 18 ASP H H 18 7.995 7.995 7.793 0.202 25158 1659 1 5 . 1 1 19 19 ALA N N 19 120.191 120.191 123.088 -2.897 25158 1660 1 5 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.080 -0.032 25158 1661 1 5 . 1 1 19 19 ALA C C 19 179.549 179.549 179.008 0.541 25158 1662 1 5 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.161 0.252 25158 1663 1 5 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.652 -1.339 25158 1664 1 5 . 1 1 19 19 ALA H H 19 7.085 7.085 7.467 -0.382 25158 1665 1 5 . 1 1 20 20 VAL N N 20 120.613 120.613 119.179 1.434 25158 1666 1 5 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.703 -0.092 25158 1667 1 5 . 1 1 20 20 VAL C C 20 178.153 178.153 177.516 0.637 25158 1668 1 5 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.355 1.412 25158 1669 1 5 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.180 0.688 25158 1670 1 5 . 1 1 20 20 VAL H H 20 7.835 7.835 7.595 0.240 25158 1671 1 5 . 1 1 21 21 ALA N N 21 121.767 121.767 122.147 -0.380 25158 1672 1 5 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.102 -0.040 25158 1673 1 5 . 1 1 21 21 ALA C C 21 179.298 179.298 179.730 -0.432 25158 1674 1 5 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.211 0.033 25158 1675 1 5 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.257 -0.468 25158 1676 1 5 . 1 1 21 21 ALA H H 21 7.804 7.804 7.778 0.026 25158 1677 1 5 . 1 1 22 22 LEU N N 22 117.555 117.555 119.721 -2.166 25158 1678 1 5 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.104 0.042 25158 1679 1 5 . 1 1 22 22 LEU C C 22 177.914 177.914 178.251 -0.337 25158 1680 1 5 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.209 0.484 25158 1681 1 5 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.672 -0.157 25158 1682 1 5 . 1 1 22 22 LEU H H 22 8.619 8.619 7.578 1.041 25158 1683 1 5 . 1 1 23 23 LYS N N 23 120.335 120.335 119.780 0.555 25158 1684 1 5 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.919 -0.000 25158 1685 1 5 . 1 1 23 23 LYS C C 23 177.731 177.731 179.024 -1.293 25158 1686 1 5 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.901 0.436 25158 1687 1 5 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.305 -0.207 25158 1688 1 5 . 1 1 23 23 LYS H H 23 8.230 8.230 8.111 0.119 25158 1689 1 5 . 1 1 24 24 ARG N N 24 116.831 116.831 117.706 -0.875 25158 1690 1 5 . 1 1 24 24 ARG HA H 24 3.959 3.959 3.983 -0.024 25158 1691 1 5 . 1 1 24 24 ARG C C 24 178.616 178.616 178.707 -0.091 25158 1692 1 5 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.234 0.723 25158 1693 1 5 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.055 -0.492 25158 1694 1 5 . 1 1 24 24 ARG H H 24 7.927 7.927 7.715 0.212 25158 1695 1 5 . 1 1 25 25 TYR N N 25 120.960 120.960 121.052 -0.092 25158 1696 1 5 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.191 0.019 25158 1697 1 5 . 1 1 25 25 TYR C C 25 179.465 179.465 177.968 1.497 25158 1698 1 5 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.495 0.350 25158 1699 1 5 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.352 0.713 25158 1700 1 5 . 1 1 25 25 TYR H H 25 8.321 8.321 7.551 0.770 25158 1701 1 5 . 1 1 26 26 VAL N N 26 120.405 120.405 118.490 1.915 25158 1702 1 5 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.927 -0.153 25158 1703 1 5 . 1 1 26 26 VAL C C 26 177.826 177.826 177.360 0.466 25158 1704 1 5 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.371 0.069 25158 1705 1 5 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.430 0.127 25158 1706 1 5 . 1 1 26 26 VAL H H 26 8.803 8.803 8.096 0.707 25158 1707 1 5 . 1 1 27 27 LEU N N 27 119.247 119.247 118.114 1.133 25158 1708 1 5 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.355 -0.079 25158 1709 1 5 . 1 1 27 27 LEU C C 27 176.753 176.753 176.389 0.364 25158 1710 1 5 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.817 0.858 25158 1711 1 5 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.147 -0.554 25158 1712 1 5 . 1 1 27 27 LEU H H 27 7.898 7.898 7.227 0.671 25158 1713 1 5 . 1 1 28 28 ARG N N 28 116.082 116.082 117.360 -1.278 25158 1714 1 5 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.863 0.251 25158 1715 1 5 . 1 1 28 28 ARG C C 28 176.521 176.521 176.128 0.393 25158 1716 1 5 . 1 1 28 28 ARG CA C 28 56.154 56.154 56.759 -0.605 25158 1717 1 5 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.219 0.252 25158 1718 1 5 . 1 1 28 28 ARG H H 28 7.993 7.993 7.920 0.073 25158 1719 1 5 . 1 1 29 29 SER N N 29 113.579 113.579 115.240 -1.661 25158 1720 1 5 . 1 1 29 29 SER HA H 29 4.305 4.305 4.334 -0.029 25158 1721 1 5 . 1 1 29 29 SER C C 29 175.368 175.368 175.147 0.221 25158 1722 1 5 . 1 1 29 29 SER CA C 29 59.699 59.699 60.324 -0.625 25158 1723 1 5 . 1 1 29 29 SER CB C 29 63.908 63.908 63.836 0.072 25158 1724 1 5 . 1 1 29 29 SER H H 29 8.094 8.094 7.813 0.281 25158 1725 1 5 . 1 1 30 30 GLY N N 30 109.920 109.920 108.207 1.713 25158 1726 1 5 . 1 1 30 30 GLY C C 30 174.115 174.115 174.041 0.074 25158 1727 1 5 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.744 1.027 25158 1728 1 5 . 1 1 30 30 GLY H H 30 8.577 8.577 8.337 0.240 25158 1729 1 5 . 1 1 31 31 ILE N N 31 119.084 119.084 119.578 -0.494 25158 1730 1 5 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.286 0.072 25158 1731 1 5 . 1 1 31 31 ILE C C 31 174.392 174.392 175.381 -0.989 25158 1732 1 5 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.559 -0.314 25158 1733 1 5 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.228 0.351 25158 1734 1 5 . 1 1 31 31 ILE H H 31 7.387 7.387 7.564 -0.177 25158 1735 1 5 . 1 1 32 32 SER N N 32 120.582 120.582 122.836 -2.254 25158 1736 1 5 . 1 1 32 32 SER HA H 32 4.845 4.845 4.844 0.001 25158 1737 1 5 . 1 1 32 32 SER C C 32 173.891 173.891 174.082 -0.191 25158 1738 1 5 . 1 1 32 32 SER CA C 32 57.603 57.603 58.279 -0.676 25158 1739 1 5 . 1 1 32 32 SER CB C 32 63.849 63.849 63.076 0.773 25158 1740 1 5 . 1 1 32 32 SER H H 32 8.339 8.339 8.513 -0.174 25158 1741 1 5 . 1 1 33 33 ILE N N 33 116.629 116.629 120.640 -4.011 25158 1742 1 5 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.627 0.006 25158 1743 1 5 . 1 1 33 33 ILE C C 33 174.195 174.195 174.207 -0.012 25158 1744 1 5 . 1 1 33 33 ILE CA C 33 59.112 59.112 58.943 0.169 25158 1745 1 5 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.486 2.096 25158 1746 1 5 . 1 1 33 33 ILE H H 33 7.873 7.873 8.105 -0.232 25158 1747 1 5 . 1 1 34 34 ASN N N 34 118.342 118.342 119.545 -1.203 25158 1748 1 5 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.885 -0.149 25158 1749 1 5 . 1 1 34 34 ASN C C 34 176.217 176.217 176.101 0.116 25158 1750 1 5 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.031 0.155 25158 1751 1 5 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.471 -1.972 25158 1752 1 5 . 1 1 34 34 ASN H H 34 8.839 8.839 8.234 0.605 25158 1753 1 5 . 1 1 35 35 THR N N 35 116.120 116.120 118.307 -2.187 25158 1754 1 5 . 1 1 35 35 THR HA H 35 3.559 3.559 3.997 -0.438 25158 1755 1 5 . 1 1 35 35 THR C C 35 177.347 177.347 176.211 1.136 25158 1756 1 5 . 1 1 35 35 THR CA C 35 64.686 64.686 65.751 -1.065 25158 1757 1 5 . 1 1 35 35 THR CB C 35 67.758 67.758 68.764 -1.006 25158 1758 1 5 . 1 1 35 35 THR H H 35 7.939 7.939 8.501 -0.562 25158 1759 1 5 . 1 1 36 36 ASP N N 36 123.528 123.528 121.901 1.627 25158 1760 1 5 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.410 0.010 25158 1761 1 5 . 1 1 36 36 ASP C C 36 177.752 177.752 177.233 0.519 25158 1762 1 5 . 1 1 36 36 ASP CA C 36 57.074 57.074 56.929 0.145 25158 1763 1 5 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.821 -0.923 25158 1764 1 5 . 1 1 36 36 ASP H H 36 7.980 7.980 8.027 -0.047 25158 1765 1 5 . 1 1 37 37 ASN N N 37 115.690 115.690 116.087 -0.397 25158 1766 1 5 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.498 -0.232 25158 1767 1 5 . 1 1 37 37 ASN C C 37 175.589 175.589 176.950 -1.361 25158 1768 1 5 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.887 -2.327 25158 1769 1 5 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.579 -0.616 25158 1770 1 5 . 1 1 37 37 ASN H H 37 7.251 7.251 7.757 -0.506 25158 1771 1 5 . 1 1 38 38 ALA N N 38 119.560 119.560 122.604 -3.044 25158 1772 1 5 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.014 0.066 25158 1773 1 5 . 1 1 38 38 ALA C C 38 173.638 173.638 177.378 -3.740 25158 1774 1 5 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.026 -1.806 25158 1775 1 5 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.709 4.162 25158 1776 1 5 . 1 1 38 38 ALA H H 38 7.142 7.142 7.945 -0.803 25158 1777 1 5 . 1 1 39 39 ASP N N 39 115.003 115.003 119.442 -4.439 25158 1778 1 5 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.500 0.440 25158 1779 1 5 . 1 1 39 39 ASP C C 39 177.163 177.163 176.497 0.666 25158 1780 1 5 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.648 -2.477 25158 1781 1 5 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.906 -0.959 25158 1782 1 5 . 1 1 39 39 ASP H H 39 7.096 7.096 7.852 -0.756 25158 1783 1 5 . 1 1 40 40 LEU N N 40 123.245 123.245 124.150 -0.905 25158 1784 1 5 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.329 -0.258 25158 1785 1 5 . 1 1 40 40 LEU C C 40 175.865 175.865 177.765 -1.900 25158 1786 1 5 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.099 0.494 25158 1787 1 5 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.085 -0.156 25158 1788 1 5 . 1 1 40 40 LEU H H 40 8.572 8.572 7.877 0.695 25158 1789 1 5 . 1 1 41 41 ASN N N 41 112.723 112.723 113.474 -0.751 25158 1790 1 5 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.915 0.084 25158 1791 1 5 . 1 1 41 41 ASN C C 41 173.846 173.846 175.448 -1.602 25158 1792 1 5 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.099 -0.866 25158 1793 1 5 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.023 -1.629 25158 1794 1 5 . 1 1 41 41 ASN H H 41 8.004 8.004 7.917 0.087 25158 1795 1 5 . 1 1 42 42 GLU N N 42 115.798 115.798 116.419 -0.621 25158 1796 1 5 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.334 -0.382 25158 1797 1 5 . 1 1 42 42 GLU C C 42 175.172 175.172 175.889 -0.717 25158 1798 1 5 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.724 -0.373 25158 1799 1 5 . 1 1 42 42 GLU CB C 42 28.221 28.221 26.989 1.232 25158 1800 1 5 . 1 1 42 42 GLU H H 42 7.642 7.642 8.394 -0.752 25158 1801 1 5 . 1 1 43 43 ASP N N 43 117.453 117.453 118.202 -0.749 25158 1802 1 5 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.571 0.268 25158 1803 1 5 . 1 1 43 43 ASP C C 43 178.129 178.129 177.786 0.343 25158 1804 1 5 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.188 -1.550 25158 1805 1 5 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.167 0.047 25158 1806 1 5 . 1 1 43 43 ASP H H 43 8.473 8.473 8.687 -0.214 25158 1807 1 5 . 1 1 44 44 GLY N N 44 112.490 112.490 107.744 4.746 25158 1808 1 5 . 1 1 44 44 GLY C C 44 173.717 173.717 173.760 -0.043 25158 1809 1 5 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.900 0.417 25158 1810 1 5 . 1 1 44 44 GLY H H 44 10.139 10.139 8.147 1.992 25158 1811 1 5 . 1 1 45 45 ARG N N 45 118.154 118.154 117.198 0.956 25158 1812 1 5 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.583 0.205 25158 1813 1 5 . 1 1 45 45 ARG C C 45 175.602 175.602 174.052 1.550 25158 1814 1 5 . 1 1 45 45 ARG CA C 45 53.832 53.832 55.242 -1.411 25158 1815 1 5 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.781 0.883 25158 1816 1 5 . 1 1 45 45 ARG H H 45 7.994 7.994 9.018 -1.024 25158 1817 1 5 . 1 1 46 46 VAL N N 46 126.392 126.392 122.811 3.581 25158 1818 1 5 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.502 0.288 25158 1819 1 5 . 1 1 46 46 VAL C C 46 174.644 174.644 175.436 -0.792 25158 1820 1 5 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.427 -0.698 25158 1821 1 5 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.843 0.823 25158 1822 1 5 . 1 1 46 46 VAL H H 46 9.115 9.115 8.444 0.671 25158 1823 1 5 . 1 1 47 47 ASN N N 47 126.737 126.737 126.246 0.491 25158 1824 1 5 . 1 1 47 47 ASN HA H 47 4.875 4.875 5.040 -0.165 25158 1825 1 5 . 1 1 47 47 ASN C C 47 176.467 176.467 175.872 0.595 25158 1826 1 5 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.145 0.895 25158 1827 1 5 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.769 -0.582 25158 1828 1 5 . 1 1 47 47 ASN H H 47 10.077 10.077 9.128 0.949 25158 1829 1 5 . 1 1 48 48 SER N N 48 113.409 113.409 114.849 -1.440 25158 1830 1 5 . 1 1 48 48 SER HA H 48 4.086 4.086 4.149 -0.063 25158 1831 1 5 . 1 1 48 48 SER C C 48 176.671 176.671 176.101 0.570 25158 1832 1 5 . 1 1 48 48 SER CA C 48 62.375 62.375 61.637 0.738 25158 1833 1 5 . 1 1 48 48 SER CB C 48 62.375 62.375 62.949 -0.574 25158 1834 1 5 . 1 1 48 48 SER H H 48 8.936 8.936 8.726 0.210 25158 1835 1 5 . 1 1 49 49 THR N N 49 121.885 121.885 117.848 4.037 25158 1836 1 5 . 1 1 49 49 THR HA H 49 4.112 4.112 3.907 0.205 25158 1837 1 5 . 1 1 49 49 THR C C 49 177.320 177.320 176.335 0.985 25158 1838 1 5 . 1 1 49 49 THR CA C 49 66.713 66.713 66.470 0.243 25158 1839 1 5 . 1 1 49 49 THR CB C 49 67.787 67.787 68.082 -0.295 25158 1840 1 5 . 1 1 49 49 THR H H 49 8.124 8.124 8.080 0.044 25158 1841 1 5 . 1 1 50 50 ASP N N 50 120.401 120.401 121.673 -1.272 25158 1842 1 5 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.287 0.083 25158 1843 1 5 . 1 1 50 50 ASP C C 50 177.033 177.033 178.235 -1.202 25158 1844 1 5 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.329 1.491 25158 1845 1 5 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.309 1.399 25158 1846 1 5 . 1 1 50 50 ASP H H 50 7.560 7.560 8.041 -0.481 25158 1847 1 5 . 1 1 51 51 LEU N N 51 118.174 118.174 120.588 -2.414 25158 1848 1 5 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.054 0.134 25158 1849 1 5 . 1 1 51 51 LEU C C 51 177.441 177.441 178.311 -0.870 25158 1850 1 5 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.794 0.343 25158 1851 1 5 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.648 0.199 25158 1852 1 5 . 1 1 51 51 LEU H H 51 7.134 7.134 7.587 -0.453 25158 1853 1 5 . 1 1 52 52 GLY N N 52 105.596 105.596 106.953 -1.357 25158 1854 1 5 . 1 1 52 52 GLY C C 52 176.764 176.764 175.865 0.899 25158 1855 1 5 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.997 0.645 25158 1856 1 5 . 1 1 52 52 GLY H H 52 8.034 8.034 7.729 0.305 25158 1857 1 5 . 1 1 53 53 ILE N N 53 122.043 122.043 122.719 -0.676 25158 1858 1 5 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.682 -0.233 25158 1859 1 5 . 1 1 53 53 ILE C C 53 177.112 177.112 177.668 -0.556 25158 1860 1 5 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.578 0.810 25158 1861 1 5 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.853 0.405 25158 1862 1 5 . 1 1 53 53 ILE H H 53 7.611 7.611 7.762 -0.151 25158 1863 1 5 . 1 1 54 54 LEU N N 54 120.787 120.787 121.520 -0.733 25158 1864 1 5 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.961 -0.020 25158 1865 1 5 . 1 1 54 54 LEU C C 54 175.340 175.340 178.429 -3.089 25158 1866 1 5 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.564 -0.369 25158 1867 1 5 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.999 -0.778 25158 1868 1 5 . 1 1 54 54 LEU H H 54 8.323 8.323 7.923 0.400 25158 1869 1 5 . 1 1 55 55 LYS N N 55 116.833 116.833 119.007 -2.174 25158 1870 1 5 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.943 -0.059 25158 1871 1 5 . 1 1 55 55 LYS C C 55 179.067 179.067 179.284 -0.217 25158 1872 1 5 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.964 0.687 25158 1873 1 5 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.245 -0.236 25158 1874 1 5 . 1 1 55 55 LYS H H 55 8.356 8.356 7.539 0.817 25158 1875 1 5 . 1 1 56 56 ARG N N 56 117.092 117.092 118.543 -1.451 25158 1876 1 5 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.294 -0.378 25158 1877 1 5 . 1 1 56 56 ARG C C 56 178.223 178.223 178.573 -0.350 25158 1878 1 5 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.231 1.120 25158 1879 1 5 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.207 0.573 25158 1880 1 5 . 1 1 56 56 ARG H H 56 7.543 7.543 7.938 -0.395 25158 1881 1 5 . 1 1 57 57 TYR N N 57 122.187 122.187 121.124 1.063 25158 1882 1 5 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.637 -0.245 25158 1883 1 5 . 1 1 57 57 TYR C C 57 180.009 180.009 178.451 1.558 25158 1884 1 5 . 1 1 57 57 TYR CA C 57 61.579 61.579 60.973 0.606 25158 1885 1 5 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.600 0.236 25158 1886 1 5 . 1 1 57 57 TYR H H 57 8.592 8.592 7.645 0.947 25158 1887 1 5 . 1 1 58 58 ILE N N 58 122.825 122.825 117.989 4.836 25158 1888 1 5 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.846 -0.167 25158 1889 1 5 . 1 1 58 58 ILE C C 58 178.186 178.186 176.833 1.353 25158 1890 1 5 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.770 0.998 25158 1891 1 5 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.430 -0.710 25158 1892 1 5 . 1 1 58 58 ILE H H 58 8.779 8.779 7.643 1.136 25158 1893 1 5 . 1 1 59 59 LEU N N 59 118.552 118.552 118.663 -0.111 25158 1894 1 5 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.400 -0.177 25158 1895 1 5 . 1 1 59 59 LEU C C 59 175.937 175.937 175.647 0.290 25158 1896 1 5 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.109 1.403 25158 1897 1 5 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.615 0.811 25158 1898 1 5 . 1 1 59 59 LEU H H 59 7.539 7.539 7.583 -0.044 25158 1899 1 5 . 1 1 60 60 LYS N N 60 113.650 113.650 117.818 -4.168 25158 1900 1 5 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.800 0.195 25158 1901 1 5 . 1 1 60 60 LYS C C 60 176.535 176.535 176.383 0.152 25158 1902 1 5 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.592 -0.301 25158 1903 1 5 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.561 -2.290 25158 1904 1 5 . 1 1 60 60 LYS H H 60 7.815 7.815 7.685 0.130 25158 1905 1 5 . 1 1 61 61 GLU N N 61 117.535 117.535 116.026 1.509 25158 1906 1 5 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.258 -0.114 25158 1907 1 5 . 1 1 61 61 GLU C C 61 176.992 176.992 176.646 0.346 25158 1908 1 5 . 1 1 61 61 GLU CA C 61 57.689 57.689 58.050 -0.361 25158 1909 1 5 . 1 1 61 61 GLU CB C 61 30.692 30.692 30.895 -0.204 25158 1910 1 5 . 1 1 61 61 GLU H H 61 8.438 8.438 8.306 0.132 25158 1911 1 5 . 1 1 62 62 ILE N N 62 112.102 112.102 114.502 -2.400 25158 1912 1 5 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.528 -0.145 25158 1913 1 5 . 1 1 62 62 ILE C C 62 175.425 175.425 174.303 1.122 25158 1914 1 5 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.275 -0.349 25158 1915 1 5 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.561 1.187 25158 1916 1 5 . 1 1 62 62 ILE H H 62 6.867 6.867 7.466 -0.599 25158 1917 1 5 . 1 1 63 63 ASP N N 63 119.719 119.719 123.759 -4.040 25158 1918 1 5 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.930 -0.256 25158 1919 1 5 . 1 1 63 63 ASP C C 63 176.202 176.202 175.722 0.480 25158 1920 1 5 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.422 1.396 25158 1921 1 5 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.495 0.722 25158 1922 1 5 . 1 1 63 63 ASP H H 63 8.561 8.561 8.865 -0.304 25158 1923 1 5 . 1 1 64 64 THR N N 64 113.289 113.289 116.771 -3.482 25158 1924 1 5 . 1 1 64 64 THR HA H 64 4.712 4.712 4.629 0.083 25158 1925 1 5 . 1 1 64 64 THR C C 64 170.854 170.854 173.025 -2.171 25158 1926 1 5 . 1 1 64 64 THR CA C 64 61.269 61.269 61.799 -0.530 25158 1927 1 5 . 1 1 64 64 THR CB C 64 71.993 71.993 69.014 2.979 25158 1928 1 5 . 1 1 64 64 THR H H 64 7.410 7.410 7.752 -0.342 25158 1929 1 5 . 1 1 65 65 LEU N N 65 121.012 121.012 127.189 -6.177 25158 1930 1 5 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.709 -0.480 25158 1931 1 5 . 1 1 65 65 LEU C C 65 174.763 174.763 174.854 -0.091 25158 1932 1 5 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.752 -0.117 25158 1933 1 5 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.458 0.062 25158 1934 1 5 . 1 1 65 65 LEU H H 65 7.877 7.877 8.411 -0.534 25158 1935 1 5 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.143 -0.151 25158 1936 1 5 . 1 1 66 66 PRO C C 66 174.419 174.419 174.866 -0.447 25158 1937 1 5 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.035 0.275 25158 1938 1 5 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.193 3.033 25158 1939 1 5 . 1 1 67 67 TYR N N 67 122.616 122.616 120.300 2.316 25158 1940 1 5 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.303 0.353 25158 1941 1 5 . 1 1 67 67 TYR C C 67 174.446 174.446 175.678 -1.232 25158 1942 1 5 . 1 1 67 67 TYR CA C 67 58.011 58.011 59.431 -1.420 25158 1943 1 5 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.410 1.671 25158 1944 1 5 . 1 1 67 67 TYR H H 67 8.662 8.662 8.361 0.301 25158 1945 1 5 . 1 1 68 68 LYS N N 68 126.223 126.223 127.548 -1.325 25158 1946 1 5 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.351 -0.083 25158 1947 1 5 . 1 1 68 68 LYS C C 68 174.748 174.748 174.745 0.003 25158 1948 1 5 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.135 0.468 25158 1949 1 5 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.924 0.846 25158 1950 1 5 . 1 1 68 68 LYS H H 68 8.112 8.112 8.088 0.024 25158 1951 1 6 . 1 1 2 2 THR N N 2 116.700 116.700 116.253 0.447 25158 1952 1 6 . 1 1 2 2 THR HA H 2 4.313 4.313 4.469 -0.156 25158 1953 1 6 . 1 1 2 2 THR C C 2 173.968 173.968 174.613 -0.645 25158 1954 1 6 . 1 1 2 2 THR CA C 2 62.326 62.326 60.987 1.339 25158 1955 1 6 . 1 1 2 2 THR CB C 2 70.154 70.154 69.955 0.199 25158 1956 1 6 . 1 1 2 2 THR H H 2 8.657 8.657 8.343 0.314 25158 1957 1 6 . 1 1 3 3 LYS N N 3 125.500 125.500 125.410 0.090 25158 1958 1 6 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.220 -0.155 25158 1959 1 6 . 1 1 3 3 LYS C C 3 174.926 174.926 175.702 -0.776 25158 1960 1 6 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.789 0.050 25158 1961 1 6 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.910 0.867 25158 1962 1 6 . 1 1 3 3 LYS H H 3 8.318 8.318 8.372 -0.054 25158 1963 1 6 . 1 1 4 4 LEU N N 4 127.473 127.473 125.093 2.380 25158 1964 1 6 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.463 0.020 25158 1965 1 6 . 1 1 4 4 LEU C C 4 174.734 174.734 174.917 -0.183 25158 1966 1 6 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.397 -0.138 25158 1967 1 6 . 1 1 4 4 LEU CB C 4 40.929 40.929 46.443 -5.514 25158 1968 1 6 . 1 1 4 4 LEU H H 4 7.726 7.726 7.837 -0.111 25158 1969 1 6 . 1 1 5 5 TYR N N 5 123.074 123.074 120.906 2.168 25158 1970 1 6 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.543 -0.920 25158 1971 1 6 . 1 1 5 5 TYR C C 5 175.406 175.406 177.024 -1.618 25158 1972 1 6 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.557 3.255 25158 1973 1 6 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.837 1.272 25158 1974 1 6 . 1 1 5 5 TYR H H 5 7.816 7.816 8.397 -0.581 25158 1975 1 6 . 1 1 6 6 GLY N N 6 108.614 108.614 114.060 -5.446 25158 1976 1 6 . 1 1 6 6 GLY C C 6 172.585 172.585 173.540 -0.955 25158 1977 1 6 . 1 1 6 6 GLY CA C 6 45.387 45.387 45.074 0.313 25158 1978 1 6 . 1 1 6 6 GLY H H 6 8.915 8.915 8.512 0.403 25158 1979 1 6 . 1 1 7 7 ASP N N 7 118.023 118.023 123.036 -5.013 25158 1980 1 6 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.699 0.285 25158 1981 1 6 . 1 1 7 7 ASP C C 7 177.806 177.806 177.710 0.096 25158 1982 1 6 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.754 -1.562 25158 1983 1 6 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.422 -0.272 25158 1984 1 6 . 1 1 7 7 ASP H H 7 7.976 7.976 8.032 -0.056 25158 1985 1 6 . 1 1 8 8 VAL N N 8 120.293 120.293 119.410 0.883 25158 1986 1 6 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.203 -0.220 25158 1987 1 6 . 1 1 8 8 VAL C C 8 175.717 175.717 176.980 -1.263 25158 1988 1 6 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.841 -0.395 25158 1989 1 6 . 1 1 8 8 VAL CB C 8 31.271 31.271 32.097 -0.826 25158 1990 1 6 . 1 1 8 8 VAL H H 8 8.156 8.156 8.397 -0.241 25158 1991 1 6 . 1 1 9 9 ASN N N 9 115.226 115.226 115.831 -0.605 25158 1992 1 6 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.591 0.398 25158 1993 1 6 . 1 1 9 9 ASN C C 9 174.626 174.626 175.253 -0.627 25158 1994 1 6 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.944 -1.994 25158 1995 1 6 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.216 -0.515 25158 1996 1 6 . 1 1 9 9 ASN H H 9 8.008 8.008 8.169 -0.161 25158 1997 1 6 . 1 1 10 10 ASP N N 10 115.600 115.600 118.649 -3.049 25158 1998 1 6 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.530 -0.094 25158 1999 1 6 . 1 1 10 10 ASP C C 10 175.125 175.125 175.179 -0.054 25158 2000 1 6 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.423 0.812 25158 2001 1 6 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.658 0.542 25158 2002 1 6 . 1 1 10 10 ASP H H 10 7.374 7.374 8.069 -0.695 25158 2003 1 6 . 1 1 11 11 ASP N N 11 118.402 118.402 116.012 2.390 25158 2004 1 6 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.649 0.168 25158 2005 1 6 . 1 1 11 11 ASP C C 11 178.299 178.299 176.806 1.493 25158 2006 1 6 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.124 -0.303 25158 2007 1 6 . 1 1 11 11 ASP CB C 11 41.114 41.114 42.141 -1.026 25158 2008 1 6 . 1 1 11 11 ASP H H 11 8.801 8.801 9.022 -0.221 25158 2009 1 6 . 1 1 12 12 GLY N N 12 112.353 112.353 107.699 4.654 25158 2010 1 6 . 1 1 12 12 GLY C C 12 173.284 173.284 173.886 -0.602 25158 2011 1 6 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.306 0.318 25158 2012 1 6 . 1 1 12 12 GLY H H 12 10.293 10.293 8.365 1.928 25158 2013 1 6 . 1 1 13 13 LYS N N 13 118.118 118.118 119.523 -1.405 25158 2014 1 6 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.511 0.148 25158 2015 1 6 . 1 1 13 13 LYS C C 13 175.595 175.595 174.706 0.889 25158 2016 1 6 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.597 -1.839 25158 2017 1 6 . 1 1 13 13 LYS CB C 13 36.339 36.339 34.940 1.399 25158 2018 1 6 . 1 1 13 13 LYS H H 13 7.848 7.848 8.277 -0.429 25158 2019 1 6 . 1 1 14 14 VAL N N 14 126.591 126.591 126.208 0.383 25158 2020 1 6 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.457 0.298 25158 2021 1 6 . 1 1 14 14 VAL C C 14 175.052 175.052 175.667 -0.615 25158 2022 1 6 . 1 1 14 14 VAL CA C 14 62.070 62.070 60.915 1.155 25158 2023 1 6 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.498 0.957 25158 2024 1 6 . 1 1 14 14 VAL H H 14 9.109 9.109 8.605 0.504 25158 2025 1 6 . 1 1 15 15 ASN N N 15 126.287 126.287 126.741 -0.454 25158 2026 1 6 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.918 -0.103 25158 2027 1 6 . 1 1 15 15 ASN C C 15 176.340 176.340 176.190 0.150 25158 2028 1 6 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.579 0.696 25158 2029 1 6 . 1 1 15 15 ASN CB C 15 39.220 39.220 40.104 -0.884 25158 2030 1 6 . 1 1 15 15 ASN H H 15 10.071 10.071 9.156 0.915 25158 2031 1 6 . 1 1 16 16 SER N N 16 113.168 113.168 115.363 -2.195 25158 2032 1 6 . 1 1 16 16 SER HA H 16 4.047 4.047 4.241 -0.194 25158 2033 1 6 . 1 1 16 16 SER C C 16 176.197 176.197 175.914 0.283 25158 2034 1 6 . 1 1 16 16 SER CA C 16 62.681 62.681 61.641 1.040 25158 2035 1 6 . 1 1 16 16 SER CB C 16 62.681 62.681 62.876 -0.195 25158 2036 1 6 . 1 1 16 16 SER H H 16 8.825 8.825 8.836 -0.011 25158 2037 1 6 . 1 1 17 17 THR N N 17 119.391 119.391 116.246 3.145 25158 2038 1 6 . 1 1 17 17 THR HA H 17 3.983 3.983 4.098 -0.115 25158 2039 1 6 . 1 1 17 17 THR C C 17 177.149 177.149 176.345 0.804 25158 2040 1 6 . 1 1 17 17 THR CA C 17 66.791 66.791 65.830 0.961 25158 2041 1 6 . 1 1 17 17 THR CB C 17 67.757 67.757 68.088 -0.331 25158 2042 1 6 . 1 1 17 17 THR H H 17 7.946 7.946 8.245 -0.299 25158 2043 1 6 . 1 1 18 18 ASP N N 18 120.318 120.318 121.142 -0.824 25158 2044 1 6 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.346 0.024 25158 2045 1 6 . 1 1 18 18 ASP C C 18 177.168 177.168 177.974 -0.806 25158 2046 1 6 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.596 1.318 25158 2047 1 6 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.606 1.556 25158 2048 1 6 . 1 1 18 18 ASP H H 18 7.995 7.995 7.983 0.012 25158 2049 1 6 . 1 1 19 19 ALA N N 19 120.191 120.191 123.245 -3.054 25158 2050 1 6 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.113 -0.065 25158 2051 1 6 . 1 1 19 19 ALA C C 19 179.549 179.549 179.014 0.535 25158 2052 1 6 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.099 0.314 25158 2053 1 6 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.608 -1.296 25158 2054 1 6 . 1 1 19 19 ALA H H 19 7.085 7.085 7.305 -0.220 25158 2055 1 6 . 1 1 20 20 VAL N N 20 120.613 120.613 118.975 1.638 25158 2056 1 6 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.613 -0.002 25158 2057 1 6 . 1 1 20 20 VAL C C 20 178.153 178.153 177.346 0.807 25158 2058 1 6 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.694 1.073 25158 2059 1 6 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.739 0.129 25158 2060 1 6 . 1 1 20 20 VAL H H 20 7.835 7.835 7.567 0.268 25158 2061 1 6 . 1 1 21 21 ALA N N 21 121.767 121.767 122.162 -0.395 25158 2062 1 6 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.072 -0.011 25158 2063 1 6 . 1 1 21 21 ALA C C 21 179.298 179.298 179.439 -0.141 25158 2064 1 6 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.317 -0.073 25158 2065 1 6 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.198 -0.409 25158 2066 1 6 . 1 1 21 21 ALA H H 21 7.804 7.804 7.976 -0.172 25158 2067 1 6 . 1 1 22 22 LEU N N 22 117.555 117.555 119.406 -1.851 25158 2068 1 6 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.097 0.049 25158 2069 1 6 . 1 1 22 22 LEU C C 22 177.914 177.914 178.318 -0.404 25158 2070 1 6 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.472 0.221 25158 2071 1 6 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.696 -0.181 25158 2072 1 6 . 1 1 22 22 LEU H H 22 8.619 8.619 7.585 1.034 25158 2073 1 6 . 1 1 23 23 LYS N N 23 120.335 120.335 120.061 0.274 25158 2074 1 6 . 1 1 23 23 LYS HA H 23 3.919 3.919 4.032 -0.113 25158 2075 1 6 . 1 1 23 23 LYS C C 23 177.731 177.731 179.043 -1.312 25158 2076 1 6 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.457 0.880 25158 2077 1 6 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.189 -0.091 25158 2078 1 6 . 1 1 23 23 LYS H H 23 8.230 8.230 7.847 0.383 25158 2079 1 6 . 1 1 24 24 ARG N N 24 116.831 116.831 118.230 -1.399 25158 2080 1 6 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.045 -0.086 25158 2081 1 6 . 1 1 24 24 ARG C C 24 178.616 178.616 178.882 -0.266 25158 2082 1 6 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.580 0.377 25158 2083 1 6 . 1 1 24 24 ARG CB C 24 29.563 29.563 29.798 -0.235 25158 2084 1 6 . 1 1 24 24 ARG H H 24 7.927 7.927 7.965 -0.038 25158 2085 1 6 . 1 1 25 25 TYR N N 25 120.960 120.960 121.254 -0.294 25158 2086 1 6 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.188 0.022 25158 2087 1 6 . 1 1 25 25 TYR C C 25 179.465 179.465 178.525 0.940 25158 2088 1 6 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.487 0.358 25158 2089 1 6 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.466 0.599 25158 2090 1 6 . 1 1 25 25 TYR H H 25 8.321 8.321 7.811 0.510 25158 2091 1 6 . 1 1 26 26 VAL N N 26 120.405 120.405 117.206 3.199 25158 2092 1 6 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.773 0.001 25158 2093 1 6 . 1 1 26 26 VAL C C 26 177.826 177.826 177.178 0.648 25158 2094 1 6 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.159 0.281 25158 2095 1 6 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.237 0.320 25158 2096 1 6 . 1 1 26 26 VAL H H 26 8.803 8.803 7.920 0.883 25158 2097 1 6 . 1 1 27 27 LEU N N 27 119.247 119.247 117.657 1.590 25158 2098 1 6 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.343 -0.067 25158 2099 1 6 . 1 1 27 27 LEU C C 27 176.753 176.753 176.055 0.698 25158 2100 1 6 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.316 1.359 25158 2101 1 6 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.228 -0.635 25158 2102 1 6 . 1 1 27 27 LEU H H 27 7.898 7.898 7.703 0.195 25158 2103 1 6 . 1 1 28 28 ARG N N 28 116.082 116.082 117.792 -1.710 25158 2104 1 6 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.863 0.251 25158 2105 1 6 . 1 1 28 28 ARG C C 28 176.521 176.521 175.919 0.602 25158 2106 1 6 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.009 -0.855 25158 2107 1 6 . 1 1 28 28 ARG CB C 28 27.471 27.471 26.884 0.587 25158 2108 1 6 . 1 1 28 28 ARG H H 28 7.993 7.993 7.698 0.295 25158 2109 1 6 . 1 1 29 29 SER N N 29 113.579 113.579 114.892 -1.313 25158 2110 1 6 . 1 1 29 29 SER HA H 29 4.305 4.305 4.405 -0.100 25158 2111 1 6 . 1 1 29 29 SER C C 29 175.368 175.368 175.459 -0.091 25158 2112 1 6 . 1 1 29 29 SER CA C 29 59.699 59.699 60.343 -0.644 25158 2113 1 6 . 1 1 29 29 SER CB C 29 63.908 63.908 64.058 -0.150 25158 2114 1 6 . 1 1 29 29 SER H H 29 8.094 8.094 8.480 -0.386 25158 2115 1 6 . 1 1 30 30 GLY N N 30 109.920 109.920 109.125 0.795 25158 2116 1 6 . 1 1 30 30 GLY C C 30 174.115 174.115 173.541 0.574 25158 2117 1 6 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.837 0.934 25158 2118 1 6 . 1 1 30 30 GLY H H 30 8.577 8.577 8.367 0.210 25158 2119 1 6 . 1 1 31 31 ILE N N 31 119.084 119.084 119.696 -0.612 25158 2120 1 6 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.386 -0.028 25158 2121 1 6 . 1 1 31 31 ILE C C 31 174.392 174.392 174.818 -0.426 25158 2122 1 6 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.011 0.234 25158 2123 1 6 . 1 1 31 31 ILE CB C 31 39.579 39.579 40.118 -0.539 25158 2124 1 6 . 1 1 31 31 ILE H H 31 7.387 7.387 7.839 -0.452 25158 2125 1 6 . 1 1 32 32 SER N N 32 120.582 120.582 124.113 -3.531 25158 2126 1 6 . 1 1 32 32 SER HA H 32 4.845 4.845 4.656 0.189 25158 2127 1 6 . 1 1 32 32 SER C C 32 173.891 173.891 174.099 -0.208 25158 2128 1 6 . 1 1 32 32 SER CA C 32 57.603 57.603 58.417 -0.814 25158 2129 1 6 . 1 1 32 32 SER CB C 32 63.849 63.849 63.595 0.254 25158 2130 1 6 . 1 1 32 32 SER H H 32 8.339 8.339 8.622 -0.283 25158 2131 1 6 . 1 1 33 33 ILE N N 33 116.629 116.629 119.458 -2.829 25158 2132 1 6 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.435 0.198 25158 2133 1 6 . 1 1 33 33 ILE C C 33 174.195 174.195 173.812 0.383 25158 2134 1 6 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.298 -0.186 25158 2135 1 6 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.569 2.013 25158 2136 1 6 . 1 1 33 33 ILE H H 33 7.873 7.873 7.750 0.123 25158 2137 1 6 . 1 1 34 34 ASN N N 34 118.342 118.342 120.320 -1.978 25158 2138 1 6 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.811 -0.075 25158 2139 1 6 . 1 1 34 34 ASN C C 34 176.217 176.217 176.174 0.043 25158 2140 1 6 . 1 1 34 34 ASN CA C 34 52.186 52.186 53.113 -0.927 25158 2141 1 6 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.868 -2.369 25158 2142 1 6 . 1 1 34 34 ASN H H 34 8.839 8.839 8.232 0.607 25158 2143 1 6 . 1 1 35 35 THR N N 35 116.120 116.120 117.392 -1.272 25158 2144 1 6 . 1 1 35 35 THR HA H 35 3.559 3.559 3.968 -0.409 25158 2145 1 6 . 1 1 35 35 THR C C 35 177.347 177.347 175.772 1.575 25158 2146 1 6 . 1 1 35 35 THR CA C 35 64.686 64.686 65.618 -0.933 25158 2147 1 6 . 1 1 35 35 THR CB C 35 67.758 67.758 68.959 -1.201 25158 2148 1 6 . 1 1 35 35 THR H H 35 7.939 7.939 8.218 -0.279 25158 2149 1 6 . 1 1 36 36 ASP N N 36 123.528 123.528 122.513 1.015 25158 2150 1 6 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.373 0.047 25158 2151 1 6 . 1 1 36 36 ASP C C 36 177.752 177.752 177.185 0.567 25158 2152 1 6 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.295 -0.221 25158 2153 1 6 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.500 -0.602 25158 2154 1 6 . 1 1 36 36 ASP H H 36 7.980 7.980 8.811 -0.831 25158 2155 1 6 . 1 1 37 37 ASN N N 37 115.690 115.690 116.532 -0.842 25158 2156 1 6 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.609 -0.343 25158 2157 1 6 . 1 1 37 37 ASN C C 37 175.589 175.589 177.159 -1.570 25158 2158 1 6 . 1 1 37 37 ASN CA C 37 52.560 52.560 55.000 -2.440 25158 2159 1 6 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.372 -0.409 25158 2160 1 6 . 1 1 37 37 ASN H H 37 7.251 7.251 8.255 -1.004 25158 2161 1 6 . 1 1 38 38 ALA N N 38 119.560 119.560 122.884 -3.324 25158 2162 1 6 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.049 0.031 25158 2163 1 6 . 1 1 38 38 ALA C C 38 173.638 173.638 177.374 -3.736 25158 2164 1 6 . 1 1 38 38 ALA CA C 38 52.220 52.220 53.961 -1.741 25158 2165 1 6 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.741 4.130 25158 2166 1 6 . 1 1 38 38 ALA H H 38 7.142 7.142 7.761 -0.619 25158 2167 1 6 . 1 1 39 39 ASP N N 39 115.003 115.003 119.482 -4.479 25158 2168 1 6 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.516 0.424 25158 2169 1 6 . 1 1 39 39 ASP C C 39 177.163 177.163 176.591 0.572 25158 2170 1 6 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.946 -2.775 25158 2171 1 6 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.746 -0.800 25158 2172 1 6 . 1 1 39 39 ASP H H 39 7.096 7.096 7.983 -0.887 25158 2173 1 6 . 1 1 40 40 LEU N N 40 123.245 123.245 124.211 -0.966 25158 2174 1 6 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.425 -0.354 25158 2175 1 6 . 1 1 40 40 LEU C C 40 175.865 175.865 177.562 -1.697 25158 2176 1 6 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.972 0.621 25158 2177 1 6 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.255 -0.326 25158 2178 1 6 . 1 1 40 40 LEU H H 40 8.572 8.572 8.014 0.558 25158 2179 1 6 . 1 1 41 41 ASN N N 41 112.723 112.723 114.115 -1.392 25158 2180 1 6 . 1 1 41 41 ASN HA H 41 4.999 4.999 5.019 -0.020 25158 2181 1 6 . 1 1 41 41 ASN C C 41 173.846 173.846 175.212 -1.366 25158 2182 1 6 . 1 1 41 41 ASN CA C 41 51.233 51.233 51.911 -0.678 25158 2183 1 6 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.198 -1.803 25158 2184 1 6 . 1 1 41 41 ASN H H 41 8.004 8.004 7.853 0.151 25158 2185 1 6 . 1 1 42 42 GLU N N 42 115.798 115.798 115.666 0.132 25158 2186 1 6 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.277 -0.325 25158 2187 1 6 . 1 1 42 42 GLU C C 42 175.172 175.172 175.719 -0.547 25158 2188 1 6 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.437 -0.086 25158 2189 1 6 . 1 1 42 42 GLU CB C 42 28.221 28.221 26.953 1.268 25158 2190 1 6 . 1 1 42 42 GLU H H 42 7.642 7.642 8.594 -0.952 25158 2191 1 6 . 1 1 43 43 ASP N N 43 117.453 117.453 116.933 0.520 25158 2192 1 6 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.518 0.321 25158 2193 1 6 . 1 1 43 43 ASP C C 43 178.129 178.129 177.321 0.808 25158 2194 1 6 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.718 -1.079 25158 2195 1 6 . 1 1 43 43 ASP CB C 43 41.214 41.214 40.881 0.333 25158 2196 1 6 . 1 1 43 43 ASP H H 43 8.473 8.473 8.644 -0.171 25158 2197 1 6 . 1 1 44 44 GLY N N 44 112.490 112.490 107.584 4.906 25158 2198 1 6 . 1 1 44 44 GLY C C 44 173.717 173.717 173.686 0.031 25158 2199 1 6 . 1 1 44 44 GLY CA C 44 45.317 45.317 45.029 0.288 25158 2200 1 6 . 1 1 44 44 GLY H H 44 10.139 10.139 8.478 1.661 25158 2201 1 6 . 1 1 45 45 ARG N N 45 118.154 118.154 116.635 1.519 25158 2202 1 6 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.702 0.086 25158 2203 1 6 . 1 1 45 45 ARG C C 45 175.602 175.602 173.908 1.694 25158 2204 1 6 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.707 -0.875 25158 2205 1 6 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.440 1.224 25158 2206 1 6 . 1 1 45 45 ARG H H 45 7.994 7.994 8.791 -0.797 25158 2207 1 6 . 1 1 46 46 VAL N N 46 126.392 126.392 123.536 2.856 25158 2208 1 6 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.653 0.137 25158 2209 1 6 . 1 1 46 46 VAL C C 46 174.644 174.644 175.414 -0.770 25158 2210 1 6 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.289 -0.560 25158 2211 1 6 . 1 1 46 46 VAL CB C 46 31.666 31.666 31.010 0.656 25158 2212 1 6 . 1 1 46 46 VAL H H 46 9.115 9.115 8.630 0.485 25158 2213 1 6 . 1 1 47 47 ASN N N 47 126.737 126.737 126.831 -0.094 25158 2214 1 6 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.996 -0.121 25158 2215 1 6 . 1 1 47 47 ASN C C 47 176.467 176.467 175.921 0.546 25158 2216 1 6 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.256 0.784 25158 2217 1 6 . 1 1 47 47 ASN CB C 47 39.187 39.187 38.953 0.234 25158 2218 1 6 . 1 1 47 47 ASN H H 47 10.077 10.077 9.145 0.932 25158 2219 1 6 . 1 1 48 48 SER N N 48 113.409 113.409 114.871 -1.462 25158 2220 1 6 . 1 1 48 48 SER HA H 48 4.086 4.086 4.232 -0.146 25158 2221 1 6 . 1 1 48 48 SER C C 48 176.671 176.671 176.190 0.481 25158 2222 1 6 . 1 1 48 48 SER CA C 48 62.375 62.375 61.779 0.596 25158 2223 1 6 . 1 1 48 48 SER CB C 48 62.375 62.375 62.952 -0.577 25158 2224 1 6 . 1 1 48 48 SER H H 48 8.936 8.936 8.813 0.123 25158 2225 1 6 . 1 1 49 49 THR N N 49 121.885 121.885 118.164 3.721 25158 2226 1 6 . 1 1 49 49 THR HA H 49 4.112 4.112 3.939 0.173 25158 2227 1 6 . 1 1 49 49 THR C C 49 177.320 177.320 176.467 0.853 25158 2228 1 6 . 1 1 49 49 THR CA C 49 66.713 66.713 67.024 -0.311 25158 2229 1 6 . 1 1 49 49 THR CB C 49 67.787 67.787 68.306 -0.519 25158 2230 1 6 . 1 1 49 49 THR H H 49 8.124 8.124 8.169 -0.045 25158 2231 1 6 . 1 1 50 50 ASP N N 50 120.401 120.401 121.884 -1.483 25158 2232 1 6 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.372 -0.002 25158 2233 1 6 . 1 1 50 50 ASP C C 50 177.033 177.033 178.260 -1.227 25158 2234 1 6 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.429 1.391 25158 2235 1 6 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.383 1.325 25158 2236 1 6 . 1 1 50 50 ASP H H 50 7.560 7.560 7.950 -0.390 25158 2237 1 6 . 1 1 51 51 LEU N N 51 118.174 118.174 120.988 -2.814 25158 2238 1 6 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.042 0.146 25158 2239 1 6 . 1 1 51 51 LEU C C 51 177.441 177.441 178.540 -1.099 25158 2240 1 6 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.934 0.203 25158 2241 1 6 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.758 0.089 25158 2242 1 6 . 1 1 51 51 LEU H H 51 7.134 7.134 7.572 -0.438 25158 2243 1 6 . 1 1 52 52 GLY N N 52 105.596 105.596 106.833 -1.237 25158 2244 1 6 . 1 1 52 52 GLY C C 52 176.764 176.764 175.840 0.924 25158 2245 1 6 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.032 0.610 25158 2246 1 6 . 1 1 52 52 GLY H H 52 8.034 8.034 7.893 0.141 25158 2247 1 6 . 1 1 53 53 ILE N N 53 122.043 122.043 122.491 -0.448 25158 2248 1 6 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.701 -0.252 25158 2249 1 6 . 1 1 53 53 ILE C C 53 177.112 177.112 177.592 -0.480 25158 2250 1 6 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.408 0.980 25158 2251 1 6 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.955 0.303 25158 2252 1 6 . 1 1 53 53 ILE H H 53 7.611 7.611 7.656 -0.045 25158 2253 1 6 . 1 1 54 54 LEU N N 54 120.787 120.787 121.489 -0.702 25158 2254 1 6 . 1 1 54 54 LEU HA H 54 3.941 3.941 4.021 -0.080 25158 2255 1 6 . 1 1 54 54 LEU C C 54 175.340 175.340 178.324 -2.984 25158 2256 1 6 . 1 1 54 54 LEU CA C 54 58.195 58.195 59.059 -0.864 25158 2257 1 6 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.899 -0.678 25158 2258 1 6 . 1 1 54 54 LEU H H 54 8.323 8.323 8.198 0.125 25158 2259 1 6 . 1 1 55 55 LYS N N 55 116.833 116.833 119.168 -2.335 25158 2260 1 6 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.938 -0.054 25158 2261 1 6 . 1 1 55 55 LYS C C 55 179.067 179.067 179.153 -0.086 25158 2262 1 6 . 1 1 55 55 LYS CA C 55 60.651 60.651 60.065 0.586 25158 2263 1 6 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.276 -0.267 25158 2264 1 6 . 1 1 55 55 LYS H H 55 8.356 8.356 7.700 0.656 25158 2265 1 6 . 1 1 56 56 ARG N N 56 117.092 117.092 118.878 -1.786 25158 2266 1 6 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.981 -0.065 25158 2267 1 6 . 1 1 56 56 ARG C C 56 178.223 178.223 178.495 -0.272 25158 2268 1 6 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.528 0.823 25158 2269 1 6 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.279 0.501 25158 2270 1 6 . 1 1 56 56 ARG H H 56 7.543 7.543 7.700 -0.157 25158 2271 1 6 . 1 1 57 57 TYR N N 57 122.187 122.187 121.587 0.600 25158 2272 1 6 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.495 -0.103 25158 2273 1 6 . 1 1 57 57 TYR C C 57 180.009 180.009 178.702 1.307 25158 2274 1 6 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.026 0.553 25158 2275 1 6 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.432 0.404 25158 2276 1 6 . 1 1 57 57 TYR H H 57 8.592 8.592 7.927 0.665 25158 2277 1 6 . 1 1 58 58 ILE N N 58 122.825 122.825 117.976 4.849 25158 2278 1 6 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.698 -0.018 25158 2279 1 6 . 1 1 58 58 ILE C C 58 178.186 178.186 177.132 1.054 25158 2280 1 6 . 1 1 58 58 ILE CA C 58 64.768 64.768 64.369 0.399 25158 2281 1 6 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.152 -0.432 25158 2282 1 6 . 1 1 58 58 ILE H H 58 8.779 8.779 8.291 0.488 25158 2283 1 6 . 1 1 59 59 LEU N N 59 118.552 118.552 118.334 0.218 25158 2284 1 6 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.331 -0.108 25158 2285 1 6 . 1 1 59 59 LEU C C 59 175.937 175.937 175.954 -0.017 25158 2286 1 6 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.339 1.173 25158 2287 1 6 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.723 0.703 25158 2288 1 6 . 1 1 59 59 LEU H H 59 7.539 7.539 7.516 0.023 25158 2289 1 6 . 1 1 60 60 LYS N N 60 113.650 113.650 116.753 -3.103 25158 2290 1 6 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.826 0.169 25158 2291 1 6 . 1 1 60 60 LYS C C 60 176.535 176.535 176.169 0.366 25158 2292 1 6 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.789 -0.499 25158 2293 1 6 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.857 -1.586 25158 2294 1 6 . 1 1 60 60 LYS H H 60 7.815 7.815 7.469 0.346 25158 2295 1 6 . 1 1 61 61 GLU N N 61 117.535 117.535 116.235 1.300 25158 2296 1 6 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.314 -0.170 25158 2297 1 6 . 1 1 61 61 GLU C C 61 176.992 176.992 176.644 0.348 25158 2298 1 6 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.835 -0.146 25158 2299 1 6 . 1 1 61 61 GLU CB C 61 30.692 30.692 30.923 -0.231 25158 2300 1 6 . 1 1 61 61 GLU H H 61 8.438 8.438 8.048 0.390 25158 2301 1 6 . 1 1 62 62 ILE N N 62 112.102 112.102 115.940 -3.838 25158 2302 1 6 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.501 -0.118 25158 2303 1 6 . 1 1 62 62 ILE C C 62 175.425 175.425 174.742 0.683 25158 2304 1 6 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.306 -0.380 25158 2305 1 6 . 1 1 62 62 ILE CB C 62 41.748 41.748 39.796 1.952 25158 2306 1 6 . 1 1 62 62 ILE H H 62 6.867 6.867 7.287 -0.420 25158 2307 1 6 . 1 1 63 63 ASP N N 63 119.719 119.719 124.752 -5.033 25158 2308 1 6 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.941 -0.267 25158 2309 1 6 . 1 1 63 63 ASP C C 63 176.202 176.202 175.911 0.291 25158 2310 1 6 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.319 1.499 25158 2311 1 6 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.279 0.938 25158 2312 1 6 . 1 1 63 63 ASP H H 63 8.561 8.561 8.895 -0.334 25158 2313 1 6 . 1 1 64 64 THR N N 64 113.289 113.289 117.039 -3.750 25158 2314 1 6 . 1 1 64 64 THR HA H 64 4.712 4.712 4.551 0.161 25158 2315 1 6 . 1 1 64 64 THR C C 64 170.854 170.854 172.976 -2.122 25158 2316 1 6 . 1 1 64 64 THR CA C 64 61.269 61.269 62.150 -0.881 25158 2317 1 6 . 1 1 64 64 THR CB C 64 71.993 71.993 69.104 2.889 25158 2318 1 6 . 1 1 64 64 THR H H 64 7.410 7.410 7.724 -0.314 25158 2319 1 6 . 1 1 65 65 LEU N N 65 121.012 121.012 127.530 -6.518 25158 2320 1 6 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.687 -0.458 25158 2321 1 6 . 1 1 65 65 LEU C C 65 174.763 174.763 174.763 0.000 25158 2322 1 6 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.666 -0.032 25158 2323 1 6 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.500 0.020 25158 2324 1 6 . 1 1 65 65 LEU H H 65 7.877 7.877 8.376 -0.499 25158 2325 1 6 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.145 -0.153 25158 2326 1 6 . 1 1 66 66 PRO C C 66 174.419 174.419 175.132 -0.713 25158 2327 1 6 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.010 0.300 25158 2328 1 6 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.386 2.840 25158 2329 1 6 . 1 1 67 67 TYR N N 67 122.616 122.616 122.545 0.071 25158 2330 1 6 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.242 0.414 25158 2331 1 6 . 1 1 67 67 TYR C C 67 174.446 174.446 174.905 -0.459 25158 2332 1 6 . 1 1 67 67 TYR CA C 67 58.011 58.011 57.971 0.040 25158 2333 1 6 . 1 1 67 67 TYR CB C 67 41.081 41.081 38.093 2.988 25158 2334 1 6 . 1 1 67 67 TYR H H 67 8.662 8.662 8.122 0.540 25158 2335 1 6 . 1 1 68 68 LYS N N 68 126.223 126.223 129.422 -3.199 25158 2336 1 6 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.280 -0.012 25158 2337 1 6 . 1 1 68 68 LYS C C 68 174.748 174.748 175.501 -0.753 25158 2338 1 6 . 1 1 68 68 LYS CA C 68 55.603 55.603 54.459 1.145 25158 2339 1 6 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.945 0.825 25158 2340 1 6 . 1 1 68 68 LYS H H 68 8.112 8.112 8.159 -0.047 25158 2341 1 7 . 1 1 2 2 THR N N 2 116.700 116.700 115.646 1.054 25158 2342 1 7 . 1 1 2 2 THR HA H 2 4.313 4.313 4.514 -0.201 25158 2343 1 7 . 1 1 2 2 THR C C 2 173.968 173.968 174.592 -0.624 25158 2344 1 7 . 1 1 2 2 THR CA C 2 62.326 62.326 60.583 1.743 25158 2345 1 7 . 1 1 2 2 THR CB C 2 70.154 70.154 70.533 -0.379 25158 2346 1 7 . 1 1 2 2 THR H H 2 8.657 8.657 8.385 0.272 25158 2347 1 7 . 1 1 3 3 LYS N N 3 125.500 125.500 123.786 1.714 25158 2348 1 7 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.307 -0.242 25158 2349 1 7 . 1 1 3 3 LYS C C 3 174.926 174.926 175.457 -0.531 25158 2350 1 7 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.459 0.380 25158 2351 1 7 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.404 1.373 25158 2352 1 7 . 1 1 3 3 LYS H H 3 8.318 8.318 8.346 -0.028 25158 2353 1 7 . 1 1 4 4 LEU N N 4 127.473 127.473 124.085 3.388 25158 2354 1 7 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.398 0.085 25158 2355 1 7 . 1 1 4 4 LEU C C 4 174.734 174.734 175.632 -0.898 25158 2356 1 7 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.342 -0.083 25158 2357 1 7 . 1 1 4 4 LEU CB C 4 40.929 40.929 44.428 -3.499 25158 2358 1 7 . 1 1 4 4 LEU H H 4 7.726 7.726 8.049 -0.323 25158 2359 1 7 . 1 1 5 5 TYR N N 5 123.074 123.074 125.196 -2.122 25158 2360 1 7 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.395 -0.772 25158 2361 1 7 . 1 1 5 5 TYR C C 5 175.406 175.406 176.700 -1.294 25158 2362 1 7 . 1 1 5 5 TYR CA C 5 61.812 61.812 59.510 2.302 25158 2363 1 7 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.674 2.436 25158 2364 1 7 . 1 1 5 5 TYR H H 5 7.816 7.816 8.688 -0.872 25158 2365 1 7 . 1 1 6 6 GLY N N 6 108.614 108.614 114.546 -5.932 25158 2366 1 7 . 1 1 6 6 GLY C C 6 172.585 172.585 173.807 -1.222 25158 2367 1 7 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.626 0.761 25158 2368 1 7 . 1 1 6 6 GLY H H 6 8.915 8.915 8.746 0.169 25158 2369 1 7 . 1 1 7 7 ASP N N 7 118.023 118.023 124.265 -6.242 25158 2370 1 7 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.798 0.186 25158 2371 1 7 . 1 1 7 7 ASP C C 7 177.806 177.806 177.348 0.458 25158 2372 1 7 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.486 -1.294 25158 2373 1 7 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.715 -0.565 25158 2374 1 7 . 1 1 7 7 ASP H H 7 7.976 7.976 7.855 0.121 25158 2375 1 7 . 1 1 8 8 VAL N N 8 120.293 120.293 118.887 1.406 25158 2376 1 7 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.184 -0.201 25158 2377 1 7 . 1 1 8 8 VAL C C 8 175.717 175.717 176.657 -0.940 25158 2378 1 7 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.642 -0.196 25158 2379 1 7 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.903 -0.632 25158 2380 1 7 . 1 1 8 8 VAL H H 8 8.156 8.156 7.987 0.169 25158 2381 1 7 . 1 1 9 9 ASN N N 9 115.226 115.226 116.903 -1.677 25158 2382 1 7 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.563 0.426 25158 2383 1 7 . 1 1 9 9 ASN C C 9 174.626 174.626 174.636 -0.010 25158 2384 1 7 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.561 -1.611 25158 2385 1 7 . 1 1 9 9 ASN CB C 9 37.701 37.701 37.984 -0.283 25158 2386 1 7 . 1 1 9 9 ASN H H 9 8.008 8.008 8.497 -0.489 25158 2387 1 7 . 1 1 10 10 ASP N N 10 115.600 115.600 114.980 0.620 25158 2388 1 7 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.511 -0.075 25158 2389 1 7 . 1 1 10 10 ASP C C 10 175.125 175.125 175.373 -0.248 25158 2390 1 7 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.057 1.178 25158 2391 1 7 . 1 1 10 10 ASP CB C 10 40.200 40.200 38.316 1.885 25158 2392 1 7 . 1 1 10 10 ASP H H 10 7.374 7.374 8.135 -0.761 25158 2393 1 7 . 1 1 11 11 ASP N N 11 118.402 118.402 117.478 0.924 25158 2394 1 7 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.598 0.219 25158 2395 1 7 . 1 1 11 11 ASP C C 11 178.299 178.299 177.395 0.904 25158 2396 1 7 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.492 -0.672 25158 2397 1 7 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.507 -0.393 25158 2398 1 7 . 1 1 11 11 ASP H H 11 8.801 8.801 8.818 -0.017 25158 2399 1 7 . 1 1 12 12 GLY N N 12 112.353 112.353 107.778 4.575 25158 2400 1 7 . 1 1 12 12 GLY C C 12 173.284 173.284 173.901 -0.617 25158 2401 1 7 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.280 0.344 25158 2402 1 7 . 1 1 12 12 GLY H H 12 10.293 10.293 8.439 1.854 25158 2403 1 7 . 1 1 13 13 LYS N N 13 118.118 118.118 119.461 -1.343 25158 2404 1 7 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.469 0.190 25158 2405 1 7 . 1 1 13 13 LYS C C 13 175.595 175.595 174.765 0.830 25158 2406 1 7 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.167 -1.409 25158 2407 1 7 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.736 0.603 25158 2408 1 7 . 1 1 13 13 LYS H H 13 7.848 7.848 8.819 -0.971 25158 2409 1 7 . 1 1 14 14 VAL N N 14 126.591 126.591 125.179 1.412 25158 2410 1 7 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.171 0.584 25158 2411 1 7 . 1 1 14 14 VAL C C 14 175.052 175.052 175.258 -0.206 25158 2412 1 7 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.487 -0.417 25158 2413 1 7 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.344 1.111 25158 2414 1 7 . 1 1 14 14 VAL H H 14 9.109 9.109 8.607 0.502 25158 2415 1 7 . 1 1 15 15 ASN N N 15 126.287 126.287 126.274 0.013 25158 2416 1 7 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.958 -0.143 25158 2417 1 7 . 1 1 15 15 ASN C C 15 176.340 176.340 176.727 -0.387 25158 2418 1 7 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.839 0.436 25158 2419 1 7 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.925 -2.705 25158 2420 1 7 . 1 1 15 15 ASN H H 15 10.071 10.071 9.193 0.878 25158 2421 1 7 . 1 1 16 16 SER N N 16 113.168 113.168 117.119 -3.951 25158 2422 1 7 . 1 1 16 16 SER HA H 16 4.047 4.047 4.322 -0.275 25158 2423 1 7 . 1 1 16 16 SER C C 16 176.197 176.197 176.030 0.167 25158 2424 1 7 . 1 1 16 16 SER CA C 16 62.681 62.681 61.876 0.805 25158 2425 1 7 . 1 1 16 16 SER CB C 16 62.681 62.681 62.600 0.081 25158 2426 1 7 . 1 1 16 16 SER H H 16 8.825 8.825 8.834 -0.009 25158 2427 1 7 . 1 1 17 17 THR N N 17 119.391 119.391 117.586 1.805 25158 2428 1 7 . 1 1 17 17 THR HA H 17 3.983 3.983 4.093 -0.110 25158 2429 1 7 . 1 1 17 17 THR C C 17 177.149 177.149 176.756 0.393 25158 2430 1 7 . 1 1 17 17 THR CA C 17 66.791 66.791 66.599 0.192 25158 2431 1 7 . 1 1 17 17 THR CB C 17 67.757 67.757 68.181 -0.424 25158 2432 1 7 . 1 1 17 17 THR H H 17 7.946 7.946 8.336 -0.390 25158 2433 1 7 . 1 1 18 18 ASP N N 18 120.318 120.318 121.217 -0.899 25158 2434 1 7 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.456 -0.086 25158 2435 1 7 . 1 1 18 18 ASP C C 18 177.168 177.168 177.827 -0.659 25158 2436 1 7 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.595 1.319 25158 2437 1 7 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.564 1.598 25158 2438 1 7 . 1 1 18 18 ASP H H 18 7.995 7.995 7.829 0.166 25158 2439 1 7 . 1 1 19 19 ALA N N 19 120.191 120.191 122.923 -2.732 25158 2440 1 7 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.174 -0.126 25158 2441 1 7 . 1 1 19 19 ALA C C 19 179.549 179.549 179.758 -0.209 25158 2442 1 7 . 1 1 19 19 ALA CA C 19 55.413 55.413 54.973 0.440 25158 2443 1 7 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.322 -1.008 25158 2444 1 7 . 1 1 19 19 ALA H H 19 7.085 7.085 7.267 -0.182 25158 2445 1 7 . 1 1 20 20 VAL N N 20 120.613 120.613 118.967 1.646 25158 2446 1 7 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.650 -0.039 25158 2447 1 7 . 1 1 20 20 VAL C C 20 178.153 178.153 177.333 0.820 25158 2448 1 7 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.467 1.300 25158 2449 1 7 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.628 0.240 25158 2450 1 7 . 1 1 20 20 VAL H H 20 7.835 7.835 7.579 0.256 25158 2451 1 7 . 1 1 21 21 ALA N N 21 121.767 121.767 122.078 -0.311 25158 2452 1 7 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.067 -0.005 25158 2453 1 7 . 1 1 21 21 ALA C C 21 179.298 179.298 179.672 -0.374 25158 2454 1 7 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.207 0.037 25158 2455 1 7 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.171 -0.382 25158 2456 1 7 . 1 1 21 21 ALA H H 21 7.804 7.804 7.899 -0.095 25158 2457 1 7 . 1 1 22 22 LEU N N 22 117.555 117.555 119.585 -2.030 25158 2458 1 7 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.094 0.052 25158 2459 1 7 . 1 1 22 22 LEU C C 22 177.914 177.914 178.591 -0.677 25158 2460 1 7 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.508 0.185 25158 2461 1 7 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.651 -0.136 25158 2462 1 7 . 1 1 22 22 LEU H H 22 8.619 8.619 7.718 0.901 25158 2463 1 7 . 1 1 23 23 LYS N N 23 120.335 120.335 119.300 1.035 25158 2464 1 7 . 1 1 23 23 LYS HA H 23 3.919 3.919 4.008 -0.089 25158 2465 1 7 . 1 1 23 23 LYS C C 23 177.731 177.731 179.353 -1.622 25158 2466 1 7 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.263 1.074 25158 2467 1 7 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.083 0.015 25158 2468 1 7 . 1 1 23 23 LYS H H 23 8.230 8.230 7.599 0.631 25158 2469 1 7 . 1 1 24 24 ARG N N 24 116.831 116.831 117.778 -0.947 25158 2470 1 7 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.075 -0.116 25158 2471 1 7 . 1 1 24 24 ARG C C 24 178.616 178.616 179.126 -0.510 25158 2472 1 7 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.067 0.890 25158 2473 1 7 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.113 -0.550 25158 2474 1 7 . 1 1 24 24 ARG H H 24 7.927 7.927 7.696 0.231 25158 2475 1 7 . 1 1 25 25 TYR N N 25 120.960 120.960 121.909 -0.949 25158 2476 1 7 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.235 -0.025 25158 2477 1 7 . 1 1 25 25 TYR C C 25 179.465 179.465 178.176 1.289 25158 2478 1 7 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.367 0.478 25158 2479 1 7 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.486 0.579 25158 2480 1 7 . 1 1 25 25 TYR H H 25 8.321 8.321 7.595 0.726 25158 2481 1 7 . 1 1 26 26 VAL N N 26 120.405 120.405 119.021 1.384 25158 2482 1 7 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.665 0.109 25158 2483 1 7 . 1 1 26 26 VAL C C 26 177.826 177.826 177.479 0.347 25158 2484 1 7 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.566 -0.126 25158 2485 1 7 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.670 -0.113 25158 2486 1 7 . 1 1 26 26 VAL H H 26 8.803 8.803 7.883 0.919 25158 2487 1 7 . 1 1 27 27 LEU N N 27 119.247 119.247 118.201 1.046 25158 2488 1 7 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.179 0.097 25158 2489 1 7 . 1 1 27 27 LEU C C 27 176.753 176.753 176.441 0.312 25158 2490 1 7 . 1 1 27 27 LEU CA C 27 55.675 55.675 55.315 0.360 25158 2491 1 7 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.428 -0.836 25158 2492 1 7 . 1 1 27 27 LEU H H 27 7.898 7.898 7.438 0.460 25158 2493 1 7 . 1 1 28 28 ARG N N 28 116.082 116.082 118.318 -2.236 25158 2494 1 7 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.886 0.228 25158 2495 1 7 . 1 1 28 28 ARG C C 28 176.521 176.521 175.937 0.584 25158 2496 1 7 . 1 1 28 28 ARG CA C 28 56.154 56.154 56.907 -0.753 25158 2497 1 7 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.412 0.059 25158 2498 1 7 . 1 1 28 28 ARG H H 28 7.993 7.993 7.684 0.309 25158 2499 1 7 . 1 1 29 29 SER N N 29 113.579 113.579 114.408 -0.829 25158 2500 1 7 . 1 1 29 29 SER HA H 29 4.305 4.305 4.521 -0.216 25158 2501 1 7 . 1 1 29 29 SER C C 29 175.368 175.368 175.112 0.256 25158 2502 1 7 . 1 1 29 29 SER CA C 29 59.699 59.699 57.967 1.732 25158 2503 1 7 . 1 1 29 29 SER CB C 29 63.908 63.908 63.640 0.268 25158 2504 1 7 . 1 1 29 29 SER H H 29 8.094 8.094 7.879 0.215 25158 2505 1 7 . 1 1 30 30 GLY N N 30 109.920 109.920 110.427 -0.507 25158 2506 1 7 . 1 1 30 30 GLY C C 30 174.115 174.115 174.031 0.084 25158 2507 1 7 . 1 1 30 30 GLY CA C 30 45.771 45.771 45.657 0.114 25158 2508 1 7 . 1 1 30 30 GLY H H 30 8.577 8.577 8.326 0.251 25158 2509 1 7 . 1 1 31 31 ILE N N 31 119.084 119.084 119.865 -0.781 25158 2510 1 7 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.168 0.191 25158 2511 1 7 . 1 1 31 31 ILE C C 31 174.392 174.392 175.134 -0.742 25158 2512 1 7 . 1 1 31 31 ILE CA C 31 60.246 60.246 61.144 -0.898 25158 2513 1 7 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.041 0.538 25158 2514 1 7 . 1 1 31 31 ILE H H 31 7.387 7.387 7.680 -0.293 25158 2515 1 7 . 1 1 32 32 SER N N 32 120.582 120.582 124.284 -3.702 25158 2516 1 7 . 1 1 32 32 SER HA H 32 4.845 4.845 4.800 0.045 25158 2517 1 7 . 1 1 32 32 SER C C 32 173.891 173.891 174.182 -0.291 25158 2518 1 7 . 1 1 32 32 SER CA C 32 57.603 57.603 58.234 -0.631 25158 2519 1 7 . 1 1 32 32 SER CB C 32 63.849 63.849 63.203 0.646 25158 2520 1 7 . 1 1 32 32 SER H H 32 8.339 8.339 8.644 -0.305 25158 2521 1 7 . 1 1 33 33 ILE N N 33 116.629 116.629 120.856 -4.227 25158 2522 1 7 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.550 0.083 25158 2523 1 7 . 1 1 33 33 ILE C C 33 174.195 174.195 173.962 0.233 25158 2524 1 7 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.145 -0.034 25158 2525 1 7 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.266 2.316 25158 2526 1 7 . 1 1 33 33 ILE H H 33 7.873 7.873 7.924 -0.051 25158 2527 1 7 . 1 1 34 34 ASN N N 34 118.342 118.342 119.828 -1.486 25158 2528 1 7 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.922 -0.186 25158 2529 1 7 . 1 1 34 34 ASN C C 34 176.217 176.217 175.779 0.438 25158 2530 1 7 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.655 -0.469 25158 2531 1 7 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.641 -2.142 25158 2532 1 7 . 1 1 34 34 ASN H H 34 8.839 8.839 8.230 0.609 25158 2533 1 7 . 1 1 35 35 THR N N 35 116.120 116.120 116.119 0.001 25158 2534 1 7 . 1 1 35 35 THR HA H 35 3.559 3.559 3.985 -0.426 25158 2535 1 7 . 1 1 35 35 THR C C 35 177.347 177.347 176.057 1.290 25158 2536 1 7 . 1 1 35 35 THR CA C 35 64.686 64.686 65.895 -1.209 25158 2537 1 7 . 1 1 35 35 THR CB C 35 67.758 67.758 69.083 -1.325 25158 2538 1 7 . 1 1 35 35 THR H H 35 7.939 7.939 8.194 -0.255 25158 2539 1 7 . 1 1 36 36 ASP N N 36 123.528 123.528 122.028 1.500 25158 2540 1 7 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.375 0.045 25158 2541 1 7 . 1 1 36 36 ASP C C 36 177.752 177.752 177.444 0.308 25158 2542 1 7 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.939 -0.865 25158 2543 1 7 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.735 -0.837 25158 2544 1 7 . 1 1 36 36 ASP H H 36 7.980 7.980 8.856 -0.876 25158 2545 1 7 . 1 1 37 37 ASN N N 37 115.690 115.690 116.170 -0.480 25158 2546 1 7 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.494 -0.228 25158 2547 1 7 . 1 1 37 37 ASN C C 37 175.589 175.589 176.883 -1.294 25158 2548 1 7 . 1 1 37 37 ASN CA C 37 52.560 52.560 55.022 -2.462 25158 2549 1 7 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.204 -0.241 25158 2550 1 7 . 1 1 37 37 ASN H H 37 7.251 7.251 8.325 -1.074 25158 2551 1 7 . 1 1 38 38 ALA N N 38 119.560 119.560 122.536 -2.976 25158 2552 1 7 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.024 0.056 25158 2553 1 7 . 1 1 38 38 ALA C C 38 173.638 173.638 177.307 -3.669 25158 2554 1 7 . 1 1 38 38 ALA CA C 38 52.220 52.220 53.900 -1.680 25158 2555 1 7 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.681 4.189 25158 2556 1 7 . 1 1 38 38 ALA H H 38 7.142 7.142 7.779 -0.637 25158 2557 1 7 . 1 1 39 39 ASP N N 39 115.003 115.003 119.527 -4.524 25158 2558 1 7 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.526 0.414 25158 2559 1 7 . 1 1 39 39 ASP C C 39 177.163 177.163 176.531 0.632 25158 2560 1 7 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.646 -2.475 25158 2561 1 7 . 1 1 39 39 ASP CB C 39 38.946 38.946 40.282 -1.336 25158 2562 1 7 . 1 1 39 39 ASP H H 39 7.096 7.096 7.870 -0.774 25158 2563 1 7 . 1 1 40 40 LEU N N 40 123.245 123.245 124.606 -1.361 25158 2564 1 7 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.318 -0.247 25158 2565 1 7 . 1 1 40 40 LEU C C 40 175.865 175.865 177.417 -1.552 25158 2566 1 7 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.198 0.395 25158 2567 1 7 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.353 -0.424 25158 2568 1 7 . 1 1 40 40 LEU H H 40 8.572 8.572 8.043 0.529 25158 2569 1 7 . 1 1 41 41 ASN N N 41 112.723 112.723 114.104 -1.381 25158 2570 1 7 . 1 1 41 41 ASN HA H 41 4.999 4.999 5.068 -0.069 25158 2571 1 7 . 1 1 41 41 ASN C C 41 173.846 173.846 175.285 -1.439 25158 2572 1 7 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.575 -1.341 25158 2573 1 7 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.250 -1.855 25158 2574 1 7 . 1 1 41 41 ASN H H 41 8.004 8.004 7.991 0.013 25158 2575 1 7 . 1 1 42 42 GLU N N 42 115.798 115.798 115.661 0.137 25158 2576 1 7 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.294 -0.342 25158 2577 1 7 . 1 1 42 42 GLU C C 42 175.172 175.172 175.522 -0.350 25158 2578 1 7 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.601 -0.250 25158 2579 1 7 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.185 1.036 25158 2580 1 7 . 1 1 42 42 GLU H H 42 7.642 7.642 8.643 -1.001 25158 2581 1 7 . 1 1 43 43 ASP N N 43 117.453 117.453 118.550 -1.097 25158 2582 1 7 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.552 0.287 25158 2583 1 7 . 1 1 43 43 ASP C C 43 178.129 178.129 177.783 0.346 25158 2584 1 7 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.138 -1.500 25158 2585 1 7 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.128 0.086 25158 2586 1 7 . 1 1 43 43 ASP H H 43 8.473 8.473 8.783 -0.310 25158 2587 1 7 . 1 1 44 44 GLY N N 44 112.490 112.490 107.662 4.828 25158 2588 1 7 . 1 1 44 44 GLY C C 44 173.717 173.717 173.707 0.010 25158 2589 1 7 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.886 0.431 25158 2590 1 7 . 1 1 44 44 GLY H H 44 10.139 10.139 8.351 1.788 25158 2591 1 7 . 1 1 45 45 ARG N N 45 118.154 118.154 117.236 0.918 25158 2592 1 7 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.620 0.168 25158 2593 1 7 . 1 1 45 45 ARG C C 45 175.602 175.602 174.156 1.446 25158 2594 1 7 . 1 1 45 45 ARG CA C 45 53.832 53.832 55.151 -1.319 25158 2595 1 7 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.916 0.748 25158 2596 1 7 . 1 1 45 45 ARG H H 45 7.994 7.994 9.085 -1.091 25158 2597 1 7 . 1 1 46 46 VAL N N 46 126.392 126.392 123.258 3.134 25158 2598 1 7 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.607 0.183 25158 2599 1 7 . 1 1 46 46 VAL C C 46 174.644 174.644 175.480 -0.836 25158 2600 1 7 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.995 -0.266 25158 2601 1 7 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.986 0.680 25158 2602 1 7 . 1 1 46 46 VAL H H 46 9.115 9.115 8.528 0.587 25158 2603 1 7 . 1 1 47 47 ASN N N 47 126.737 126.737 126.303 0.434 25158 2604 1 7 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.958 -0.083 25158 2605 1 7 . 1 1 47 47 ASN C C 47 176.467 176.467 175.449 1.018 25158 2606 1 7 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.285 0.755 25158 2607 1 7 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.466 -0.279 25158 2608 1 7 . 1 1 47 47 ASN H H 47 10.077 10.077 8.589 1.488 25158 2609 1 7 . 1 1 48 48 SER N N 48 113.409 113.409 113.763 -0.354 25158 2610 1 7 . 1 1 48 48 SER HA H 48 4.086 4.086 4.213 -0.127 25158 2611 1 7 . 1 1 48 48 SER C C 48 176.671 176.671 175.852 0.819 25158 2612 1 7 . 1 1 48 48 SER CA C 48 62.375 62.375 61.328 1.047 25158 2613 1 7 . 1 1 48 48 SER CB C 48 62.375 62.375 63.039 -0.664 25158 2614 1 7 . 1 1 48 48 SER H H 48 8.936 8.936 8.743 0.193 25158 2615 1 7 . 1 1 49 49 THR N N 49 121.885 121.885 117.818 4.067 25158 2616 1 7 . 1 1 49 49 THR HA H 49 4.112 4.112 3.949 0.163 25158 2617 1 7 . 1 1 49 49 THR C C 49 177.320 177.320 176.651 0.669 25158 2618 1 7 . 1 1 49 49 THR CA C 49 66.713 66.713 66.130 0.583 25158 2619 1 7 . 1 1 49 49 THR CB C 49 67.787 67.787 68.113 -0.326 25158 2620 1 7 . 1 1 49 49 THR H H 49 8.124 8.124 8.053 0.071 25158 2621 1 7 . 1 1 50 50 ASP N N 50 120.401 120.401 122.180 -1.779 25158 2622 1 7 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.385 -0.015 25158 2623 1 7 . 1 1 50 50 ASP C C 50 177.033 177.033 178.360 -1.327 25158 2624 1 7 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.165 1.655 25158 2625 1 7 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.012 1.696 25158 2626 1 7 . 1 1 50 50 ASP H H 50 7.560 7.560 8.136 -0.576 25158 2627 1 7 . 1 1 51 51 LEU N N 51 118.174 118.174 120.977 -2.803 25158 2628 1 7 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.096 0.092 25158 2629 1 7 . 1 1 51 51 LEU C C 51 177.441 177.441 178.873 -1.432 25158 2630 1 7 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.846 0.291 25158 2631 1 7 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.126 0.721 25158 2632 1 7 . 1 1 51 51 LEU H H 51 7.134 7.134 7.562 -0.428 25158 2633 1 7 . 1 1 52 52 GLY N N 52 105.596 105.596 107.032 -1.436 25158 2634 1 7 . 1 1 52 52 GLY C C 52 176.764 176.764 176.209 0.555 25158 2635 1 7 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.937 0.705 25158 2636 1 7 . 1 1 52 52 GLY H H 52 8.034 8.034 7.792 0.242 25158 2637 1 7 . 1 1 53 53 ILE N N 53 122.043 122.043 122.999 -0.956 25158 2638 1 7 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.666 -0.217 25158 2639 1 7 . 1 1 53 53 ILE C C 53 177.112 177.112 177.428 -0.316 25158 2640 1 7 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.603 0.785 25158 2641 1 7 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.861 0.397 25158 2642 1 7 . 1 1 53 53 ILE H H 53 7.611 7.611 7.696 -0.085 25158 2643 1 7 . 1 1 54 54 LEU N N 54 120.787 120.787 121.281 -0.494 25158 2644 1 7 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.892 0.049 25158 2645 1 7 . 1 1 54 54 LEU C C 54 175.340 175.340 178.661 -3.321 25158 2646 1 7 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.511 -0.316 25158 2647 1 7 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.875 -0.654 25158 2648 1 7 . 1 1 54 54 LEU H H 54 8.323 8.323 8.423 -0.100 25158 2649 1 7 . 1 1 55 55 LYS N N 55 116.833 116.833 118.412 -1.579 25158 2650 1 7 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.989 -0.105 25158 2651 1 7 . 1 1 55 55 LYS C C 55 179.067 179.067 179.182 -0.115 25158 2652 1 7 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.686 0.965 25158 2653 1 7 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.150 -0.141 25158 2654 1 7 . 1 1 55 55 LYS H H 55 8.356 8.356 7.559 0.797 25158 2655 1 7 . 1 1 56 56 ARG N N 56 117.092 117.092 119.925 -2.833 25158 2656 1 7 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.983 -0.067 25158 2657 1 7 . 1 1 56 56 ARG C C 56 178.223 178.223 178.436 -0.213 25158 2658 1 7 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.632 0.719 25158 2659 1 7 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.248 0.531 25158 2660 1 7 . 1 1 56 56 ARG H H 56 7.543 7.543 7.584 -0.041 25158 2661 1 7 . 1 1 57 57 TYR N N 57 122.187 122.187 120.940 1.247 25158 2662 1 7 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.560 -0.168 25158 2663 1 7 . 1 1 57 57 TYR C C 57 180.009 180.009 178.546 1.463 25158 2664 1 7 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.130 0.449 25158 2665 1 7 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.619 0.217 25158 2666 1 7 . 1 1 57 57 TYR H H 57 8.592 8.592 7.948 0.644 25158 2667 1 7 . 1 1 58 58 ILE N N 58 122.825 122.825 117.858 4.967 25158 2668 1 7 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.861 -0.181 25158 2669 1 7 . 1 1 58 58 ILE C C 58 178.186 178.186 176.914 1.272 25158 2670 1 7 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.869 0.899 25158 2671 1 7 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.289 -0.569 25158 2672 1 7 . 1 1 58 58 ILE H H 58 8.779 8.779 7.664 1.115 25158 2673 1 7 . 1 1 59 59 LEU N N 59 118.552 118.552 118.987 -0.435 25158 2674 1 7 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.372 -0.149 25158 2675 1 7 . 1 1 59 59 LEU C C 59 175.937 175.937 175.689 0.248 25158 2676 1 7 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.167 1.345 25158 2677 1 7 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.852 0.574 25158 2678 1 7 . 1 1 59 59 LEU H H 59 7.539 7.539 7.558 -0.019 25158 2679 1 7 . 1 1 60 60 LYS N N 60 113.650 113.650 118.482 -4.832 25158 2680 1 7 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.753 0.242 25158 2681 1 7 . 1 1 60 60 LYS C C 60 176.535 176.535 176.280 0.255 25158 2682 1 7 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.576 -0.285 25158 2683 1 7 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.602 -2.331 25158 2684 1 7 . 1 1 60 60 LYS H H 60 7.815 7.815 7.366 0.449 25158 2685 1 7 . 1 1 61 61 GLU N N 61 117.535 117.535 115.364 2.171 25158 2686 1 7 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.306 -0.162 25158 2687 1 7 . 1 1 61 61 GLU C C 61 176.992 176.992 176.647 0.345 25158 2688 1 7 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.839 -0.150 25158 2689 1 7 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.074 -0.382 25158 2690 1 7 . 1 1 61 61 GLU H H 61 8.438 8.438 8.034 0.404 25158 2691 1 7 . 1 1 62 62 ILE N N 62 112.102 112.102 115.715 -3.613 25158 2692 1 7 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.488 -0.105 25158 2693 1 7 . 1 1 62 62 ILE C C 62 175.425 175.425 174.689 0.736 25158 2694 1 7 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.051 -0.125 25158 2695 1 7 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.276 1.472 25158 2696 1 7 . 1 1 62 62 ILE H H 62 6.867 6.867 7.296 -0.429 25158 2697 1 7 . 1 1 63 63 ASP N N 63 119.719 119.719 124.883 -5.164 25158 2698 1 7 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.849 -0.175 25158 2699 1 7 . 1 1 63 63 ASP C C 63 176.202 176.202 176.247 -0.045 25158 2700 1 7 . 1 1 63 63 ASP CA C 63 54.818 54.818 55.347 -0.529 25158 2701 1 7 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.356 -0.139 25158 2702 1 7 . 1 1 63 63 ASP H H 63 8.561 8.561 8.807 -0.246 25158 2703 1 7 . 1 1 64 64 THR N N 64 113.289 113.289 118.023 -4.734 25158 2704 1 7 . 1 1 64 64 THR HA H 64 4.712 4.712 4.368 0.344 25158 2705 1 7 . 1 1 64 64 THR C C 64 170.854 170.854 173.523 -2.669 25158 2706 1 7 . 1 1 64 64 THR CA C 64 61.269 61.269 63.708 -2.439 25158 2707 1 7 . 1 1 64 64 THR CB C 64 71.993 71.993 68.851 3.142 25158 2708 1 7 . 1 1 64 64 THR H H 64 7.410 7.410 8.053 -0.643 25158 2709 1 7 . 1 1 65 65 LEU N N 65 121.012 121.012 127.359 -6.347 25158 2710 1 7 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.723 -0.494 25158 2711 1 7 . 1 1 65 65 LEU C C 65 174.763 174.763 175.012 -0.249 25158 2712 1 7 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.032 -0.397 25158 2713 1 7 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.084 0.437 25158 2714 1 7 . 1 1 65 65 LEU H H 65 7.877 7.877 8.323 -0.446 25158 2715 1 7 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.389 -0.397 25158 2716 1 7 . 1 1 66 66 PRO C C 66 174.419 174.419 174.876 -0.457 25158 2717 1 7 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.180 0.130 25158 2718 1 7 . 1 1 66 66 PRO CB C 66 35.226 35.226 31.926 3.300 25158 2719 1 7 . 1 1 67 67 TYR N N 67 122.616 122.616 121.125 1.491 25158 2720 1 7 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.382 0.274 25158 2721 1 7 . 1 1 67 67 TYR C C 67 174.446 174.446 174.962 -0.516 25158 2722 1 7 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.526 -0.515 25158 2723 1 7 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.374 1.707 25158 2724 1 7 . 1 1 67 67 TYR H H 67 8.662 8.662 8.153 0.509 25158 2725 1 7 . 1 1 68 68 LYS N N 68 126.223 126.223 124.817 1.406 25158 2726 1 7 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.196 0.072 25158 2727 1 7 . 1 1 68 68 LYS C C 68 174.748 174.748 174.125 0.623 25158 2728 1 7 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.161 0.442 25158 2729 1 7 . 1 1 68 68 LYS CB C 68 32.770 32.770 32.748 0.022 25158 2730 1 7 . 1 1 68 68 LYS H H 68 8.112 8.112 8.093 0.019 25158 2731 1 8 . 1 1 2 2 THR N N 2 116.700 116.700 114.195 2.505 25158 2732 1 8 . 1 1 2 2 THR HA H 2 4.313 4.313 4.565 -0.252 25158 2733 1 8 . 1 1 2 2 THR C C 2 173.968 173.968 173.101 0.867 25158 2734 1 8 . 1 1 2 2 THR CA C 2 62.326 62.326 61.422 0.904 25158 2735 1 8 . 1 1 2 2 THR CB C 2 70.154 70.154 70.970 -0.816 25158 2736 1 8 . 1 1 2 2 THR H H 2 8.657 8.657 8.580 0.077 25158 2737 1 8 . 1 1 3 3 LYS N N 3 125.500 125.500 124.353 1.147 25158 2738 1 8 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.171 -0.106 25158 2739 1 8 . 1 1 3 3 LYS C C 3 174.926 174.926 175.487 -0.561 25158 2740 1 8 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.490 0.349 25158 2741 1 8 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.415 1.362 25158 2742 1 8 . 1 1 3 3 LYS H H 3 8.318 8.318 8.432 -0.115 25158 2743 1 8 . 1 1 4 4 LEU N N 4 127.473 127.473 125.503 1.970 25158 2744 1 8 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.471 0.012 25158 2745 1 8 . 1 1 4 4 LEU C C 4 174.734 174.734 175.717 -0.983 25158 2746 1 8 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.774 -0.515 25158 2747 1 8 . 1 1 4 4 LEU CB C 4 40.929 40.929 44.852 -3.923 25158 2748 1 8 . 1 1 4 4 LEU H H 4 7.726 7.726 7.946 -0.220 25158 2749 1 8 . 1 1 5 5 TYR N N 5 123.074 123.074 125.898 -2.824 25158 2750 1 8 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.184 -0.561 25158 2751 1 8 . 1 1 5 5 TYR C C 5 175.406 175.406 176.466 -1.060 25158 2752 1 8 . 1 1 5 5 TYR CA C 5 61.812 61.812 59.858 1.954 25158 2753 1 8 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.614 2.496 25158 2754 1 8 . 1 1 5 5 TYR H H 5 7.816 7.816 8.917 -1.101 25158 2755 1 8 . 1 1 6 6 GLY N N 6 108.614 108.614 114.299 -5.685 25158 2756 1 8 . 1 1 6 6 GLY C C 6 172.585 172.585 174.031 -1.446 25158 2757 1 8 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.667 0.720 25158 2758 1 8 . 1 1 6 6 GLY H H 6 8.915 8.915 8.384 0.531 25158 2759 1 8 . 1 1 7 7 ASP N N 7 118.023 118.023 124.366 -6.343 25158 2760 1 8 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.741 0.243 25158 2761 1 8 . 1 1 7 7 ASP C C 7 177.806 177.806 177.761 0.045 25158 2762 1 8 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.938 -1.746 25158 2763 1 8 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.769 -0.619 25158 2764 1 8 . 1 1 7 7 ASP H H 7 7.976 7.976 7.869 0.107 25158 2765 1 8 . 1 1 8 8 VAL N N 8 120.293 120.293 119.139 1.154 25158 2766 1 8 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.155 -0.172 25158 2767 1 8 . 1 1 8 8 VAL C C 8 175.717 175.717 176.834 -1.117 25158 2768 1 8 . 1 1 8 8 VAL CA C 8 63.446 63.446 64.133 -0.688 25158 2769 1 8 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.563 -0.292 25158 2770 1 8 . 1 1 8 8 VAL H H 8 8.156 8.156 8.618 -0.462 25158 2771 1 8 . 1 1 9 9 ASN N N 9 115.226 115.226 116.073 -0.847 25158 2772 1 8 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.560 0.429 25158 2773 1 8 . 1 1 9 9 ASN C C 9 174.626 174.626 175.198 -0.572 25158 2774 1 8 . 1 1 9 9 ASN CA C 9 50.950 50.950 53.163 -2.213 25158 2775 1 8 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.271 -0.570 25158 2776 1 8 . 1 1 9 9 ASN H H 9 8.008 8.008 8.073 -0.065 25158 2777 1 8 . 1 1 10 10 ASP N N 10 115.600 115.600 118.884 -3.284 25158 2778 1 8 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.540 -0.104 25158 2779 1 8 . 1 1 10 10 ASP C C 10 175.125 175.125 175.499 -0.374 25158 2780 1 8 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.121 1.114 25158 2781 1 8 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.498 0.702 25158 2782 1 8 . 1 1 10 10 ASP H H 10 7.374 7.374 8.069 -0.695 25158 2783 1 8 . 1 1 11 11 ASP N N 11 118.402 118.402 115.923 2.479 25158 2784 1 8 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.651 0.166 25158 2785 1 8 . 1 1 11 11 ASP C C 11 178.299 178.299 177.324 0.975 25158 2786 1 8 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.648 -0.827 25158 2787 1 8 . 1 1 11 11 ASP CB C 11 41.114 41.114 42.117 -1.003 25158 2788 1 8 . 1 1 11 11 ASP H H 11 8.801 8.801 8.877 -0.076 25158 2789 1 8 . 1 1 12 12 GLY N N 12 112.353 112.353 107.701 4.652 25158 2790 1 8 . 1 1 12 12 GLY C C 12 173.284 173.284 173.822 -0.538 25158 2791 1 8 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.223 0.401 25158 2792 1 8 . 1 1 12 12 GLY H H 12 10.293 10.293 8.634 1.659 25158 2793 1 8 . 1 1 13 13 LYS N N 13 118.118 118.118 118.677 -0.559 25158 2794 1 8 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.580 0.079 25158 2795 1 8 . 1 1 13 13 LYS C C 13 175.595 175.595 174.276 1.319 25158 2796 1 8 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.040 -1.282 25158 2797 1 8 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.495 0.844 25158 2798 1 8 . 1 1 13 13 LYS H H 13 7.848 7.848 8.152 -0.304 25158 2799 1 8 . 1 1 14 14 VAL N N 14 126.591 126.591 122.048 4.543 25158 2800 1 8 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.316 0.439 25158 2801 1 8 . 1 1 14 14 VAL C C 14 175.052 175.052 175.264 -0.212 25158 2802 1 8 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.372 0.698 25158 2803 1 8 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.376 1.079 25158 2804 1 8 . 1 1 14 14 VAL H H 14 9.109 9.109 8.432 0.677 25158 2805 1 8 . 1 1 15 15 ASN N N 15 126.287 126.287 126.396 -0.109 25158 2806 1 8 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.910 -0.095 25158 2807 1 8 . 1 1 15 15 ASN C C 15 176.340 176.340 176.347 -0.007 25158 2808 1 8 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.676 0.599 25158 2809 1 8 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.929 -2.709 25158 2810 1 8 . 1 1 15 15 ASN H H 15 10.071 10.071 9.191 0.880 25158 2811 1 8 . 1 1 16 16 SER N N 16 113.168 113.168 115.992 -2.824 25158 2812 1 8 . 1 1 16 16 SER HA H 16 4.047 4.047 4.195 -0.148 25158 2813 1 8 . 1 1 16 16 SER C C 16 176.197 176.197 175.848 0.349 25158 2814 1 8 . 1 1 16 16 SER CA C 16 62.681 62.681 60.748 1.933 25158 2815 1 8 . 1 1 16 16 SER CB C 16 62.681 62.681 63.175 -0.494 25158 2816 1 8 . 1 1 16 16 SER H H 16 8.825 8.825 8.809 0.016 25158 2817 1 8 . 1 1 17 17 THR N N 17 119.391 119.391 117.425 1.966 25158 2818 1 8 . 1 1 17 17 THR HA H 17 3.983 3.983 4.040 -0.057 25158 2819 1 8 . 1 1 17 17 THR C C 17 177.149 177.149 176.214 0.935 25158 2820 1 8 . 1 1 17 17 THR CA C 17 66.791 66.791 66.519 0.272 25158 2821 1 8 . 1 1 17 17 THR CB C 17 67.757 67.757 68.446 -0.689 25158 2822 1 8 . 1 1 17 17 THR H H 17 7.946 7.946 8.258 -0.312 25158 2823 1 8 . 1 1 18 18 ASP N N 18 120.318 120.318 121.737 -1.419 25158 2824 1 8 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.467 -0.097 25158 2825 1 8 . 1 1 18 18 ASP C C 18 177.168 177.168 177.744 -0.576 25158 2826 1 8 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.750 1.164 25158 2827 1 8 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.278 1.884 25158 2828 1 8 . 1 1 18 18 ASP H H 18 7.995 7.995 7.957 0.038 25158 2829 1 8 . 1 1 19 19 ALA N N 19 120.191 120.191 122.948 -2.757 25158 2830 1 8 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.052 -0.004 25158 2831 1 8 . 1 1 19 19 ALA C C 19 179.549 179.549 179.062 0.487 25158 2832 1 8 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.283 0.130 25158 2833 1 8 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.647 -1.334 25158 2834 1 8 . 1 1 19 19 ALA H H 19 7.085 7.085 7.545 -0.460 25158 2835 1 8 . 1 1 20 20 VAL N N 20 120.613 120.613 118.356 2.257 25158 2836 1 8 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.714 -0.103 25158 2837 1 8 . 1 1 20 20 VAL C C 20 178.153 178.153 177.317 0.836 25158 2838 1 8 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.263 1.504 25158 2839 1 8 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.747 0.121 25158 2840 1 8 . 1 1 20 20 VAL H H 20 7.835 7.835 7.492 0.343 25158 2841 1 8 . 1 1 21 21 ALA N N 21 121.767 121.767 122.770 -1.003 25158 2842 1 8 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.055 0.007 25158 2843 1 8 . 1 1 21 21 ALA C C 21 179.298 179.298 179.275 0.023 25158 2844 1 8 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.203 0.041 25158 2845 1 8 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.505 -0.716 25158 2846 1 8 . 1 1 21 21 ALA H H 21 7.804 7.804 7.943 -0.139 25158 2847 1 8 . 1 1 22 22 LEU N N 22 117.555 117.555 119.119 -1.564 25158 2848 1 8 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.125 0.021 25158 2849 1 8 . 1 1 22 22 LEU C C 22 177.914 177.914 178.597 -0.683 25158 2850 1 8 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.602 0.091 25158 2851 1 8 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.881 -0.366 25158 2852 1 8 . 1 1 22 22 LEU H H 22 8.619 8.619 8.149 0.470 25158 2853 1 8 . 1 1 23 23 LYS N N 23 120.335 120.335 119.531 0.804 25158 2854 1 8 . 1 1 23 23 LYS HA H 23 3.919 3.919 4.020 -0.101 25158 2855 1 8 . 1 1 23 23 LYS C C 23 177.731 177.731 179.350 -1.619 25158 2856 1 8 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.574 0.763 25158 2857 1 8 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.062 0.036 25158 2858 1 8 . 1 1 23 23 LYS H H 23 8.230 8.230 7.829 0.401 25158 2859 1 8 . 1 1 24 24 ARG N N 24 116.831 116.831 118.496 -1.665 25158 2860 1 8 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.038 -0.079 25158 2861 1 8 . 1 1 24 24 ARG C C 24 178.616 178.616 178.532 0.084 25158 2862 1 8 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.337 0.620 25158 2863 1 8 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.162 -0.599 25158 2864 1 8 . 1 1 24 24 ARG H H 24 7.927 7.927 7.797 0.130 25158 2865 1 8 . 1 1 25 25 TYR N N 25 120.960 120.960 121.154 -0.194 25158 2866 1 8 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.218 -0.008 25158 2867 1 8 . 1 1 25 25 TYR C C 25 179.465 179.465 178.432 1.033 25158 2868 1 8 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.606 0.239 25158 2869 1 8 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.508 0.557 25158 2870 1 8 . 1 1 25 25 TYR H H 25 8.321 8.321 7.558 0.763 25158 2871 1 8 . 1 1 26 26 VAL N N 26 120.405 120.405 119.245 1.160 25158 2872 1 8 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.701 0.073 25158 2873 1 8 . 1 1 26 26 VAL C C 26 177.826 177.826 177.610 0.216 25158 2874 1 8 . 1 1 26 26 VAL CA C 26 65.440 65.440 66.022 -0.582 25158 2875 1 8 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.650 -0.093 25158 2876 1 8 . 1 1 26 26 VAL H H 26 8.803 8.803 8.039 0.764 25158 2877 1 8 . 1 1 27 27 LEU N N 27 119.247 119.247 117.799 1.448 25158 2878 1 8 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.226 0.050 25158 2879 1 8 . 1 1 27 27 LEU C C 27 176.753 176.753 176.396 0.357 25158 2880 1 8 . 1 1 27 27 LEU CA C 27 55.675 55.675 55.266 0.409 25158 2881 1 8 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.581 -0.988 25158 2882 1 8 . 1 1 27 27 LEU H H 27 7.898 7.898 7.506 0.392 25158 2883 1 8 . 1 1 28 28 ARG N N 28 116.082 116.082 117.252 -1.170 25158 2884 1 8 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.933 0.181 25158 2885 1 8 . 1 1 28 28 ARG C C 28 176.521 176.521 175.810 0.711 25158 2886 1 8 . 1 1 28 28 ARG CA C 28 56.154 56.154 56.898 -0.744 25158 2887 1 8 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.041 0.430 25158 2888 1 8 . 1 1 28 28 ARG H H 28 7.993 7.993 8.066 -0.073 25158 2889 1 8 . 1 1 29 29 SER N N 29 113.579 113.579 114.190 -0.611 25158 2890 1 8 . 1 1 29 29 SER HA H 29 4.305 4.305 4.544 -0.239 25158 2891 1 8 . 1 1 29 29 SER C C 29 175.368 175.368 175.070 0.298 25158 2892 1 8 . 1 1 29 29 SER CA C 29 59.699 59.699 57.499 2.200 25158 2893 1 8 . 1 1 29 29 SER CB C 29 63.908 63.908 63.332 0.576 25158 2894 1 8 . 1 1 29 29 SER H H 29 8.094 8.094 7.788 0.306 25158 2895 1 8 . 1 1 30 30 GLY N N 30 109.920 109.920 110.083 -0.163 25158 2896 1 8 . 1 1 30 30 GLY C C 30 174.115 174.115 174.199 -0.084 25158 2897 1 8 . 1 1 30 30 GLY CA C 30 45.771 45.771 45.616 0.155 25158 2898 1 8 . 1 1 30 30 GLY H H 30 8.577 8.577 8.300 0.277 25158 2899 1 8 . 1 1 31 31 ILE N N 31 119.084 119.084 118.654 0.430 25158 2900 1 8 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.320 0.038 25158 2901 1 8 . 1 1 31 31 ILE C C 31 174.392 174.392 174.957 -0.565 25158 2902 1 8 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.544 -0.298 25158 2903 1 8 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.991 -0.412 25158 2904 1 8 . 1 1 31 31 ILE H H 31 7.387 7.387 7.612 -0.225 25158 2905 1 8 . 1 1 32 32 SER N N 32 120.582 120.582 122.237 -1.655 25158 2906 1 8 . 1 1 32 32 SER HA H 32 4.845 4.845 4.938 -0.093 25158 2907 1 8 . 1 1 32 32 SER C C 32 173.891 173.891 173.992 -0.101 25158 2908 1 8 . 1 1 32 32 SER CA C 32 57.603 57.603 57.576 0.027 25158 2909 1 8 . 1 1 32 32 SER CB C 32 63.849 63.849 63.907 -0.058 25158 2910 1 8 . 1 1 32 32 SER H H 32 8.339 8.339 8.462 -0.123 25158 2911 1 8 . 1 1 33 33 ILE N N 33 116.629 116.629 120.059 -3.430 25158 2912 1 8 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.461 0.172 25158 2913 1 8 . 1 1 33 33 ILE C C 33 174.195 174.195 173.754 0.441 25158 2914 1 8 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.734 -0.622 25158 2915 1 8 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.217 2.365 25158 2916 1 8 . 1 1 33 33 ILE H H 33 7.873 7.873 8.101 -0.228 25158 2917 1 8 . 1 1 34 34 ASN N N 34 118.342 118.342 120.527 -2.185 25158 2918 1 8 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.915 -0.179 25158 2919 1 8 . 1 1 34 34 ASN C C 34 176.217 176.217 175.851 0.366 25158 2920 1 8 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.569 -0.383 25158 2921 1 8 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.703 -2.204 25158 2922 1 8 . 1 1 34 34 ASN H H 34 8.839 8.839 8.260 0.579 25158 2923 1 8 . 1 1 35 35 THR N N 35 116.120 116.120 117.462 -1.342 25158 2924 1 8 . 1 1 35 35 THR HA H 35 3.559 3.559 3.997 -0.438 25158 2925 1 8 . 1 1 35 35 THR C C 35 177.347 177.347 175.973 1.374 25158 2926 1 8 . 1 1 35 35 THR CA C 35 64.686 64.686 65.194 -0.508 25158 2927 1 8 . 1 1 35 35 THR CB C 35 67.758 67.758 68.705 -0.947 25158 2928 1 8 . 1 1 35 35 THR H H 35 7.939 7.939 8.281 -0.342 25158 2929 1 8 . 1 1 36 36 ASP N N 36 123.528 123.528 122.217 1.311 25158 2930 1 8 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.371 0.049 25158 2931 1 8 . 1 1 36 36 ASP C C 36 177.752 177.752 177.235 0.517 25158 2932 1 8 . 1 1 36 36 ASP CA C 36 57.074 57.074 56.850 0.224 25158 2933 1 8 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.173 -0.276 25158 2934 1 8 . 1 1 36 36 ASP H H 36 7.980 7.980 8.881 -0.901 25158 2935 1 8 . 1 1 37 37 ASN N N 37 115.690 115.690 116.283 -0.593 25158 2936 1 8 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.574 -0.308 25158 2937 1 8 . 1 1 37 37 ASN C C 37 175.589 175.589 176.768 -1.179 25158 2938 1 8 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.578 -2.018 25158 2939 1 8 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.439 -0.476 25158 2940 1 8 . 1 1 37 37 ASN H H 37 7.251 7.251 8.358 -1.107 25158 2941 1 8 . 1 1 38 38 ALA N N 38 119.560 119.560 123.983 -4.423 25158 2942 1 8 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.010 0.070 25158 2943 1 8 . 1 1 38 38 ALA C C 38 173.638 173.638 177.369 -3.731 25158 2944 1 8 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.061 -1.841 25158 2945 1 8 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.717 4.154 25158 2946 1 8 . 1 1 38 38 ALA H H 38 7.142 7.142 7.778 -0.636 25158 2947 1 8 . 1 1 39 39 ASP N N 39 115.003 115.003 119.472 -4.469 25158 2948 1 8 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.650 0.290 25158 2949 1 8 . 1 1 39 39 ASP C C 39 177.163 177.163 177.035 0.128 25158 2950 1 8 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.923 -2.752 25158 2951 1 8 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.904 -0.958 25158 2952 1 8 . 1 1 39 39 ASP H H 39 7.096 7.096 7.802 -0.706 25158 2953 1 8 . 1 1 40 40 LEU N N 40 123.245 123.245 124.123 -0.878 25158 2954 1 8 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.368 -0.297 25158 2955 1 8 . 1 1 40 40 LEU C C 40 175.865 175.865 177.932 -2.067 25158 2956 1 8 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.093 0.500 25158 2957 1 8 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.060 -0.131 25158 2958 1 8 . 1 1 40 40 LEU H H 40 8.572 8.572 8.084 0.488 25158 2959 1 8 . 1 1 41 41 ASN N N 41 112.723 112.723 114.297 -1.574 25158 2960 1 8 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.906 0.093 25158 2961 1 8 . 1 1 41 41 ASN C C 41 173.846 173.846 175.506 -1.660 25158 2962 1 8 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.250 -1.017 25158 2963 1 8 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.227 -1.832 25158 2964 1 8 . 1 1 41 41 ASN H H 41 8.004 8.004 7.922 0.082 25158 2965 1 8 . 1 1 42 42 GLU N N 42 115.798 115.798 115.671 0.127 25158 2966 1 8 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.280 -0.328 25158 2967 1 8 . 1 1 42 42 GLU C C 42 175.172 175.172 175.656 -0.484 25158 2968 1 8 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.492 -0.141 25158 2969 1 8 . 1 1 42 42 GLU CB C 42 28.221 28.221 26.956 1.265 25158 2970 1 8 . 1 1 42 42 GLU H H 42 7.642 7.642 8.650 -1.008 25158 2971 1 8 . 1 1 43 43 ASP N N 43 117.453 117.453 118.385 -0.932 25158 2972 1 8 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.557 0.282 25158 2973 1 8 . 1 1 43 43 ASP C C 43 178.129 178.129 177.654 0.475 25158 2974 1 8 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.309 -1.671 25158 2975 1 8 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.169 0.045 25158 2976 1 8 . 1 1 43 43 ASP H H 43 8.473 8.473 8.566 -0.093 25158 2977 1 8 . 1 1 44 44 GLY N N 44 112.490 112.490 107.271 5.219 25158 2978 1 8 . 1 1 44 44 GLY C C 44 173.717 173.717 173.768 -0.051 25158 2979 1 8 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.892 0.425 25158 2980 1 8 . 1 1 44 44 GLY H H 44 10.139 10.139 8.383 1.756 25158 2981 1 8 . 1 1 45 45 ARG N N 45 118.154 118.154 117.850 0.304 25158 2982 1 8 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.693 0.095 25158 2983 1 8 . 1 1 45 45 ARG C C 45 175.602 175.602 173.829 1.773 25158 2984 1 8 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.052 -0.220 25158 2985 1 8 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.643 1.021 25158 2986 1 8 . 1 1 45 45 ARG H H 45 7.994 7.994 8.508 -0.514 25158 2987 1 8 . 1 1 46 46 VAL N N 46 126.392 126.392 122.091 4.301 25158 2988 1 8 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.535 0.255 25158 2989 1 8 . 1 1 46 46 VAL C C 46 174.644 174.644 175.641 -0.997 25158 2990 1 8 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.540 0.189 25158 2991 1 8 . 1 1 46 46 VAL CB C 46 31.666 31.666 29.895 1.771 25158 2992 1 8 . 1 1 46 46 VAL H H 46 9.115 9.115 8.539 0.576 25158 2993 1 8 . 1 1 47 47 ASN N N 47 126.737 126.737 127.574 -0.837 25158 2994 1 8 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.959 -0.084 25158 2995 1 8 . 1 1 47 47 ASN C C 47 176.467 176.467 175.868 0.599 25158 2996 1 8 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.659 0.381 25158 2997 1 8 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.529 -0.342 25158 2998 1 8 . 1 1 47 47 ASN H H 47 10.077 10.077 9.344 0.733 25158 2999 1 8 . 1 1 48 48 SER N N 48 113.409 113.409 114.389 -0.980 25158 3000 1 8 . 1 1 48 48 SER HA H 48 4.086 4.086 4.199 -0.113 25158 3001 1 8 . 1 1 48 48 SER C C 48 176.671 176.671 176.119 0.552 25158 3002 1 8 . 1 1 48 48 SER CA C 48 62.375 62.375 61.441 0.934 25158 3003 1 8 . 1 1 48 48 SER CB C 48 62.375 62.375 62.798 -0.423 25158 3004 1 8 . 1 1 48 48 SER H H 48 8.936 8.936 8.734 0.202 25158 3005 1 8 . 1 1 49 49 THR N N 49 121.885 121.885 118.135 3.750 25158 3006 1 8 . 1 1 49 49 THR HA H 49 4.112 4.112 3.863 0.249 25158 3007 1 8 . 1 1 49 49 THR C C 49 177.320 177.320 176.506 0.814 25158 3008 1 8 . 1 1 49 49 THR CA C 49 66.713 66.713 67.242 -0.529 25158 3009 1 8 . 1 1 49 49 THR CB C 49 67.787 67.787 68.469 -0.682 25158 3010 1 8 . 1 1 49 49 THR H H 49 8.124 8.124 7.594 0.530 25158 3011 1 8 . 1 1 50 50 ASP N N 50 120.401 120.401 121.752 -1.351 25158 3012 1 8 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.257 0.113 25158 3013 1 8 . 1 1 50 50 ASP C C 50 177.033 177.033 178.083 -1.050 25158 3014 1 8 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.616 1.204 25158 3015 1 8 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.504 1.204 25158 3016 1 8 . 1 1 50 50 ASP H H 50 7.560 7.560 7.771 -0.211 25158 3017 1 8 . 1 1 51 51 LEU N N 51 118.174 118.174 121.030 -2.856 25158 3018 1 8 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.042 0.146 25158 3019 1 8 . 1 1 51 51 LEU C C 51 177.441 177.441 178.828 -1.387 25158 3020 1 8 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.616 0.521 25158 3021 1 8 . 1 1 51 51 LEU CB C 51 41.847 41.847 40.989 0.858 25158 3022 1 8 . 1 1 51 51 LEU H H 51 7.134 7.134 7.610 -0.476 25158 3023 1 8 . 1 1 52 52 GLY N N 52 105.596 105.596 106.521 -0.925 25158 3024 1 8 . 1 1 52 52 GLY C C 52 176.764 176.764 176.190 0.574 25158 3025 1 8 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.094 0.548 25158 3026 1 8 . 1 1 52 52 GLY H H 52 8.034 8.034 7.908 0.126 25158 3027 1 8 . 1 1 53 53 ILE N N 53 122.043 122.043 122.407 -0.364 25158 3028 1 8 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.747 -0.298 25158 3029 1 8 . 1 1 53 53 ILE C C 53 177.112 177.112 177.504 -0.392 25158 3030 1 8 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.403 0.986 25158 3031 1 8 . 1 1 53 53 ILE CB C 53 38.258 38.258 38.038 0.219 25158 3032 1 8 . 1 1 53 53 ILE H H 53 7.611 7.611 7.488 0.123 25158 3033 1 8 . 1 1 54 54 LEU N N 54 120.787 120.787 121.911 -1.124 25158 3034 1 8 . 1 1 54 54 LEU HA H 54 3.941 3.941 4.099 -0.158 25158 3035 1 8 . 1 1 54 54 LEU C C 54 175.340 175.340 178.200 -2.860 25158 3036 1 8 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.543 -0.348 25158 3037 1 8 . 1 1 54 54 LEU CB C 54 41.221 41.221 42.009 -0.788 25158 3038 1 8 . 1 1 54 54 LEU H H 54 8.323 8.323 8.392 -0.069 25158 3039 1 8 . 1 1 55 55 LYS N N 55 116.833 116.833 119.795 -2.962 25158 3040 1 8 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.959 -0.075 25158 3041 1 8 . 1 1 55 55 LYS C C 55 179.067 179.067 179.097 -0.030 25158 3042 1 8 . 1 1 55 55 LYS CA C 55 60.651 60.651 60.261 0.390 25158 3043 1 8 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.319 -0.310 25158 3044 1 8 . 1 1 55 55 LYS H H 55 8.356 8.356 8.060 0.296 25158 3045 1 8 . 1 1 56 56 ARG N N 56 117.092 117.092 118.593 -1.501 25158 3046 1 8 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.307 -0.391 25158 3047 1 8 . 1 1 56 56 ARG C C 56 178.223 178.223 178.803 -0.580 25158 3048 1 8 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.295 1.056 25158 3049 1 8 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.223 0.557 25158 3050 1 8 . 1 1 56 56 ARG H H 56 7.543 7.543 7.584 -0.041 25158 3051 1 8 . 1 1 57 57 TYR N N 57 122.187 122.187 122.171 0.016 25158 3052 1 8 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.605 -0.213 25158 3053 1 8 . 1 1 57 57 TYR C C 57 180.009 180.009 178.659 1.350 25158 3054 1 8 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.016 0.563 25158 3055 1 8 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.479 0.357 25158 3056 1 8 . 1 1 57 57 TYR H H 57 8.592 8.592 7.833 0.759 25158 3057 1 8 . 1 1 58 58 ILE N N 58 122.825 122.825 117.659 5.166 25158 3058 1 8 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.736 -0.056 25158 3059 1 8 . 1 1 58 58 ILE C C 58 178.186 178.186 177.020 1.166 25158 3060 1 8 . 1 1 58 58 ILE CA C 58 64.768 64.768 64.045 0.723 25158 3061 1 8 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.166 -0.446 25158 3062 1 8 . 1 1 58 58 ILE H H 58 8.779 8.779 8.176 0.603 25158 3063 1 8 . 1 1 59 59 LEU N N 59 118.552 118.552 118.724 -0.172 25158 3064 1 8 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.324 -0.101 25158 3065 1 8 . 1 1 59 59 LEU C C 59 175.937 175.937 175.809 0.128 25158 3066 1 8 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.430 1.082 25158 3067 1 8 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.773 0.653 25158 3068 1 8 . 1 1 59 59 LEU H H 59 7.539 7.539 7.517 0.022 25158 3069 1 8 . 1 1 60 60 LYS N N 60 113.650 113.650 117.038 -3.388 25158 3070 1 8 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.829 0.166 25158 3071 1 8 . 1 1 60 60 LYS C C 60 176.535 176.535 176.028 0.507 25158 3072 1 8 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.825 -0.534 25158 3073 1 8 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.841 -1.570 25158 3074 1 8 . 1 1 60 60 LYS H H 60 7.815 7.815 7.485 0.330 25158 3075 1 8 . 1 1 61 61 GLU N N 61 117.535 117.535 116.670 0.865 25158 3076 1 8 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.288 -0.144 25158 3077 1 8 . 1 1 61 61 GLU C C 61 176.992 176.992 176.517 0.475 25158 3078 1 8 . 1 1 61 61 GLU CA C 61 57.689 57.689 58.162 -0.473 25158 3079 1 8 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.226 -0.534 25158 3080 1 8 . 1 1 61 61 GLU H H 61 8.438 8.438 8.332 0.106 25158 3081 1 8 . 1 1 62 62 ILE N N 62 112.102 112.102 116.314 -4.212 25158 3082 1 8 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.524 -0.141 25158 3083 1 8 . 1 1 62 62 ILE C C 62 175.425 175.425 174.711 0.714 25158 3084 1 8 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.273 -0.347 25158 3085 1 8 . 1 1 62 62 ILE CB C 62 41.748 41.748 39.916 1.832 25158 3086 1 8 . 1 1 62 62 ILE H H 62 6.867 6.867 7.324 -0.457 25158 3087 1 8 . 1 1 63 63 ASP N N 63 119.719 119.719 123.012 -3.293 25158 3088 1 8 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.949 -0.275 25158 3089 1 8 . 1 1 63 63 ASP C C 63 176.202 176.202 176.247 -0.045 25158 3090 1 8 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.663 1.155 25158 3091 1 8 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.243 0.974 25158 3092 1 8 . 1 1 63 63 ASP H H 63 8.561 8.561 8.851 -0.290 25158 3093 1 8 . 1 1 64 64 THR N N 64 113.289 113.289 116.796 -3.507 25158 3094 1 8 . 1 1 64 64 THR HA H 64 4.712 4.712 4.572 0.140 25158 3095 1 8 . 1 1 64 64 THR C C 64 170.854 170.854 173.186 -2.332 25158 3096 1 8 . 1 1 64 64 THR CA C 64 61.269 61.269 62.003 -0.734 25158 3097 1 8 . 1 1 64 64 THR CB C 64 71.993 71.993 69.332 2.661 25158 3098 1 8 . 1 1 64 64 THR H H 64 7.410 7.410 7.653 -0.243 25158 3099 1 8 . 1 1 65 65 LEU N N 65 121.012 121.012 126.320 -5.308 25158 3100 1 8 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.669 -0.440 25158 3101 1 8 . 1 1 65 65 LEU C C 65 174.763 174.763 174.894 -0.131 25158 3102 1 8 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.981 -0.346 25158 3103 1 8 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.178 1.342 25158 3104 1 8 . 1 1 65 65 LEU H H 65 7.877 7.877 8.361 -0.484 25158 3105 1 8 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.049 -0.057 25158 3106 1 8 . 1 1 66 66 PRO C C 66 174.419 174.419 174.923 -0.504 25158 3107 1 8 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.363 -0.053 25158 3108 1 8 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.313 2.913 25158 3109 1 8 . 1 1 67 67 TYR N N 67 122.616 122.616 120.500 2.116 25158 3110 1 8 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.318 0.338 25158 3111 1 8 . 1 1 67 67 TYR C C 67 174.446 174.446 175.943 -1.497 25158 3112 1 8 . 1 1 67 67 TYR CA C 67 58.011 58.011 59.352 -1.341 25158 3113 1 8 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.889 1.192 25158 3114 1 8 . 1 1 67 67 TYR H H 67 8.662 8.662 8.129 0.533 25158 3115 1 8 . 1 1 68 68 LYS N N 68 126.223 126.223 123.178 3.045 25158 3116 1 8 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.309 -0.041 25158 3117 1 8 . 1 1 68 68 LYS C C 68 174.748 174.748 173.933 0.815 25158 3118 1 8 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.469 0.134 25158 3119 1 8 . 1 1 68 68 LYS CB C 68 32.770 32.770 32.802 -0.032 25158 3120 1 8 . 1 1 68 68 LYS H H 68 8.112 8.112 7.678 0.434 25158 3121 1 9 . 1 1 2 2 THR N N 2 116.700 116.700 115.568 1.132 25158 3122 1 9 . 1 1 2 2 THR HA H 2 4.313 4.313 4.467 -0.154 25158 3123 1 9 . 1 1 2 2 THR C C 2 173.968 173.968 174.161 -0.193 25158 3124 1 9 . 1 1 2 2 THR CA C 2 62.326 62.326 61.611 0.715 25158 3125 1 9 . 1 1 2 2 THR CB C 2 70.154 70.154 69.710 0.444 25158 3126 1 9 . 1 1 2 2 THR H H 2 8.657 8.657 8.406 0.251 25158 3127 1 9 . 1 1 3 3 LYS N N 3 125.500 125.500 123.668 1.832 25158 3128 1 9 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.492 -0.427 25158 3129 1 9 . 1 1 3 3 LYS C C 3 174.926 174.926 175.348 -0.422 25158 3130 1 9 . 1 1 3 3 LYS CA C 3 56.839 56.839 55.593 1.246 25158 3131 1 9 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.520 1.257 25158 3132 1 9 . 1 1 3 3 LYS H H 3 8.318 8.318 8.423 -0.105 25158 3133 1 9 . 1 1 4 4 LEU N N 4 127.473 127.473 123.743 3.730 25158 3134 1 9 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.309 0.174 25158 3135 1 9 . 1 1 4 4 LEU C C 4 174.734 174.734 176.062 -1.328 25158 3136 1 9 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.414 -0.155 25158 3137 1 9 . 1 1 4 4 LEU CB C 4 40.929 40.929 45.378 -4.449 25158 3138 1 9 . 1 1 4 4 LEU H H 4 7.726 7.726 7.575 0.151 25158 3139 1 9 . 1 1 5 5 TYR N N 5 123.074 123.074 123.174 -0.100 25158 3140 1 9 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.421 -0.798 25158 3141 1 9 . 1 1 5 5 TYR C C 5 175.406 175.406 176.910 -1.504 25158 3142 1 9 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.392 3.420 25158 3143 1 9 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.583 2.527 25158 3144 1 9 . 1 1 5 5 TYR H H 5 7.816 7.816 8.330 -0.514 25158 3145 1 9 . 1 1 6 6 GLY N N 6 108.614 108.614 114.790 -6.176 25158 3146 1 9 . 1 1 6 6 GLY C C 6 172.585 172.585 173.802 -1.217 25158 3147 1 9 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.969 0.418 25158 3148 1 9 . 1 1 6 6 GLY H H 6 8.915 8.915 8.458 0.457 25158 3149 1 9 . 1 1 7 7 ASP N N 7 118.023 118.023 124.099 -6.076 25158 3150 1 9 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.729 0.255 25158 3151 1 9 . 1 1 7 7 ASP C C 7 177.806 177.806 177.607 0.199 25158 3152 1 9 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.789 -1.597 25158 3153 1 9 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.733 -0.583 25158 3154 1 9 . 1 1 7 7 ASP H H 7 7.976 7.976 7.703 0.273 25158 3155 1 9 . 1 1 8 8 VAL N N 8 120.293 120.293 119.615 0.678 25158 3156 1 9 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.080 -0.097 25158 3157 1 9 . 1 1 8 8 VAL C C 8 175.717 175.717 176.816 -1.099 25158 3158 1 9 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.718 -0.272 25158 3159 1 9 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.562 -0.291 25158 3160 1 9 . 1 1 8 8 VAL H H 8 8.156 8.156 8.488 -0.332 25158 3161 1 9 . 1 1 9 9 ASN N N 9 115.226 115.226 116.497 -1.271 25158 3162 1 9 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.575 0.414 25158 3163 1 9 . 1 1 9 9 ASN C C 9 174.626 174.626 174.895 -0.269 25158 3164 1 9 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.836 -1.886 25158 3165 1 9 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.399 -0.698 25158 3166 1 9 . 1 1 9 9 ASN H H 9 8.008 8.008 8.224 -0.216 25158 3167 1 9 . 1 1 10 10 ASP N N 10 115.600 115.600 116.783 -1.183 25158 3168 1 9 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.594 -0.158 25158 3169 1 9 . 1 1 10 10 ASP C C 10 175.125 175.125 174.918 0.207 25158 3170 1 9 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.468 0.767 25158 3171 1 9 . 1 1 10 10 ASP CB C 10 40.200 40.200 38.973 1.227 25158 3172 1 9 . 1 1 10 10 ASP H H 10 7.374 7.374 7.985 -0.611 25158 3173 1 9 . 1 1 11 11 ASP N N 11 118.402 118.402 115.791 2.611 25158 3174 1 9 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.628 0.189 25158 3175 1 9 . 1 1 11 11 ASP C C 11 178.299 178.299 177.256 1.043 25158 3176 1 9 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.629 -0.808 25158 3177 1 9 . 1 1 11 11 ASP CB C 11 41.114 41.114 42.137 -1.023 25158 3178 1 9 . 1 1 11 11 ASP H H 11 8.801 8.801 9.009 -0.208 25158 3179 1 9 . 1 1 12 12 GLY N N 12 112.353 112.353 107.829 4.524 25158 3180 1 9 . 1 1 12 12 GLY C C 12 173.284 173.284 173.738 -0.454 25158 3181 1 9 . 1 1 12 12 GLY CA C 12 45.624 45.624 44.985 0.639 25158 3182 1 9 . 1 1 12 12 GLY H H 12 10.293 10.293 8.256 2.037 25158 3183 1 9 . 1 1 13 13 LYS N N 13 118.118 118.118 119.377 -1.259 25158 3184 1 9 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.545 0.114 25158 3185 1 9 . 1 1 13 13 LYS C C 13 175.595 175.595 174.417 1.178 25158 3186 1 9 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.883 -2.125 25158 3187 1 9 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.146 1.193 25158 3188 1 9 . 1 1 13 13 LYS H H 13 7.848 7.848 8.212 -0.364 25158 3189 1 9 . 1 1 14 14 VAL N N 14 126.591 126.591 125.459 1.132 25158 3190 1 9 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.570 0.185 25158 3191 1 9 . 1 1 14 14 VAL C C 14 175.052 175.052 175.563 -0.511 25158 3192 1 9 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.749 0.321 25158 3193 1 9 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.356 1.099 25158 3194 1 9 . 1 1 14 14 VAL H H 14 9.109 9.109 8.530 0.579 25158 3195 1 9 . 1 1 15 15 ASN N N 15 126.287 126.287 125.597 0.690 25158 3196 1 9 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.988 -0.173 25158 3197 1 9 . 1 1 15 15 ASN C C 15 176.340 176.340 176.056 0.284 25158 3198 1 9 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.555 0.720 25158 3199 1 9 . 1 1 15 15 ASN CB C 15 39.220 39.220 39.998 -0.778 25158 3200 1 9 . 1 1 15 15 ASN H H 15 10.071 10.071 9.150 0.921 25158 3201 1 9 . 1 1 16 16 SER N N 16 113.168 113.168 113.396 -0.228 25158 3202 1 9 . 1 1 16 16 SER HA H 16 4.047 4.047 4.209 -0.162 25158 3203 1 9 . 1 1 16 16 SER C C 16 176.197 176.197 176.064 0.133 25158 3204 1 9 . 1 1 16 16 SER CA C 16 62.681 62.681 61.510 1.171 25158 3205 1 9 . 1 1 16 16 SER CB C 16 62.681 62.681 63.012 -0.331 25158 3206 1 9 . 1 1 16 16 SER H H 16 8.825 8.825 8.722 0.103 25158 3207 1 9 . 1 1 17 17 THR N N 17 119.391 119.391 117.641 1.750 25158 3208 1 9 . 1 1 17 17 THR HA H 17 3.983 3.983 4.018 -0.035 25158 3209 1 9 . 1 1 17 17 THR C C 17 177.149 177.149 176.023 1.126 25158 3210 1 9 . 1 1 17 17 THR CA C 17 66.791 66.791 66.657 0.134 25158 3211 1 9 . 1 1 17 17 THR CB C 17 67.757 67.757 68.335 -0.578 25158 3212 1 9 . 1 1 17 17 THR H H 17 7.946 7.946 8.113 -0.167 25158 3213 1 9 . 1 1 18 18 ASP N N 18 120.318 120.318 121.201 -0.883 25158 3214 1 9 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.512 -0.142 25158 3215 1 9 . 1 1 18 18 ASP C C 18 177.168 177.168 177.736 -0.568 25158 3216 1 9 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.386 1.528 25158 3217 1 9 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.642 1.520 25158 3218 1 9 . 1 1 18 18 ASP H H 18 7.995 7.995 7.874 0.121 25158 3219 1 9 . 1 1 19 19 ALA N N 19 120.191 120.191 122.988 -2.797 25158 3220 1 9 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.133 -0.085 25158 3221 1 9 . 1 1 19 19 ALA C C 19 179.549 179.549 179.257 0.292 25158 3222 1 9 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.092 0.321 25158 3223 1 9 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.571 -1.258 25158 3224 1 9 . 1 1 19 19 ALA H H 19 7.085 7.085 7.550 -0.465 25158 3225 1 9 . 1 1 20 20 VAL N N 20 120.613 120.613 118.666 1.947 25158 3226 1 9 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.814 -0.203 25158 3227 1 9 . 1 1 20 20 VAL C C 20 178.153 178.153 177.401 0.752 25158 3228 1 9 . 1 1 20 20 VAL CA C 20 66.767 66.767 64.864 1.903 25158 3229 1 9 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.296 0.572 25158 3230 1 9 . 1 1 20 20 VAL H H 20 7.835 7.835 7.604 0.231 25158 3231 1 9 . 1 1 21 21 ALA N N 21 121.767 121.767 123.200 -1.433 25158 3232 1 9 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.112 -0.050 25158 3233 1 9 . 1 1 21 21 ALA C C 21 179.298 179.298 179.598 -0.300 25158 3234 1 9 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.275 -0.031 25158 3235 1 9 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.265 -0.476 25158 3236 1 9 . 1 1 21 21 ALA H H 21 7.804 7.804 7.916 -0.112 25158 3237 1 9 . 1 1 22 22 LEU N N 22 117.555 117.555 119.061 -1.506 25158 3238 1 9 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.135 0.011 25158 3239 1 9 . 1 1 22 22 LEU C C 22 177.914 177.914 178.461 -0.547 25158 3240 1 9 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.318 0.375 25158 3241 1 9 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.852 -0.337 25158 3242 1 9 . 1 1 22 22 LEU H H 22 8.619 8.619 7.814 0.805 25158 3243 1 9 . 1 1 23 23 LYS N N 23 120.335 120.335 119.530 0.805 25158 3244 1 9 . 1 1 23 23 LYS HA H 23 3.919 3.919 4.021 -0.102 25158 3245 1 9 . 1 1 23 23 LYS C C 23 177.731 177.731 179.017 -1.286 25158 3246 1 9 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.540 0.797 25158 3247 1 9 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.209 -0.111 25158 3248 1 9 . 1 1 23 23 LYS H H 23 8.230 8.230 7.542 0.688 25158 3249 1 9 . 1 1 24 24 ARG N N 24 116.831 116.831 118.744 -1.913 25158 3250 1 9 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.058 -0.099 25158 3251 1 9 . 1 1 24 24 ARG C C 24 178.616 178.616 178.586 0.030 25158 3252 1 9 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.516 0.441 25158 3253 1 9 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.121 -0.558 25158 3254 1 9 . 1 1 24 24 ARG H H 24 7.927 7.927 7.724 0.203 25158 3255 1 9 . 1 1 25 25 TYR N N 25 120.960 120.960 120.695 0.265 25158 3256 1 9 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.292 -0.082 25158 3257 1 9 . 1 1 25 25 TYR C C 25 179.465 179.465 178.273 1.192 25158 3258 1 9 . 1 1 25 25 TYR CA C 25 61.845 61.845 60.750 1.095 25158 3259 1 9 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.411 0.654 25158 3260 1 9 . 1 1 25 25 TYR H H 25 8.321 8.321 7.681 0.640 25158 3261 1 9 . 1 1 26 26 VAL N N 26 120.405 120.405 118.654 1.751 25158 3262 1 9 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.637 0.137 25158 3263 1 9 . 1 1 26 26 VAL C C 26 177.826 177.826 177.032 0.794 25158 3264 1 9 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.820 -0.380 25158 3265 1 9 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.621 -0.064 25158 3266 1 9 . 1 1 26 26 VAL H H 26 8.803 8.803 7.836 0.967 25158 3267 1 9 . 1 1 27 27 LEU N N 27 119.247 119.247 117.777 1.470 25158 3268 1 9 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.281 -0.005 25158 3269 1 9 . 1 1 27 27 LEU C C 27 176.753 176.753 176.182 0.571 25158 3270 1 9 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.222 1.453 25158 3271 1 9 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.611 -0.019 25158 3272 1 9 . 1 1 27 27 LEU H H 27 7.898 7.898 7.345 0.553 25158 3273 1 9 . 1 1 28 28 ARG N N 28 116.082 116.082 117.622 -1.540 25158 3274 1 9 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.857 0.257 25158 3275 1 9 . 1 1 28 28 ARG C C 28 176.521 176.521 176.301 0.220 25158 3276 1 9 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.120 -0.966 25158 3277 1 9 . 1 1 28 28 ARG CB C 28 27.471 27.471 26.642 0.829 25158 3278 1 9 . 1 1 28 28 ARG H H 28 7.993 7.993 8.039 -0.046 25158 3279 1 9 . 1 1 29 29 SER N N 29 113.579 113.579 115.208 -1.629 25158 3280 1 9 . 1 1 29 29 SER HA H 29 4.305 4.305 4.390 -0.085 25158 3281 1 9 . 1 1 29 29 SER C C 29 175.368 175.368 175.837 -0.469 25158 3282 1 9 . 1 1 29 29 SER CA C 29 59.699 59.699 60.413 -0.714 25158 3283 1 9 . 1 1 29 29 SER CB C 29 63.908 63.908 63.812 0.097 25158 3284 1 9 . 1 1 29 29 SER H H 29 8.094 8.094 8.060 0.034 25158 3285 1 9 . 1 1 30 30 GLY N N 30 109.920 109.920 108.935 0.985 25158 3286 1 9 . 1 1 30 30 GLY C C 30 174.115 174.115 173.867 0.248 25158 3287 1 9 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.856 0.915 25158 3288 1 9 . 1 1 30 30 GLY H H 30 8.577 8.577 8.524 0.053 25158 3289 1 9 . 1 1 31 31 ILE N N 31 119.084 119.084 119.383 -0.299 25158 3290 1 9 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.337 0.021 25158 3291 1 9 . 1 1 31 31 ILE C C 31 174.392 174.392 175.031 -0.639 25158 3292 1 9 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.252 -0.006 25158 3293 1 9 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.462 0.116 25158 3294 1 9 . 1 1 31 31 ILE H H 31 7.387 7.387 7.854 -0.467 25158 3295 1 9 . 1 1 32 32 SER N N 32 120.582 120.582 122.015 -1.433 25158 3296 1 9 . 1 1 32 32 SER HA H 32 4.845 4.845 4.718 0.127 25158 3297 1 9 . 1 1 32 32 SER C C 32 173.891 173.891 173.635 0.256 25158 3298 1 9 . 1 1 32 32 SER CA C 32 57.603 57.603 57.678 -0.075 25158 3299 1 9 . 1 1 32 32 SER CB C 32 63.849 63.849 63.600 0.249 25158 3300 1 9 . 1 1 32 32 SER H H 32 8.339 8.339 8.420 -0.081 25158 3301 1 9 . 1 1 33 33 ILE N N 33 116.629 116.629 120.398 -3.769 25158 3302 1 9 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.506 0.127 25158 3303 1 9 . 1 1 33 33 ILE C C 33 174.195 174.195 173.925 0.270 25158 3304 1 9 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.019 0.093 25158 3305 1 9 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.372 2.210 25158 3306 1 9 . 1 1 33 33 ILE H H 33 7.873 7.873 7.880 -0.007 25158 3307 1 9 . 1 1 34 34 ASN N N 34 118.342 118.342 119.566 -1.224 25158 3308 1 9 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.968 -0.232 25158 3309 1 9 . 1 1 34 34 ASN C C 34 176.217 176.217 175.836 0.381 25158 3310 1 9 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.557 -0.371 25158 3311 1 9 . 1 1 34 34 ASN CB C 34 36.499 36.499 39.158 -2.659 25158 3312 1 9 . 1 1 34 34 ASN H H 34 8.839 8.839 8.201 0.638 25158 3313 1 9 . 1 1 35 35 THR N N 35 116.120 116.120 117.630 -1.510 25158 3314 1 9 . 1 1 35 35 THR HA H 35 3.559 3.559 4.135 -0.576 25158 3315 1 9 . 1 1 35 35 THR C C 35 177.347 177.347 176.109 1.238 25158 3316 1 9 . 1 1 35 35 THR CA C 35 64.686 64.686 65.843 -1.157 25158 3317 1 9 . 1 1 35 35 THR CB C 35 67.758 67.758 69.053 -1.295 25158 3318 1 9 . 1 1 35 35 THR H H 35 7.939 7.939 8.444 -0.505 25158 3319 1 9 . 1 1 36 36 ASP N N 36 123.528 123.528 121.577 1.951 25158 3320 1 9 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.369 0.051 25158 3321 1 9 . 1 1 36 36 ASP C C 36 177.752 177.752 178.028 -0.276 25158 3322 1 9 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.804 -0.730 25158 3323 1 9 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.596 -0.698 25158 3324 1 9 . 1 1 36 36 ASP H H 36 7.980 7.980 8.778 -0.798 25158 3325 1 9 . 1 1 37 37 ASN N N 37 115.690 115.690 117.535 -1.845 25158 3326 1 9 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.649 -0.383 25158 3327 1 9 . 1 1 37 37 ASN C C 37 175.589 175.589 177.495 -1.906 25158 3328 1 9 . 1 1 37 37 ASN CA C 37 52.560 52.560 55.438 -2.878 25158 3329 1 9 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.030 -0.067 25158 3330 1 9 . 1 1 37 37 ASN H H 37 7.251 7.251 8.361 -1.110 25158 3331 1 9 . 1 1 38 38 ALA N N 38 119.560 119.560 122.701 -3.141 25158 3332 1 9 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.068 0.012 25158 3333 1 9 . 1 1 38 38 ALA C C 38 173.638 173.638 177.416 -3.778 25158 3334 1 9 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.080 -1.860 25158 3335 1 9 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.807 4.064 25158 3336 1 9 . 1 1 38 38 ALA H H 38 7.142 7.142 8.108 -0.966 25158 3337 1 9 . 1 1 39 39 ASP N N 39 115.003 115.003 119.758 -4.755 25158 3338 1 9 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.754 0.186 25158 3339 1 9 . 1 1 39 39 ASP C C 39 177.163 177.163 177.067 0.096 25158 3340 1 9 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.912 -2.741 25158 3341 1 9 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.989 -1.043 25158 3342 1 9 . 1 1 39 39 ASP H H 39 7.096 7.096 7.935 -0.839 25158 3343 1 9 . 1 1 40 40 LEU N N 40 123.245 123.245 124.112 -0.867 25158 3344 1 9 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.247 -0.176 25158 3345 1 9 . 1 1 40 40 LEU C C 40 175.865 175.865 177.568 -1.703 25158 3346 1 9 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.937 0.656 25158 3347 1 9 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.169 -0.240 25158 3348 1 9 . 1 1 40 40 LEU H H 40 8.572 8.572 7.969 0.603 25158 3349 1 9 . 1 1 41 41 ASN N N 41 112.723 112.723 113.387 -0.664 25158 3350 1 9 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.922 0.077 25158 3351 1 9 . 1 1 41 41 ASN C C 41 173.846 173.846 175.210 -1.364 25158 3352 1 9 . 1 1 41 41 ASN CA C 41 51.233 51.233 51.984 -0.751 25158 3353 1 9 . 1 1 41 41 ASN CB C 41 37.395 37.395 38.946 -1.551 25158 3354 1 9 . 1 1 41 41 ASN H H 41 8.004 8.004 7.818 0.186 25158 3355 1 9 . 1 1 42 42 GLU N N 42 115.798 115.798 116.042 -0.244 25158 3356 1 9 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.281 -0.329 25158 3357 1 9 . 1 1 42 42 GLU C C 42 175.172 175.172 175.798 -0.626 25158 3358 1 9 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.654 -0.303 25158 3359 1 9 . 1 1 42 42 GLU CB C 42 28.221 28.221 26.706 1.515 25158 3360 1 9 . 1 1 42 42 GLU H H 42 7.642 7.642 8.396 -0.754 25158 3361 1 9 . 1 1 43 43 ASP N N 43 117.453 117.453 117.151 0.302 25158 3362 1 9 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.520 0.319 25158 3363 1 9 . 1 1 43 43 ASP C C 43 178.129 178.129 177.435 0.694 25158 3364 1 9 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.914 -1.276 25158 3365 1 9 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.131 0.083 25158 3366 1 9 . 1 1 43 43 ASP H H 43 8.473 8.473 8.560 -0.087 25158 3367 1 9 . 1 1 44 44 GLY N N 44 112.490 112.490 107.726 4.764 25158 3368 1 9 . 1 1 44 44 GLY C C 44 173.717 173.717 173.641 0.076 25158 3369 1 9 . 1 1 44 44 GLY CA C 44 45.317 45.317 45.114 0.203 25158 3370 1 9 . 1 1 44 44 GLY H H 44 10.139 10.139 8.546 1.593 25158 3371 1 9 . 1 1 45 45 ARG N N 45 118.154 118.154 117.229 0.925 25158 3372 1 9 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.539 0.249 25158 3373 1 9 . 1 1 45 45 ARG C C 45 175.602 175.602 174.168 1.434 25158 3374 1 9 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.435 -0.603 25158 3375 1 9 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.690 0.974 25158 3376 1 9 . 1 1 45 45 ARG H H 45 7.994 7.994 9.008 -1.014 25158 3377 1 9 . 1 1 46 46 VAL N N 46 126.392 126.392 124.137 2.255 25158 3378 1 9 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.341 0.449 25158 3379 1 9 . 1 1 46 46 VAL C C 46 174.644 174.644 175.264 -0.620 25158 3380 1 9 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.416 -0.687 25158 3381 1 9 . 1 1 46 46 VAL CB C 46 31.666 31.666 31.620 0.046 25158 3382 1 9 . 1 1 46 46 VAL H H 46 9.115 9.115 8.651 0.464 25158 3383 1 9 . 1 1 47 47 ASN N N 47 126.737 126.737 125.946 0.791 25158 3384 1 9 . 1 1 47 47 ASN HA H 47 4.875 4.875 5.021 -0.146 25158 3385 1 9 . 1 1 47 47 ASN C C 47 176.467 176.467 176.105 0.362 25158 3386 1 9 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.847 0.193 25158 3387 1 9 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.877 -0.690 25158 3388 1 9 . 1 1 47 47 ASN H H 47 10.077 10.077 7.684 2.393 25158 3389 1 9 . 1 1 48 48 SER N N 48 113.409 113.409 114.671 -1.262 25158 3390 1 9 . 1 1 48 48 SER HA H 48 4.086 4.086 4.157 -0.071 25158 3391 1 9 . 1 1 48 48 SER C C 48 176.671 176.671 176.415 0.256 25158 3392 1 9 . 1 1 48 48 SER CA C 48 62.375 62.375 61.990 0.385 25158 3393 1 9 . 1 1 48 48 SER CB C 48 62.375 62.375 62.462 -0.087 25158 3394 1 9 . 1 1 48 48 SER H H 48 8.936 8.936 8.775 0.161 25158 3395 1 9 . 1 1 49 49 THR N N 49 121.885 121.885 118.576 3.309 25158 3396 1 9 . 1 1 49 49 THR HA H 49 4.112 4.112 4.000 0.112 25158 3397 1 9 . 1 1 49 49 THR C C 49 177.320 177.320 176.303 1.017 25158 3398 1 9 . 1 1 49 49 THR CA C 49 66.713 66.713 66.600 0.113 25158 3399 1 9 . 1 1 49 49 THR CB C 49 67.787 67.787 68.509 -0.722 25158 3400 1 9 . 1 1 49 49 THR H H 49 8.124 8.124 7.772 0.352 25158 3401 1 9 . 1 1 50 50 ASP N N 50 120.401 120.401 122.486 -2.085 25158 3402 1 9 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.392 -0.022 25158 3403 1 9 . 1 1 50 50 ASP C C 50 177.033 177.033 178.319 -1.286 25158 3404 1 9 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.178 1.642 25158 3405 1 9 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.133 1.575 25158 3406 1 9 . 1 1 50 50 ASP H H 50 7.560 7.560 7.720 -0.160 25158 3407 1 9 . 1 1 51 51 LEU N N 51 118.174 118.174 120.906 -2.732 25158 3408 1 9 . 1 1 51 51 LEU HA H 51 4.188 4.188 3.974 0.214 25158 3409 1 9 . 1 1 51 51 LEU C C 51 177.441 177.441 178.402 -0.961 25158 3410 1 9 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.195 -0.058 25158 3411 1 9 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.750 0.097 25158 3412 1 9 . 1 1 51 51 LEU H H 51 7.134 7.134 7.649 -0.515 25158 3413 1 9 . 1 1 52 52 GLY N N 52 105.596 105.596 106.549 -0.953 25158 3414 1 9 . 1 1 52 52 GLY C C 52 176.764 176.764 176.006 0.758 25158 3415 1 9 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.086 0.556 25158 3416 1 9 . 1 1 52 52 GLY H H 52 8.034 8.034 7.927 0.107 25158 3417 1 9 . 1 1 53 53 ILE N N 53 122.043 122.043 122.011 0.032 25158 3418 1 9 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.776 -0.327 25158 3419 1 9 . 1 1 53 53 ILE C C 53 177.112 177.112 177.430 -0.318 25158 3420 1 9 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.071 1.317 25158 3421 1 9 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.887 0.371 25158 3422 1 9 . 1 1 53 53 ILE H H 53 7.611 7.611 7.557 0.054 25158 3423 1 9 . 1 1 54 54 LEU N N 54 120.787 120.787 121.848 -1.061 25158 3424 1 9 . 1 1 54 54 LEU HA H 54 3.941 3.941 4.065 -0.124 25158 3425 1 9 . 1 1 54 54 LEU C C 54 175.340 175.340 178.651 -3.311 25158 3426 1 9 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.242 -0.047 25158 3427 1 9 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.044 0.178 25158 3428 1 9 . 1 1 54 54 LEU H H 54 8.323 8.323 8.228 0.095 25158 3429 1 9 . 1 1 55 55 LYS N N 55 116.833 116.833 118.814 -1.981 25158 3430 1 9 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.958 -0.074 25158 3431 1 9 . 1 1 55 55 LYS C C 55 179.067 179.067 179.026 0.041 25158 3432 1 9 . 1 1 55 55 LYS CA C 55 60.651 60.651 60.035 0.616 25158 3433 1 9 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.277 -0.268 25158 3434 1 9 . 1 1 55 55 LYS H H 55 8.356 8.356 7.841 0.515 25158 3435 1 9 . 1 1 56 56 ARG N N 56 117.092 117.092 118.764 -1.672 25158 3436 1 9 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.007 -0.091 25158 3437 1 9 . 1 1 56 56 ARG C C 56 178.223 178.223 178.452 -0.229 25158 3438 1 9 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.683 0.668 25158 3439 1 9 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.112 0.668 25158 3440 1 9 . 1 1 56 56 ARG H H 56 7.543 7.543 7.706 -0.163 25158 3441 1 9 . 1 1 57 57 TYR N N 57 122.187 122.187 120.349 1.838 25158 3442 1 9 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.691 -0.299 25158 3443 1 9 . 1 1 57 57 TYR C C 57 180.009 180.009 177.577 2.432 25158 3444 1 9 . 1 1 57 57 TYR CA C 57 61.579 61.579 60.403 1.177 25158 3445 1 9 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.560 0.275 25158 3446 1 9 . 1 1 57 57 TYR H H 57 8.592 8.592 7.403 1.189 25158 3447 1 9 . 1 1 58 58 ILE N N 58 122.825 122.825 117.158 5.667 25158 3448 1 9 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.738 -0.058 25158 3449 1 9 . 1 1 58 58 ILE C C 58 178.186 178.186 177.015 1.171 25158 3450 1 9 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.551 1.217 25158 3451 1 9 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.438 -0.718 25158 3452 1 9 . 1 1 58 58 ILE H H 58 8.779 8.779 7.510 1.269 25158 3453 1 9 . 1 1 59 59 LEU N N 59 118.552 118.552 118.084 0.468 25158 3454 1 9 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.391 -0.168 25158 3455 1 9 . 1 1 59 59 LEU C C 59 175.937 175.937 175.757 0.180 25158 3456 1 9 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.262 1.250 25158 3457 1 9 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.287 1.139 25158 3458 1 9 . 1 1 59 59 LEU H H 59 7.539 7.539 7.936 -0.397 25158 3459 1 9 . 1 1 60 60 LYS N N 60 113.650 113.650 116.629 -2.979 25158 3460 1 9 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.862 0.133 25158 3461 1 9 . 1 1 60 60 LYS C C 60 176.535 176.535 176.237 0.298 25158 3462 1 9 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.727 -0.436 25158 3463 1 9 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.803 -1.532 25158 3464 1 9 . 1 1 60 60 LYS H H 60 7.815 7.815 7.555 0.260 25158 3465 1 9 . 1 1 61 61 GLU N N 61 117.535 117.535 116.173 1.362 25158 3466 1 9 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.304 -0.160 25158 3467 1 9 . 1 1 61 61 GLU C C 61 176.992 176.992 176.519 0.473 25158 3468 1 9 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.866 -0.177 25158 3469 1 9 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.091 -0.399 25158 3470 1 9 . 1 1 61 61 GLU H H 61 8.438 8.438 8.385 0.053 25158 3471 1 9 . 1 1 62 62 ILE N N 62 112.102 112.102 114.427 -2.325 25158 3472 1 9 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.484 -0.101 25158 3473 1 9 . 1 1 62 62 ILE C C 62 175.425 175.425 174.441 0.984 25158 3474 1 9 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.600 -0.674 25158 3475 1 9 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.655 1.093 25158 3476 1 9 . 1 1 62 62 ILE H H 62 6.867 6.867 7.684 -0.817 25158 3477 1 9 . 1 1 63 63 ASP N N 63 119.719 119.719 124.193 -4.474 25158 3478 1 9 . 1 1 63 63 ASP HA H 63 4.674 4.674 5.037 -0.363 25158 3479 1 9 . 1 1 63 63 ASP C C 63 176.202 176.202 175.657 0.545 25158 3480 1 9 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.676 1.142 25158 3481 1 9 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.323 -0.106 25158 3482 1 9 . 1 1 63 63 ASP H H 63 8.561 8.561 8.903 -0.342 25158 3483 1 9 . 1 1 64 64 THR N N 64 113.289 113.289 116.941 -3.652 25158 3484 1 9 . 1 1 64 64 THR HA H 64 4.712 4.712 4.649 0.063 25158 3485 1 9 . 1 1 64 64 THR C C 64 170.854 170.854 173.001 -2.147 25158 3486 1 9 . 1 1 64 64 THR CA C 64 61.269 61.269 61.661 -0.392 25158 3487 1 9 . 1 1 64 64 THR CB C 64 71.993 71.993 69.124 2.869 25158 3488 1 9 . 1 1 64 64 THR H H 64 7.410 7.410 7.763 -0.353 25158 3489 1 9 . 1 1 65 65 LEU N N 65 121.012 121.012 126.391 -5.379 25158 3490 1 9 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.715 -0.486 25158 3491 1 9 . 1 1 65 65 LEU C C 65 174.763 174.763 175.036 -0.273 25158 3492 1 9 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.926 -0.291 25158 3493 1 9 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.307 1.213 25158 3494 1 9 . 1 1 65 65 LEU H H 65 7.877 7.877 8.400 -0.523 25158 3495 1 9 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.266 -0.274 25158 3496 1 9 . 1 1 66 66 PRO C C 66 174.419 174.419 174.954 -0.535 25158 3497 1 9 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.172 0.138 25158 3498 1 9 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.240 2.986 25158 3499 1 9 . 1 1 67 67 TYR N N 67 122.616 122.616 122.197 0.419 25158 3500 1 9 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.282 0.374 25158 3501 1 9 . 1 1 67 67 TYR C C 67 174.446 174.446 174.852 -0.406 25158 3502 1 9 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.745 -0.734 25158 3503 1 9 . 1 1 67 67 TYR CB C 67 41.081 41.081 38.411 2.670 25158 3504 1 9 . 1 1 67 67 TYR H H 67 8.662 8.662 8.041 0.621 25158 3505 1 9 . 1 1 68 68 LYS N N 68 126.223 126.223 128.974 -2.751 25158 3506 1 9 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.284 -0.016 25158 3507 1 9 . 1 1 68 68 LYS C C 68 174.748 174.748 174.880 -0.132 25158 3508 1 9 . 1 1 68 68 LYS CA C 68 55.603 55.603 54.951 0.652 25158 3509 1 9 . 1 1 68 68 LYS CB C 68 32.770 32.770 33.258 -0.488 25158 3510 1 9 . 1 1 68 68 LYS H H 68 8.112 8.112 8.292 -0.180 25158 3511 1 10 . 1 1 2 2 THR N N 2 116.700 116.700 112.631 4.069 25158 3512 1 10 . 1 1 2 2 THR HA H 2 4.313 4.313 4.551 -0.238 25158 3513 1 10 . 1 1 2 2 THR C C 2 173.968 173.968 173.173 0.795 25158 3514 1 10 . 1 1 2 2 THR CA C 2 62.326 62.326 61.512 0.814 25158 3515 1 10 . 1 1 2 2 THR CB C 2 70.154 70.154 70.817 -0.663 25158 3516 1 10 . 1 1 2 2 THR H H 2 8.657 8.657 8.457 0.199 25158 3517 1 10 . 1 1 3 3 LYS N N 3 125.500 125.500 122.754 2.746 25158 3518 1 10 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.391 -0.326 25158 3519 1 10 . 1 1 3 3 LYS C C 3 174.926 174.926 175.504 -0.578 25158 3520 1 10 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.253 0.586 25158 3521 1 10 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.622 1.155 25158 3522 1 10 . 1 1 3 3 LYS H H 3 8.318 8.318 8.368 -0.050 25158 3523 1 10 . 1 1 4 4 LEU N N 4 127.473 127.473 124.927 2.546 25158 3524 1 10 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.548 -0.065 25158 3525 1 10 . 1 1 4 4 LEU C C 4 174.734 174.734 175.574 -0.840 25158 3526 1 10 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.424 -0.165 25158 3527 1 10 . 1 1 4 4 LEU CB C 4 40.929 40.929 45.436 -4.507 25158 3528 1 10 . 1 1 4 4 LEU H H 4 7.726 7.726 7.781 -0.055 25158 3529 1 10 . 1 1 5 5 TYR N N 5 123.074 123.074 125.221 -2.147 25158 3530 1 10 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.382 -0.759 25158 3531 1 10 . 1 1 5 5 TYR C C 5 175.406 175.406 176.640 -1.234 25158 3532 1 10 . 1 1 5 5 TYR CA C 5 61.812 61.812 60.021 1.791 25158 3533 1 10 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.132 1.978 25158 3534 1 10 . 1 1 5 5 TYR H H 5 7.816 7.816 8.861 -1.045 25158 3535 1 10 . 1 1 6 6 GLY N N 6 108.614 108.614 114.347 -5.733 25158 3536 1 10 . 1 1 6 6 GLY C C 6 172.585 172.585 173.995 -1.410 25158 3537 1 10 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.606 0.781 25158 3538 1 10 . 1 1 6 6 GLY H H 6 8.915 8.915 8.703 0.212 25158 3539 1 10 . 1 1 7 7 ASP N N 7 118.023 118.023 124.154 -6.131 25158 3540 1 10 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.881 0.103 25158 3541 1 10 . 1 1 7 7 ASP C C 7 177.806 177.806 177.615 0.191 25158 3542 1 10 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.630 -1.438 25158 3543 1 10 . 1 1 7 7 ASP CB C 7 39.150 39.150 40.056 -0.906 25158 3544 1 10 . 1 1 7 7 ASP H H 7 7.976 7.976 7.744 0.232 25158 3545 1 10 . 1 1 8 8 VAL N N 8 120.293 120.293 119.217 1.076 25158 3546 1 10 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.092 -0.109 25158 3547 1 10 . 1 1 8 8 VAL C C 8 175.717 175.717 176.620 -0.903 25158 3548 1 10 . 1 1 8 8 VAL CA C 8 63.446 63.446 64.098 -0.652 25158 3549 1 10 . 1 1 8 8 VAL CB C 8 31.271 31.271 32.403 -1.132 25158 3550 1 10 . 1 1 8 8 VAL H H 8 8.156 8.156 7.926 0.230 25158 3551 1 10 . 1 1 9 9 ASN N N 9 115.226 115.226 115.392 -0.166 25158 3552 1 10 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.589 0.400 25158 3553 1 10 . 1 1 9 9 ASN C C 9 174.626 174.626 175.005 -0.379 25158 3554 1 10 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.996 -2.046 25158 3555 1 10 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.040 -0.339 25158 3556 1 10 . 1 1 9 9 ASN H H 9 8.008 8.008 8.160 -0.152 25158 3557 1 10 . 1 1 10 10 ASP N N 10 115.600 115.600 116.926 -1.326 25158 3558 1 10 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.532 -0.096 25158 3559 1 10 . 1 1 10 10 ASP C C 10 175.125 175.125 174.891 0.234 25158 3560 1 10 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.501 0.734 25158 3561 1 10 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.179 1.021 25158 3562 1 10 . 1 1 10 10 ASP H H 10 7.374 7.374 8.153 -0.779 25158 3563 1 10 . 1 1 11 11 ASP N N 11 118.402 118.402 115.087 3.315 25158 3564 1 10 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.606 0.211 25158 3565 1 10 . 1 1 11 11 ASP C C 11 178.299 178.299 177.122 1.177 25158 3566 1 10 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.058 -0.237 25158 3567 1 10 . 1 1 11 11 ASP CB C 11 41.114 41.114 42.196 -1.082 25158 3568 1 10 . 1 1 11 11 ASP H H 11 8.801 8.801 8.984 -0.183 25158 3569 1 10 . 1 1 12 12 GLY N N 12 112.353 112.353 107.715 4.638 25158 3570 1 10 . 1 1 12 12 GLY C C 12 173.284 173.284 173.513 -0.229 25158 3571 1 10 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.222 0.402 25158 3572 1 10 . 1 1 12 12 GLY H H 12 10.293 10.293 8.581 1.712 25158 3573 1 10 . 1 1 13 13 LYS N N 13 118.118 118.118 117.158 0.960 25158 3574 1 10 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.558 0.101 25158 3575 1 10 . 1 1 13 13 LYS C C 13 175.595 175.595 174.528 1.067 25158 3576 1 10 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.077 -1.319 25158 3577 1 10 . 1 1 13 13 LYS CB C 13 36.339 36.339 34.943 1.396 25158 3578 1 10 . 1 1 13 13 LYS H H 13 7.848 7.848 8.022 -0.174 25158 3579 1 10 . 1 1 14 14 VAL N N 14 126.591 126.591 120.739 5.852 25158 3580 1 10 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.408 0.347 25158 3581 1 10 . 1 1 14 14 VAL C C 14 175.052 175.052 175.873 -0.821 25158 3582 1 10 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.814 0.256 25158 3583 1 10 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.122 0.333 25158 3584 1 10 . 1 1 14 14 VAL H H 14 9.109 9.109 8.390 0.719 25158 3585 1 10 . 1 1 15 15 ASN N N 15 126.287 126.287 124.700 1.587 25158 3586 1 10 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.865 -0.050 25158 3587 1 10 . 1 1 15 15 ASN C C 15 176.340 176.340 176.511 -0.171 25158 3588 1 10 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.901 0.374 25158 3589 1 10 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.427 -2.207 25158 3590 1 10 . 1 1 15 15 ASN H H 15 10.071 10.071 7.870 2.201 25158 3591 1 10 . 1 1 16 16 SER N N 16 113.168 113.168 116.054 -2.886 25158 3592 1 10 . 1 1 16 16 SER HA H 16 4.047 4.047 4.216 -0.169 25158 3593 1 10 . 1 1 16 16 SER C C 16 176.197 176.197 175.889 0.308 25158 3594 1 10 . 1 1 16 16 SER CA C 16 62.681 62.681 60.789 1.892 25158 3595 1 10 . 1 1 16 16 SER CB C 16 62.681 62.681 63.200 -0.520 25158 3596 1 10 . 1 1 16 16 SER H H 16 8.825 8.825 8.793 0.032 25158 3597 1 10 . 1 1 17 17 THR N N 17 119.391 119.391 117.627 1.764 25158 3598 1 10 . 1 1 17 17 THR HA H 17 3.983 3.983 4.021 -0.038 25158 3599 1 10 . 1 1 17 17 THR C C 17 177.149 177.149 176.298 0.851 25158 3600 1 10 . 1 1 17 17 THR CA C 17 66.791 66.791 66.468 0.324 25158 3601 1 10 . 1 1 17 17 THR CB C 17 67.757 67.757 68.352 -0.594 25158 3602 1 10 . 1 1 17 17 THR H H 17 7.946 7.946 8.259 -0.313 25158 3603 1 10 . 1 1 18 18 ASP N N 18 120.318 120.318 121.501 -1.183 25158 3604 1 10 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.424 -0.054 25158 3605 1 10 . 1 1 18 18 ASP C C 18 177.168 177.168 177.759 -0.591 25158 3606 1 10 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.368 1.546 25158 3607 1 10 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.001 2.162 25158 3608 1 10 . 1 1 18 18 ASP H H 18 7.995 7.995 7.915 0.080 25158 3609 1 10 . 1 1 19 19 ALA N N 19 120.191 120.191 122.951 -2.760 25158 3610 1 10 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.023 0.025 25158 3611 1 10 . 1 1 19 19 ALA C C 19 179.549 179.549 179.229 0.320 25158 3612 1 10 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.186 0.227 25158 3613 1 10 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.492 -1.179 25158 3614 1 10 . 1 1 19 19 ALA H H 19 7.085 7.085 7.438 -0.353 25158 3615 1 10 . 1 1 20 20 VAL N N 20 120.613 120.613 118.820 1.793 25158 3616 1 10 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.677 -0.066 25158 3617 1 10 . 1 1 20 20 VAL C C 20 178.153 178.153 177.429 0.724 25158 3618 1 10 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.224 1.543 25158 3619 1 10 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.557 0.311 25158 3620 1 10 . 1 1 20 20 VAL H H 20 7.835 7.835 7.461 0.374 25158 3621 1 10 . 1 1 21 21 ALA N N 21 121.767 121.767 122.227 -0.460 25158 3622 1 10 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.147 -0.085 25158 3623 1 10 . 1 1 21 21 ALA C C 21 179.298 179.298 179.565 -0.267 25158 3624 1 10 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.158 0.086 25158 3625 1 10 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.305 -0.516 25158 3626 1 10 . 1 1 21 21 ALA H H 21 7.804 7.804 7.744 0.060 25158 3627 1 10 . 1 1 22 22 LEU N N 22 117.555 117.555 119.326 -1.771 25158 3628 1 10 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.109 0.037 25158 3629 1 10 . 1 1 22 22 LEU C C 22 177.914 177.914 178.559 -0.645 25158 3630 1 10 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.311 0.382 25158 3631 1 10 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.787 -0.272 25158 3632 1 10 . 1 1 22 22 LEU H H 22 8.619 8.619 8.029 0.590 25158 3633 1 10 . 1 1 23 23 LYS N N 23 120.335 120.335 119.269 1.066 25158 3634 1 10 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.998 -0.079 25158 3635 1 10 . 1 1 23 23 LYS C C 23 177.731 177.731 179.308 -1.577 25158 3636 1 10 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.888 0.449 25158 3637 1 10 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.187 -0.089 25158 3638 1 10 . 1 1 23 23 LYS H H 23 8.230 8.230 8.033 0.197 25158 3639 1 10 . 1 1 24 24 ARG N N 24 116.831 116.831 118.529 -1.698 25158 3640 1 10 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.057 -0.098 25158 3641 1 10 . 1 1 24 24 ARG C C 24 178.616 178.616 178.348 0.268 25158 3642 1 10 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.173 0.784 25158 3643 1 10 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.034 -0.471 25158 3644 1 10 . 1 1 24 24 ARG H H 24 7.927 7.927 7.608 0.319 25158 3645 1 10 . 1 1 25 25 TYR N N 25 120.960 120.960 121.879 -0.919 25158 3646 1 10 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.176 0.034 25158 3647 1 10 . 1 1 25 25 TYR C C 25 179.465 179.465 178.429 1.036 25158 3648 1 10 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.747 0.098 25158 3649 1 10 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.470 0.595 25158 3650 1 10 . 1 1 25 25 TYR H H 25 8.321 8.321 7.639 0.682 25158 3651 1 10 . 1 1 26 26 VAL N N 26 120.405 120.405 117.398 3.007 25158 3652 1 10 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.845 -0.071 25158 3653 1 10 . 1 1 26 26 VAL C C 26 177.826 177.826 177.225 0.601 25158 3654 1 10 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.164 0.276 25158 3655 1 10 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.909 -0.352 25158 3656 1 10 . 1 1 26 26 VAL H H 26 8.803 8.803 7.953 0.850 25158 3657 1 10 . 1 1 27 27 LEU N N 27 119.247 119.247 119.688 -0.441 25158 3658 1 10 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.443 -0.167 25158 3659 1 10 . 1 1 27 27 LEU C C 27 176.753 176.753 175.872 0.881 25158 3660 1 10 . 1 1 27 27 LEU CA C 27 55.675 55.675 53.895 1.780 25158 3661 1 10 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.678 -0.085 25158 3662 1 10 . 1 1 27 27 LEU H H 27 7.898 7.898 7.495 0.403 25158 3663 1 10 . 1 1 28 28 ARG N N 28 116.082 116.082 115.695 0.387 25158 3664 1 10 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.746 0.368 25158 3665 1 10 . 1 1 28 28 ARG C C 28 176.521 176.521 175.929 0.592 25158 3666 1 10 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.259 -1.105 25158 3667 1 10 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.061 0.411 25158 3668 1 10 . 1 1 28 28 ARG H H 28 7.993 7.993 7.750 0.243 25158 3669 1 10 . 1 1 29 29 SER N N 29 113.579 113.579 115.559 -1.980 25158 3670 1 10 . 1 1 29 29 SER HA H 29 4.305 4.305 4.331 -0.026 25158 3671 1 10 . 1 1 29 29 SER C C 29 175.368 175.368 175.559 -0.191 25158 3672 1 10 . 1 1 29 29 SER CA C 29 59.699 59.699 60.178 -0.479 25158 3673 1 10 . 1 1 29 29 SER CB C 29 63.908 63.908 63.983 -0.074 25158 3674 1 10 . 1 1 29 29 SER H H 29 8.094 8.094 8.019 0.075 25158 3675 1 10 . 1 1 30 30 GLY N N 30 109.920 109.920 108.395 1.525 25158 3676 1 10 . 1 1 30 30 GLY C C 30 174.115 174.115 173.924 0.191 25158 3677 1 10 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.654 1.117 25158 3678 1 10 . 1 1 30 30 GLY H H 30 8.577 8.577 8.378 0.199 25158 3679 1 10 . 1 1 31 31 ILE N N 31 119.084 119.084 119.432 -0.348 25158 3680 1 10 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.341 0.017 25158 3681 1 10 . 1 1 31 31 ILE C C 31 174.392 174.392 175.091 -0.699 25158 3682 1 10 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.127 0.119 25158 3683 1 10 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.620 -0.041 25158 3684 1 10 . 1 1 31 31 ILE H H 31 7.387 7.387 7.581 -0.194 25158 3685 1 10 . 1 1 32 32 SER N N 32 120.582 120.582 122.562 -1.980 25158 3686 1 10 . 1 1 32 32 SER HA H 32 4.845 4.845 4.921 -0.076 25158 3687 1 10 . 1 1 32 32 SER C C 32 173.891 173.891 174.212 -0.321 25158 3688 1 10 . 1 1 32 32 SER CA C 32 57.603 57.603 57.581 0.022 25158 3689 1 10 . 1 1 32 32 SER CB C 32 63.849 63.849 63.433 0.416 25158 3690 1 10 . 1 1 32 32 SER H H 32 8.339 8.339 8.520 -0.181 25158 3691 1 10 . 1 1 33 33 ILE N N 33 116.629 116.629 121.087 -4.458 25158 3692 1 10 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.615 0.018 25158 3693 1 10 . 1 1 33 33 ILE C C 33 174.195 174.195 174.049 0.146 25158 3694 1 10 . 1 1 33 33 ILE CA C 33 59.112 59.112 58.879 0.233 25158 3695 1 10 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.358 2.224 25158 3696 1 10 . 1 1 33 33 ILE H H 33 7.873 7.873 8.167 -0.294 25158 3697 1 10 . 1 1 34 34 ASN N N 34 118.342 118.342 119.141 -0.799 25158 3698 1 10 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.879 -0.143 25158 3699 1 10 . 1 1 34 34 ASN C C 34 176.217 176.217 175.839 0.378 25158 3700 1 10 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.821 -0.635 25158 3701 1 10 . 1 1 34 34 ASN CB C 34 36.499 36.499 39.265 -2.766 25158 3702 1 10 . 1 1 34 34 ASN H H 34 8.839 8.839 8.222 0.617 25158 3703 1 10 . 1 1 35 35 THR N N 35 116.120 116.120 117.810 -1.690 25158 3704 1 10 . 1 1 35 35 THR HA H 35 3.559 3.559 4.046 -0.487 25158 3705 1 10 . 1 1 35 35 THR C C 35 177.347 177.347 176.063 1.284 25158 3706 1 10 . 1 1 35 35 THR CA C 35 64.686 64.686 65.454 -0.768 25158 3707 1 10 . 1 1 35 35 THR CB C 35 67.758 67.758 69.026 -1.268 25158 3708 1 10 . 1 1 35 35 THR H H 35 7.939 7.939 8.433 -0.494 25158 3709 1 10 . 1 1 36 36 ASP N N 36 123.528 123.528 121.991 1.537 25158 3710 1 10 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.362 0.058 25158 3711 1 10 . 1 1 36 36 ASP C C 36 177.752 177.752 177.040 0.712 25158 3712 1 10 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.215 -0.141 25158 3713 1 10 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.468 -0.570 25158 3714 1 10 . 1 1 36 36 ASP H H 36 7.980 7.980 8.815 -0.835 25158 3715 1 10 . 1 1 37 37 ASN N N 37 115.690 115.690 116.569 -0.879 25158 3716 1 10 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.496 -0.230 25158 3717 1 10 . 1 1 37 37 ASN C C 37 175.589 175.589 176.949 -1.360 25158 3718 1 10 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.906 -2.346 25158 3719 1 10 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.427 -0.464 25158 3720 1 10 . 1 1 37 37 ASN H H 37 7.251 7.251 8.277 -1.026 25158 3721 1 10 . 1 1 38 38 ALA N N 38 119.560 119.560 122.429 -2.869 25158 3722 1 10 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.011 0.069 25158 3723 1 10 . 1 1 38 38 ALA C C 38 173.638 173.638 177.290 -3.652 25158 3724 1 10 . 1 1 38 38 ALA CA C 38 52.220 52.220 53.936 -1.716 25158 3725 1 10 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.683 4.188 25158 3726 1 10 . 1 1 38 38 ALA H H 38 7.142 7.142 7.863 -0.721 25158 3727 1 10 . 1 1 39 39 ASP N N 39 115.003 115.003 119.458 -4.455 25158 3728 1 10 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.764 0.176 25158 3729 1 10 . 1 1 39 39 ASP C C 39 177.163 177.163 177.111 0.052 25158 3730 1 10 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.734 -2.563 25158 3731 1 10 . 1 1 39 39 ASP CB C 39 38.946 38.946 40.006 -1.060 25158 3732 1 10 . 1 1 39 39 ASP H H 39 7.096 7.096 7.754 -0.658 25158 3733 1 10 . 1 1 40 40 LEU N N 40 123.245 123.245 124.041 -0.796 25158 3734 1 10 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.504 -0.433 25158 3735 1 10 . 1 1 40 40 LEU C C 40 175.865 175.865 177.795 -1.930 25158 3736 1 10 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.129 0.464 25158 3737 1 10 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.151 -0.222 25158 3738 1 10 . 1 1 40 40 LEU H H 40 8.572 8.572 7.940 0.632 25158 3739 1 10 . 1 1 41 41 ASN N N 41 112.723 112.723 113.704 -0.981 25158 3740 1 10 . 1 1 41 41 ASN HA H 41 4.999 4.999 5.115 -0.116 25158 3741 1 10 . 1 1 41 41 ASN C C 41 173.846 173.846 175.459 -1.613 25158 3742 1 10 . 1 1 41 41 ASN CA C 41 51.233 51.233 51.857 -0.624 25158 3743 1 10 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.096 -1.701 25158 3744 1 10 . 1 1 41 41 ASN H H 41 8.004 8.004 7.965 0.039 25158 3745 1 10 . 1 1 42 42 GLU N N 42 115.798 115.798 115.706 0.092 25158 3746 1 10 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.291 -0.339 25158 3747 1 10 . 1 1 42 42 GLU C C 42 175.172 175.172 175.606 -0.434 25158 3748 1 10 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.744 -0.393 25158 3749 1 10 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.131 1.090 25158 3750 1 10 . 1 1 42 42 GLU H H 42 7.642 7.642 8.431 -0.789 25158 3751 1 10 . 1 1 43 43 ASP N N 43 117.453 117.453 117.024 0.429 25158 3752 1 10 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.507 0.332 25158 3753 1 10 . 1 1 43 43 ASP C C 43 178.129 178.129 177.173 0.956 25158 3754 1 10 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.952 -1.314 25158 3755 1 10 . 1 1 43 43 ASP CB C 43 41.214 41.214 40.833 0.381 25158 3756 1 10 . 1 1 43 43 ASP H H 43 8.473 8.473 8.930 -0.457 25158 3757 1 10 . 1 1 44 44 GLY N N 44 112.490 112.490 107.400 5.090 25158 3758 1 10 . 1 1 44 44 GLY C C 44 173.717 173.717 173.687 0.030 25158 3759 1 10 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.833 0.484 25158 3760 1 10 . 1 1 44 44 GLY H H 44 10.139 10.139 8.526 1.613 25158 3761 1 10 . 1 1 45 45 ARG N N 45 118.154 118.154 118.498 -0.344 25158 3762 1 10 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.638 0.150 25158 3763 1 10 . 1 1 45 45 ARG C C 45 175.602 175.602 174.217 1.385 25158 3764 1 10 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.571 -0.739 25158 3765 1 10 . 1 1 45 45 ARG CB C 45 33.664 33.664 33.021 0.643 25158 3766 1 10 . 1 1 45 45 ARG H H 45 7.994 7.994 8.814 -0.820 25158 3767 1 10 . 1 1 46 46 VAL N N 46 126.392 126.392 122.250 4.142 25158 3768 1 10 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.408 0.382 25158 3769 1 10 . 1 1 46 46 VAL C C 46 174.644 174.644 175.712 -1.068 25158 3770 1 10 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.627 0.102 25158 3771 1 10 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.314 1.352 25158 3772 1 10 . 1 1 46 46 VAL H H 46 9.115 9.115 8.417 0.698 25158 3773 1 10 . 1 1 47 47 ASN N N 47 126.737 126.737 126.132 0.605 25158 3774 1 10 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.993 -0.118 25158 3775 1 10 . 1 1 47 47 ASN C C 47 176.467 176.467 176.022 0.445 25158 3776 1 10 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.423 0.617 25158 3777 1 10 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.790 -0.603 25158 3778 1 10 . 1 1 47 47 ASN H H 47 10.077 10.077 7.729 2.348 25158 3779 1 10 . 1 1 48 48 SER N N 48 113.409 113.409 115.036 -1.627 25158 3780 1 10 . 1 1 48 48 SER HA H 48 4.086 4.086 4.128 -0.042 25158 3781 1 10 . 1 1 48 48 SER C C 48 176.671 176.671 175.958 0.713 25158 3782 1 10 . 1 1 48 48 SER CA C 48 62.375 62.375 61.967 0.408 25158 3783 1 10 . 1 1 48 48 SER CB C 48 62.375 62.375 63.081 -0.706 25158 3784 1 10 . 1 1 48 48 SER H H 48 8.936 8.936 8.670 0.266 25158 3785 1 10 . 1 1 49 49 THR N N 49 121.885 121.885 118.038 3.847 25158 3786 1 10 . 1 1 49 49 THR HA H 49 4.112 4.112 4.018 0.094 25158 3787 1 10 . 1 1 49 49 THR C C 49 177.320 177.320 176.530 0.790 25158 3788 1 10 . 1 1 49 49 THR CA C 49 66.713 66.713 65.988 0.725 25158 3789 1 10 . 1 1 49 49 THR CB C 49 67.787 67.787 68.069 -0.282 25158 3790 1 10 . 1 1 49 49 THR H H 49 8.124 8.124 8.160 -0.036 25158 3791 1 10 . 1 1 50 50 ASP N N 50 120.401 120.401 122.519 -2.118 25158 3792 1 10 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.410 -0.040 25158 3793 1 10 . 1 1 50 50 ASP C C 50 177.033 177.033 178.364 -1.331 25158 3794 1 10 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.474 1.346 25158 3795 1 10 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.161 1.547 25158 3796 1 10 . 1 1 50 50 ASP H H 50 7.560 7.560 7.917 -0.357 25158 3797 1 10 . 1 1 51 51 LEU N N 51 118.174 118.174 120.821 -2.647 25158 3798 1 10 . 1 1 51 51 LEU HA H 51 4.188 4.188 3.951 0.237 25158 3799 1 10 . 1 1 51 51 LEU C C 51 177.441 177.441 178.622 -1.181 25158 3800 1 10 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.904 0.233 25158 3801 1 10 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.712 0.135 25158 3802 1 10 . 1 1 51 51 LEU H H 51 7.134 7.134 7.577 -0.443 25158 3803 1 10 . 1 1 52 52 GLY N N 52 105.596 105.596 106.732 -1.136 25158 3804 1 10 . 1 1 52 52 GLY C C 52 176.764 176.764 175.841 0.923 25158 3805 1 10 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.971 0.671 25158 3806 1 10 . 1 1 52 52 GLY H H 52 8.034 8.034 7.671 0.363 25158 3807 1 10 . 1 1 53 53 ILE N N 53 122.043 122.043 123.279 -1.236 25158 3808 1 10 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.586 -0.137 25158 3809 1 10 . 1 1 53 53 ILE C C 53 177.112 177.112 177.473 -0.361 25158 3810 1 10 . 1 1 53 53 ILE CA C 53 65.388 65.388 65.132 0.256 25158 3811 1 10 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.878 0.380 25158 3812 1 10 . 1 1 53 53 ILE H H 53 7.611 7.611 7.871 -0.260 25158 3813 1 10 . 1 1 54 54 LEU N N 54 120.787 120.787 120.042 0.745 25158 3814 1 10 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.923 0.018 25158 3815 1 10 . 1 1 54 54 LEU C C 54 175.340 175.340 178.640 -3.300 25158 3816 1 10 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.242 -0.047 25158 3817 1 10 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.738 -0.517 25158 3818 1 10 . 1 1 54 54 LEU H H 54 8.323 8.323 8.343 -0.020 25158 3819 1 10 . 1 1 55 55 LYS N N 55 116.833 116.833 119.109 -2.276 25158 3820 1 10 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.991 -0.107 25158 3821 1 10 . 1 1 55 55 LYS C C 55 179.067 179.067 179.073 -0.006 25158 3822 1 10 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.621 1.030 25158 3823 1 10 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.223 -0.214 25158 3824 1 10 . 1 1 55 55 LYS H H 55 8.356 8.356 7.578 0.778 25158 3825 1 10 . 1 1 56 56 ARG N N 56 117.092 117.092 119.466 -2.374 25158 3826 1 10 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.289 -0.373 25158 3827 1 10 . 1 1 56 56 ARG C C 56 178.223 178.223 178.831 -0.608 25158 3828 1 10 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.420 0.931 25158 3829 1 10 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.154 0.626 25158 3830 1 10 . 1 1 56 56 ARG H H 56 7.543 7.543 7.827 -0.284 25158 3831 1 10 . 1 1 57 57 TYR N N 57 122.187 122.187 121.175 1.012 25158 3832 1 10 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.500 -0.108 25158 3833 1 10 . 1 1 57 57 TYR C C 57 180.009 180.009 178.611 1.398 25158 3834 1 10 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.265 0.314 25158 3835 1 10 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.442 0.394 25158 3836 1 10 . 1 1 57 57 TYR H H 57 8.592 8.592 7.945 0.647 25158 3837 1 10 . 1 1 58 58 ILE N N 58 122.825 122.825 118.142 4.683 25158 3838 1 10 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.809 -0.129 25158 3839 1 10 . 1 1 58 58 ILE C C 58 178.186 178.186 176.937 1.249 25158 3840 1 10 . 1 1 58 58 ILE CA C 58 64.768 64.768 64.158 0.610 25158 3841 1 10 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.316 -0.596 25158 3842 1 10 . 1 1 58 58 ILE H H 58 8.779 8.779 7.564 1.215 25158 3843 1 10 . 1 1 59 59 LEU N N 59 118.552 118.552 118.650 -0.098 25158 3844 1 10 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.374 -0.151 25158 3845 1 10 . 1 1 59 59 LEU C C 59 175.937 175.937 175.467 0.470 25158 3846 1 10 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.252 1.260 25158 3847 1 10 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.472 0.954 25158 3848 1 10 . 1 1 59 59 LEU H H 59 7.539 7.539 7.504 0.035 25158 3849 1 10 . 1 1 60 60 LYS N N 60 113.650 113.650 116.888 -3.238 25158 3850 1 10 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.751 0.244 25158 3851 1 10 . 1 1 60 60 LYS C C 60 176.535 176.535 176.345 0.190 25158 3852 1 10 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.720 -0.429 25158 3853 1 10 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.823 -1.552 25158 3854 1 10 . 1 1 60 60 LYS H H 60 7.815 7.815 7.505 0.310 25158 3855 1 10 . 1 1 61 61 GLU N N 61 117.535 117.535 116.173 1.362 25158 3856 1 10 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.186 -0.042 25158 3857 1 10 . 1 1 61 61 GLU C C 61 176.992 176.992 176.395 0.597 25158 3858 1 10 . 1 1 61 61 GLU CA C 61 57.689 57.689 58.074 -0.385 25158 3859 1 10 . 1 1 61 61 GLU CB C 61 30.692 30.692 30.732 -0.040 25158 3860 1 10 . 1 1 61 61 GLU H H 61 8.438 8.438 8.247 0.191 25158 3861 1 10 . 1 1 62 62 ILE N N 62 112.102 112.102 114.773 -2.671 25158 3862 1 10 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.441 -0.058 25158 3863 1 10 . 1 1 62 62 ILE C C 62 175.425 175.425 174.859 0.566 25158 3864 1 10 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.116 -0.190 25158 3865 1 10 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.561 1.187 25158 3866 1 10 . 1 1 62 62 ILE H H 62 6.867 6.867 7.276 -0.409 25158 3867 1 10 . 1 1 63 63 ASP N N 63 119.719 119.719 122.297 -2.578 25158 3868 1 10 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.996 -0.322 25158 3869 1 10 . 1 1 63 63 ASP C C 63 176.202 176.202 175.933 0.269 25158 3870 1 10 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.171 0.647 25158 3871 1 10 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.614 -0.397 25158 3872 1 10 . 1 1 63 63 ASP H H 63 8.561 8.561 8.832 -0.271 25158 3873 1 10 . 1 1 64 64 THR N N 64 113.289 113.289 116.031 -2.742 25158 3874 1 10 . 1 1 64 64 THR HA H 64 4.712 4.712 4.584 0.128 25158 3875 1 10 . 1 1 64 64 THR C C 64 170.854 170.854 173.007 -2.153 25158 3876 1 10 . 1 1 64 64 THR CA C 64 61.269 61.269 61.776 -0.507 25158 3877 1 10 . 1 1 64 64 THR CB C 64 71.993 71.993 69.221 2.772 25158 3878 1 10 . 1 1 64 64 THR H H 64 7.410 7.410 7.657 -0.247 25158 3879 1 10 . 1 1 65 65 LEU N N 65 121.012 121.012 127.666 -6.654 25158 3880 1 10 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.735 -0.506 25158 3881 1 10 . 1 1 65 65 LEU C C 65 174.763 174.763 174.887 -0.124 25158 3882 1 10 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.942 -0.307 25158 3883 1 10 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.361 1.159 25158 3884 1 10 . 1 1 65 65 LEU H H 65 7.877 7.877 8.406 -0.529 25158 3885 1 10 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.182 -0.190 25158 3886 1 10 . 1 1 66 66 PRO C C 66 174.419 174.419 174.946 -0.527 25158 3887 1 10 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.351 -0.041 25158 3888 1 10 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.533 2.693 25158 3889 1 10 . 1 1 67 67 TYR N N 67 122.616 122.616 120.830 1.786 25158 3890 1 10 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.385 0.271 25158 3891 1 10 . 1 1 67 67 TYR C C 67 174.446 174.446 176.331 -1.885 25158 3892 1 10 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.650 -0.639 25158 3893 1 10 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.703 1.379 25158 3894 1 10 . 1 1 67 67 TYR H H 67 8.662 8.662 8.423 0.239 25158 3895 1 10 . 1 1 68 68 LYS N N 68 126.223 126.223 128.049 -1.826 25158 3896 1 10 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.114 0.154 25158 3897 1 10 . 1 1 68 68 LYS C C 68 174.748 174.748 175.099 -0.351 25158 3898 1 10 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.812 -0.209 25158 3899 1 10 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.509 1.260 25158 3900 1 10 . 1 1 68 68 LYS H H 68 8.112 8.112 8.127 -0.015 25158 3901 1 11 . 1 1 2 2 THR N N 2 116.700 116.700 116.180 0.520 25158 3902 1 11 . 1 1 2 2 THR HA H 2 4.313 4.313 4.401 -0.088 25158 3903 1 11 . 1 1 2 2 THR C C 2 173.968 173.968 172.505 1.463 25158 3904 1 11 . 1 1 2 2 THR CA C 2 62.326 62.326 61.835 0.491 25158 3905 1 11 . 1 1 2 2 THR CB C 2 70.154 70.154 69.978 0.176 25158 3906 1 11 . 1 1 2 2 THR H H 2 8.657 8.657 8.005 0.652 25158 3907 1 11 . 1 1 3 3 LYS N N 3 125.500 125.500 126.355 -0.855 25158 3908 1 11 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.341 -0.276 25158 3909 1 11 . 1 1 3 3 LYS C C 3 174.926 174.926 175.128 -0.202 25158 3910 1 11 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.556 0.283 25158 3911 1 11 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.563 1.214 25158 3912 1 11 . 1 1 3 3 LYS H H 3 8.318 8.318 8.413 -0.095 25158 3913 1 11 . 1 1 4 4 LEU N N 4 127.473 127.473 124.954 2.519 25158 3914 1 11 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.313 0.170 25158 3915 1 11 . 1 1 4 4 LEU C C 4 174.734 174.734 174.698 0.036 25158 3916 1 11 . 1 1 4 4 LEU CA C 4 53.259 53.259 52.792 0.467 25158 3917 1 11 . 1 1 4 4 LEU CB C 4 40.929 40.929 46.520 -5.591 25158 3918 1 11 . 1 1 4 4 LEU H H 4 7.726 7.726 7.838 -0.112 25158 3919 1 11 . 1 1 5 5 TYR N N 5 123.074 123.074 118.437 4.637 25158 3920 1 11 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.653 -1.030 25158 3921 1 11 . 1 1 5 5 TYR C C 5 175.406 175.406 176.885 -1.479 25158 3922 1 11 . 1 1 5 5 TYR CA C 5 61.812 61.812 57.659 4.153 25158 3923 1 11 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.609 1.501 25158 3924 1 11 . 1 1 5 5 TYR H H 5 7.816 7.816 8.180 -0.364 25158 3925 1 11 . 1 1 6 6 GLY N N 6 108.614 108.614 114.484 -5.870 25158 3926 1 11 . 1 1 6 6 GLY C C 6 172.585 172.585 173.779 -1.194 25158 3927 1 11 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.875 0.512 25158 3928 1 11 . 1 1 6 6 GLY H H 6 8.915 8.915 8.930 -0.015 25158 3929 1 11 . 1 1 7 7 ASP N N 7 118.023 118.023 123.176 -5.153 25158 3930 1 11 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.552 0.432 25158 3931 1 11 . 1 1 7 7 ASP C C 7 177.806 177.806 177.449 0.357 25158 3932 1 11 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.419 -1.226 25158 3933 1 11 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.529 -0.379 25158 3934 1 11 . 1 1 7 7 ASP H H 7 7.976 7.976 8.123 -0.147 25158 3935 1 11 . 1 1 8 8 VAL N N 8 120.293 120.293 120.183 0.110 25158 3936 1 11 . 1 1 8 8 VAL HA H 8 3.983 3.983 3.986 -0.003 25158 3937 1 11 . 1 1 8 8 VAL C C 8 175.717 175.717 176.956 -1.239 25158 3938 1 11 . 1 1 8 8 VAL CA C 8 63.446 63.446 64.072 -0.626 25158 3939 1 11 . 1 1 8 8 VAL CB C 8 31.271 31.271 32.065 -0.794 25158 3940 1 11 . 1 1 8 8 VAL H H 8 8.156 8.156 8.113 0.043 25158 3941 1 11 . 1 1 9 9 ASN N N 9 115.226 115.226 115.891 -0.665 25158 3942 1 11 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.583 0.406 25158 3943 1 11 . 1 1 9 9 ASN C C 9 174.626 174.626 175.328 -0.702 25158 3944 1 11 . 1 1 9 9 ASN CA C 9 50.950 50.950 53.075 -2.125 25158 3945 1 11 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.320 -0.619 25158 3946 1 11 . 1 1 9 9 ASN H H 9 8.008 8.008 8.026 -0.018 25158 3947 1 11 . 1 1 10 10 ASP N N 10 115.600 115.600 119.008 -3.408 25158 3948 1 11 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.562 -0.126 25158 3949 1 11 . 1 1 10 10 ASP C C 10 175.125 175.125 175.803 -0.678 25158 3950 1 11 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.195 1.040 25158 3951 1 11 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.691 0.509 25158 3952 1 11 . 1 1 10 10 ASP H H 10 7.374 7.374 7.925 -0.551 25158 3953 1 11 . 1 1 11 11 ASP N N 11 118.402 118.402 116.676 1.726 25158 3954 1 11 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.666 0.151 25158 3955 1 11 . 1 1 11 11 ASP C C 11 178.299 178.299 177.100 1.199 25158 3956 1 11 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.403 -0.582 25158 3957 1 11 . 1 1 11 11 ASP CB C 11 41.114 41.114 42.099 -0.985 25158 3958 1 11 . 1 1 11 11 ASP H H 11 8.801 8.801 9.114 -0.313 25158 3959 1 11 . 1 1 12 12 GLY N N 12 112.353 112.353 108.007 4.346 25158 3960 1 11 . 1 1 12 12 GLY C C 12 173.284 173.284 173.571 -0.287 25158 3961 1 11 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.098 0.526 25158 3962 1 11 . 1 1 12 12 GLY H H 12 10.293 10.293 8.449 1.844 25158 3963 1 11 . 1 1 13 13 LYS N N 13 118.118 118.118 116.512 1.606 25158 3964 1 11 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.589 0.070 25158 3965 1 11 . 1 1 13 13 LYS C C 13 175.595 175.595 174.288 1.307 25158 3966 1 11 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.352 -1.594 25158 3967 1 11 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.424 0.915 25158 3968 1 11 . 1 1 13 13 LYS H H 13 7.848 7.848 8.123 -0.275 25158 3969 1 11 . 1 1 14 14 VAL N N 14 126.591 126.591 121.034 5.557 25158 3970 1 11 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.522 0.233 25158 3971 1 11 . 1 1 14 14 VAL C C 14 175.052 175.052 174.946 0.106 25158 3972 1 11 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.446 0.624 25158 3973 1 11 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.856 -0.401 25158 3974 1 11 . 1 1 14 14 VAL H H 14 9.109 9.109 8.425 0.684 25158 3975 1 11 . 1 1 15 15 ASN N N 15 126.287 126.287 124.965 1.322 25158 3976 1 11 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.997 -0.182 25158 3977 1 11 . 1 1 15 15 ASN C C 15 176.340 176.340 176.417 -0.077 25158 3978 1 11 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.600 0.675 25158 3979 1 11 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.892 -2.672 25158 3980 1 11 . 1 1 15 15 ASN H H 15 10.071 10.071 9.512 0.559 25158 3981 1 11 . 1 1 16 16 SER N N 16 113.168 113.168 116.221 -3.053 25158 3982 1 11 . 1 1 16 16 SER HA H 16 4.047 4.047 4.202 -0.155 25158 3983 1 11 . 1 1 16 16 SER C C 16 176.197 176.197 175.945 0.252 25158 3984 1 11 . 1 1 16 16 SER CA C 16 62.681 62.681 61.629 1.052 25158 3985 1 11 . 1 1 16 16 SER CB C 16 62.681 62.681 62.535 0.146 25158 3986 1 11 . 1 1 16 16 SER H H 16 8.825 8.825 8.786 0.039 25158 3987 1 11 . 1 1 17 17 THR N N 17 119.391 119.391 115.121 4.270 25158 3988 1 11 . 1 1 17 17 THR HA H 17 3.983 3.983 4.101 -0.118 25158 3989 1 11 . 1 1 17 17 THR C C 17 177.149 177.149 176.369 0.780 25158 3990 1 11 . 1 1 17 17 THR CA C 17 66.791 66.791 65.785 1.006 25158 3991 1 11 . 1 1 17 17 THR CB C 17 67.757 67.757 68.305 -0.548 25158 3992 1 11 . 1 1 17 17 THR H H 17 7.946 7.946 8.253 -0.307 25158 3993 1 11 . 1 1 18 18 ASP N N 18 120.318 120.318 121.153 -0.835 25158 3994 1 11 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.475 -0.105 25158 3995 1 11 . 1 1 18 18 ASP C C 18 177.168 177.168 177.884 -0.716 25158 3996 1 11 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.481 1.433 25158 3997 1 11 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.620 1.542 25158 3998 1 11 . 1 1 18 18 ASP H H 18 7.995 7.995 7.953 0.042 25158 3999 1 11 . 1 1 19 19 ALA N N 19 120.191 120.191 123.707 -3.516 25158 4000 1 11 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.046 0.002 25158 4001 1 11 . 1 1 19 19 ALA C C 19 179.549 179.549 179.314 0.235 25158 4002 1 11 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.308 0.105 25158 4003 1 11 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.419 -1.106 25158 4004 1 11 . 1 1 19 19 ALA H H 19 7.085 7.085 7.321 -0.236 25158 4005 1 11 . 1 1 20 20 VAL N N 20 120.613 120.613 118.145 2.468 25158 4006 1 11 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.691 -0.080 25158 4007 1 11 . 1 1 20 20 VAL C C 20 178.153 178.153 177.283 0.870 25158 4008 1 11 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.225 1.542 25158 4009 1 11 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.769 0.099 25158 4010 1 11 . 1 1 20 20 VAL H H 20 7.835 7.835 7.678 0.157 25158 4011 1 11 . 1 1 21 21 ALA N N 21 121.767 121.767 122.771 -1.004 25158 4012 1 11 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.053 0.009 25158 4013 1 11 . 1 1 21 21 ALA C C 21 179.298 179.298 179.572 -0.274 25158 4014 1 11 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.239 0.005 25158 4015 1 11 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.216 -0.427 25158 4016 1 11 . 1 1 21 21 ALA H H 21 7.804 7.804 7.620 0.184 25158 4017 1 11 . 1 1 22 22 LEU N N 22 117.555 117.555 119.580 -2.025 25158 4018 1 11 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.045 0.101 25158 4019 1 11 . 1 1 22 22 LEU C C 22 177.914 177.914 178.474 -0.560 25158 4020 1 11 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.626 0.067 25158 4021 1 11 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.654 -0.139 25158 4022 1 11 . 1 1 22 22 LEU H H 22 8.619 8.619 8.205 0.414 25158 4023 1 11 . 1 1 23 23 LYS N N 23 120.335 120.335 118.796 1.539 25158 4024 1 11 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.952 -0.033 25158 4025 1 11 . 1 1 23 23 LYS C C 23 177.731 177.731 179.149 -1.418 25158 4026 1 11 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.636 0.701 25158 4027 1 11 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.173 -0.075 25158 4028 1 11 . 1 1 23 23 LYS H H 23 8.230 8.230 7.649 0.581 25158 4029 1 11 . 1 1 24 24 ARG N N 24 116.831 116.831 117.218 -0.387 25158 4030 1 11 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.097 -0.138 25158 4031 1 11 . 1 1 24 24 ARG C C 24 178.616 178.616 178.361 0.255 25158 4032 1 11 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.285 0.672 25158 4033 1 11 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.061 -0.498 25158 4034 1 11 . 1 1 24 24 ARG H H 24 7.927 7.927 7.616 0.311 25158 4035 1 11 . 1 1 25 25 TYR N N 25 120.960 120.960 121.161 -0.201 25158 4036 1 11 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.283 -0.073 25158 4037 1 11 . 1 1 25 25 TYR C C 25 179.465 179.465 178.418 1.047 25158 4038 1 11 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.419 0.426 25158 4039 1 11 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.433 0.632 25158 4040 1 11 . 1 1 25 25 TYR H H 25 8.321 8.321 7.553 0.768 25158 4041 1 11 . 1 1 26 26 VAL N N 26 120.405 120.405 119.729 0.676 25158 4042 1 11 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.751 0.023 25158 4043 1 11 . 1 1 26 26 VAL C C 26 177.826 177.826 177.341 0.485 25158 4044 1 11 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.524 -0.084 25158 4045 1 11 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.899 -0.342 25158 4046 1 11 . 1 1 26 26 VAL H H 26 8.803 8.803 7.966 0.837 25158 4047 1 11 . 1 1 27 27 LEU N N 27 119.247 119.247 118.084 1.163 25158 4048 1 11 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.298 -0.022 25158 4049 1 11 . 1 1 27 27 LEU C C 27 176.753 176.753 176.093 0.660 25158 4050 1 11 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.801 0.874 25158 4051 1 11 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.219 -0.626 25158 4052 1 11 . 1 1 27 27 LEU H H 27 7.898 7.898 7.481 0.417 25158 4053 1 11 . 1 1 28 28 ARG N N 28 116.082 116.082 118.190 -2.108 25158 4054 1 11 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.867 0.247 25158 4055 1 11 . 1 1 28 28 ARG C C 28 176.521 176.521 175.980 0.541 25158 4056 1 11 . 1 1 28 28 ARG CA C 28 56.154 56.154 56.737 -0.583 25158 4057 1 11 . 1 1 28 28 ARG CB C 28 27.471 27.471 26.963 0.508 25158 4058 1 11 . 1 1 28 28 ARG H H 28 7.993 7.993 7.515 0.478 25158 4059 1 11 . 1 1 29 29 SER N N 29 113.579 113.579 114.174 -0.595 25158 4060 1 11 . 1 1 29 29 SER HA H 29 4.305 4.305 4.500 -0.195 25158 4061 1 11 . 1 1 29 29 SER C C 29 175.368 175.368 174.311 1.057 25158 4062 1 11 . 1 1 29 29 SER CA C 29 59.699 59.699 58.819 0.880 25158 4063 1 11 . 1 1 29 29 SER CB C 29 63.908 63.908 63.473 0.435 25158 4064 1 11 . 1 1 29 29 SER H H 29 8.094 8.094 8.096 -0.002 25158 4065 1 11 . 1 1 30 30 GLY N N 30 109.920 109.920 109.568 0.352 25158 4066 1 11 . 1 1 30 30 GLY C C 30 174.115 174.115 173.856 0.259 25158 4067 1 11 . 1 1 30 30 GLY CA C 30 45.771 45.771 45.379 0.392 25158 4068 1 11 . 1 1 30 30 GLY H H 30 8.577 8.577 8.200 0.377 25158 4069 1 11 . 1 1 31 31 ILE N N 31 119.084 119.084 119.832 -0.748 25158 4070 1 11 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.316 0.042 25158 4071 1 11 . 1 1 31 31 ILE C C 31 174.392 174.392 174.924 -0.532 25158 4072 1 11 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.490 -0.244 25158 4073 1 11 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.404 0.175 25158 4074 1 11 . 1 1 31 31 ILE H H 31 7.387 7.387 7.859 -0.472 25158 4075 1 11 . 1 1 32 32 SER N N 32 120.582 120.582 124.503 -3.921 25158 4076 1 11 . 1 1 32 32 SER HA H 32 4.845 4.845 4.832 0.013 25158 4077 1 11 . 1 1 32 32 SER C C 32 173.891 173.891 174.042 -0.151 25158 4078 1 11 . 1 1 32 32 SER CA C 32 57.603 57.603 58.564 -0.961 25158 4079 1 11 . 1 1 32 32 SER CB C 32 63.849 63.849 63.377 0.472 25158 4080 1 11 . 1 1 32 32 SER H H 32 8.339 8.339 8.667 -0.328 25158 4081 1 11 . 1 1 33 33 ILE N N 33 116.629 116.629 120.488 -3.859 25158 4082 1 11 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.555 0.078 25158 4083 1 11 . 1 1 33 33 ILE C C 33 174.195 174.195 174.208 -0.013 25158 4084 1 11 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.130 -0.018 25158 4085 1 11 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.671 1.911 25158 4086 1 11 . 1 1 33 33 ILE H H 33 7.873 7.873 8.105 -0.232 25158 4087 1 11 . 1 1 34 34 ASN N N 34 118.342 118.342 121.170 -2.828 25158 4088 1 11 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.942 -0.206 25158 4089 1 11 . 1 1 34 34 ASN C C 34 176.217 176.217 176.224 -0.007 25158 4090 1 11 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.377 -0.191 25158 4091 1 11 . 1 1 34 34 ASN CB C 34 36.499 36.499 37.915 -1.416 25158 4092 1 11 . 1 1 34 34 ASN H H 34 8.839 8.839 8.357 0.482 25158 4093 1 11 . 1 1 35 35 THR N N 35 116.120 116.120 116.721 -0.601 25158 4094 1 11 . 1 1 35 35 THR HA H 35 3.559 3.559 3.854 -0.295 25158 4095 1 11 . 1 1 35 35 THR C C 35 177.347 177.347 176.159 1.188 25158 4096 1 11 . 1 1 35 35 THR CA C 35 64.686 64.686 66.259 -1.573 25158 4097 1 11 . 1 1 35 35 THR CB C 35 67.758 67.758 68.913 -1.155 25158 4098 1 11 . 1 1 35 35 THR H H 35 7.939 7.939 7.966 -0.027 25158 4099 1 11 . 1 1 36 36 ASP N N 36 123.528 123.528 121.554 1.974 25158 4100 1 11 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.413 0.007 25158 4101 1 11 . 1 1 36 36 ASP C C 36 177.752 177.752 177.516 0.236 25158 4102 1 11 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.366 -0.292 25158 4103 1 11 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.702 -0.804 25158 4104 1 11 . 1 1 36 36 ASP H H 36 7.980 7.980 8.843 -0.863 25158 4105 1 11 . 1 1 37 37 ASN N N 37 115.690 115.690 116.687 -0.997 25158 4106 1 11 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.667 -0.401 25158 4107 1 11 . 1 1 37 37 ASN C C 37 175.589 175.589 177.118 -1.529 25158 4108 1 11 . 1 1 37 37 ASN CA C 37 52.560 52.560 55.100 -2.540 25158 4109 1 11 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.427 -0.464 25158 4110 1 11 . 1 1 37 37 ASN H H 37 7.251 7.251 8.200 -0.949 25158 4111 1 11 . 1 1 38 38 ALA N N 38 119.560 119.560 123.263 -3.703 25158 4112 1 11 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.027 0.053 25158 4113 1 11 . 1 1 38 38 ALA C C 38 173.638 173.638 177.411 -3.773 25158 4114 1 11 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.031 -1.811 25158 4115 1 11 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.732 4.139 25158 4116 1 11 . 1 1 38 38 ALA H H 38 7.142 7.142 8.351 -1.209 25158 4117 1 11 . 1 1 39 39 ASP N N 39 115.003 115.003 119.673 -4.670 25158 4118 1 11 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.665 0.275 25158 4119 1 11 . 1 1 39 39 ASP C C 39 177.163 177.163 177.042 0.121 25158 4120 1 11 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.828 -2.657 25158 4121 1 11 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.982 -1.036 25158 4122 1 11 . 1 1 39 39 ASP H H 39 7.096 7.096 7.723 -0.627 25158 4123 1 11 . 1 1 40 40 LEU N N 40 123.245 123.245 125.111 -1.866 25158 4124 1 11 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.246 -0.175 25158 4125 1 11 . 1 1 40 40 LEU C C 40 175.865 175.865 177.906 -2.041 25158 4126 1 11 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.613 -0.020 25158 4127 1 11 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.283 -0.354 25158 4128 1 11 . 1 1 40 40 LEU H H 40 8.572 8.572 8.167 0.405 25158 4129 1 11 . 1 1 41 41 ASN N N 41 112.723 112.723 114.777 -2.054 25158 4130 1 11 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.899 0.100 25158 4131 1 11 . 1 1 41 41 ASN C C 41 173.846 173.846 175.411 -1.565 25158 4132 1 11 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.037 -0.804 25158 4133 1 11 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.381 -1.986 25158 4134 1 11 . 1 1 41 41 ASN H H 41 8.004 8.004 8.000 0.004 25158 4135 1 11 . 1 1 42 42 GLU N N 42 115.798 115.798 115.352 0.446 25158 4136 1 11 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.268 -0.316 25158 4137 1 11 . 1 1 42 42 GLU C C 42 175.172 175.172 175.537 -0.365 25158 4138 1 11 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.363 -0.012 25158 4139 1 11 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.205 1.016 25158 4140 1 11 . 1 1 42 42 GLU H H 42 7.642 7.642 8.613 -0.971 25158 4141 1 11 . 1 1 43 43 ASP N N 43 117.453 117.453 118.102 -0.649 25158 4142 1 11 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.514 0.325 25158 4143 1 11 . 1 1 43 43 ASP C C 43 178.129 178.129 177.751 0.378 25158 4144 1 11 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.076 -1.438 25158 4145 1 11 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.096 0.118 25158 4146 1 11 . 1 1 43 43 ASP H H 43 8.473 8.473 8.784 -0.311 25158 4147 1 11 . 1 1 44 44 GLY N N 44 112.490 112.490 107.701 4.789 25158 4148 1 11 . 1 1 44 44 GLY C C 44 173.717 173.717 173.736 -0.019 25158 4149 1 11 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.889 0.428 25158 4150 1 11 . 1 1 44 44 GLY H H 44 10.139 10.139 8.345 1.794 25158 4151 1 11 . 1 1 45 45 ARG N N 45 118.154 118.154 118.668 -0.514 25158 4152 1 11 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.693 0.095 25158 4153 1 11 . 1 1 45 45 ARG C C 45 175.602 175.602 174.440 1.162 25158 4154 1 11 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.670 -0.838 25158 4155 1 11 . 1 1 45 45 ARG CB C 45 33.664 33.664 33.128 0.536 25158 4156 1 11 . 1 1 45 45 ARG H H 45 7.994 7.994 8.641 -0.647 25158 4157 1 11 . 1 1 46 46 VAL N N 46 126.392 126.392 123.175 3.217 25158 4158 1 11 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.244 0.546 25158 4159 1 11 . 1 1 46 46 VAL C C 46 174.644 174.644 175.261 -0.617 25158 4160 1 11 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.383 -0.654 25158 4161 1 11 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.552 1.115 25158 4162 1 11 . 1 1 46 46 VAL H H 46 9.115 9.115 8.535 0.580 25158 4163 1 11 . 1 1 47 47 ASN N N 47 126.737 126.737 126.588 0.149 25158 4164 1 11 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.970 -0.095 25158 4165 1 11 . 1 1 47 47 ASN C C 47 176.467 176.467 175.656 0.811 25158 4166 1 11 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.264 0.776 25158 4167 1 11 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.241 -0.054 25158 4168 1 11 . 1 1 47 47 ASN H H 47 10.077 10.077 8.397 1.680 25158 4169 1 11 . 1 1 48 48 SER N N 48 113.409 113.409 114.621 -1.212 25158 4170 1 11 . 1 1 48 48 SER HA H 48 4.086 4.086 4.165 -0.079 25158 4171 1 11 . 1 1 48 48 SER C C 48 176.671 176.671 176.038 0.633 25158 4172 1 11 . 1 1 48 48 SER CA C 48 62.375 62.375 62.027 0.348 25158 4173 1 11 . 1 1 48 48 SER CB C 48 62.375 62.375 63.010 -0.635 25158 4174 1 11 . 1 1 48 48 SER H H 48 8.936 8.936 8.830 0.106 25158 4175 1 11 . 1 1 49 49 THR N N 49 121.885 121.885 118.260 3.625 25158 4176 1 11 . 1 1 49 49 THR HA H 49 4.112 4.112 3.943 0.169 25158 4177 1 11 . 1 1 49 49 THR C C 49 177.320 177.320 176.537 0.783 25158 4178 1 11 . 1 1 49 49 THR CA C 49 66.713 66.713 66.331 0.382 25158 4179 1 11 . 1 1 49 49 THR CB C 49 67.787 67.787 68.286 -0.499 25158 4180 1 11 . 1 1 49 49 THR H H 49 8.124 8.124 8.168 -0.044 25158 4181 1 11 . 1 1 50 50 ASP N N 50 120.401 120.401 122.611 -2.210 25158 4182 1 11 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.330 0.040 25158 4183 1 11 . 1 1 50 50 ASP C C 50 177.033 177.033 178.413 -1.380 25158 4184 1 11 . 1 1 50 50 ASP CA C 50 58.820 58.820 58.047 0.773 25158 4185 1 11 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.371 1.337 25158 4186 1 11 . 1 1 50 50 ASP H H 50 7.560 7.560 7.922 -0.362 25158 4187 1 11 . 1 1 51 51 LEU N N 51 118.174 118.174 121.333 -3.159 25158 4188 1 11 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.023 0.165 25158 4189 1 11 . 1 1 51 51 LEU C C 51 177.441 177.441 178.583 -1.142 25158 4190 1 11 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.935 0.202 25158 4191 1 11 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.314 0.533 25158 4192 1 11 . 1 1 51 51 LEU H H 51 7.134 7.134 7.451 -0.317 25158 4193 1 11 . 1 1 52 52 GLY N N 52 105.596 105.596 107.082 -1.486 25158 4194 1 11 . 1 1 52 52 GLY C C 52 176.764 176.764 176.094 0.670 25158 4195 1 11 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.287 0.355 25158 4196 1 11 . 1 1 52 52 GLY H H 52 8.034 8.034 8.161 -0.127 25158 4197 1 11 . 1 1 53 53 ILE N N 53 122.043 122.043 122.935 -0.892 25158 4198 1 11 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.531 -0.082 25158 4199 1 11 . 1 1 53 53 ILE C C 53 177.112 177.112 177.759 -0.647 25158 4200 1 11 . 1 1 53 53 ILE CA C 53 65.388 65.388 65.034 0.354 25158 4201 1 11 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.657 0.601 25158 4202 1 11 . 1 1 53 53 ILE H H 53 7.611 7.611 7.798 -0.187 25158 4203 1 11 . 1 1 54 54 LEU N N 54 120.787 120.787 120.822 -0.035 25158 4204 1 11 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.991 -0.050 25158 4205 1 11 . 1 1 54 54 LEU C C 54 175.340 175.340 178.592 -3.252 25158 4206 1 11 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.035 0.160 25158 4207 1 11 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.005 0.215 25158 4208 1 11 . 1 1 54 54 LEU H H 54 8.323 8.323 7.879 0.444 25158 4209 1 11 . 1 1 55 55 LYS N N 55 116.833 116.833 119.489 -2.656 25158 4210 1 11 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.958 -0.074 25158 4211 1 11 . 1 1 55 55 LYS C C 55 179.067 179.067 179.218 -0.151 25158 4212 1 11 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.709 0.942 25158 4213 1 11 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.405 -0.396 25158 4214 1 11 . 1 1 55 55 LYS H H 55 8.356 8.356 7.855 0.501 25158 4215 1 11 . 1 1 56 56 ARG N N 56 117.092 117.092 118.305 -1.213 25158 4216 1 11 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.995 -0.079 25158 4217 1 11 . 1 1 56 56 ARG C C 56 178.223 178.223 178.536 -0.313 25158 4218 1 11 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.205 1.146 25158 4219 1 11 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.186 0.594 25158 4220 1 11 . 1 1 56 56 ARG H H 56 7.543 7.543 8.342 -0.799 25158 4221 1 11 . 1 1 57 57 TYR N N 57 122.187 122.187 121.887 0.300 25158 4222 1 11 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.598 -0.206 25158 4223 1 11 . 1 1 57 57 TYR C C 57 180.009 180.009 178.430 1.579 25158 4224 1 11 . 1 1 57 57 TYR CA C 57 61.579 61.579 60.857 0.722 25158 4225 1 11 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.508 0.328 25158 4226 1 11 . 1 1 57 57 TYR H H 57 8.592 8.592 8.215 0.377 25158 4227 1 11 . 1 1 58 58 ILE N N 58 122.825 122.825 116.919 5.906 25158 4228 1 11 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.789 -0.109 25158 4229 1 11 . 1 1 58 58 ILE C C 58 178.186 178.186 176.661 1.525 25158 4230 1 11 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.031 1.737 25158 4231 1 11 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.232 -0.512 25158 4232 1 11 . 1 1 58 58 ILE H H 58 8.779 8.779 7.705 1.074 25158 4233 1 11 . 1 1 59 59 LEU N N 59 118.552 118.552 119.675 -1.123 25158 4234 1 11 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.361 -0.138 25158 4235 1 11 . 1 1 59 59 LEU C C 59 175.937 175.937 175.791 0.146 25158 4236 1 11 . 1 1 59 59 LEU CA C 59 55.512 55.512 53.937 1.575 25158 4237 1 11 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.408 1.018 25158 4238 1 11 . 1 1 59 59 LEU H H 59 7.539 7.539 7.482 0.057 25158 4239 1 11 . 1 1 60 60 LYS N N 60 113.650 113.650 117.832 -4.182 25158 4240 1 11 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.844 0.151 25158 4241 1 11 . 1 1 60 60 LYS C C 60 176.535 176.535 176.204 0.331 25158 4242 1 11 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.832 -0.541 25158 4243 1 11 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.264 -1.993 25158 4244 1 11 . 1 1 60 60 LYS H H 60 7.815 7.815 7.653 0.162 25158 4245 1 11 . 1 1 61 61 GLU N N 61 117.535 117.535 116.209 1.326 25158 4246 1 11 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.336 -0.192 25158 4247 1 11 . 1 1 61 61 GLU C C 61 176.992 176.992 176.768 0.224 25158 4248 1 11 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.526 0.163 25158 4249 1 11 . 1 1 61 61 GLU CB C 61 30.692 30.692 30.972 -0.280 25158 4250 1 11 . 1 1 61 61 GLU H H 61 8.438 8.438 7.973 0.465 25158 4251 1 11 . 1 1 62 62 ILE N N 62 112.102 112.102 115.333 -3.231 25158 4252 1 11 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.500 -0.117 25158 4253 1 11 . 1 1 62 62 ILE C C 62 175.425 175.425 174.492 0.933 25158 4254 1 11 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.556 -0.631 25158 4255 1 11 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.276 1.472 25158 4256 1 11 . 1 1 62 62 ILE H H 62 6.867 6.867 7.375 -0.508 25158 4257 1 11 . 1 1 63 63 ASP N N 63 119.719 119.719 123.440 -3.721 25158 4258 1 11 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.837 -0.163 25158 4259 1 11 . 1 1 63 63 ASP C C 63 176.202 176.202 176.065 0.137 25158 4260 1 11 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.403 1.415 25158 4261 1 11 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.542 0.675 25158 4262 1 11 . 1 1 63 63 ASP H H 63 8.561 8.561 8.823 -0.262 25158 4263 1 11 . 1 1 64 64 THR N N 64 113.289 113.289 117.151 -3.862 25158 4264 1 11 . 1 1 64 64 THR HA H 64 4.712 4.712 4.560 0.152 25158 4265 1 11 . 1 1 64 64 THR C C 64 170.854 170.854 172.936 -2.082 25158 4266 1 11 . 1 1 64 64 THR CA C 64 61.269 61.269 62.448 -1.179 25158 4267 1 11 . 1 1 64 64 THR CB C 64 71.993 71.993 68.930 3.063 25158 4268 1 11 . 1 1 64 64 THR H H 64 7.410 7.410 7.767 -0.357 25158 4269 1 11 . 1 1 65 65 LEU N N 65 121.012 121.012 126.916 -5.904 25158 4270 1 11 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.739 -0.510 25158 4271 1 11 . 1 1 65 65 LEU C C 65 174.763 174.763 175.161 -0.398 25158 4272 1 11 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.800 -0.165 25158 4273 1 11 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.058 1.462 25158 4274 1 11 . 1 1 65 65 LEU H H 65 7.877 7.877 8.475 -0.598 25158 4275 1 11 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.197 -0.205 25158 4276 1 11 . 1 1 66 66 PRO C C 66 174.419 174.419 175.086 -0.667 25158 4277 1 11 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.154 0.156 25158 4278 1 11 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.316 2.910 25158 4279 1 11 . 1 1 67 67 TYR N N 67 122.616 122.616 121.087 1.529 25158 4280 1 11 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.303 0.353 25158 4281 1 11 . 1 1 67 67 TYR C C 67 174.446 174.446 175.937 -1.491 25158 4282 1 11 . 1 1 67 67 TYR CA C 67 58.011 58.011 57.919 0.092 25158 4283 1 11 . 1 1 67 67 TYR CB C 67 41.081 41.081 38.890 2.191 25158 4284 1 11 . 1 1 67 67 TYR H H 67 8.662 8.662 7.971 0.691 25158 4285 1 11 . 1 1 68 68 LYS N N 68 126.223 126.223 129.407 -3.184 25158 4286 1 11 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.040 0.228 25158 4287 1 11 . 1 1 68 68 LYS C C 68 174.748 174.748 175.220 -0.472 25158 4288 1 11 . 1 1 68 68 LYS CA C 68 55.603 55.603 56.691 -1.087 25158 4289 1 11 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.480 1.290 25158 4290 1 11 . 1 1 68 68 LYS H H 68 8.112 8.112 8.457 -0.344 25158 4291 1 12 . 1 1 2 2 THR N N 2 116.700 116.700 115.932 0.768 25158 4292 1 12 . 1 1 2 2 THR HA H 2 4.313 4.313 4.268 0.045 25158 4293 1 12 . 1 1 2 2 THR C C 2 173.968 173.968 174.573 -0.605 25158 4294 1 12 . 1 1 2 2 THR CA C 2 62.326 62.326 61.873 0.453 25158 4295 1 12 . 1 1 2 2 THR CB C 2 70.154 70.154 69.667 0.487 25158 4296 1 12 . 1 1 2 2 THR H H 2 8.657 8.657 8.096 0.561 25158 4297 1 12 . 1 1 3 3 LYS N N 3 125.500 125.500 125.357 0.143 25158 4298 1 12 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.379 -0.314 25158 4299 1 12 . 1 1 3 3 LYS C C 3 174.926 174.926 175.377 -0.451 25158 4300 1 12 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.079 0.760 25158 4301 1 12 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.723 1.054 25158 4302 1 12 . 1 1 3 3 LYS H H 3 8.318 8.318 8.380 -0.062 25158 4303 1 12 . 1 1 4 4 LEU N N 4 127.473 127.473 125.346 2.127 25158 4304 1 12 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.313 0.170 25158 4305 1 12 . 1 1 4 4 LEU C C 4 174.734 174.734 175.378 -0.644 25158 4306 1 12 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.884 -0.625 25158 4307 1 12 . 1 1 4 4 LEU CB C 4 40.929 40.929 44.786 -3.857 25158 4308 1 12 . 1 1 4 4 LEU H H 4 7.726 7.726 7.720 0.006 25158 4309 1 12 . 1 1 5 5 TYR N N 5 123.074 123.074 124.808 -1.734 25158 4310 1 12 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.285 -0.662 25158 4311 1 12 . 1 1 5 5 TYR C C 5 175.406 175.406 177.000 -1.594 25158 4312 1 12 . 1 1 5 5 TYR CA C 5 61.812 61.812 57.851 3.961 25158 4313 1 12 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.974 2.136 25158 4314 1 12 . 1 1 5 5 TYR H H 5 7.816 7.816 8.401 -0.585 25158 4315 1 12 . 1 1 6 6 GLY N N 6 108.614 108.614 114.301 -5.687 25158 4316 1 12 . 1 1 6 6 GLY C C 6 172.585 172.585 172.873 -0.288 25158 4317 1 12 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.947 0.440 25158 4318 1 12 . 1 1 6 6 GLY H H 6 8.915 8.915 8.305 0.610 25158 4319 1 12 . 1 1 7 7 ASP N N 7 118.023 118.023 120.726 -2.703 25158 4320 1 12 . 1 1 7 7 ASP HA H 7 4.984 4.984 5.395 -0.411 25158 4321 1 12 . 1 1 7 7 ASP C C 7 177.806 177.806 176.965 0.841 25158 4322 1 12 . 1 1 7 7 ASP CA C 7 52.192 52.192 51.729 0.463 25158 4323 1 12 . 1 1 7 7 ASP CB C 7 39.150 39.150 41.576 -2.426 25158 4324 1 12 . 1 1 7 7 ASP H H 7 7.976 7.976 7.590 0.386 25158 4325 1 12 . 1 1 8 8 VAL N N 8 120.293 120.293 119.866 0.427 25158 4326 1 12 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.095 -0.112 25158 4327 1 12 . 1 1 8 8 VAL C C 8 175.717 175.717 176.628 -0.911 25158 4328 1 12 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.765 -0.319 25158 4329 1 12 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.485 -0.214 25158 4330 1 12 . 1 1 8 8 VAL H H 8 8.156 8.156 7.839 0.317 25158 4331 1 12 . 1 1 9 9 ASN N N 9 115.226 115.226 117.091 -1.865 25158 4332 1 12 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.606 0.383 25158 4333 1 12 . 1 1 9 9 ASN C C 9 174.626 174.626 175.311 -0.685 25158 4334 1 12 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.983 -2.033 25158 4335 1 12 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.380 -0.680 25158 4336 1 12 . 1 1 9 9 ASN H H 9 8.008 8.008 8.088 -0.080 25158 4337 1 12 . 1 1 10 10 ASP N N 10 115.600 115.600 117.554 -1.954 25158 4338 1 12 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.488 -0.052 25158 4339 1 12 . 1 1 10 10 ASP C C 10 175.125 175.125 175.363 -0.238 25158 4340 1 12 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.464 0.771 25158 4341 1 12 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.579 0.621 25158 4342 1 12 . 1 1 10 10 ASP H H 10 7.374 7.374 8.142 -0.768 25158 4343 1 12 . 1 1 11 11 ASP N N 11 118.402 118.402 117.411 0.991 25158 4344 1 12 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.672 0.145 25158 4345 1 12 . 1 1 11 11 ASP C C 11 178.299 178.299 177.472 0.827 25158 4346 1 12 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.630 -0.809 25158 4347 1 12 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.584 -0.470 25158 4348 1 12 . 1 1 11 11 ASP H H 11 8.801 8.801 8.463 0.338 25158 4349 1 12 . 1 1 12 12 GLY N N 12 112.353 112.353 107.440 4.913 25158 4350 1 12 . 1 1 12 12 GLY C C 12 173.284 173.284 173.924 -0.640 25158 4351 1 12 . 1 1 12 12 GLY CA C 12 45.624 45.624 44.965 0.659 25158 4352 1 12 . 1 1 12 12 GLY H H 12 10.293 10.293 8.555 1.738 25158 4353 1 12 . 1 1 13 13 LYS N N 13 118.118 118.118 119.393 -1.275 25158 4354 1 12 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.497 0.162 25158 4355 1 12 . 1 1 13 13 LYS C C 13 175.595 175.595 174.936 0.659 25158 4356 1 12 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.396 -1.638 25158 4357 1 12 . 1 1 13 13 LYS CB C 13 36.339 36.339 36.138 0.201 25158 4358 1 12 . 1 1 13 13 LYS H H 13 7.848 7.848 8.886 -1.038 25158 4359 1 12 . 1 1 14 14 VAL N N 14 126.591 126.591 125.536 1.055 25158 4360 1 12 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.152 0.603 25158 4361 1 12 . 1 1 14 14 VAL C C 14 175.052 175.052 175.163 -0.111 25158 4362 1 12 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.421 -0.351 25158 4363 1 12 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.959 0.496 25158 4364 1 12 . 1 1 14 14 VAL H H 14 9.109 9.109 8.543 0.566 25158 4365 1 12 . 1 1 15 15 ASN N N 15 126.287 126.287 126.470 -0.183 25158 4366 1 12 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.917 -0.102 25158 4367 1 12 . 1 1 15 15 ASN C C 15 176.340 176.340 176.226 0.114 25158 4368 1 12 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.760 0.515 25158 4369 1 12 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.705 -2.485 25158 4370 1 12 . 1 1 15 15 ASN H H 15 10.071 10.071 8.273 1.798 25158 4371 1 12 . 1 1 16 16 SER N N 16 113.168 113.168 116.192 -3.024 25158 4372 1 12 . 1 1 16 16 SER HA H 16 4.047 4.047 4.318 -0.271 25158 4373 1 12 . 1 1 16 16 SER C C 16 176.197 176.197 175.974 0.223 25158 4374 1 12 . 1 1 16 16 SER CA C 16 62.681 62.681 61.426 1.255 25158 4375 1 12 . 1 1 16 16 SER CB C 16 62.681 62.681 62.962 -0.281 25158 4376 1 12 . 1 1 16 16 SER H H 16 8.825 8.825 8.824 0.001 25158 4377 1 12 . 1 1 17 17 THR N N 17 119.391 119.391 116.684 2.707 25158 4378 1 12 . 1 1 17 17 THR HA H 17 3.983 3.983 4.072 -0.089 25158 4379 1 12 . 1 1 17 17 THR C C 17 177.149 177.149 176.407 0.742 25158 4380 1 12 . 1 1 17 17 THR CA C 17 66.791 66.791 66.358 0.433 25158 4381 1 12 . 1 1 17 17 THR CB C 17 67.757 67.757 68.471 -0.714 25158 4382 1 12 . 1 1 17 17 THR H H 17 7.946 7.946 8.181 -0.235 25158 4383 1 12 . 1 1 18 18 ASP N N 18 120.318 120.318 121.552 -1.234 25158 4384 1 12 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.509 -0.139 25158 4385 1 12 . 1 1 18 18 ASP C C 18 177.168 177.168 177.562 -0.394 25158 4386 1 12 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.558 1.356 25158 4387 1 12 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.196 1.966 25158 4388 1 12 . 1 1 18 18 ASP H H 18 7.995 7.995 7.849 0.146 25158 4389 1 12 . 1 1 19 19 ALA N N 19 120.191 120.191 123.159 -2.968 25158 4390 1 12 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.048 0.000 25158 4391 1 12 . 1 1 19 19 ALA C C 19 179.549 179.549 179.156 0.393 25158 4392 1 12 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.181 0.232 25158 4393 1 12 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.612 -1.299 25158 4394 1 12 . 1 1 19 19 ALA H H 19 7.085 7.085 7.500 -0.415 25158 4395 1 12 . 1 1 20 20 VAL N N 20 120.613 120.613 118.802 1.811 25158 4396 1 12 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.712 -0.101 25158 4397 1 12 . 1 1 20 20 VAL C C 20 178.153 178.153 177.252 0.901 25158 4398 1 12 . 1 1 20 20 VAL CA C 20 66.767 66.767 64.966 1.801 25158 4399 1 12 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.571 0.297 25158 4400 1 12 . 1 1 20 20 VAL H H 20 7.835 7.835 7.464 0.371 25158 4401 1 12 . 1 1 21 21 ALA N N 21 121.767 121.767 122.812 -1.045 25158 4402 1 12 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.093 -0.031 25158 4403 1 12 . 1 1 21 21 ALA C C 21 179.298 179.298 179.610 -0.312 25158 4404 1 12 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.351 -0.107 25158 4405 1 12 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.190 -0.401 25158 4406 1 12 . 1 1 21 21 ALA H H 21 7.804 7.804 7.793 0.011 25158 4407 1 12 . 1 1 22 22 LEU N N 22 117.555 117.555 119.379 -1.824 25158 4408 1 12 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.047 0.099 25158 4409 1 12 . 1 1 22 22 LEU C C 22 177.914 177.914 178.340 -0.426 25158 4410 1 12 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.512 0.181 25158 4411 1 12 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.579 -0.064 25158 4412 1 12 . 1 1 22 22 LEU H H 22 8.619 8.619 7.995 0.624 25158 4413 1 12 . 1 1 23 23 LYS N N 23 120.335 120.335 119.589 0.746 25158 4414 1 12 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.991 -0.072 25158 4415 1 12 . 1 1 23 23 LYS C C 23 177.731 177.731 179.104 -1.373 25158 4416 1 12 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.771 0.566 25158 4417 1 12 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.258 -0.160 25158 4418 1 12 . 1 1 23 23 LYS H H 23 8.230 8.230 7.690 0.540 25158 4419 1 12 . 1 1 24 24 ARG N N 24 116.831 116.831 118.078 -1.247 25158 4420 1 12 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.001 -0.042 25158 4421 1 12 . 1 1 24 24 ARG C C 24 178.616 178.616 178.443 0.173 25158 4422 1 12 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.410 0.547 25158 4423 1 12 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.049 -0.486 25158 4424 1 12 . 1 1 24 24 ARG H H 24 7.927 7.927 7.993 -0.066 25158 4425 1 12 . 1 1 25 25 TYR N N 25 120.960 120.960 121.428 -0.468 25158 4426 1 12 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.186 0.024 25158 4427 1 12 . 1 1 25 25 TYR C C 25 179.465 179.465 178.393 1.072 25158 4428 1 12 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.625 0.220 25158 4429 1 12 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.452 0.613 25158 4430 1 12 . 1 1 25 25 TYR H H 25 8.321 8.321 7.612 0.709 25158 4431 1 12 . 1 1 26 26 VAL N N 26 120.405 120.405 118.436 1.969 25158 4432 1 12 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.759 0.015 25158 4433 1 12 . 1 1 26 26 VAL C C 26 177.826 177.826 177.579 0.247 25158 4434 1 12 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.737 -0.297 25158 4435 1 12 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.283 0.274 25158 4436 1 12 . 1 1 26 26 VAL H H 26 8.803 8.803 7.827 0.976 25158 4437 1 12 . 1 1 27 27 LEU N N 27 119.247 119.247 118.113 1.134 25158 4438 1 12 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.249 0.027 25158 4439 1 12 . 1 1 27 27 LEU C C 27 176.753 176.753 176.192 0.561 25158 4440 1 12 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.993 0.682 25158 4441 1 12 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.379 -0.786 25158 4442 1 12 . 1 1 27 27 LEU H H 27 7.898 7.898 7.554 0.344 25158 4443 1 12 . 1 1 28 28 ARG N N 28 116.082 116.082 116.229 -0.147 25158 4444 1 12 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.853 0.261 25158 4445 1 12 . 1 1 28 28 ARG C C 28 176.521 176.521 176.028 0.493 25158 4446 1 12 . 1 1 28 28 ARG CA C 28 56.154 56.154 56.943 -0.789 25158 4447 1 12 . 1 1 28 28 ARG CB C 28 27.471 27.471 26.755 0.716 25158 4448 1 12 . 1 1 28 28 ARG H H 28 7.993 7.993 7.905 0.088 25158 4449 1 12 . 1 1 29 29 SER N N 29 113.579 113.579 115.671 -2.092 25158 4450 1 12 . 1 1 29 29 SER HA H 29 4.305 4.305 4.371 -0.066 25158 4451 1 12 . 1 1 29 29 SER C C 29 175.368 175.368 175.455 -0.087 25158 4452 1 12 . 1 1 29 29 SER CA C 29 59.699 59.699 60.227 -0.528 25158 4453 1 12 . 1 1 29 29 SER CB C 29 63.908 63.908 63.966 -0.058 25158 4454 1 12 . 1 1 29 29 SER H H 29 8.094 8.094 8.339 -0.245 25158 4455 1 12 . 1 1 30 30 GLY N N 30 109.920 109.920 108.883 1.037 25158 4456 1 12 . 1 1 30 30 GLY C C 30 174.115 174.115 173.739 0.376 25158 4457 1 12 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.594 1.177 25158 4458 1 12 . 1 1 30 30 GLY H H 30 8.577 8.577 8.420 0.157 25158 4459 1 12 . 1 1 31 31 ILE N N 31 119.084 119.084 119.991 -0.907 25158 4460 1 12 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.336 0.022 25158 4461 1 12 . 1 1 31 31 ILE C C 31 174.392 174.392 175.127 -0.735 25158 4462 1 12 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.302 -0.056 25158 4463 1 12 . 1 1 31 31 ILE CB C 31 39.579 39.579 38.994 0.585 25158 4464 1 12 . 1 1 31 31 ILE H H 31 7.387 7.387 7.822 -0.435 25158 4465 1 12 . 1 1 32 32 SER N N 32 120.582 120.582 124.306 -3.724 25158 4466 1 12 . 1 1 32 32 SER HA H 32 4.845 4.845 4.682 0.163 25158 4467 1 12 . 1 1 32 32 SER C C 32 173.891 173.891 174.037 -0.146 25158 4468 1 12 . 1 1 32 32 SER CA C 32 57.603 57.603 59.039 -1.436 25158 4469 1 12 . 1 1 32 32 SER CB C 32 63.849 63.849 63.630 0.219 25158 4470 1 12 . 1 1 32 32 SER H H 32 8.339 8.339 8.674 -0.335 25158 4471 1 12 . 1 1 33 33 ILE N N 33 116.629 116.629 119.647 -3.018 25158 4472 1 12 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.549 0.084 25158 4473 1 12 . 1 1 33 33 ILE C C 33 174.195 174.195 174.113 0.082 25158 4474 1 12 . 1 1 33 33 ILE CA C 33 59.112 59.112 58.855 0.257 25158 4475 1 12 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.770 1.812 25158 4476 1 12 . 1 1 33 33 ILE H H 33 7.873 7.873 7.911 -0.038 25158 4477 1 12 . 1 1 34 34 ASN N N 34 118.342 118.342 119.873 -1.531 25158 4478 1 12 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.994 -0.258 25158 4479 1 12 . 1 1 34 34 ASN C C 34 176.217 176.217 176.067 0.150 25158 4480 1 12 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.418 -0.232 25158 4481 1 12 . 1 1 34 34 ASN CB C 34 36.499 36.499 39.289 -2.791 25158 4482 1 12 . 1 1 34 34 ASN H H 34 8.839 8.839 8.144 0.695 25158 4483 1 12 . 1 1 35 35 THR N N 35 116.120 116.120 117.467 -1.347 25158 4484 1 12 . 1 1 35 35 THR HA H 35 3.559 3.559 4.020 -0.461 25158 4485 1 12 . 1 1 35 35 THR C C 35 177.347 177.347 176.208 1.139 25158 4486 1 12 . 1 1 35 35 THR CA C 35 64.686 64.686 65.996 -1.310 25158 4487 1 12 . 1 1 35 35 THR CB C 35 67.758 67.758 69.029 -1.271 25158 4488 1 12 . 1 1 35 35 THR H H 35 7.939 7.939 8.383 -0.444 25158 4489 1 12 . 1 1 36 36 ASP N N 36 123.528 123.528 122.039 1.489 25158 4490 1 12 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.338 0.082 25158 4491 1 12 . 1 1 36 36 ASP C C 36 177.752 177.752 177.732 0.020 25158 4492 1 12 . 1 1 36 36 ASP CA C 36 57.074 57.074 58.572 -1.498 25158 4493 1 12 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.736 -0.838 25158 4494 1 12 . 1 1 36 36 ASP H H 36 7.980 7.980 8.814 -0.834 25158 4495 1 12 . 1 1 37 37 ASN N N 37 115.690 115.690 116.284 -0.594 25158 4496 1 12 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.569 -0.303 25158 4497 1 12 . 1 1 37 37 ASN C C 37 175.589 175.589 177.075 -1.486 25158 4498 1 12 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.859 -2.300 25158 4499 1 12 . 1 1 37 37 ASN CB C 37 37.963 37.963 37.909 0.054 25158 4500 1 12 . 1 1 37 37 ASN H H 37 7.251 7.251 8.322 -1.071 25158 4501 1 12 . 1 1 38 38 ALA N N 38 119.560 119.560 122.969 -3.409 25158 4502 1 12 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.031 0.049 25158 4503 1 12 . 1 1 38 38 ALA C C 38 173.638 173.638 177.350 -3.712 25158 4504 1 12 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.013 -1.793 25158 4505 1 12 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.743 4.128 25158 4506 1 12 . 1 1 38 38 ALA H H 38 7.142 7.142 8.018 -0.876 25158 4507 1 12 . 1 1 39 39 ASP N N 39 115.003 115.003 119.429 -4.426 25158 4508 1 12 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.489 0.451 25158 4509 1 12 . 1 1 39 39 ASP C C 39 177.163 177.163 176.514 0.649 25158 4510 1 12 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.933 -2.762 25158 4511 1 12 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.748 -0.802 25158 4512 1 12 . 1 1 39 39 ASP H H 39 7.096 7.096 7.894 -0.798 25158 4513 1 12 . 1 1 40 40 LEU N N 40 123.245 123.245 124.545 -1.300 25158 4514 1 12 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.220 -0.149 25158 4515 1 12 . 1 1 40 40 LEU C C 40 175.865 175.865 177.579 -1.714 25158 4516 1 12 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.087 0.506 25158 4517 1 12 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.356 -0.427 25158 4518 1 12 . 1 1 40 40 LEU H H 40 8.572 8.572 7.954 0.618 25158 4519 1 12 . 1 1 41 41 ASN N N 41 112.723 112.723 113.924 -1.201 25158 4520 1 12 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.967 0.032 25158 4521 1 12 . 1 1 41 41 ASN C C 41 173.846 173.846 175.466 -1.620 25158 4522 1 12 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.234 -1.001 25158 4523 1 12 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.081 -1.686 25158 4524 1 12 . 1 1 41 41 ASN H H 41 8.004 8.004 7.883 0.121 25158 4525 1 12 . 1 1 42 42 GLU N N 42 115.798 115.798 114.621 1.177 25158 4526 1 12 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.260 -0.308 25158 4527 1 12 . 1 1 42 42 GLU C C 42 175.172 175.172 175.556 -0.384 25158 4528 1 12 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.596 -0.245 25158 4529 1 12 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.404 0.817 25158 4530 1 12 . 1 1 42 42 GLU H H 42 7.642 7.642 8.531 -0.889 25158 4531 1 12 . 1 1 43 43 ASP N N 43 117.453 117.453 115.684 1.769 25158 4532 1 12 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.511 0.328 25158 4533 1 12 . 1 1 43 43 ASP C C 43 178.129 178.129 177.240 0.889 25158 4534 1 12 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.941 -1.303 25158 4535 1 12 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.289 -0.075 25158 4536 1 12 . 1 1 43 43 ASP H H 43 8.473 8.473 8.936 -0.463 25158 4537 1 12 . 1 1 44 44 GLY N N 44 112.490 112.490 108.903 3.587 25158 4538 1 12 . 1 1 44 44 GLY C C 44 173.717 173.717 173.708 0.009 25158 4539 1 12 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.907 0.410 25158 4540 1 12 . 1 1 44 44 GLY H H 44 10.139 10.139 8.505 1.634 25158 4541 1 12 . 1 1 45 45 ARG N N 45 118.154 118.154 119.847 -1.693 25158 4542 1 12 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.715 0.073 25158 4543 1 12 . 1 1 45 45 ARG C C 45 175.602 175.602 174.646 0.956 25158 4544 1 12 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.453 -0.620 25158 4545 1 12 . 1 1 45 45 ARG CB C 45 33.664 33.664 33.052 0.612 25158 4546 1 12 . 1 1 45 45 ARG H H 45 7.994 7.994 8.808 -0.814 25158 4547 1 12 . 1 1 46 46 VAL N N 46 126.392 126.392 123.378 3.014 25158 4548 1 12 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.499 0.291 25158 4549 1 12 . 1 1 46 46 VAL C C 46 174.644 174.644 175.791 -1.147 25158 4550 1 12 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.204 0.525 25158 4551 1 12 . 1 1 46 46 VAL CB C 46 31.666 31.666 29.981 1.685 25158 4552 1 12 . 1 1 46 46 VAL H H 46 9.115 9.115 8.541 0.574 25158 4553 1 12 . 1 1 47 47 ASN N N 47 126.737 126.737 126.059 0.678 25158 4554 1 12 . 1 1 47 47 ASN HA H 47 4.875 4.875 5.106 -0.231 25158 4555 1 12 . 1 1 47 47 ASN C C 47 176.467 176.467 175.934 0.533 25158 4556 1 12 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.586 0.454 25158 4557 1 12 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.752 -0.565 25158 4558 1 12 . 1 1 47 47 ASN H H 47 10.077 10.077 9.247 0.830 25158 4559 1 12 . 1 1 48 48 SER N N 48 113.409 113.409 114.063 -0.654 25158 4560 1 12 . 1 1 48 48 SER HA H 48 4.086 4.086 4.105 -0.019 25158 4561 1 12 . 1 1 48 48 SER C C 48 176.671 176.671 176.242 0.429 25158 4562 1 12 . 1 1 48 48 SER CA C 48 62.375 62.375 61.721 0.654 25158 4563 1 12 . 1 1 48 48 SER CB C 48 62.375 62.375 62.922 -0.547 25158 4564 1 12 . 1 1 48 48 SER H H 48 8.936 8.936 8.571 0.365 25158 4565 1 12 . 1 1 49 49 THR N N 49 121.885 121.885 119.339 2.546 25158 4566 1 12 . 1 1 49 49 THR HA H 49 4.112 4.112 3.900 0.212 25158 4567 1 12 . 1 1 49 49 THR C C 49 177.320 177.320 176.465 0.855 25158 4568 1 12 . 1 1 49 49 THR CA C 49 66.713 66.713 67.031 -0.319 25158 4569 1 12 . 1 1 49 49 THR CB C 49 67.787 67.787 68.332 -0.544 25158 4570 1 12 . 1 1 49 49 THR H H 49 8.124 8.124 7.998 0.126 25158 4571 1 12 . 1 1 50 50 ASP N N 50 120.401 120.401 121.412 -1.011 25158 4572 1 12 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.331 0.039 25158 4573 1 12 . 1 1 50 50 ASP C C 50 177.033 177.033 178.138 -1.105 25158 4574 1 12 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.311 1.509 25158 4575 1 12 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.424 1.284 25158 4576 1 12 . 1 1 50 50 ASP H H 50 7.560 7.560 8.021 -0.461 25158 4577 1 12 . 1 1 51 51 LEU N N 51 118.174 118.174 121.022 -2.848 25158 4578 1 12 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.063 0.125 25158 4579 1 12 . 1 1 51 51 LEU C C 51 177.441 177.441 178.192 -0.751 25158 4580 1 12 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.635 0.502 25158 4581 1 12 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.534 0.313 25158 4582 1 12 . 1 1 51 51 LEU H H 51 7.134 7.134 7.522 -0.388 25158 4583 1 12 . 1 1 52 52 GLY N N 52 105.596 105.596 106.459 -0.863 25158 4584 1 12 . 1 1 52 52 GLY C C 52 176.764 176.764 176.132 0.632 25158 4585 1 12 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.002 0.639 25158 4586 1 12 . 1 1 52 52 GLY H H 52 8.034 8.034 7.844 0.190 25158 4587 1 12 . 1 1 53 53 ILE N N 53 122.043 122.043 122.370 -0.327 25158 4588 1 12 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.741 -0.292 25158 4589 1 12 . 1 1 53 53 ILE C C 53 177.112 177.112 177.271 -0.159 25158 4590 1 12 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.215 1.173 25158 4591 1 12 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.939 0.319 25158 4592 1 12 . 1 1 53 53 ILE H H 53 7.611 7.611 7.517 0.094 25158 4593 1 12 . 1 1 54 54 LEU N N 54 120.787 120.787 121.631 -0.844 25158 4594 1 12 . 1 1 54 54 LEU HA H 54 3.941 3.941 4.025 -0.084 25158 4595 1 12 . 1 1 54 54 LEU C C 54 175.340 175.340 177.969 -2.629 25158 4596 1 12 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.922 -0.727 25158 4597 1 12 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.991 -0.770 25158 4598 1 12 . 1 1 54 54 LEU H H 54 8.323 8.323 7.930 0.393 25158 4599 1 12 . 1 1 55 55 LYS N N 55 116.833 116.833 117.796 -0.963 25158 4600 1 12 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.929 -0.045 25158 4601 1 12 . 1 1 55 55 LYS C C 55 179.067 179.067 179.026 0.041 25158 4602 1 12 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.430 1.221 25158 4603 1 12 . 1 1 55 55 LYS CB C 55 32.009 32.009 31.698 0.311 25158 4604 1 12 . 1 1 55 55 LYS H H 55 8.356 8.356 7.640 0.716 25158 4605 1 12 . 1 1 56 56 ARG N N 56 117.092 117.092 119.522 -2.430 25158 4606 1 12 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.973 -0.057 25158 4607 1 12 . 1 1 56 56 ARG C C 56 178.223 178.223 178.482 -0.259 25158 4608 1 12 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.415 0.936 25158 4609 1 12 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.116 0.664 25158 4610 1 12 . 1 1 56 56 ARG H H 56 7.543 7.543 7.696 -0.153 25158 4611 1 12 . 1 1 57 57 TYR N N 57 122.187 122.187 120.473 1.714 25158 4612 1 12 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.663 -0.271 25158 4613 1 12 . 1 1 57 57 TYR C C 57 180.009 180.009 177.877 2.132 25158 4614 1 12 . 1 1 57 57 TYR CA C 57 61.579 61.579 60.929 0.650 25158 4615 1 12 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.697 0.139 25158 4616 1 12 . 1 1 57 57 TYR H H 57 8.592 8.592 7.687 0.905 25158 4617 1 12 . 1 1 58 58 ILE N N 58 122.825 122.825 117.016 5.809 25158 4618 1 12 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.900 -0.220 25158 4619 1 12 . 1 1 58 58 ILE C C 58 178.186 178.186 176.365 1.821 25158 4620 1 12 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.362 1.406 25158 4621 1 12 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.335 -0.615 25158 4622 1 12 . 1 1 58 58 ILE H H 58 8.779 8.779 7.490 1.289 25158 4623 1 12 . 1 1 59 59 LEU N N 59 118.552 118.552 119.508 -0.956 25158 4624 1 12 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.387 -0.164 25158 4625 1 12 . 1 1 59 59 LEU C C 59 175.937 175.937 175.926 0.011 25158 4626 1 12 . 1 1 59 59 LEU CA C 59 55.512 55.512 53.961 1.551 25158 4627 1 12 . 1 1 59 59 LEU CB C 59 42.426 42.426 40.902 1.524 25158 4628 1 12 . 1 1 59 59 LEU H H 59 7.539 7.539 7.891 -0.352 25158 4629 1 12 . 1 1 60 60 LYS N N 60 113.650 113.650 116.434 -2.784 25158 4630 1 12 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.866 0.129 25158 4631 1 12 . 1 1 60 60 LYS C C 60 176.535 176.535 176.089 0.446 25158 4632 1 12 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.548 -0.257 25158 4633 1 12 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.521 -1.250 25158 4634 1 12 . 1 1 60 60 LYS H H 60 7.815 7.815 7.662 0.153 25158 4635 1 12 . 1 1 61 61 GLU N N 61 117.535 117.535 116.033 1.502 25158 4636 1 12 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.381 -0.237 25158 4637 1 12 . 1 1 61 61 GLU C C 61 176.992 176.992 176.474 0.518 25158 4638 1 12 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.481 0.208 25158 4639 1 12 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.302 -0.610 25158 4640 1 12 . 1 1 61 61 GLU H H 61 8.438 8.438 8.532 -0.094 25158 4641 1 12 . 1 1 62 62 ILE N N 62 112.102 112.102 115.252 -3.150 25158 4642 1 12 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.556 -0.173 25158 4643 1 12 . 1 1 62 62 ILE C C 62 175.425 175.425 174.583 0.842 25158 4644 1 12 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.069 -0.143 25158 4645 1 12 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.822 0.926 25158 4646 1 12 . 1 1 62 62 ILE H H 62 6.867 6.867 7.509 -0.642 25158 4647 1 12 . 1 1 63 63 ASP N N 63 119.719 119.719 123.160 -3.441 25158 4648 1 12 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.905 -0.231 25158 4649 1 12 . 1 1 63 63 ASP C C 63 176.202 176.202 176.106 0.096 25158 4650 1 12 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.436 0.382 25158 4651 1 12 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.023 0.194 25158 4652 1 12 . 1 1 63 63 ASP H H 63 8.561 8.561 8.810 -0.249 25158 4653 1 12 . 1 1 64 64 THR N N 64 113.289 113.289 117.516 -4.227 25158 4654 1 12 . 1 1 64 64 THR HA H 64 4.712 4.712 4.427 0.285 25158 4655 1 12 . 1 1 64 64 THR C C 64 170.854 170.854 173.939 -3.085 25158 4656 1 12 . 1 1 64 64 THR CA C 64 61.269 61.269 62.894 -1.625 25158 4657 1 12 . 1 1 64 64 THR CB C 64 71.993 71.993 69.031 2.962 25158 4658 1 12 . 1 1 64 64 THR H H 64 7.410 7.410 7.860 -0.450 25158 4659 1 12 . 1 1 65 65 LEU N N 65 121.012 121.012 126.979 -5.967 25158 4660 1 12 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.703 -0.474 25158 4661 1 12 . 1 1 65 65 LEU C C 65 174.763 174.763 174.905 -0.142 25158 4662 1 12 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.304 -0.669 25158 4663 1 12 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.772 -0.252 25158 4664 1 12 . 1 1 65 65 LEU H H 65 7.877 7.877 8.295 -0.418 25158 4665 1 12 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.299 -0.307 25158 4666 1 12 . 1 1 66 66 PRO C C 66 174.419 174.419 174.925 -0.506 25158 4667 1 12 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.178 0.132 25158 4668 1 12 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.072 3.154 25158 4669 1 12 . 1 1 67 67 TYR N N 67 122.616 122.616 120.884 1.732 25158 4670 1 12 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.355 0.301 25158 4671 1 12 . 1 1 67 67 TYR C C 67 174.446 174.446 175.114 -0.668 25158 4672 1 12 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.915 -0.904 25158 4673 1 12 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.945 1.136 25158 4674 1 12 . 1 1 67 67 TYR H H 67 8.662 8.662 8.119 0.543 25158 4675 1 12 . 1 1 68 68 LYS N N 68 126.223 126.223 126.042 0.181 25158 4676 1 12 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.263 0.005 25158 4677 1 12 . 1 1 68 68 LYS C C 68 174.748 174.748 175.013 -0.265 25158 4678 1 12 . 1 1 68 68 LYS CA C 68 55.603 55.603 54.280 1.323 25158 4679 1 12 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.900 0.870 25158 4680 1 12 . 1 1 68 68 LYS H H 68 8.112 8.112 7.576 0.536 25158 4681 1 13 . 1 1 2 2 THR N N 2 116.700 116.700 115.817 0.883 25158 4682 1 13 . 1 1 2 2 THR HA H 2 4.313 4.313 4.598 -0.285 25158 4683 1 13 . 1 1 2 2 THR C C 2 173.968 173.968 173.983 -0.015 25158 4684 1 13 . 1 1 2 2 THR CA C 2 62.326 62.326 61.249 1.077 25158 4685 1 13 . 1 1 2 2 THR CB C 2 70.154 70.154 69.756 0.398 25158 4686 1 13 . 1 1 2 2 THR H H 2 8.657 8.657 8.213 0.444 25158 4687 1 13 . 1 1 3 3 LYS N N 3 125.500 125.500 123.876 1.624 25158 4688 1 13 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.198 -0.133 25158 4689 1 13 . 1 1 3 3 LYS C C 3 174.926 174.926 175.533 -0.607 25158 4690 1 13 . 1 1 3 3 LYS CA C 3 56.839 56.839 57.127 -0.288 25158 4691 1 13 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.555 1.222 25158 4692 1 13 . 1 1 3 3 LYS H H 3 8.318 8.318 8.309 0.009 25158 4693 1 13 . 1 1 4 4 LEU N N 4 127.473 127.473 125.167 2.306 25158 4694 1 13 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.321 0.162 25158 4695 1 13 . 1 1 4 4 LEU C C 4 174.734 174.734 174.651 0.083 25158 4696 1 13 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.476 -0.217 25158 4697 1 13 . 1 1 4 4 LEU CB C 4 40.929 40.929 46.444 -5.515 25158 4698 1 13 . 1 1 4 4 LEU H H 4 7.726 7.726 7.766 -0.040 25158 4699 1 13 . 1 1 5 5 TYR N N 5 123.074 123.074 118.708 4.366 25158 4700 1 13 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.398 -0.775 25158 4701 1 13 . 1 1 5 5 TYR C C 5 175.406 175.406 176.820 -1.414 25158 4702 1 13 . 1 1 5 5 TYR CA C 5 61.812 61.812 57.788 4.024 25158 4703 1 13 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.685 1.425 25158 4704 1 13 . 1 1 5 5 TYR H H 5 7.816 7.816 8.216 -0.400 25158 4705 1 13 . 1 1 6 6 GLY N N 6 108.614 108.614 113.858 -5.244 25158 4706 1 13 . 1 1 6 6 GLY C C 6 172.585 172.585 173.640 -1.055 25158 4707 1 13 . 1 1 6 6 GLY CA C 6 45.387 45.387 45.068 0.319 25158 4708 1 13 . 1 1 6 6 GLY H H 6 8.915 8.915 8.239 0.676 25158 4709 1 13 . 1 1 7 7 ASP N N 7 118.023 118.023 122.606 -4.583 25158 4710 1 13 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.742 0.242 25158 4711 1 13 . 1 1 7 7 ASP C C 7 177.806 177.806 177.555 0.251 25158 4712 1 13 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.375 -1.183 25158 4713 1 13 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.968 -0.818 25158 4714 1 13 . 1 1 7 7 ASP H H 7 7.976 7.976 7.979 -0.003 25158 4715 1 13 . 1 1 8 8 VAL N N 8 120.293 120.293 120.448 -0.155 25158 4716 1 13 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.067 -0.084 25158 4717 1 13 . 1 1 8 8 VAL C C 8 175.717 175.717 176.713 -0.996 25158 4718 1 13 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.576 -0.130 25158 4719 1 13 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.922 -0.651 25158 4720 1 13 . 1 1 8 8 VAL H H 8 8.156 8.156 7.908 0.248 25158 4721 1 13 . 1 1 9 9 ASN N N 9 115.226 115.226 116.141 -0.915 25158 4722 1 13 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.592 0.397 25158 4723 1 13 . 1 1 9 9 ASN C C 9 174.626 174.626 175.296 -0.670 25158 4724 1 13 . 1 1 9 9 ASN CA C 9 50.950 50.950 53.133 -2.183 25158 4725 1 13 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.429 -0.728 25158 4726 1 13 . 1 1 9 9 ASN H H 9 8.008 8.008 8.061 -0.053 25158 4727 1 13 . 1 1 10 10 ASP N N 10 115.600 115.600 119.069 -3.469 25158 4728 1 13 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.501 -0.065 25158 4729 1 13 . 1 1 10 10 ASP C C 10 175.125 175.125 175.385 -0.260 25158 4730 1 13 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.296 0.939 25158 4731 1 13 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.676 0.524 25158 4732 1 13 . 1 1 10 10 ASP H H 10 7.374 7.374 8.192 -0.818 25158 4733 1 13 . 1 1 11 11 ASP N N 11 118.402 118.402 117.103 1.299 25158 4734 1 13 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.637 0.180 25158 4735 1 13 . 1 1 11 11 ASP C C 11 178.299 178.299 177.357 0.942 25158 4736 1 13 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.582 -0.761 25158 4737 1 13 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.922 -0.808 25158 4738 1 13 . 1 1 11 11 ASP H H 11 8.801 8.801 8.766 0.035 25158 4739 1 13 . 1 1 12 12 GLY N N 12 112.353 112.353 107.918 4.435 25158 4740 1 13 . 1 1 12 12 GLY C C 12 173.284 173.284 173.756 -0.472 25158 4741 1 13 . 1 1 12 12 GLY CA C 12 45.624 45.624 44.966 0.658 25158 4742 1 13 . 1 1 12 12 GLY H H 12 10.293 10.293 8.537 1.756 25158 4743 1 13 . 1 1 13 13 LYS N N 13 118.118 118.118 119.379 -1.261 25158 4744 1 13 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.499 0.160 25158 4745 1 13 . 1 1 13 13 LYS C C 13 175.595 175.595 174.840 0.755 25158 4746 1 13 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.347 -1.589 25158 4747 1 13 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.707 0.632 25158 4748 1 13 . 1 1 13 13 LYS H H 13 7.848 7.848 8.228 -0.380 25158 4749 1 13 . 1 1 14 14 VAL N N 14 126.591 126.591 125.479 1.112 25158 4750 1 13 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.431 0.324 25158 4751 1 13 . 1 1 14 14 VAL C C 14 175.052 175.052 175.468 -0.416 25158 4752 1 13 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.102 -0.032 25158 4753 1 13 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.211 0.244 25158 4754 1 13 . 1 1 14 14 VAL H H 14 9.109 9.109 8.537 0.572 25158 4755 1 13 . 1 1 15 15 ASN N N 15 126.287 126.287 126.363 -0.076 25158 4756 1 13 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.929 -0.114 25158 4757 1 13 . 1 1 15 15 ASN C C 15 176.340 176.340 176.096 0.244 25158 4758 1 13 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.663 0.613 25158 4759 1 13 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.553 -2.333 25158 4760 1 13 . 1 1 15 15 ASN H H 15 10.071 10.071 8.335 1.736 25158 4761 1 13 . 1 1 16 16 SER N N 16 113.168 113.168 116.365 -3.197 25158 4762 1 13 . 1 1 16 16 SER HA H 16 4.047 4.047 4.293 -0.246 25158 4763 1 13 . 1 1 16 16 SER C C 16 176.197 176.197 175.608 0.589 25158 4764 1 13 . 1 1 16 16 SER CA C 16 62.681 62.681 60.943 1.738 25158 4765 1 13 . 1 1 16 16 SER CB C 16 62.681 62.681 63.129 -0.448 25158 4766 1 13 . 1 1 16 16 SER H H 16 8.825 8.825 8.857 -0.032 25158 4767 1 13 . 1 1 17 17 THR N N 17 119.391 119.391 116.631 2.760 25158 4768 1 13 . 1 1 17 17 THR HA H 17 3.983 3.983 4.048 -0.065 25158 4769 1 13 . 1 1 17 17 THR C C 17 177.149 177.149 176.430 0.719 25158 4770 1 13 . 1 1 17 17 THR CA C 17 66.791 66.791 65.842 0.949 25158 4771 1 13 . 1 1 17 17 THR CB C 17 67.757 67.757 68.050 -0.293 25158 4772 1 13 . 1 1 17 17 THR H H 17 7.946 7.946 8.202 -0.256 25158 4773 1 13 . 1 1 18 18 ASP N N 18 120.318 120.318 121.135 -0.817 25158 4774 1 13 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.356 0.014 25158 4775 1 13 . 1 1 18 18 ASP C C 18 177.168 177.168 178.002 -0.834 25158 4776 1 13 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.287 1.627 25158 4777 1 13 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.221 1.941 25158 4778 1 13 . 1 1 18 18 ASP H H 18 7.995 7.995 7.925 0.070 25158 4779 1 13 . 1 1 19 19 ALA N N 19 120.191 120.191 123.030 -2.839 25158 4780 1 13 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.073 -0.025 25158 4781 1 13 . 1 1 19 19 ALA C C 19 179.549 179.549 179.213 0.336 25158 4782 1 13 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.121 0.292 25158 4783 1 13 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.567 -1.254 25158 4784 1 13 . 1 1 19 19 ALA H H 19 7.085 7.085 7.515 -0.430 25158 4785 1 13 . 1 1 20 20 VAL N N 20 120.613 120.613 119.265 1.348 25158 4786 1 13 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.644 -0.033 25158 4787 1 13 . 1 1 20 20 VAL C C 20 178.153 178.153 177.351 0.802 25158 4788 1 13 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.397 1.370 25158 4789 1 13 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.623 0.245 25158 4790 1 13 . 1 1 20 20 VAL H H 20 7.835 7.835 7.487 0.348 25158 4791 1 13 . 1 1 21 21 ALA N N 21 121.767 121.767 122.063 -0.296 25158 4792 1 13 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.076 -0.014 25158 4793 1 13 . 1 1 21 21 ALA C C 21 179.298 179.298 179.548 -0.250 25158 4794 1 13 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.293 -0.049 25158 4795 1 13 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.187 -0.398 25158 4796 1 13 . 1 1 21 21 ALA H H 21 7.804 7.804 8.048 -0.244 25158 4797 1 13 . 1 1 22 22 LEU N N 22 117.555 117.555 119.236 -1.681 25158 4798 1 13 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.070 0.076 25158 4799 1 13 . 1 1 22 22 LEU C C 22 177.914 177.914 178.546 -0.632 25158 4800 1 13 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.363 0.330 25158 4801 1 13 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.729 -0.214 25158 4802 1 13 . 1 1 22 22 LEU H H 22 8.619 8.619 7.649 0.970 25158 4803 1 13 . 1 1 23 23 LYS N N 23 120.335 120.335 119.626 0.709 25158 4804 1 13 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.950 -0.031 25158 4805 1 13 . 1 1 23 23 LYS C C 23 177.731 177.731 179.128 -1.397 25158 4806 1 13 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.984 0.353 25158 4807 1 13 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.176 -0.078 25158 4808 1 13 . 1 1 23 23 LYS H H 23 8.230 8.230 7.727 0.503 25158 4809 1 13 . 1 1 24 24 ARG N N 24 116.831 116.831 117.867 -1.036 25158 4810 1 13 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.066 -0.107 25158 4811 1 13 . 1 1 24 24 ARG C C 24 178.616 178.616 178.658 -0.042 25158 4812 1 13 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.323 0.634 25158 4813 1 13 . 1 1 24 24 ARG CB C 24 29.563 29.563 29.806 -0.243 25158 4814 1 13 . 1 1 24 24 ARG H H 24 7.927 7.927 7.632 0.295 25158 4815 1 13 . 1 1 25 25 TYR N N 25 120.960 120.960 121.110 -0.150 25158 4816 1 13 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.232 -0.022 25158 4817 1 13 . 1 1 25 25 TYR C C 25 179.465 179.465 178.523 0.942 25158 4818 1 13 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.513 0.332 25158 4819 1 13 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.559 0.506 25158 4820 1 13 . 1 1 25 25 TYR H H 25 8.321 8.321 7.595 0.726 25158 4821 1 13 . 1 1 26 26 VAL N N 26 120.405 120.405 117.609 2.796 25158 4822 1 13 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.929 -0.155 25158 4823 1 13 . 1 1 26 26 VAL C C 26 177.826 177.826 176.834 0.992 25158 4824 1 13 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.396 0.044 25158 4825 1 13 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.449 0.108 25158 4826 1 13 . 1 1 26 26 VAL H H 26 8.803 8.803 8.215 0.588 25158 4827 1 13 . 1 1 27 27 LEU N N 27 119.247 119.247 118.069 1.178 25158 4828 1 13 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.295 -0.019 25158 4829 1 13 . 1 1 27 27 LEU C C 27 176.753 176.753 176.607 0.146 25158 4830 1 13 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.437 1.238 25158 4831 1 13 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.853 -0.260 25158 4832 1 13 . 1 1 27 27 LEU H H 27 7.898 7.898 7.767 0.131 25158 4833 1 13 . 1 1 28 28 ARG N N 28 116.082 116.082 117.242 -1.160 25158 4834 1 13 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.858 0.256 25158 4835 1 13 . 1 1 28 28 ARG C C 28 176.521 176.521 176.167 0.354 25158 4836 1 13 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.052 -0.898 25158 4837 1 13 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.782 -0.311 25158 4838 1 13 . 1 1 28 28 ARG H H 28 7.993 7.993 7.419 0.574 25158 4839 1 13 . 1 1 29 29 SER N N 29 113.579 113.579 115.082 -1.503 25158 4840 1 13 . 1 1 29 29 SER HA H 29 4.305 4.305 4.423 -0.118 25158 4841 1 13 . 1 1 29 29 SER C C 29 175.368 175.368 175.483 -0.115 25158 4842 1 13 . 1 1 29 29 SER CA C 29 59.699 59.699 59.934 -0.235 25158 4843 1 13 . 1 1 29 29 SER CB C 29 63.908 63.908 64.019 -0.111 25158 4844 1 13 . 1 1 29 29 SER H H 29 8.094 8.094 8.031 0.063 25158 4845 1 13 . 1 1 30 30 GLY N N 30 109.920 109.920 109.335 0.585 25158 4846 1 13 . 1 1 30 30 GLY C C 30 174.115 174.115 173.773 0.342 25158 4847 1 13 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.670 1.101 25158 4848 1 13 . 1 1 30 30 GLY H H 30 8.577 8.577 8.271 0.306 25158 4849 1 13 . 1 1 31 31 ILE N N 31 119.084 119.084 119.063 0.021 25158 4850 1 13 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.334 0.024 25158 4851 1 13 . 1 1 31 31 ILE C C 31 174.392 174.392 175.163 -0.771 25158 4852 1 13 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.444 -0.198 25158 4853 1 13 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.549 0.030 25158 4854 1 13 . 1 1 31 31 ILE H H 31 7.387 7.387 7.600 -0.213 25158 4855 1 13 . 1 1 32 32 SER N N 32 120.582 120.582 121.552 -0.970 25158 4856 1 13 . 1 1 32 32 SER HA H 32 4.845 4.845 4.872 -0.027 25158 4857 1 13 . 1 1 32 32 SER C C 32 173.891 173.891 173.917 -0.026 25158 4858 1 13 . 1 1 32 32 SER CA C 32 57.603 57.603 57.424 0.179 25158 4859 1 13 . 1 1 32 32 SER CB C 32 63.849 63.849 63.451 0.398 25158 4860 1 13 . 1 1 32 32 SER H H 32 8.339 8.339 8.421 -0.082 25158 4861 1 13 . 1 1 33 33 ILE N N 33 116.629 116.629 120.971 -4.342 25158 4862 1 13 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.542 0.091 25158 4863 1 13 . 1 1 33 33 ILE C C 33 174.195 174.195 174.106 0.089 25158 4864 1 13 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.488 -0.376 25158 4865 1 13 . 1 1 33 33 ILE CB C 33 42.582 42.582 41.013 1.569 25158 4866 1 13 . 1 1 33 33 ILE H H 33 7.873 7.873 8.130 -0.257 25158 4867 1 13 . 1 1 34 34 ASN N N 34 118.342 118.342 121.264 -2.922 25158 4868 1 13 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.783 -0.047 25158 4869 1 13 . 1 1 34 34 ASN C C 34 176.217 176.217 176.284 -0.067 25158 4870 1 13 . 1 1 34 34 ASN CA C 34 52.186 52.186 53.195 -1.009 25158 4871 1 13 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.150 -1.651 25158 4872 1 13 . 1 1 34 34 ASN H H 34 8.839 8.839 8.437 0.402 25158 4873 1 13 . 1 1 35 35 THR N N 35 116.120 116.120 117.228 -1.108 25158 4874 1 13 . 1 1 35 35 THR HA H 35 3.559 3.559 3.839 -0.280 25158 4875 1 13 . 1 1 35 35 THR C C 35 177.347 177.347 175.854 1.493 25158 4876 1 13 . 1 1 35 35 THR CA C 35 64.686 64.686 66.196 -1.510 25158 4877 1 13 . 1 1 35 35 THR CB C 35 67.758 67.758 68.788 -1.030 25158 4878 1 13 . 1 1 35 35 THR H H 35 7.939 7.939 8.004 -0.065 25158 4879 1 13 . 1 1 36 36 ASP N N 36 123.528 123.528 121.957 1.571 25158 4880 1 13 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.354 0.066 25158 4881 1 13 . 1 1 36 36 ASP C C 36 177.752 177.752 177.420 0.332 25158 4882 1 13 . 1 1 36 36 ASP CA C 36 57.074 57.074 56.987 0.087 25158 4883 1 13 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.562 -0.664 25158 4884 1 13 . 1 1 36 36 ASP H H 36 7.980 7.980 8.828 -0.848 25158 4885 1 13 . 1 1 37 37 ASN N N 37 115.690 115.690 116.745 -1.055 25158 4886 1 13 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.611 -0.345 25158 4887 1 13 . 1 1 37 37 ASN C C 37 175.589 175.589 176.993 -1.404 25158 4888 1 13 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.913 -2.353 25158 4889 1 13 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.318 -0.354 25158 4890 1 13 . 1 1 37 37 ASN H H 37 7.251 7.251 8.173 -0.922 25158 4891 1 13 . 1 1 38 38 ALA N N 38 119.560 119.560 123.346 -3.786 25158 4892 1 13 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.020 0.060 25158 4893 1 13 . 1 1 38 38 ALA C C 38 173.638 173.638 177.379 -3.741 25158 4894 1 13 . 1 1 38 38 ALA CA C 38 52.220 52.220 53.884 -1.664 25158 4895 1 13 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.749 4.122 25158 4896 1 13 . 1 1 38 38 ALA H H 38 7.142 7.142 8.178 -1.036 25158 4897 1 13 . 1 1 39 39 ASP N N 39 115.003 115.003 119.442 -4.439 25158 4898 1 13 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.458 0.482 25158 4899 1 13 . 1 1 39 39 ASP C C 39 177.163 177.163 176.545 0.618 25158 4900 1 13 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.866 -2.695 25158 4901 1 13 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.687 -0.741 25158 4902 1 13 . 1 1 39 39 ASP H H 39 7.096 7.096 7.824 -0.728 25158 4903 1 13 . 1 1 40 40 LEU N N 40 123.245 123.245 124.353 -1.108 25158 4904 1 13 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.299 -0.228 25158 4905 1 13 . 1 1 40 40 LEU C C 40 175.865 175.865 177.532 -1.667 25158 4906 1 13 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.960 0.633 25158 4907 1 13 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.224 -0.295 25158 4908 1 13 . 1 1 40 40 LEU H H 40 8.572 8.572 7.938 0.634 25158 4909 1 13 . 1 1 41 41 ASN N N 41 112.723 112.723 113.567 -0.844 25158 4910 1 13 . 1 1 41 41 ASN HA H 41 4.999 4.999 5.072 -0.073 25158 4911 1 13 . 1 1 41 41 ASN C C 41 173.846 173.846 175.323 -1.477 25158 4912 1 13 . 1 1 41 41 ASN CA C 41 51.233 51.233 51.810 -0.577 25158 4913 1 13 . 1 1 41 41 ASN CB C 41 37.395 37.395 38.951 -1.556 25158 4914 1 13 . 1 1 41 41 ASN H H 41 8.004 8.004 7.854 0.150 25158 4915 1 13 . 1 1 42 42 GLU N N 42 115.798 115.798 116.444 -0.646 25158 4916 1 13 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.271 -0.319 25158 4917 1 13 . 1 1 42 42 GLU C C 42 175.172 175.172 175.772 -0.600 25158 4918 1 13 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.787 -0.436 25158 4919 1 13 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.127 1.094 25158 4920 1 13 . 1 1 42 42 GLU H H 42 7.642 7.642 8.499 -0.857 25158 4921 1 13 . 1 1 43 43 ASP N N 43 117.453 117.453 116.796 0.657 25158 4922 1 13 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.541 0.298 25158 4923 1 13 . 1 1 43 43 ASP C C 43 178.129 178.129 177.415 0.714 25158 4924 1 13 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.067 -1.429 25158 4925 1 13 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.212 0.002 25158 4926 1 13 . 1 1 43 43 ASP H H 43 8.473 8.473 8.637 -0.164 25158 4927 1 13 . 1 1 44 44 GLY N N 44 112.490 112.490 107.366 5.124 25158 4928 1 13 . 1 1 44 44 GLY C C 44 173.717 173.717 173.597 0.120 25158 4929 1 13 . 1 1 44 44 GLY CA C 44 45.317 45.317 45.012 0.305 25158 4930 1 13 . 1 1 44 44 GLY H H 44 10.139 10.139 8.596 1.543 25158 4931 1 13 . 1 1 45 45 ARG N N 45 118.154 118.154 116.748 1.406 25158 4932 1 13 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.662 0.126 25158 4933 1 13 . 1 1 45 45 ARG C C 45 175.602 175.602 173.853 1.749 25158 4934 1 13 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.631 -0.799 25158 4935 1 13 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.520 1.144 25158 4936 1 13 . 1 1 45 45 ARG H H 45 7.994 7.994 8.769 -0.775 25158 4937 1 13 . 1 1 46 46 VAL N N 46 126.392 126.392 123.122 3.270 25158 4938 1 13 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.539 0.251 25158 4939 1 13 . 1 1 46 46 VAL C C 46 174.644 174.644 175.378 -0.734 25158 4940 1 13 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.267 -0.538 25158 4941 1 13 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.959 0.707 25158 4942 1 13 . 1 1 46 46 VAL H H 46 9.115 9.115 8.546 0.569 25158 4943 1 13 . 1 1 47 47 ASN N N 47 126.737 126.737 126.396 0.341 25158 4944 1 13 . 1 1 47 47 ASN HA H 47 4.875 4.875 5.009 -0.134 25158 4945 1 13 . 1 1 47 47 ASN C C 47 176.467 176.467 175.494 0.973 25158 4946 1 13 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.307 0.733 25158 4947 1 13 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.725 -0.538 25158 4948 1 13 . 1 1 47 47 ASN H H 47 10.077 10.077 9.029 1.048 25158 4949 1 13 . 1 1 48 48 SER N N 48 113.409 113.409 114.790 -1.381 25158 4950 1 13 . 1 1 48 48 SER HA H 48 4.086 4.086 4.151 -0.065 25158 4951 1 13 . 1 1 48 48 SER C C 48 176.671 176.671 176.055 0.616 25158 4952 1 13 . 1 1 48 48 SER CA C 48 62.375 62.375 61.327 1.048 25158 4953 1 13 . 1 1 48 48 SER CB C 48 62.375 62.375 62.820 -0.445 25158 4954 1 13 . 1 1 48 48 SER H H 48 8.936 8.936 8.726 0.210 25158 4955 1 13 . 1 1 49 49 THR N N 49 121.885 121.885 118.368 3.517 25158 4956 1 13 . 1 1 49 49 THR HA H 49 4.112 4.112 3.920 0.192 25158 4957 1 13 . 1 1 49 49 THR C C 49 177.320 177.320 176.642 0.678 25158 4958 1 13 . 1 1 49 49 THR CA C 49 66.713 66.713 66.245 0.468 25158 4959 1 13 . 1 1 49 49 THR CB C 49 67.787 67.787 68.400 -0.613 25158 4960 1 13 . 1 1 49 49 THR H H 49 8.124 8.124 8.131 -0.007 25158 4961 1 13 . 1 1 50 50 ASP N N 50 120.401 120.401 122.017 -1.616 25158 4962 1 13 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.337 0.033 25158 4963 1 13 . 1 1 50 50 ASP C C 50 177.033 177.033 178.239 -1.206 25158 4964 1 13 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.316 1.504 25158 4965 1 13 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.278 1.430 25158 4966 1 13 . 1 1 50 50 ASP H H 50 7.560 7.560 8.093 -0.533 25158 4967 1 13 . 1 1 51 51 LEU N N 51 118.174 118.174 119.720 -1.546 25158 4968 1 13 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.066 0.122 25158 4969 1 13 . 1 1 51 51 LEU C C 51 177.441 177.441 178.522 -1.081 25158 4970 1 13 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.244 -0.107 25158 4971 1 13 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.815 0.032 25158 4972 1 13 . 1 1 51 51 LEU H H 51 7.134 7.134 7.589 -0.455 25158 4973 1 13 . 1 1 52 52 GLY N N 52 105.596 105.596 106.432 -0.836 25158 4974 1 13 . 1 1 52 52 GLY C C 52 176.764 176.764 175.950 0.814 25158 4975 1 13 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.827 0.815 25158 4976 1 13 . 1 1 52 52 GLY H H 52 8.034 8.034 7.351 0.683 25158 4977 1 13 . 1 1 53 53 ILE N N 53 122.043 122.043 122.467 -0.424 25158 4978 1 13 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.561 -0.112 25158 4979 1 13 . 1 1 53 53 ILE C C 53 177.112 177.112 177.446 -0.334 25158 4980 1 13 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.916 0.472 25158 4981 1 13 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.844 0.414 25158 4982 1 13 . 1 1 53 53 ILE H H 53 7.611 7.611 7.833 -0.223 25158 4983 1 13 . 1 1 54 54 LEU N N 54 120.787 120.787 120.847 -0.060 25158 4984 1 13 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.945 -0.004 25158 4985 1 13 . 1 1 54 54 LEU C C 54 175.340 175.340 178.216 -2.876 25158 4986 1 13 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.851 -0.656 25158 4987 1 13 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.856 -0.635 25158 4988 1 13 . 1 1 54 54 LEU H H 54 8.323 8.323 8.155 0.168 25158 4989 1 13 . 1 1 55 55 LYS N N 55 116.833 116.833 119.143 -2.310 25158 4990 1 13 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.919 -0.035 25158 4991 1 13 . 1 1 55 55 LYS C C 55 179.067 179.067 179.253 -0.186 25158 4992 1 13 . 1 1 55 55 LYS CA C 55 60.651 60.651 60.035 0.617 25158 4993 1 13 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.189 -0.180 25158 4994 1 13 . 1 1 55 55 LYS H H 55 8.356 8.356 7.529 0.827 25158 4995 1 13 . 1 1 56 56 ARG N N 56 117.092 117.092 118.491 -1.399 25158 4996 1 13 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.229 -0.313 25158 4997 1 13 . 1 1 56 56 ARG C C 56 178.223 178.223 178.675 -0.452 25158 4998 1 13 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.392 0.959 25158 4999 1 13 . 1 1 56 56 ARG CB C 56 30.780 30.780 29.996 0.784 25158 5000 1 13 . 1 1 56 56 ARG H H 56 7.543 7.543 7.704 -0.161 25158 5001 1 13 . 1 1 57 57 TYR N N 57 122.187 122.187 121.719 0.468 25158 5002 1 13 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.565 -0.173 25158 5003 1 13 . 1 1 57 57 TYR C C 57 180.009 180.009 178.711 1.298 25158 5004 1 13 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.039 0.540 25158 5005 1 13 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.712 0.124 25158 5006 1 13 . 1 1 57 57 TYR H H 57 8.592 8.592 7.564 1.028 25158 5007 1 13 . 1 1 58 58 ILE N N 58 122.825 122.825 118.363 4.462 25158 5008 1 13 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.765 -0.085 25158 5009 1 13 . 1 1 58 58 ILE C C 58 178.186 178.186 177.166 1.020 25158 5010 1 13 . 1 1 58 58 ILE CA C 58 64.768 64.768 64.475 0.293 25158 5011 1 13 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.099 -0.379 25158 5012 1 13 . 1 1 58 58 ILE H H 58 8.779 8.779 8.225 0.554 25158 5013 1 13 . 1 1 59 59 LEU N N 59 118.552 118.552 117.731 0.821 25158 5014 1 13 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.318 -0.095 25158 5015 1 13 . 1 1 59 59 LEU C C 59 175.937 175.937 176.147 -0.210 25158 5016 1 13 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.429 1.083 25158 5017 1 13 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.722 0.704 25158 5018 1 13 . 1 1 59 59 LEU H H 59 7.539 7.539 7.583 -0.044 25158 5019 1 13 . 1 1 60 60 LYS N N 60 113.650 113.650 116.814 -3.164 25158 5020 1 13 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.806 0.189 25158 5021 1 13 . 1 1 60 60 LYS C C 60 176.535 176.535 176.155 0.380 25158 5022 1 13 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.602 -0.312 25158 5023 1 13 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.167 -1.896 25158 5024 1 13 . 1 1 60 60 LYS H H 60 7.815 7.815 7.563 0.252 25158 5025 1 13 . 1 1 61 61 GLU N N 61 117.535 117.535 116.548 0.987 25158 5026 1 13 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.264 -0.120 25158 5027 1 13 . 1 1 61 61 GLU C C 61 176.992 176.992 176.639 0.353 25158 5028 1 13 . 1 1 61 61 GLU CA C 61 57.689 57.689 58.017 -0.328 25158 5029 1 13 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.051 -0.359 25158 5030 1 13 . 1 1 61 61 GLU H H 61 8.438 8.438 8.086 0.352 25158 5031 1 13 . 1 1 62 62 ILE N N 62 112.102 112.102 115.074 -2.972 25158 5032 1 13 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.477 -0.094 25158 5033 1 13 . 1 1 62 62 ILE C C 62 175.425 175.425 174.377 1.048 25158 5034 1 13 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.279 -0.353 25158 5035 1 13 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.606 1.142 25158 5036 1 13 . 1 1 62 62 ILE H H 62 6.867 6.867 7.378 -0.511 25158 5037 1 13 . 1 1 63 63 ASP N N 63 119.719 119.719 124.306 -4.587 25158 5038 1 13 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.740 -0.066 25158 5039 1 13 . 1 1 63 63 ASP C C 63 176.202 176.202 175.900 0.302 25158 5040 1 13 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.213 0.605 25158 5041 1 13 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.222 -0.005 25158 5042 1 13 . 1 1 63 63 ASP H H 63 8.561 8.561 8.871 -0.310 25158 5043 1 13 . 1 1 64 64 THR N N 64 113.289 113.289 117.545 -4.256 25158 5044 1 13 . 1 1 64 64 THR HA H 64 4.712 4.712 4.508 0.204 25158 5045 1 13 . 1 1 64 64 THR C C 64 170.854 170.854 172.791 -1.937 25158 5046 1 13 . 1 1 64 64 THR CA C 64 61.269 61.269 61.892 -0.623 25158 5047 1 13 . 1 1 64 64 THR CB C 64 71.993 71.993 69.141 2.851 25158 5048 1 13 . 1 1 64 64 THR H H 64 7.410 7.410 7.789 -0.379 25158 5049 1 13 . 1 1 65 65 LEU N N 65 121.012 121.012 126.770 -5.758 25158 5050 1 13 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.745 -0.516 25158 5051 1 13 . 1 1 65 65 LEU C C 65 174.763 174.763 175.050 -0.287 25158 5052 1 13 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.837 -0.202 25158 5053 1 13 . 1 1 65 65 LEU CB C 65 44.520 44.520 42.918 1.602 25158 5054 1 13 . 1 1 65 65 LEU H H 65 7.877 7.877 8.432 -0.555 25158 5055 1 13 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.310 -0.318 25158 5056 1 13 . 1 1 66 66 PRO C C 66 174.419 174.419 175.019 -0.600 25158 5057 1 13 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.534 -0.224 25158 5058 1 13 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.630 2.595 25158 5059 1 13 . 1 1 67 67 TYR N N 67 122.616 122.616 121.080 1.536 25158 5060 1 13 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.380 0.276 25158 5061 1 13 . 1 1 67 67 TYR C C 67 174.446 174.446 175.561 -1.115 25158 5062 1 13 . 1 1 67 67 TYR CA C 67 58.011 58.011 59.221 -1.210 25158 5063 1 13 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.910 1.171 25158 5064 1 13 . 1 1 67 67 TYR H H 67 8.662 8.662 8.339 0.323 25158 5065 1 13 . 1 1 68 68 LYS N N 68 126.223 126.223 127.085 -0.862 25158 5066 1 13 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.269 -0.001 25158 5067 1 13 . 1 1 68 68 LYS C C 68 174.748 174.748 174.532 0.216 25158 5068 1 13 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.042 0.561 25158 5069 1 13 . 1 1 68 68 LYS CB C 68 32.770 32.770 32.988 -0.218 25158 5070 1 13 . 1 1 68 68 LYS H H 68 8.112 8.112 7.772 0.340 25158 5071 1 14 . 1 1 2 2 THR N N 2 116.700 116.700 116.141 0.559 25158 5072 1 14 . 1 1 2 2 THR HA H 2 4.313 4.313 4.430 -0.117 25158 5073 1 14 . 1 1 2 2 THR C C 2 173.968 173.968 173.183 0.785 25158 5074 1 14 . 1 1 2 2 THR CA C 2 62.326 62.326 61.856 0.470 25158 5075 1 14 . 1 1 2 2 THR CB C 2 70.154 70.154 69.738 0.416 25158 5076 1 14 . 1 1 2 2 THR H H 2 8.657 8.657 7.970 0.687 25158 5077 1 14 . 1 1 3 3 LYS N N 3 125.500 125.500 124.435 1.065 25158 5078 1 14 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.243 -0.178 25158 5079 1 14 . 1 1 3 3 LYS C C 3 174.926 174.926 175.386 -0.460 25158 5080 1 14 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.641 0.198 25158 5081 1 14 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.878 0.899 25158 5082 1 14 . 1 1 3 3 LYS H H 3 8.318 8.318 8.309 0.009 25158 5083 1 14 . 1 1 4 4 LEU N N 4 127.473 127.473 126.126 1.347 25158 5084 1 14 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.394 0.089 25158 5085 1 14 . 1 1 4 4 LEU C C 4 174.734 174.734 174.830 -0.096 25158 5086 1 14 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.579 -0.320 25158 5087 1 14 . 1 1 4 4 LEU CB C 4 40.929 40.929 45.791 -4.862 25158 5088 1 14 . 1 1 4 4 LEU H H 4 7.726 7.726 7.910 -0.184 25158 5089 1 14 . 1 1 5 5 TYR N N 5 123.074 123.074 124.013 -0.939 25158 5090 1 14 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.354 -0.731 25158 5091 1 14 . 1 1 5 5 TYR C C 5 175.406 175.406 177.354 -1.948 25158 5092 1 14 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.631 3.181 25158 5093 1 14 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.337 1.773 25158 5094 1 14 . 1 1 5 5 TYR H H 5 7.816 7.816 8.365 -0.549 25158 5095 1 14 . 1 1 6 6 GLY N N 6 108.614 108.614 114.139 -5.525 25158 5096 1 14 . 1 1 6 6 GLY C C 6 172.585 172.585 172.835 -0.250 25158 5097 1 14 . 1 1 6 6 GLY CA C 6 45.387 45.387 45.008 0.379 25158 5098 1 14 . 1 1 6 6 GLY H H 6 8.915 8.915 8.478 0.437 25158 5099 1 14 . 1 1 7 7 ASP N N 7 118.023 118.023 119.834 -1.811 25158 5100 1 14 . 1 1 7 7 ASP HA H 7 4.984 4.984 5.325 -0.341 25158 5101 1 14 . 1 1 7 7 ASP C C 7 177.806 177.806 177.021 0.785 25158 5102 1 14 . 1 1 7 7 ASP CA C 7 52.192 52.192 51.947 0.245 25158 5103 1 14 . 1 1 7 7 ASP CB C 7 39.150 39.150 41.455 -2.305 25158 5104 1 14 . 1 1 7 7 ASP H H 7 7.976 7.976 7.608 0.368 25158 5105 1 14 . 1 1 8 8 VAL N N 8 120.293 120.293 120.281 0.012 25158 5106 1 14 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.137 -0.154 25158 5107 1 14 . 1 1 8 8 VAL C C 8 175.717 175.717 176.869 -1.152 25158 5108 1 14 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.209 0.237 25158 5109 1 14 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.730 -0.459 25158 5110 1 14 . 1 1 8 8 VAL H H 8 8.156 8.156 8.755 -0.599 25158 5111 1 14 . 1 1 9 9 ASN N N 9 115.226 115.226 115.883 -0.657 25158 5112 1 14 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.568 0.421 25158 5113 1 14 . 1 1 9 9 ASN C C 9 174.626 174.626 175.401 -0.775 25158 5114 1 14 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.991 -2.041 25158 5115 1 14 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.285 -0.584 25158 5116 1 14 . 1 1 9 9 ASN H H 9 8.008 8.008 7.983 0.025 25158 5117 1 14 . 1 1 10 10 ASP N N 10 115.600 115.600 119.088 -3.488 25158 5118 1 14 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.582 -0.146 25158 5119 1 14 . 1 1 10 10 ASP C C 10 175.125 175.125 175.436 -0.311 25158 5120 1 14 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.347 0.888 25158 5121 1 14 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.444 0.756 25158 5122 1 14 . 1 1 10 10 ASP H H 10 7.374 7.374 8.053 -0.679 25158 5123 1 14 . 1 1 11 11 ASP N N 11 118.402 118.402 115.943 2.459 25158 5124 1 14 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.638 0.179 25158 5125 1 14 . 1 1 11 11 ASP C C 11 178.299 178.299 177.158 1.141 25158 5126 1 14 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.766 -0.945 25158 5127 1 14 . 1 1 11 11 ASP CB C 11 41.114 41.114 42.457 -1.343 25158 5128 1 14 . 1 1 11 11 ASP H H 11 8.801 8.801 8.927 -0.126 25158 5129 1 14 . 1 1 12 12 GLY N N 12 112.353 112.353 108.384 3.969 25158 5130 1 14 . 1 1 12 12 GLY C C 12 173.284 173.284 173.682 -0.398 25158 5131 1 14 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.314 0.310 25158 5132 1 14 . 1 1 12 12 GLY H H 12 10.293 10.293 8.499 1.794 25158 5133 1 14 . 1 1 13 13 LYS N N 13 118.118 118.118 119.053 -0.935 25158 5134 1 14 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.474 0.185 25158 5135 1 14 . 1 1 13 13 LYS C C 13 175.595 175.595 174.576 1.019 25158 5136 1 14 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.617 -1.859 25158 5137 1 14 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.483 0.856 25158 5138 1 14 . 1 1 13 13 LYS H H 13 7.848 7.848 7.840 0.008 25158 5139 1 14 . 1 1 14 14 VAL N N 14 126.591 126.591 124.227 2.364 25158 5140 1 14 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.376 0.379 25158 5141 1 14 . 1 1 14 14 VAL C C 14 175.052 175.052 175.263 -0.211 25158 5142 1 14 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.210 -0.140 25158 5143 1 14 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.547 -0.092 25158 5144 1 14 . 1 1 14 14 VAL H H 14 9.109 9.109 8.563 0.546 25158 5145 1 14 . 1 1 15 15 ASN N N 15 126.287 126.287 125.986 0.301 25158 5146 1 14 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.956 -0.141 25158 5147 1 14 . 1 1 15 15 ASN C C 15 176.340 176.340 176.095 0.245 25158 5148 1 14 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.494 0.781 25158 5149 1 14 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.597 -2.377 25158 5150 1 14 . 1 1 15 15 ASN H H 15 10.071 10.071 8.572 1.499 25158 5151 1 14 . 1 1 16 16 SER N N 16 113.168 113.168 115.663 -2.495 25158 5152 1 14 . 1 1 16 16 SER HA H 16 4.047 4.047 4.220 -0.173 25158 5153 1 14 . 1 1 16 16 SER C C 16 176.197 176.197 176.032 0.165 25158 5154 1 14 . 1 1 16 16 SER CA C 16 62.681 62.681 61.353 1.328 25158 5155 1 14 . 1 1 16 16 SER CB C 16 62.681 62.681 63.159 -0.478 25158 5156 1 14 . 1 1 16 16 SER H H 16 8.825 8.825 8.695 0.130 25158 5157 1 14 . 1 1 17 17 THR N N 17 119.391 119.391 115.803 3.588 25158 5158 1 14 . 1 1 17 17 THR HA H 17 3.983 3.983 4.081 -0.098 25158 5159 1 14 . 1 1 17 17 THR C C 17 177.149 177.149 176.283 0.866 25158 5160 1 14 . 1 1 17 17 THR CA C 17 66.791 66.791 65.491 1.300 25158 5161 1 14 . 1 1 17 17 THR CB C 17 67.757 67.757 68.704 -0.947 25158 5162 1 14 . 1 1 17 17 THR H H 17 7.946 7.946 8.205 -0.259 25158 5163 1 14 . 1 1 18 18 ASP N N 18 120.318 120.318 120.927 -0.609 25158 5164 1 14 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.326 0.044 25158 5165 1 14 . 1 1 18 18 ASP C C 18 177.168 177.168 177.969 -0.801 25158 5166 1 14 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.673 1.240 25158 5167 1 14 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.859 1.303 25158 5168 1 14 . 1 1 18 18 ASP H H 18 7.995 7.995 7.841 0.154 25158 5169 1 14 . 1 1 19 19 ALA N N 19 120.191 120.191 123.098 -2.907 25158 5170 1 14 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.187 -0.139 25158 5171 1 14 . 1 1 19 19 ALA C C 19 179.549 179.549 179.706 -0.157 25158 5172 1 14 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.054 0.359 25158 5173 1 14 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.337 -1.024 25158 5174 1 14 . 1 1 19 19 ALA H H 19 7.085 7.085 7.541 -0.456 25158 5175 1 14 . 1 1 20 20 VAL N N 20 120.613 120.613 118.836 1.777 25158 5176 1 14 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.729 -0.118 25158 5177 1 14 . 1 1 20 20 VAL C C 20 178.153 178.153 177.563 0.590 25158 5178 1 14 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.147 1.620 25158 5179 1 14 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.255 0.614 25158 5180 1 14 . 1 1 20 20 VAL H H 20 7.835 7.835 7.477 0.358 25158 5181 1 14 . 1 1 21 21 ALA N N 21 121.767 121.767 122.676 -0.909 25158 5182 1 14 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.093 -0.031 25158 5183 1 14 . 1 1 21 21 ALA C C 21 179.298 179.298 179.653 -0.355 25158 5184 1 14 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.236 0.008 25158 5185 1 14 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.254 -0.465 25158 5186 1 14 . 1 1 21 21 ALA H H 21 7.804 7.804 7.873 -0.069 25158 5187 1 14 . 1 1 22 22 LEU N N 22 117.555 117.555 119.301 -1.746 25158 5188 1 14 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.122 0.024 25158 5189 1 14 . 1 1 22 22 LEU C C 22 177.914 177.914 178.470 -0.556 25158 5190 1 14 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.249 0.444 25158 5191 1 14 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.720 -0.205 25158 5192 1 14 . 1 1 22 22 LEU H H 22 8.619 8.619 7.653 0.966 25158 5193 1 14 . 1 1 23 23 LYS N N 23 120.335 120.335 119.416 0.919 25158 5194 1 14 . 1 1 23 23 LYS HA H 23 3.919 3.919 4.010 -0.091 25158 5195 1 14 . 1 1 23 23 LYS C C 23 177.731 177.731 179.219 -1.488 25158 5196 1 14 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.560 0.777 25158 5197 1 14 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.245 -0.146 25158 5198 1 14 . 1 1 23 23 LYS H H 23 8.230 8.230 7.612 0.618 25158 5199 1 14 . 1 1 24 24 ARG N N 24 116.831 116.831 118.619 -1.788 25158 5200 1 14 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.066 -0.107 25158 5201 1 14 . 1 1 24 24 ARG C C 24 178.616 178.616 178.698 -0.082 25158 5202 1 14 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.512 0.445 25158 5203 1 14 . 1 1 24 24 ARG CB C 24 29.563 29.563 29.971 -0.408 25158 5204 1 14 . 1 1 24 24 ARG H H 24 7.927 7.927 7.503 0.424 25158 5205 1 14 . 1 1 25 25 TYR N N 25 120.960 120.960 121.165 -0.205 25158 5206 1 14 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.173 0.037 25158 5207 1 14 . 1 1 25 25 TYR C C 25 179.465 179.465 178.386 1.079 25158 5208 1 14 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.792 0.053 25158 5209 1 14 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.465 0.600 25158 5210 1 14 . 1 1 25 25 TYR H H 25 8.321 8.321 7.652 0.669 25158 5211 1 14 . 1 1 26 26 VAL N N 26 120.405 120.405 117.738 2.667 25158 5212 1 14 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.893 -0.119 25158 5213 1 14 . 1 1 26 26 VAL C C 26 177.826 177.826 177.162 0.664 25158 5214 1 14 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.066 0.374 25158 5215 1 14 . 1 1 26 26 VAL CB C 26 31.557 31.557 32.033 -0.476 25158 5216 1 14 . 1 1 26 26 VAL H H 26 8.803 8.803 7.862 0.941 25158 5217 1 14 . 1 1 27 27 LEU N N 27 119.247 119.247 118.886 0.361 25158 5218 1 14 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.401 -0.124 25158 5219 1 14 . 1 1 27 27 LEU C C 27 176.753 176.753 176.085 0.668 25158 5220 1 14 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.362 1.313 25158 5221 1 14 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.642 -0.049 25158 5222 1 14 . 1 1 27 27 LEU H H 27 7.898 7.898 7.190 0.708 25158 5223 1 14 . 1 1 28 28 ARG N N 28 116.082 116.082 116.841 -0.759 25158 5224 1 14 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.856 0.258 25158 5225 1 14 . 1 1 28 28 ARG C C 28 176.521 176.521 175.876 0.645 25158 5226 1 14 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.138 -0.984 25158 5227 1 14 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.745 -0.275 25158 5228 1 14 . 1 1 28 28 ARG H H 28 7.993 7.993 7.699 0.294 25158 5229 1 14 . 1 1 29 29 SER N N 29 113.579 113.579 114.494 -0.915 25158 5230 1 14 . 1 1 29 29 SER HA H 29 4.305 4.305 4.341 -0.036 25158 5231 1 14 . 1 1 29 29 SER C C 29 175.368 175.368 175.453 -0.085 25158 5232 1 14 . 1 1 29 29 SER CA C 29 59.699 59.699 60.190 -0.490 25158 5233 1 14 . 1 1 29 29 SER CB C 29 63.908 63.908 63.782 0.126 25158 5234 1 14 . 1 1 29 29 SER H H 29 8.094 8.094 8.308 -0.214 25158 5235 1 14 . 1 1 30 30 GLY N N 30 109.920 109.920 108.394 1.526 25158 5236 1 14 . 1 1 30 30 GLY C C 30 174.115 174.115 174.045 0.070 25158 5237 1 14 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.882 0.889 25158 5238 1 14 . 1 1 30 30 GLY H H 30 8.577 8.577 8.321 0.256 25158 5239 1 14 . 1 1 31 31 ILE N N 31 119.084 119.084 119.290 -0.206 25158 5240 1 14 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.235 0.123 25158 5241 1 14 . 1 1 31 31 ILE C C 31 174.392 174.392 175.443 -1.051 25158 5242 1 14 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.762 -0.516 25158 5243 1 14 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.224 0.355 25158 5244 1 14 . 1 1 31 31 ILE H H 31 7.387 7.387 7.475 -0.088 25158 5245 1 14 . 1 1 32 32 SER N N 32 120.582 120.582 122.260 -1.678 25158 5246 1 14 . 1 1 32 32 SER HA H 32 4.845 4.845 4.815 0.030 25158 5247 1 14 . 1 1 32 32 SER C C 32 173.891 173.891 174.068 -0.177 25158 5248 1 14 . 1 1 32 32 SER CA C 32 57.603 57.603 57.767 -0.165 25158 5249 1 14 . 1 1 32 32 SER CB C 32 63.849 63.849 62.853 0.996 25158 5250 1 14 . 1 1 32 32 SER H H 32 8.339 8.339 8.449 -0.110 25158 5251 1 14 . 1 1 33 33 ILE N N 33 116.629 116.629 121.554 -4.925 25158 5252 1 14 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.801 -0.168 25158 5253 1 14 . 1 1 33 33 ILE C C 33 174.195 174.195 174.426 -0.231 25158 5254 1 14 . 1 1 33 33 ILE CA C 33 59.112 59.112 58.932 0.180 25158 5255 1 14 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.836 1.746 25158 5256 1 14 . 1 1 33 33 ILE H H 33 7.873 7.873 8.034 -0.161 25158 5257 1 14 . 1 1 34 34 ASN N N 34 118.342 118.342 119.768 -1.426 25158 5258 1 14 . 1 1 34 34 ASN HA H 34 4.736 4.736 5.029 -0.293 25158 5259 1 14 . 1 1 34 34 ASN C C 34 176.217 176.217 175.815 0.402 25158 5260 1 14 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.254 -0.068 25158 5261 1 14 . 1 1 34 34 ASN CB C 34 36.499 36.499 39.134 -2.635 25158 5262 1 14 . 1 1 34 34 ASN H H 34 8.839 8.839 8.257 0.582 25158 5263 1 14 . 1 1 35 35 THR N N 35 116.120 116.120 116.956 -0.836 25158 5264 1 14 . 1 1 35 35 THR HA H 35 3.559 3.559 3.958 -0.399 25158 5265 1 14 . 1 1 35 35 THR C C 35 177.347 177.347 175.977 1.370 25158 5266 1 14 . 1 1 35 35 THR CA C 35 64.686 64.686 66.074 -1.388 25158 5267 1 14 . 1 1 35 35 THR CB C 35 67.758 67.758 69.008 -1.250 25158 5268 1 14 . 1 1 35 35 THR H H 35 7.939 7.939 8.371 -0.432 25158 5269 1 14 . 1 1 36 36 ASP N N 36 123.528 123.528 121.266 2.262 25158 5270 1 14 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.401 0.019 25158 5271 1 14 . 1 1 36 36 ASP C C 36 177.752 177.752 177.496 0.256 25158 5272 1 14 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.035 0.039 25158 5273 1 14 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.465 -0.567 25158 5274 1 14 . 1 1 36 36 ASP H H 36 7.980 7.980 8.886 -0.906 25158 5275 1 14 . 1 1 37 37 ASN N N 37 115.690 115.690 116.436 -0.746 25158 5276 1 14 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.560 -0.294 25158 5277 1 14 . 1 1 37 37 ASN C C 37 175.589 175.589 176.914 -1.325 25158 5278 1 14 . 1 1 37 37 ASN CA C 37 52.560 52.560 55.016 -2.456 25158 5279 1 14 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.458 -0.495 25158 5280 1 14 . 1 1 37 37 ASN H H 37 7.251 7.251 8.301 -1.050 25158 5281 1 14 . 1 1 38 38 ALA N N 38 119.560 119.560 123.250 -3.690 25158 5282 1 14 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.079 0.001 25158 5283 1 14 . 1 1 38 38 ALA C C 38 173.638 173.638 178.003 -4.365 25158 5284 1 14 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.035 -1.815 25158 5285 1 14 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.793 4.078 25158 5286 1 14 . 1 1 38 38 ALA H H 38 7.142 7.142 8.336 -1.194 25158 5287 1 14 . 1 1 39 39 ASP N N 39 115.003 115.003 119.790 -4.787 25158 5288 1 14 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.715 0.225 25158 5289 1 14 . 1 1 39 39 ASP C C 39 177.163 177.163 177.017 0.146 25158 5290 1 14 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.898 -2.727 25158 5291 1 14 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.943 -0.997 25158 5292 1 14 . 1 1 39 39 ASP H H 39 7.096 7.096 7.832 -0.736 25158 5293 1 14 . 1 1 40 40 LEU N N 40 123.245 123.245 124.284 -1.039 25158 5294 1 14 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.242 -0.171 25158 5295 1 14 . 1 1 40 40 LEU C C 40 175.865 175.865 177.511 -1.646 25158 5296 1 14 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.964 0.629 25158 5297 1 14 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.216 -0.287 25158 5298 1 14 . 1 1 40 40 LEU H H 40 8.572 8.572 7.948 0.624 25158 5299 1 14 . 1 1 41 41 ASN N N 41 112.723 112.723 113.295 -0.572 25158 5300 1 14 . 1 1 41 41 ASN HA H 41 4.999 4.999 5.117 -0.118 25158 5301 1 14 . 1 1 41 41 ASN C C 41 173.846 173.846 175.286 -1.440 25158 5302 1 14 . 1 1 41 41 ASN CA C 41 51.233 51.233 51.822 -0.589 25158 5303 1 14 . 1 1 41 41 ASN CB C 41 37.395 37.395 38.987 -1.592 25158 5304 1 14 . 1 1 41 41 ASN H H 41 8.004 8.004 7.824 0.180 25158 5305 1 14 . 1 1 42 42 GLU N N 42 115.798 115.798 116.121 -0.323 25158 5306 1 14 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.279 -0.327 25158 5307 1 14 . 1 1 42 42 GLU C C 42 175.172 175.172 175.835 -0.663 25158 5308 1 14 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.728 -0.377 25158 5309 1 14 . 1 1 42 42 GLU CB C 42 28.221 28.221 26.854 1.367 25158 5310 1 14 . 1 1 42 42 GLU H H 42 7.642 7.642 8.491 -0.849 25158 5311 1 14 . 1 1 43 43 ASP N N 43 117.453 117.453 118.207 -0.754 25158 5312 1 14 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.550 0.289 25158 5313 1 14 . 1 1 43 43 ASP C C 43 178.129 178.129 177.797 0.332 25158 5314 1 14 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.153 -1.515 25158 5315 1 14 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.158 0.056 25158 5316 1 14 . 1 1 43 43 ASP H H 43 8.473 8.473 8.757 -0.284 25158 5317 1 14 . 1 1 44 44 GLY N N 44 112.490 112.490 107.864 4.626 25158 5318 1 14 . 1 1 44 44 GLY C C 44 173.717 173.717 173.688 0.029 25158 5319 1 14 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.901 0.416 25158 5320 1 14 . 1 1 44 44 GLY H H 44 10.139 10.139 8.663 1.476 25158 5321 1 14 . 1 1 45 45 ARG N N 45 118.154 118.154 118.822 -0.668 25158 5322 1 14 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.609 0.179 25158 5323 1 14 . 1 1 45 45 ARG C C 45 175.602 175.602 174.410 1.192 25158 5324 1 14 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.174 -0.342 25158 5325 1 14 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.943 0.721 25158 5326 1 14 . 1 1 45 45 ARG H H 45 7.994 7.994 8.814 -0.820 25158 5327 1 14 . 1 1 46 46 VAL N N 46 126.392 126.392 123.167 3.225 25158 5328 1 14 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.252 0.538 25158 5329 1 14 . 1 1 46 46 VAL C C 46 174.644 174.644 175.306 -0.662 25158 5330 1 14 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.964 -0.235 25158 5331 1 14 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.424 1.242 25158 5332 1 14 . 1 1 46 46 VAL H H 46 9.115 9.115 8.546 0.569 25158 5333 1 14 . 1 1 47 47 ASN N N 47 126.737 126.737 126.024 0.713 25158 5334 1 14 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.939 -0.064 25158 5335 1 14 . 1 1 47 47 ASN C C 47 176.467 176.467 175.809 0.658 25158 5336 1 14 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.650 0.390 25158 5337 1 14 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.495 -0.308 25158 5338 1 14 . 1 1 47 47 ASN H H 47 10.077 10.077 7.682 2.395 25158 5339 1 14 . 1 1 48 48 SER N N 48 113.409 113.409 114.610 -1.201 25158 5340 1 14 . 1 1 48 48 SER HA H 48 4.086 4.086 4.157 -0.071 25158 5341 1 14 . 1 1 48 48 SER C C 48 176.671 176.671 176.084 0.587 25158 5342 1 14 . 1 1 48 48 SER CA C 48 62.375 62.375 61.833 0.542 25158 5343 1 14 . 1 1 48 48 SER CB C 48 62.375 62.375 62.821 -0.445 25158 5344 1 14 . 1 1 48 48 SER H H 48 8.936 8.936 8.793 0.143 25158 5345 1 14 . 1 1 49 49 THR N N 49 121.885 121.885 118.277 3.608 25158 5346 1 14 . 1 1 49 49 THR HA H 49 4.112 4.112 3.951 0.161 25158 5347 1 14 . 1 1 49 49 THR C C 49 177.320 177.320 176.447 0.873 25158 5348 1 14 . 1 1 49 49 THR CA C 49 66.713 66.713 66.235 0.478 25158 5349 1 14 . 1 1 49 49 THR CB C 49 67.787 67.787 68.421 -0.634 25158 5350 1 14 . 1 1 49 49 THR H H 49 8.124 8.124 7.631 0.493 25158 5351 1 14 . 1 1 50 50 ASP N N 50 120.401 120.401 122.359 -1.958 25158 5352 1 14 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.332 0.038 25158 5353 1 14 . 1 1 50 50 ASP C C 50 177.033 177.033 178.211 -1.178 25158 5354 1 14 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.284 1.536 25158 5355 1 14 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.122 1.586 25158 5356 1 14 . 1 1 50 50 ASP H H 50 7.560 7.560 7.715 -0.155 25158 5357 1 14 . 1 1 51 51 LEU N N 51 118.174 118.174 119.755 -1.581 25158 5358 1 14 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.028 0.160 25158 5359 1 14 . 1 1 51 51 LEU C C 51 177.441 177.441 178.541 -1.100 25158 5360 1 14 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.591 -0.454 25158 5361 1 14 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.842 0.005 25158 5362 1 14 . 1 1 51 51 LEU H H 51 7.134 7.134 7.662 -0.528 25158 5363 1 14 . 1 1 52 52 GLY N N 52 105.596 105.596 104.931 0.665 25158 5364 1 14 . 1 1 52 52 GLY C C 52 176.764 176.764 175.917 0.847 25158 5365 1 14 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.794 0.848 25158 5366 1 14 . 1 1 52 52 GLY H H 52 8.034 8.034 7.547 0.487 25158 5367 1 14 . 1 1 53 53 ILE N N 53 122.043 122.043 122.775 -0.732 25158 5368 1 14 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.725 -0.276 25158 5369 1 14 . 1 1 53 53 ILE C C 53 177.112 177.112 177.252 -0.140 25158 5370 1 14 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.072 1.316 25158 5371 1 14 . 1 1 53 53 ILE CB C 53 38.258 38.258 38.051 0.207 25158 5372 1 14 . 1 1 53 53 ILE H H 53 7.611 7.611 7.289 0.322 25158 5373 1 14 . 1 1 54 54 LEU N N 54 120.787 120.787 121.094 -0.307 25158 5374 1 14 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.963 -0.022 25158 5375 1 14 . 1 1 54 54 LEU C C 54 175.340 175.340 178.356 -3.016 25158 5376 1 14 . 1 1 54 54 LEU CA C 54 58.195 58.195 59.261 -1.067 25158 5377 1 14 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.957 -0.736 25158 5378 1 14 . 1 1 54 54 LEU H H 54 8.323 8.323 8.603 -0.280 25158 5379 1 14 . 1 1 55 55 LYS N N 55 116.833 116.833 118.260 -1.427 25158 5380 1 14 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.944 -0.060 25158 5381 1 14 . 1 1 55 55 LYS C C 55 179.067 179.067 179.298 -0.231 25158 5382 1 14 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.881 0.770 25158 5383 1 14 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.172 -0.164 25158 5384 1 14 . 1 1 55 55 LYS H H 55 8.356 8.356 7.747 0.609 25158 5385 1 14 . 1 1 56 56 ARG N N 56 117.092 117.092 119.064 -1.972 25158 5386 1 14 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.322 -0.406 25158 5387 1 14 . 1 1 56 56 ARG C C 56 178.223 178.223 178.872 -0.649 25158 5388 1 14 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.268 1.083 25158 5389 1 14 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.207 0.573 25158 5390 1 14 . 1 1 56 56 ARG H H 56 7.543 7.543 7.637 -0.094 25158 5391 1 14 . 1 1 57 57 TYR N N 57 122.187 122.187 121.911 0.276 25158 5392 1 14 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.497 -0.105 25158 5393 1 14 . 1 1 57 57 TYR C C 57 180.009 180.009 178.624 1.385 25158 5394 1 14 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.304 0.275 25158 5395 1 14 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.497 0.339 25158 5396 1 14 . 1 1 57 57 TYR H H 57 8.592 8.592 8.147 0.445 25158 5397 1 14 . 1 1 58 58 ILE N N 58 122.825 122.825 116.159 6.666 25158 5398 1 14 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.875 -0.195 25158 5399 1 14 . 1 1 58 58 ILE C C 58 178.186 178.186 176.017 2.169 25158 5400 1 14 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.313 1.455 25158 5401 1 14 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.190 -0.470 25158 5402 1 14 . 1 1 58 58 ILE H H 58 8.779 8.779 7.731 1.048 25158 5403 1 14 . 1 1 59 59 LEU N N 59 118.552 118.552 118.978 -0.426 25158 5404 1 14 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.337 -0.114 25158 5405 1 14 . 1 1 59 59 LEU C C 59 175.937 175.937 176.209 -0.272 25158 5406 1 14 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.032 1.480 25158 5407 1 14 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.611 0.815 25158 5408 1 14 . 1 1 59 59 LEU H H 59 7.539 7.539 7.164 0.375 25158 5409 1 14 . 1 1 60 60 LYS N N 60 113.650 113.650 116.875 -3.225 25158 5410 1 14 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.801 0.194 25158 5411 1 14 . 1 1 60 60 LYS C C 60 176.535 176.535 176.194 0.341 25158 5412 1 14 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.749 -0.458 25158 5413 1 14 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.976 -1.705 25158 5414 1 14 . 1 1 60 60 LYS H H 60 7.815 7.815 7.498 0.317 25158 5415 1 14 . 1 1 61 61 GLU N N 61 117.535 117.535 116.340 1.195 25158 5416 1 14 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.250 -0.106 25158 5417 1 14 . 1 1 61 61 GLU C C 61 176.992 176.992 176.458 0.534 25158 5418 1 14 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.963 -0.274 25158 5419 1 14 . 1 1 61 61 GLU CB C 61 30.692 30.692 30.869 -0.177 25158 5420 1 14 . 1 1 61 61 GLU H H 61 8.438 8.438 8.082 0.356 25158 5421 1 14 . 1 1 62 62 ILE N N 62 112.102 112.102 114.689 -2.587 25158 5422 1 14 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.543 -0.160 25158 5423 1 14 . 1 1 62 62 ILE C C 62 175.425 175.425 174.616 0.809 25158 5424 1 14 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.041 -0.115 25158 5425 1 14 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.782 0.966 25158 5426 1 14 . 1 1 62 62 ILE H H 62 6.867 6.867 7.282 -0.415 25158 5427 1 14 . 1 1 63 63 ASP N N 63 119.719 119.719 123.212 -3.493 25158 5428 1 14 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.677 -0.003 25158 5429 1 14 . 1 1 63 63 ASP C C 63 176.202 176.202 176.656 -0.454 25158 5430 1 14 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.167 0.651 25158 5431 1 14 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.037 1.180 25158 5432 1 14 . 1 1 63 63 ASP H H 63 8.561 8.561 8.740 -0.179 25158 5433 1 14 . 1 1 64 64 THR N N 64 113.289 113.289 117.386 -4.097 25158 5434 1 14 . 1 1 64 64 THR HA H 64 4.712 4.712 4.369 0.343 25158 5435 1 14 . 1 1 64 64 THR C C 64 170.854 170.854 173.128 -2.274 25158 5436 1 14 . 1 1 64 64 THR CA C 64 61.269 61.269 62.719 -1.450 25158 5437 1 14 . 1 1 64 64 THR CB C 64 71.993 71.993 69.003 2.990 25158 5438 1 14 . 1 1 64 64 THR H H 64 7.410 7.410 7.795 -0.385 25158 5439 1 14 . 1 1 65 65 LEU N N 65 121.012 121.012 127.797 -6.785 25158 5440 1 14 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.698 -0.469 25158 5441 1 14 . 1 1 65 65 LEU C C 65 174.763 174.763 174.906 -0.143 25158 5442 1 14 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.398 0.237 25158 5443 1 14 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.387 0.133 25158 5444 1 14 . 1 1 65 65 LEU H H 65 7.877 7.877 8.311 -0.434 25158 5445 1 14 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.136 -0.144 25158 5446 1 14 . 1 1 66 66 PRO C C 66 174.419 174.419 174.933 -0.514 25158 5447 1 14 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.100 0.210 25158 5448 1 14 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.222 3.004 25158 5449 1 14 . 1 1 67 67 TYR N N 67 122.616 122.616 120.154 2.462 25158 5450 1 14 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.278 0.378 25158 5451 1 14 . 1 1 67 67 TYR C C 67 174.446 174.446 175.675 -1.229 25158 5452 1 14 . 1 1 67 67 TYR CA C 67 58.011 58.011 59.409 -1.398 25158 5453 1 14 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.557 1.524 25158 5454 1 14 . 1 1 67 67 TYR H H 67 8.662 8.662 8.182 0.480 25158 5455 1 14 . 1 1 68 68 LYS N N 68 126.223 126.223 128.817 -2.594 25158 5456 1 14 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.337 -0.069 25158 5457 1 14 . 1 1 68 68 LYS C C 68 174.748 174.748 174.546 0.202 25158 5458 1 14 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.765 -0.162 25158 5459 1 14 . 1 1 68 68 LYS CB C 68 32.770 32.770 32.468 0.302 25158 5460 1 14 . 1 1 68 68 LYS H H 68 8.112 8.112 8.105 0.007 25158 5461 1 15 . 1 1 2 2 THR N N 2 116.700 116.700 115.745 0.955 25158 5462 1 15 . 1 1 2 2 THR HA H 2 4.313 4.313 4.403 -0.090 25158 5463 1 15 . 1 1 2 2 THR C C 2 173.968 173.968 174.802 -0.834 25158 5464 1 15 . 1 1 2 2 THR CA C 2 62.326 62.326 61.627 0.699 25158 5465 1 15 . 1 1 2 2 THR CB C 2 70.154 70.154 69.802 0.352 25158 5466 1 15 . 1 1 2 2 THR H H 2 8.657 8.657 8.332 0.325 25158 5467 1 15 . 1 1 3 3 LYS N N 3 125.500 125.500 125.971 -0.471 25158 5468 1 15 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.266 -0.201 25158 5469 1 15 . 1 1 3 3 LYS C C 3 174.926 174.926 175.419 -0.493 25158 5470 1 15 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.626 0.214 25158 5471 1 15 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.938 0.839 25158 5472 1 15 . 1 1 3 3 LYS H H 3 8.318 8.318 8.408 -0.090 25158 5473 1 15 . 1 1 4 4 LEU N N 4 127.473 127.473 125.786 1.687 25158 5474 1 15 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.490 -0.007 25158 5475 1 15 . 1 1 4 4 LEU C C 4 174.734 174.734 174.974 -0.240 25158 5476 1 15 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.220 0.039 25158 5477 1 15 . 1 1 4 4 LEU CB C 4 40.929 40.929 45.582 -4.653 25158 5478 1 15 . 1 1 4 4 LEU H H 4 7.726 7.726 7.780 -0.054 25158 5479 1 15 . 1 1 5 5 TYR N N 5 123.074 123.074 124.040 -0.966 25158 5480 1 15 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.352 -0.729 25158 5481 1 15 . 1 1 5 5 TYR C C 5 175.406 175.406 176.794 -1.388 25158 5482 1 15 . 1 1 5 5 TYR CA C 5 61.812 61.812 59.269 2.543 25158 5483 1 15 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.434 1.677 25158 5484 1 15 . 1 1 5 5 TYR H H 5 7.816 7.816 8.464 -0.648 25158 5485 1 15 . 1 1 6 6 GLY N N 6 108.614 108.614 114.590 -5.976 25158 5486 1 15 . 1 1 6 6 GLY C C 6 172.585 172.585 173.002 -0.417 25158 5487 1 15 . 1 1 6 6 GLY CA C 6 45.387 45.387 45.197 0.190 25158 5488 1 15 . 1 1 6 6 GLY H H 6 8.915 8.915 8.540 0.375 25158 5489 1 15 . 1 1 7 7 ASP N N 7 118.023 118.023 120.442 -2.419 25158 5490 1 15 . 1 1 7 7 ASP HA H 7 4.984 4.984 5.421 -0.437 25158 5491 1 15 . 1 1 7 7 ASP C C 7 177.806 177.806 177.183 0.623 25158 5492 1 15 . 1 1 7 7 ASP CA C 7 52.192 52.192 51.621 0.571 25158 5493 1 15 . 1 1 7 7 ASP CB C 7 39.150 39.150 41.151 -2.001 25158 5494 1 15 . 1 1 7 7 ASP H H 7 7.976 7.976 7.653 0.323 25158 5495 1 15 . 1 1 8 8 VAL N N 8 120.293 120.293 119.265 1.028 25158 5496 1 15 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.074 -0.091 25158 5497 1 15 . 1 1 8 8 VAL C C 8 175.717 175.717 176.733 -1.016 25158 5498 1 15 . 1 1 8 8 VAL CA C 8 63.446 63.446 64.369 -0.923 25158 5499 1 15 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.570 -0.299 25158 5500 1 15 . 1 1 8 8 VAL H H 8 8.156 8.156 8.203 -0.047 25158 5501 1 15 . 1 1 9 9 ASN N N 9 115.226 115.226 116.407 -1.181 25158 5502 1 15 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.532 0.457 25158 5503 1 15 . 1 1 9 9 ASN C C 9 174.626 174.626 175.060 -0.434 25158 5504 1 15 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.998 -2.047 25158 5505 1 15 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.258 -0.557 25158 5506 1 15 . 1 1 9 9 ASN H H 9 8.008 8.008 8.076 -0.068 25158 5507 1 15 . 1 1 10 10 ASP N N 10 115.600 115.600 117.320 -1.720 25158 5508 1 15 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.586 -0.150 25158 5509 1 15 . 1 1 10 10 ASP C C 10 175.125 175.125 174.813 0.312 25158 5510 1 15 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.565 0.671 25158 5511 1 15 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.473 0.727 25158 5512 1 15 . 1 1 10 10 ASP H H 10 7.374 7.374 7.969 -0.595 25158 5513 1 15 . 1 1 11 11 ASP N N 11 118.402 118.402 116.307 2.095 25158 5514 1 15 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.655 0.162 25158 5515 1 15 . 1 1 11 11 ASP C C 11 178.299 178.299 177.277 1.022 25158 5516 1 15 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.481 -0.660 25158 5517 1 15 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.848 -0.734 25158 5518 1 15 . 1 1 11 11 ASP H H 11 8.801 8.801 8.905 -0.104 25158 5519 1 15 . 1 1 12 12 GLY N N 12 112.353 112.353 107.658 4.695 25158 5520 1 15 . 1 1 12 12 GLY C C 12 173.284 173.284 173.968 -0.684 25158 5521 1 15 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.054 0.570 25158 5522 1 15 . 1 1 12 12 GLY H H 12 10.293 10.293 8.208 2.085 25158 5523 1 15 . 1 1 13 13 LYS N N 13 118.118 118.118 119.699 -1.581 25158 5524 1 15 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.547 0.112 25158 5525 1 15 . 1 1 13 13 LYS C C 13 175.595 175.595 174.468 1.127 25158 5526 1 15 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.711 -1.953 25158 5527 1 15 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.695 0.644 25158 5528 1 15 . 1 1 13 13 LYS H H 13 7.848 7.848 8.774 -0.926 25158 5529 1 15 . 1 1 14 14 VAL N N 14 126.591 126.591 124.372 2.219 25158 5530 1 15 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.404 0.351 25158 5531 1 15 . 1 1 14 14 VAL C C 14 175.052 175.052 175.365 -0.313 25158 5532 1 15 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.732 0.338 25158 5533 1 15 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.109 1.346 25158 5534 1 15 . 1 1 14 14 VAL H H 14 9.109 9.109 8.402 0.707 25158 5535 1 15 . 1 1 15 15 ASN N N 15 126.287 126.287 125.820 0.467 25158 5536 1 15 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.942 -0.127 25158 5537 1 15 . 1 1 15 15 ASN C C 15 176.340 176.340 176.810 -0.470 25158 5538 1 15 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.728 0.547 25158 5539 1 15 . 1 1 15 15 ASN CB C 15 39.220 39.220 42.002 -2.782 25158 5540 1 15 . 1 1 15 15 ASN H H 15 10.071 10.071 8.472 1.599 25158 5541 1 15 . 1 1 16 16 SER N N 16 113.168 113.168 116.898 -3.730 25158 5542 1 15 . 1 1 16 16 SER HA H 16 4.047 4.047 4.311 -0.264 25158 5543 1 15 . 1 1 16 16 SER C C 16 176.197 176.197 176.066 0.131 25158 5544 1 15 . 1 1 16 16 SER CA C 16 62.681 62.681 61.984 0.697 25158 5545 1 15 . 1 1 16 16 SER CB C 16 62.681 62.681 62.518 0.163 25158 5546 1 15 . 1 1 16 16 SER H H 16 8.825 8.825 8.839 -0.014 25158 5547 1 15 . 1 1 17 17 THR N N 17 119.391 119.391 117.861 1.530 25158 5548 1 15 . 1 1 17 17 THR HA H 17 3.983 3.983 4.119 -0.136 25158 5549 1 15 . 1 1 17 17 THR C C 17 177.149 177.149 176.892 0.257 25158 5550 1 15 . 1 1 17 17 THR CA C 17 66.791 66.791 65.986 0.806 25158 5551 1 15 . 1 1 17 17 THR CB C 17 67.757 67.757 68.041 -0.284 25158 5552 1 15 . 1 1 17 17 THR H H 17 7.946 7.946 8.267 -0.321 25158 5553 1 15 . 1 1 18 18 ASP N N 18 120.318 120.318 121.295 -0.977 25158 5554 1 15 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.492 -0.122 25158 5555 1 15 . 1 1 18 18 ASP C C 18 177.168 177.168 177.823 -0.655 25158 5556 1 15 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.764 1.150 25158 5557 1 15 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.383 1.779 25158 5558 1 15 . 1 1 18 18 ASP H H 18 7.995 7.995 7.929 0.066 25158 5559 1 15 . 1 1 19 19 ALA N N 19 120.191 120.191 122.832 -2.641 25158 5560 1 15 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.068 -0.020 25158 5561 1 15 . 1 1 19 19 ALA C C 19 179.549 179.549 179.149 0.400 25158 5562 1 15 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.221 0.192 25158 5563 1 15 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.540 -1.227 25158 5564 1 15 . 1 1 19 19 ALA H H 19 7.085 7.085 7.231 -0.146 25158 5565 1 15 . 1 1 20 20 VAL N N 20 120.613 120.613 118.455 2.158 25158 5566 1 15 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.740 -0.129 25158 5567 1 15 . 1 1 20 20 VAL C C 20 178.153 178.153 177.426 0.727 25158 5568 1 15 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.451 1.317 25158 5569 1 15 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.272 0.596 25158 5570 1 15 . 1 1 20 20 VAL H H 20 7.835 7.835 7.743 0.092 25158 5571 1 15 . 1 1 21 21 ALA N N 21 121.767 121.767 122.597 -0.830 25158 5572 1 15 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.146 -0.084 25158 5573 1 15 . 1 1 21 21 ALA C C 21 179.298 179.298 179.625 -0.327 25158 5574 1 15 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.033 0.211 25158 5575 1 15 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.315 -0.526 25158 5576 1 15 . 1 1 21 21 ALA H H 21 7.804 7.804 7.466 0.338 25158 5577 1 15 . 1 1 22 22 LEU N N 22 117.555 117.555 119.719 -2.164 25158 5578 1 15 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.161 -0.015 25158 5579 1 15 . 1 1 22 22 LEU C C 22 177.914 177.914 178.523 -0.609 25158 5580 1 15 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.534 0.159 25158 5581 1 15 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.887 -0.372 25158 5582 1 15 . 1 1 22 22 LEU H H 22 8.619 8.619 7.754 0.865 25158 5583 1 15 . 1 1 23 23 LYS N N 23 120.335 120.335 119.650 0.685 25158 5584 1 15 . 1 1 23 23 LYS HA H 23 3.919 3.919 4.062 -0.143 25158 5585 1 15 . 1 1 23 23 LYS C C 23 177.731 177.731 179.211 -1.480 25158 5586 1 15 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.177 1.160 25158 5587 1 15 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.168 -0.070 25158 5588 1 15 . 1 1 23 23 LYS H H 23 8.230 8.230 7.791 0.439 25158 5589 1 15 . 1 1 24 24 ARG N N 24 116.831 116.831 118.293 -1.462 25158 5590 1 15 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.060 -0.101 25158 5591 1 15 . 1 1 24 24 ARG C C 24 178.616 178.616 178.805 -0.189 25158 5592 1 15 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.455 0.502 25158 5593 1 15 . 1 1 24 24 ARG CB C 24 29.563 29.563 29.819 -0.256 25158 5594 1 15 . 1 1 24 24 ARG H H 24 7.927 7.927 7.579 0.348 25158 5595 1 15 . 1 1 25 25 TYR N N 25 120.960 120.960 121.111 -0.151 25158 5596 1 15 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.243 -0.033 25158 5597 1 15 . 1 1 25 25 TYR C C 25 179.465 179.465 178.355 1.110 25158 5598 1 15 . 1 1 25 25 TYR CA C 25 61.845 61.845 60.811 1.034 25158 5599 1 15 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.181 0.884 25158 5600 1 15 . 1 1 25 25 TYR H H 25 8.321 8.321 7.720 0.601 25158 5601 1 15 . 1 1 26 26 VAL N N 26 120.405 120.405 116.647 3.758 25158 5602 1 15 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.694 0.080 25158 5603 1 15 . 1 1 26 26 VAL C C 26 177.826 177.826 177.166 0.660 25158 5604 1 15 . 1 1 26 26 VAL CA C 26 65.440 65.440 64.965 0.475 25158 5605 1 15 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.584 -0.027 25158 5606 1 15 . 1 1 26 26 VAL H H 26 8.803 8.803 7.678 1.125 25158 5607 1 15 . 1 1 27 27 LEU N N 27 119.247 119.247 119.248 -0.001 25158 5608 1 15 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.358 -0.082 25158 5609 1 15 . 1 1 27 27 LEU C C 27 176.753 176.753 176.357 0.396 25158 5610 1 15 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.203 1.472 25158 5611 1 15 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.663 -0.070 25158 5612 1 15 . 1 1 27 27 LEU H H 27 7.898 7.898 7.462 0.436 25158 5613 1 15 . 1 1 28 28 ARG N N 28 116.082 116.082 118.083 -2.001 25158 5614 1 15 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.897 0.217 25158 5615 1 15 . 1 1 28 28 ARG C C 28 176.521 176.521 176.222 0.299 25158 5616 1 15 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.165 -1.011 25158 5617 1 15 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.149 0.322 25158 5618 1 15 . 1 1 28 28 ARG H H 28 7.993 7.993 7.720 0.273 25158 5619 1 15 . 1 1 29 29 SER N N 29 113.579 113.579 113.819 -0.240 25158 5620 1 15 . 1 1 29 29 SER HA H 29 4.305 4.305 4.470 -0.165 25158 5621 1 15 . 1 1 29 29 SER C C 29 175.368 175.368 175.173 0.195 25158 5622 1 15 . 1 1 29 29 SER CA C 29 59.699 59.699 59.423 0.276 25158 5623 1 15 . 1 1 29 29 SER CB C 29 63.908 63.908 63.611 0.297 25158 5624 1 15 . 1 1 29 29 SER H H 29 8.094 8.094 7.991 0.103 25158 5625 1 15 . 1 1 30 30 GLY N N 30 109.920 109.920 109.701 0.219 25158 5626 1 15 . 1 1 30 30 GLY C C 30 174.115 174.115 173.917 0.198 25158 5627 1 15 . 1 1 30 30 GLY CA C 30 45.771 45.771 45.680 0.091 25158 5628 1 15 . 1 1 30 30 GLY H H 30 8.577 8.577 8.359 0.218 25158 5629 1 15 . 1 1 31 31 ILE N N 31 119.084 119.084 119.594 -0.510 25158 5630 1 15 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.306 0.052 25158 5631 1 15 . 1 1 31 31 ILE C C 31 174.392 174.392 174.711 -0.319 25158 5632 1 15 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.573 -0.327 25158 5633 1 15 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.385 0.194 25158 5634 1 15 . 1 1 31 31 ILE H H 31 7.387 7.387 7.824 -0.437 25158 5635 1 15 . 1 1 32 32 SER N N 32 120.582 120.582 123.719 -3.137 25158 5636 1 15 . 1 1 32 32 SER HA H 32 4.845 4.845 4.607 0.238 25158 5637 1 15 . 1 1 32 32 SER C C 32 173.891 173.891 174.227 -0.336 25158 5638 1 15 . 1 1 32 32 SER CA C 32 57.603 57.603 57.600 0.003 25158 5639 1 15 . 1 1 32 32 SER CB C 32 63.849 63.849 63.461 0.388 25158 5640 1 15 . 1 1 32 32 SER H H 32 8.339 8.339 8.470 -0.131 25158 5641 1 15 . 1 1 33 33 ILE N N 33 116.629 116.629 121.489 -4.860 25158 5642 1 15 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.449 0.184 25158 5643 1 15 . 1 1 33 33 ILE C C 33 174.195 174.195 174.143 0.052 25158 5644 1 15 . 1 1 33 33 ILE CA C 33 59.112 59.112 58.684 0.428 25158 5645 1 15 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.436 2.146 25158 5646 1 15 . 1 1 33 33 ILE H H 33 7.873 7.873 7.590 0.283 25158 5647 1 15 . 1 1 34 34 ASN N N 34 118.342 118.342 119.457 -1.115 25158 5648 1 15 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.799 -0.063 25158 5649 1 15 . 1 1 34 34 ASN C C 34 176.217 176.217 176.280 -0.063 25158 5650 1 15 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.709 -0.523 25158 5651 1 15 . 1 1 34 34 ASN CB C 34 36.499 36.499 39.090 -2.591 25158 5652 1 15 . 1 1 34 34 ASN H H 34 8.839 8.839 8.150 0.689 25158 5653 1 15 . 1 1 35 35 THR N N 35 116.120 116.120 117.345 -1.225 25158 5654 1 15 . 1 1 35 35 THR HA H 35 3.559 3.559 4.128 -0.569 25158 5655 1 15 . 1 1 35 35 THR C C 35 177.347 177.347 175.976 1.371 25158 5656 1 15 . 1 1 35 35 THR CA C 35 64.686 64.686 65.750 -1.064 25158 5657 1 15 . 1 1 35 35 THR CB C 35 67.758 67.758 69.054 -1.296 25158 5658 1 15 . 1 1 35 35 THR H H 35 7.939 7.939 8.335 -0.396 25158 5659 1 15 . 1 1 36 36 ASP N N 36 123.528 123.528 122.732 0.796 25158 5660 1 15 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.408 0.012 25158 5661 1 15 . 1 1 36 36 ASP C C 36 177.752 177.752 177.173 0.579 25158 5662 1 15 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.605 -0.531 25158 5663 1 15 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.659 -0.761 25158 5664 1 15 . 1 1 36 36 ASP H H 36 7.980 7.980 8.857 -0.877 25158 5665 1 15 . 1 1 37 37 ASN N N 37 115.690 115.690 115.983 -0.293 25158 5666 1 15 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.563 -0.297 25158 5667 1 15 . 1 1 37 37 ASN C C 37 175.589 175.589 176.704 -1.115 25158 5668 1 15 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.804 -2.244 25158 5669 1 15 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.319 -0.356 25158 5670 1 15 . 1 1 37 37 ASN H H 37 7.251 7.251 8.361 -1.109 25158 5671 1 15 . 1 1 38 38 ALA N N 38 119.560 119.560 122.924 -3.364 25158 5672 1 15 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.086 -0.006 25158 5673 1 15 . 1 1 38 38 ALA C C 38 173.638 173.638 177.355 -3.717 25158 5674 1 15 . 1 1 38 38 ALA CA C 38 52.220 52.220 53.976 -1.756 25158 5675 1 15 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.820 4.051 25158 5676 1 15 . 1 1 38 38 ALA H H 38 7.142 7.142 7.864 -0.722 25158 5677 1 15 . 1 1 39 39 ASP N N 39 115.003 115.003 119.389 -4.386 25158 5678 1 15 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.524 0.416 25158 5679 1 15 . 1 1 39 39 ASP C C 39 177.163 177.163 176.875 0.288 25158 5680 1 15 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.868 -2.697 25158 5681 1 15 . 1 1 39 39 ASP CB C 39 38.946 38.946 40.037 -1.091 25158 5682 1 15 . 1 1 39 39 ASP H H 39 7.096 7.096 8.015 -0.919 25158 5683 1 15 . 1 1 40 40 LEU N N 40 123.245 123.245 124.464 -1.219 25158 5684 1 15 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.206 -0.135 25158 5685 1 15 . 1 1 40 40 LEU C C 40 175.865 175.865 177.556 -1.691 25158 5686 1 15 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.954 0.639 25158 5687 1 15 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.198 -0.269 25158 5688 1 15 . 1 1 40 40 LEU H H 40 8.572 8.572 8.077 0.495 25158 5689 1 15 . 1 1 41 41 ASN N N 41 112.723 112.723 114.167 -1.444 25158 5690 1 15 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.974 0.025 25158 5691 1 15 . 1 1 41 41 ASN C C 41 173.846 173.846 175.439 -1.593 25158 5692 1 15 . 1 1 41 41 ASN CA C 41 51.233 51.233 51.808 -0.575 25158 5693 1 15 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.285 -1.891 25158 5694 1 15 . 1 1 41 41 ASN H H 41 8.004 8.004 7.924 0.080 25158 5695 1 15 . 1 1 42 42 GLU N N 42 115.798 115.798 115.279 0.519 25158 5696 1 15 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.267 -0.315 25158 5697 1 15 . 1 1 42 42 GLU C C 42 175.172 175.172 175.475 -0.303 25158 5698 1 15 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.446 -0.095 25158 5699 1 15 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.204 1.017 25158 5700 1 15 . 1 1 42 42 GLU H H 42 7.642 7.642 8.604 -0.962 25158 5701 1 15 . 1 1 43 43 ASP N N 43 117.453 117.453 116.615 0.838 25158 5702 1 15 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.522 0.317 25158 5703 1 15 . 1 1 43 43 ASP C C 43 178.129 178.129 177.343 0.786 25158 5704 1 15 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.941 -1.302 25158 5705 1 15 . 1 1 43 43 ASP CB C 43 41.214 41.214 40.984 0.230 25158 5706 1 15 . 1 1 43 43 ASP H H 43 8.473 8.473 8.909 -0.436 25158 5707 1 15 . 1 1 44 44 GLY N N 44 112.490 112.490 107.576 4.914 25158 5708 1 15 . 1 1 44 44 GLY C C 44 173.717 173.717 173.845 -0.128 25158 5709 1 15 . 1 1 44 44 GLY CA C 44 45.317 45.317 45.156 0.161 25158 5710 1 15 . 1 1 44 44 GLY H H 44 10.139 10.139 8.380 1.759 25158 5711 1 15 . 1 1 45 45 ARG N N 45 118.154 118.154 117.183 0.971 25158 5712 1 15 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.606 0.182 25158 5713 1 15 . 1 1 45 45 ARG C C 45 175.602 175.602 174.129 1.473 25158 5714 1 15 . 1 1 45 45 ARG CA C 45 53.832 53.832 55.106 -1.274 25158 5715 1 15 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.370 1.294 25158 5716 1 15 . 1 1 45 45 ARG H H 45 7.994 7.994 9.096 -1.102 25158 5717 1 15 . 1 1 46 46 VAL N N 46 126.392 126.392 124.287 2.105 25158 5718 1 15 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.573 0.217 25158 5719 1 15 . 1 1 46 46 VAL C C 46 174.644 174.644 175.253 -0.609 25158 5720 1 15 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.013 -0.284 25158 5721 1 15 . 1 1 46 46 VAL CB C 46 31.666 31.666 31.086 0.580 25158 5722 1 15 . 1 1 46 46 VAL H H 46 9.115 9.115 8.527 0.588 25158 5723 1 15 . 1 1 47 47 ASN N N 47 126.737 126.737 125.836 0.901 25158 5724 1 15 . 1 1 47 47 ASN HA H 47 4.875 4.875 5.054 -0.179 25158 5725 1 15 . 1 1 47 47 ASN C C 47 176.467 176.467 175.869 0.598 25158 5726 1 15 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.750 0.290 25158 5727 1 15 . 1 1 47 47 ASN CB C 47 39.187 39.187 40.155 -0.968 25158 5728 1 15 . 1 1 47 47 ASN H H 47 10.077 10.077 8.550 1.527 25158 5729 1 15 . 1 1 48 48 SER N N 48 113.409 113.409 115.044 -1.635 25158 5730 1 15 . 1 1 48 48 SER HA H 48 4.086 4.086 4.179 -0.093 25158 5731 1 15 . 1 1 48 48 SER C C 48 176.671 176.671 176.343 0.328 25158 5732 1 15 . 1 1 48 48 SER CA C 48 62.375 62.375 61.369 1.006 25158 5733 1 15 . 1 1 48 48 SER CB C 48 62.375 62.375 62.730 -0.354 25158 5734 1 15 . 1 1 48 48 SER H H 48 8.936 8.936 8.731 0.205 25158 5735 1 15 . 1 1 49 49 THR N N 49 121.885 121.885 118.032 3.853 25158 5736 1 15 . 1 1 49 49 THR HA H 49 4.112 4.112 4.050 0.062 25158 5737 1 15 . 1 1 49 49 THR C C 49 177.320 177.320 176.785 0.535 25158 5738 1 15 . 1 1 49 49 THR CA C 49 66.713 66.713 65.874 0.839 25158 5739 1 15 . 1 1 49 49 THR CB C 49 67.787 67.787 68.179 -0.392 25158 5740 1 15 . 1 1 49 49 THR H H 49 8.124 8.124 8.206 -0.082 25158 5741 1 15 . 1 1 50 50 ASP N N 50 120.401 120.401 121.696 -1.295 25158 5742 1 15 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.369 0.001 25158 5743 1 15 . 1 1 50 50 ASP C C 50 177.033 177.033 178.230 -1.197 25158 5744 1 15 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.499 1.321 25158 5745 1 15 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.294 1.414 25158 5746 1 15 . 1 1 50 50 ASP H H 50 7.560 7.560 7.798 -0.238 25158 5747 1 15 . 1 1 51 51 LEU N N 51 118.174 118.174 119.866 -1.692 25158 5748 1 15 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.134 0.054 25158 5749 1 15 . 1 1 51 51 LEU C C 51 177.441 177.441 178.526 -1.085 25158 5750 1 15 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.754 0.383 25158 5751 1 15 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.821 0.027 25158 5752 1 15 . 1 1 51 51 LEU H H 51 7.134 7.134 7.654 -0.520 25158 5753 1 15 . 1 1 52 52 GLY N N 52 105.596 105.596 106.481 -0.885 25158 5754 1 15 . 1 1 52 52 GLY C C 52 176.764 176.764 175.989 0.775 25158 5755 1 15 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.824 0.818 25158 5756 1 15 . 1 1 52 52 GLY H H 52 8.034 8.034 7.723 0.311 25158 5757 1 15 . 1 1 53 53 ILE N N 53 122.043 122.043 122.788 -0.745 25158 5758 1 15 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.647 -0.198 25158 5759 1 15 . 1 1 53 53 ILE C C 53 177.112 177.112 177.639 -0.527 25158 5760 1 15 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.440 0.948 25158 5761 1 15 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.916 0.342 25158 5762 1 15 . 1 1 53 53 ILE H H 53 7.611 7.611 7.558 0.054 25158 5763 1 15 . 1 1 54 54 LEU N N 54 120.787 120.787 120.997 -0.210 25158 5764 1 15 . 1 1 54 54 LEU HA H 54 3.941 3.941 4.031 -0.090 25158 5765 1 15 . 1 1 54 54 LEU C C 54 175.340 175.340 178.287 -2.947 25158 5766 1 15 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.991 -0.796 25158 5767 1 15 . 1 1 54 54 LEU CB C 54 41.221 41.221 42.009 -0.788 25158 5768 1 15 . 1 1 54 54 LEU H H 54 8.323 8.323 8.206 0.117 25158 5769 1 15 . 1 1 55 55 LYS N N 55 116.833 116.833 119.082 -2.249 25158 5770 1 15 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.949 -0.065 25158 5771 1 15 . 1 1 55 55 LYS C C 55 179.067 179.067 179.324 -0.257 25158 5772 1 15 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.855 0.796 25158 5773 1 15 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.330 -0.321 25158 5774 1 15 . 1 1 55 55 LYS H H 55 8.356 8.356 7.587 0.769 25158 5775 1 15 . 1 1 56 56 ARG N N 56 117.092 117.092 118.335 -1.243 25158 5776 1 15 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.040 -0.124 25158 5777 1 15 . 1 1 56 56 ARG C C 56 178.223 178.223 178.334 -0.111 25158 5778 1 15 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.238 1.113 25158 5779 1 15 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.241 0.539 25158 5780 1 15 . 1 1 56 56 ARG H H 56 7.543 7.543 7.912 -0.369 25158 5781 1 15 . 1 1 57 57 TYR N N 57 122.187 122.187 121.914 0.273 25158 5782 1 15 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.593 -0.201 25158 5783 1 15 . 1 1 57 57 TYR C C 57 180.009 180.009 178.503 1.506 25158 5784 1 15 . 1 1 57 57 TYR CA C 57 61.579 61.579 60.963 0.616 25158 5785 1 15 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.632 0.204 25158 5786 1 15 . 1 1 57 57 TYR H H 57 8.592 8.592 7.728 0.864 25158 5787 1 15 . 1 1 58 58 ILE N N 58 122.825 122.825 116.772 6.053 25158 5788 1 15 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.874 -0.194 25158 5789 1 15 . 1 1 58 58 ILE C C 58 178.186 178.186 176.141 2.045 25158 5790 1 15 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.201 1.567 25158 5791 1 15 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.081 -0.361 25158 5792 1 15 . 1 1 58 58 ILE H H 58 8.779 8.779 7.906 0.873 25158 5793 1 15 . 1 1 59 59 LEU N N 59 118.552 118.552 119.569 -1.017 25158 5794 1 15 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.374 -0.151 25158 5795 1 15 . 1 1 59 59 LEU C C 59 175.937 175.937 176.086 -0.149 25158 5796 1 15 . 1 1 59 59 LEU CA C 59 55.512 55.512 53.966 1.546 25158 5797 1 15 . 1 1 59 59 LEU CB C 59 42.426 42.426 40.922 1.504 25158 5798 1 15 . 1 1 59 59 LEU H H 59 7.539 7.539 7.528 0.011 25158 5799 1 15 . 1 1 60 60 LYS N N 60 113.650 113.650 115.541 -1.891 25158 5800 1 15 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.858 0.137 25158 5801 1 15 . 1 1 60 60 LYS C C 60 176.535 176.535 176.448 0.087 25158 5802 1 15 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.552 -0.261 25158 5803 1 15 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.342 -1.071 25158 5804 1 15 . 1 1 60 60 LYS H H 60 7.815 7.815 7.524 0.291 25158 5805 1 15 . 1 1 61 61 GLU N N 61 117.535 117.535 116.193 1.342 25158 5806 1 15 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.310 -0.166 25158 5807 1 15 . 1 1 61 61 GLU C C 61 176.992 176.992 176.578 0.414 25158 5808 1 15 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.643 0.046 25158 5809 1 15 . 1 1 61 61 GLU CB C 61 30.692 30.692 30.949 -0.257 25158 5810 1 15 . 1 1 61 61 GLU H H 61 8.438 8.438 8.342 0.096 25158 5811 1 15 . 1 1 62 62 ILE N N 62 112.102 112.102 114.447 -2.345 25158 5812 1 15 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.502 -0.119 25158 5813 1 15 . 1 1 62 62 ILE C C 62 175.425 175.425 174.115 1.310 25158 5814 1 15 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.316 -0.390 25158 5815 1 15 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.788 0.960 25158 5816 1 15 . 1 1 62 62 ILE H H 62 6.867 6.867 7.453 -0.586 25158 5817 1 15 . 1 1 63 63 ASP N N 63 119.719 119.719 123.540 -3.821 25158 5818 1 15 . 1 1 63 63 ASP HA H 63 4.674 4.674 5.032 -0.358 25158 5819 1 15 . 1 1 63 63 ASP C C 63 176.202 176.202 175.810 0.392 25158 5820 1 15 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.887 0.931 25158 5821 1 15 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.034 0.183 25158 5822 1 15 . 1 1 63 63 ASP H H 63 8.561 8.561 8.807 -0.246 25158 5823 1 15 . 1 1 64 64 THR N N 64 113.289 113.289 116.624 -3.335 25158 5824 1 15 . 1 1 64 64 THR HA H 64 4.712 4.712 4.501 0.211 25158 5825 1 15 . 1 1 64 64 THR C C 64 170.854 170.854 173.102 -2.248 25158 5826 1 15 . 1 1 64 64 THR CA C 64 61.269 61.269 62.125 -0.856 25158 5827 1 15 . 1 1 64 64 THR CB C 64 71.993 71.993 68.872 3.121 25158 5828 1 15 . 1 1 64 64 THR H H 64 7.410 7.410 7.758 -0.348 25158 5829 1 15 . 1 1 65 65 LEU N N 65 121.012 121.012 126.522 -5.510 25158 5830 1 15 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.767 -0.538 25158 5831 1 15 . 1 1 65 65 LEU C C 65 174.763 174.763 174.982 -0.219 25158 5832 1 15 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.190 -0.555 25158 5833 1 15 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.694 0.827 25158 5834 1 15 . 1 1 65 65 LEU H H 65 7.877 7.877 8.426 -0.549 25158 5835 1 15 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.099 -0.107 25158 5836 1 15 . 1 1 66 66 PRO C C 66 174.419 174.419 174.986 -0.567 25158 5837 1 15 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.282 0.028 25158 5838 1 15 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.129 3.097 25158 5839 1 15 . 1 1 67 67 TYR N N 67 122.616 122.616 123.388 -0.772 25158 5840 1 15 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.362 0.294 25158 5841 1 15 . 1 1 67 67 TYR C C 67 174.446 174.446 175.580 -1.134 25158 5842 1 15 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.145 -0.133 25158 5843 1 15 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.877 1.204 25158 5844 1 15 . 1 1 67 67 TYR H H 67 8.662 8.662 8.136 0.526 25158 5845 1 15 . 1 1 68 68 LYS N N 68 126.223 126.223 125.509 0.714 25158 5846 1 15 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.101 0.167 25158 5847 1 15 . 1 1 68 68 LYS C C 68 174.748 174.748 174.516 0.232 25158 5848 1 15 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.311 0.292 25158 5849 1 15 . 1 1 68 68 LYS CB C 68 32.770 32.770 30.678 2.092 25158 5850 1 15 . 1 1 68 68 LYS H H 68 8.112 8.112 8.018 0.094 25158 5851 1 16 . 1 1 2 2 THR N N 2 116.700 116.700 115.698 1.002 25158 5852 1 16 . 1 1 2 2 THR HA H 2 4.313 4.313 4.456 -0.143 25158 5853 1 16 . 1 1 2 2 THR C C 2 173.968 173.968 174.078 -0.110 25158 5854 1 16 . 1 1 2 2 THR CA C 2 62.326 62.326 61.392 0.934 25158 5855 1 16 . 1 1 2 2 THR CB C 2 70.154 70.154 70.730 -0.576 25158 5856 1 16 . 1 1 2 2 THR H H 2 8.657 8.657 8.419 0.238 25158 5857 1 16 . 1 1 3 3 LYS N N 3 125.500 125.500 126.905 -1.405 25158 5858 1 16 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.162 -0.097 25158 5859 1 16 . 1 1 3 3 LYS C C 3 174.926 174.926 175.502 -0.576 25158 5860 1 16 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.774 0.065 25158 5861 1 16 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.259 1.518 25158 5862 1 16 . 1 1 3 3 LYS H H 3 8.318 8.318 8.433 -0.115 25158 5863 1 16 . 1 1 4 4 LEU N N 4 127.473 127.473 124.939 2.534 25158 5864 1 16 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.367 0.116 25158 5865 1 16 . 1 1 4 4 LEU C C 4 174.734 174.734 175.029 -0.295 25158 5866 1 16 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.536 -0.277 25158 5867 1 16 . 1 1 4 4 LEU CB C 4 40.929 40.929 46.181 -5.252 25158 5868 1 16 . 1 1 4 4 LEU H H 4 7.726 7.726 7.762 -0.036 25158 5869 1 16 . 1 1 5 5 TYR N N 5 123.074 123.074 120.681 2.393 25158 5870 1 16 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.398 -0.775 25158 5871 1 16 . 1 1 5 5 TYR C C 5 175.406 175.406 177.121 -1.715 25158 5872 1 16 . 1 1 5 5 TYR CA C 5 61.812 61.812 59.064 2.748 25158 5873 1 16 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.648 1.462 25158 5874 1 16 . 1 1 5 5 TYR H H 5 7.816 7.816 8.196 -0.380 25158 5875 1 16 . 1 1 6 6 GLY N N 6 108.614 108.614 115.054 -6.440 25158 5876 1 16 . 1 1 6 6 GLY C C 6 172.585 172.585 173.858 -1.273 25158 5877 1 16 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.832 0.555 25158 5878 1 16 . 1 1 6 6 GLY H H 6 8.915 8.915 9.032 -0.117 25158 5879 1 16 . 1 1 7 7 ASP N N 7 118.023 118.023 123.278 -5.255 25158 5880 1 16 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.636 0.348 25158 5881 1 16 . 1 1 7 7 ASP C C 7 177.806 177.806 177.665 0.141 25158 5882 1 16 . 1 1 7 7 ASP CA C 7 52.192 52.192 54.045 -1.853 25158 5883 1 16 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.781 -0.631 25158 5884 1 16 . 1 1 7 7 ASP H H 7 7.976 7.976 7.655 0.321 25158 5885 1 16 . 1 1 8 8 VAL N N 8 120.293 120.293 119.779 0.514 25158 5886 1 16 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.220 -0.237 25158 5887 1 16 . 1 1 8 8 VAL C C 8 175.717 175.717 176.879 -1.162 25158 5888 1 16 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.560 -0.114 25158 5889 1 16 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.978 -0.707 25158 5890 1 16 . 1 1 8 8 VAL H H 8 8.156 8.156 8.440 -0.284 25158 5891 1 16 . 1 1 9 9 ASN N N 9 115.226 115.226 116.127 -0.901 25158 5892 1 16 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.629 0.360 25158 5893 1 16 . 1 1 9 9 ASN C C 9 174.626 174.626 175.044 -0.418 25158 5894 1 16 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.679 -1.730 25158 5895 1 16 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.462 -0.762 25158 5896 1 16 . 1 1 9 9 ASN H H 9 8.008 8.008 8.160 -0.152 25158 5897 1 16 . 1 1 10 10 ASP N N 10 115.600 115.600 117.135 -1.535 25158 5898 1 16 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.585 -0.149 25158 5899 1 16 . 1 1 10 10 ASP C C 10 175.125 175.125 175.289 -0.164 25158 5900 1 16 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.322 0.913 25158 5901 1 16 . 1 1 10 10 ASP CB C 10 40.200 40.200 38.681 1.519 25158 5902 1 16 . 1 1 10 10 ASP H H 10 7.374 7.374 8.158 -0.784 25158 5903 1 16 . 1 1 11 11 ASP N N 11 118.402 118.402 115.714 2.688 25158 5904 1 16 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.661 0.156 25158 5905 1 16 . 1 1 11 11 ASP C C 11 178.299 178.299 177.183 1.116 25158 5906 1 16 . 1 1 11 11 ASP CA C 11 52.821 52.821 52.948 -0.127 25158 5907 1 16 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.566 -0.452 25158 5908 1 16 . 1 1 11 11 ASP H H 11 8.801 8.801 9.026 -0.225 25158 5909 1 16 . 1 1 12 12 GLY N N 12 112.353 112.353 108.430 3.923 25158 5910 1 16 . 1 1 12 12 GLY C C 12 173.284 173.284 173.828 -0.544 25158 5911 1 16 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.230 0.394 25158 5912 1 16 . 1 1 12 12 GLY H H 12 10.293 10.293 8.413 1.880 25158 5913 1 16 . 1 1 13 13 LYS N N 13 118.118 118.118 121.077 -2.959 25158 5914 1 16 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.684 -0.025 25158 5915 1 16 . 1 1 13 13 LYS C C 13 175.595 175.595 175.067 0.528 25158 5916 1 16 . 1 1 13 13 LYS CA C 13 53.758 53.758 54.712 -0.954 25158 5917 1 16 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.521 0.818 25158 5918 1 16 . 1 1 13 13 LYS H H 13 7.848 7.848 8.667 -0.819 25158 5919 1 16 . 1 1 14 14 VAL N N 14 126.591 126.591 125.976 0.615 25158 5920 1 16 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.353 0.402 25158 5921 1 16 . 1 1 14 14 VAL C C 14 175.052 175.052 175.504 -0.452 25158 5922 1 16 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.210 -0.140 25158 5923 1 16 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.169 0.286 25158 5924 1 16 . 1 1 14 14 VAL H H 14 9.109 9.109 8.534 0.575 25158 5925 1 16 . 1 1 15 15 ASN N N 15 126.287 126.287 126.028 0.259 25158 5926 1 16 . 1 1 15 15 ASN HA H 15 4.815 4.815 5.108 -0.293 25158 5927 1 16 . 1 1 15 15 ASN C C 15 176.340 176.340 176.191 0.149 25158 5928 1 16 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.944 0.331 25158 5929 1 16 . 1 1 15 15 ASN CB C 15 39.220 39.220 40.348 -1.128 25158 5930 1 16 . 1 1 15 15 ASN H H 15 10.071 10.071 8.597 1.474 25158 5931 1 16 . 1 1 16 16 SER N N 16 113.168 113.168 115.596 -2.428 25158 5932 1 16 . 1 1 16 16 SER HA H 16 4.047 4.047 4.314 -0.267 25158 5933 1 16 . 1 1 16 16 SER C C 16 176.197 176.197 175.920 0.277 25158 5934 1 16 . 1 1 16 16 SER CA C 16 62.681 62.681 61.447 1.234 25158 5935 1 16 . 1 1 16 16 SER CB C 16 62.681 62.681 63.023 -0.342 25158 5936 1 16 . 1 1 16 16 SER H H 16 8.825 8.825 8.743 0.082 25158 5937 1 16 . 1 1 17 17 THR N N 17 119.391 119.391 117.453 1.938 25158 5938 1 16 . 1 1 17 17 THR HA H 17 3.983 3.983 4.032 -0.049 25158 5939 1 16 . 1 1 17 17 THR C C 17 177.149 177.149 176.489 0.660 25158 5940 1 16 . 1 1 17 17 THR CA C 17 66.791 66.791 66.470 0.321 25158 5941 1 16 . 1 1 17 17 THR CB C 17 67.757 67.757 68.325 -0.568 25158 5942 1 16 . 1 1 17 17 THR H H 17 7.946 7.946 8.307 -0.361 25158 5943 1 16 . 1 1 18 18 ASP N N 18 120.318 120.318 121.032 -0.714 25158 5944 1 16 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.506 -0.136 25158 5945 1 16 . 1 1 18 18 ASP C C 18 177.168 177.168 177.569 -0.401 25158 5946 1 16 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.297 1.617 25158 5947 1 16 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.788 1.374 25158 5948 1 16 . 1 1 18 18 ASP H H 18 7.995 7.995 7.664 0.331 25158 5949 1 16 . 1 1 19 19 ALA N N 19 120.191 120.191 123.311 -3.120 25158 5950 1 16 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.182 -0.134 25158 5951 1 16 . 1 1 19 19 ALA C C 19 179.549 179.549 179.403 0.146 25158 5952 1 16 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.058 0.355 25158 5953 1 16 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.429 -1.116 25158 5954 1 16 . 1 1 19 19 ALA H H 19 7.085 7.085 7.483 -0.398 25158 5955 1 16 . 1 1 20 20 VAL N N 20 120.613 120.613 118.408 2.205 25158 5956 1 16 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.661 -0.050 25158 5957 1 16 . 1 1 20 20 VAL C C 20 178.153 178.153 177.292 0.861 25158 5958 1 16 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.818 0.949 25158 5959 1 16 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.789 0.079 25158 5960 1 16 . 1 1 20 20 VAL H H 20 7.835 7.835 7.579 0.256 25158 5961 1 16 . 1 1 21 21 ALA N N 21 121.767 121.767 122.432 -0.665 25158 5962 1 16 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.137 -0.075 25158 5963 1 16 . 1 1 21 21 ALA C C 21 179.298 179.298 179.352 -0.054 25158 5964 1 16 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.087 0.157 25158 5965 1 16 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.266 -0.477 25158 5966 1 16 . 1 1 21 21 ALA H H 21 7.804 7.804 7.482 0.322 25158 5967 1 16 . 1 1 22 22 LEU N N 22 117.555 117.555 120.124 -2.569 25158 5968 1 16 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.058 0.088 25158 5969 1 16 . 1 1 22 22 LEU C C 22 177.914 177.914 178.297 -0.383 25158 5970 1 16 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.513 0.180 25158 5971 1 16 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.760 -0.245 25158 5972 1 16 . 1 1 22 22 LEU H H 22 8.619 8.619 7.872 0.747 25158 5973 1 16 . 1 1 23 23 LYS N N 23 120.335 120.335 119.618 0.717 25158 5974 1 16 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.916 0.003 25158 5975 1 16 . 1 1 23 23 LYS C C 23 177.731 177.731 178.862 -1.131 25158 5976 1 16 . 1 1 23 23 LYS CA C 23 60.337 60.337 60.044 0.294 25158 5977 1 16 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.194 -0.096 25158 5978 1 16 . 1 1 23 23 LYS H H 23 8.230 8.230 8.161 0.069 25158 5979 1 16 . 1 1 24 24 ARG N N 24 116.831 116.831 117.943 -1.112 25158 5980 1 16 . 1 1 24 24 ARG HA H 24 3.959 3.959 3.993 -0.034 25158 5981 1 16 . 1 1 24 24 ARG C C 24 178.616 178.616 178.425 0.191 25158 5982 1 16 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.504 0.453 25158 5983 1 16 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.140 -0.577 25158 5984 1 16 . 1 1 24 24 ARG H H 24 7.927 7.927 7.614 0.313 25158 5985 1 16 . 1 1 25 25 TYR N N 25 120.960 120.960 121.384 -0.424 25158 5986 1 16 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.244 -0.034 25158 5987 1 16 . 1 1 25 25 TYR C C 25 179.465 179.465 178.531 0.934 25158 5988 1 16 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.669 0.176 25158 5989 1 16 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.659 0.406 25158 5990 1 16 . 1 1 25 25 TYR H H 25 8.321 8.321 7.579 0.742 25158 5991 1 16 . 1 1 26 26 VAL N N 26 120.405 120.405 117.626 2.779 25158 5992 1 16 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.820 -0.046 25158 5993 1 16 . 1 1 26 26 VAL C C 26 177.826 177.826 176.851 0.975 25158 5994 1 16 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.405 0.035 25158 5995 1 16 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.973 -0.416 25158 5996 1 16 . 1 1 26 26 VAL H H 26 8.803 8.803 8.526 0.277 25158 5997 1 16 . 1 1 27 27 LEU N N 27 119.247 119.247 117.677 1.570 25158 5998 1 16 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.329 -0.053 25158 5999 1 16 . 1 1 27 27 LEU C C 27 176.753 176.753 176.125 0.628 25158 6000 1 16 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.337 1.339 25158 6001 1 16 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.070 -0.477 25158 6002 1 16 . 1 1 27 27 LEU H H 27 7.898 7.898 7.934 -0.036 25158 6003 1 16 . 1 1 28 28 ARG N N 28 116.082 116.082 118.082 -2.000 25158 6004 1 16 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.824 0.290 25158 6005 1 16 . 1 1 28 28 ARG C C 28 176.521 176.521 176.046 0.475 25158 6006 1 16 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.181 -1.027 25158 6007 1 16 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.021 0.450 25158 6008 1 16 . 1 1 28 28 ARG H H 28 7.993 7.993 7.772 0.221 25158 6009 1 16 . 1 1 29 29 SER N N 29 113.579 113.579 115.351 -1.772 25158 6010 1 16 . 1 1 29 29 SER HA H 29 4.305 4.305 4.377 -0.072 25158 6011 1 16 . 1 1 29 29 SER C C 29 175.368 175.368 175.373 -0.005 25158 6012 1 16 . 1 1 29 29 SER CA C 29 59.699 59.699 59.745 -0.046 25158 6013 1 16 . 1 1 29 29 SER CB C 29 63.908 63.908 64.155 -0.247 25158 6014 1 16 . 1 1 29 29 SER H H 29 8.094 8.094 8.659 -0.565 25158 6015 1 16 . 1 1 30 30 GLY N N 30 109.920 109.920 109.350 0.570 25158 6016 1 16 . 1 1 30 30 GLY C C 30 174.115 174.115 173.550 0.565 25158 6017 1 16 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.766 1.005 25158 6018 1 16 . 1 1 30 30 GLY H H 30 8.577 8.577 8.224 0.353 25158 6019 1 16 . 1 1 31 31 ILE N N 31 119.084 119.084 119.871 -0.787 25158 6020 1 16 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.398 -0.040 25158 6021 1 16 . 1 1 31 31 ILE C C 31 174.392 174.392 175.020 -0.628 25158 6022 1 16 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.095 0.151 25158 6023 1 16 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.889 -0.311 25158 6024 1 16 . 1 1 31 31 ILE H H 31 7.387 7.387 7.741 -0.354 25158 6025 1 16 . 1 1 32 32 SER N N 32 120.582 120.582 122.863 -2.281 25158 6026 1 16 . 1 1 32 32 SER HA H 32 4.845 4.845 4.859 -0.014 25158 6027 1 16 . 1 1 32 32 SER C C 32 173.891 173.891 174.205 -0.314 25158 6028 1 16 . 1 1 32 32 SER CA C 32 57.603 57.603 57.561 0.042 25158 6029 1 16 . 1 1 32 32 SER CB C 32 63.849 63.849 63.040 0.809 25158 6030 1 16 . 1 1 32 32 SER H H 32 8.339 8.339 8.533 -0.194 25158 6031 1 16 . 1 1 33 33 ILE N N 33 116.629 116.629 120.871 -4.242 25158 6032 1 16 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.557 0.076 25158 6033 1 16 . 1 1 33 33 ILE C C 33 174.195 174.195 173.937 0.258 25158 6034 1 16 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.046 0.066 25158 6035 1 16 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.319 2.263 25158 6036 1 16 . 1 1 33 33 ILE H H 33 7.873 7.873 8.014 -0.141 25158 6037 1 16 . 1 1 34 34 ASN N N 34 118.342 118.342 119.986 -1.644 25158 6038 1 16 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.817 -0.081 25158 6039 1 16 . 1 1 34 34 ASN C C 34 176.217 176.217 175.886 0.331 25158 6040 1 16 . 1 1 34 34 ASN CA C 34 52.186 52.186 51.953 0.234 25158 6041 1 16 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.550 -2.051 25158 6042 1 16 . 1 1 34 34 ASN H H 34 8.839 8.839 8.268 0.571 25158 6043 1 16 . 1 1 35 35 THR N N 35 116.120 116.120 119.239 -3.119 25158 6044 1 16 . 1 1 35 35 THR HA H 35 3.559 3.559 3.888 -0.329 25158 6045 1 16 . 1 1 35 35 THR C C 35 177.347 177.347 176.387 0.960 25158 6046 1 16 . 1 1 35 35 THR CA C 35 64.686 64.686 65.209 -0.523 25158 6047 1 16 . 1 1 35 35 THR CB C 35 67.758 67.758 68.459 -0.701 25158 6048 1 16 . 1 1 35 35 THR H H 35 7.939 7.939 8.298 -0.359 25158 6049 1 16 . 1 1 36 36 ASP N N 36 123.528 123.528 122.112 1.416 25158 6050 1 16 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.352 0.068 25158 6051 1 16 . 1 1 36 36 ASP C C 36 177.752 177.752 178.221 -0.469 25158 6052 1 16 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.245 -0.171 25158 6053 1 16 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.660 -0.762 25158 6054 1 16 . 1 1 36 36 ASP H H 36 7.980 7.980 8.079 -0.099 25158 6055 1 16 . 1 1 37 37 ASN N N 37 115.690 115.690 117.965 -2.275 25158 6056 1 16 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.537 -0.271 25158 6057 1 16 . 1 1 37 37 ASN C C 37 175.589 175.589 177.431 -1.842 25158 6058 1 16 . 1 1 37 37 ASN CA C 37 52.560 52.560 55.030 -2.470 25158 6059 1 16 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.264 -0.301 25158 6060 1 16 . 1 1 37 37 ASN H H 37 7.251 7.251 8.339 -1.088 25158 6061 1 16 . 1 1 38 38 ALA N N 38 119.560 119.560 122.622 -3.062 25158 6062 1 16 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.006 0.074 25158 6063 1 16 . 1 1 38 38 ALA C C 38 173.638 173.638 177.343 -3.705 25158 6064 1 16 . 1 1 38 38 ALA CA C 38 52.220 52.220 53.970 -1.750 25158 6065 1 16 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.642 4.229 25158 6066 1 16 . 1 1 38 38 ALA H H 38 7.142 7.142 7.844 -0.702 25158 6067 1 16 . 1 1 39 39 ASP N N 39 115.003 115.003 119.436 -4.433 25158 6068 1 16 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.704 0.236 25158 6069 1 16 . 1 1 39 39 ASP C C 39 177.163 177.163 177.034 0.129 25158 6070 1 16 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.891 -2.720 25158 6071 1 16 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.983 -1.037 25158 6072 1 16 . 1 1 39 39 ASP H H 39 7.096 7.096 7.775 -0.679 25158 6073 1 16 . 1 1 40 40 LEU N N 40 123.245 123.245 124.215 -0.970 25158 6074 1 16 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.340 -0.269 25158 6075 1 16 . 1 1 40 40 LEU C C 40 175.865 175.865 177.339 -1.474 25158 6076 1 16 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.742 0.850 25158 6077 1 16 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.150 -0.221 25158 6078 1 16 . 1 1 40 40 LEU H H 40 8.572 8.572 7.998 0.574 25158 6079 1 16 . 1 1 41 41 ASN N N 41 112.723 112.723 113.696 -0.973 25158 6080 1 16 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.915 0.084 25158 6081 1 16 . 1 1 41 41 ASN C C 41 173.846 173.846 175.390 -1.544 25158 6082 1 16 . 1 1 41 41 ASN CA C 41 51.233 51.233 51.739 -0.506 25158 6083 1 16 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.364 -1.969 25158 6084 1 16 . 1 1 41 41 ASN H H 41 8.004 8.004 7.863 0.141 25158 6085 1 16 . 1 1 42 42 GLU N N 42 115.798 115.798 115.587 0.211 25158 6086 1 16 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.263 -0.311 25158 6087 1 16 . 1 1 42 42 GLU C C 42 175.172 175.172 175.404 -0.232 25158 6088 1 16 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.799 -0.448 25158 6089 1 16 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.689 0.532 25158 6090 1 16 . 1 1 42 42 GLU H H 42 7.642 7.642 8.547 -0.905 25158 6091 1 16 . 1 1 43 43 ASP N N 43 117.453 117.453 116.298 1.155 25158 6092 1 16 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.513 0.326 25158 6093 1 16 . 1 1 43 43 ASP C C 43 178.129 178.129 177.573 0.556 25158 6094 1 16 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.376 -1.738 25158 6095 1 16 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.296 -0.082 25158 6096 1 16 . 1 1 43 43 ASP H H 43 8.473 8.473 8.543 -0.070 25158 6097 1 16 . 1 1 44 44 GLY N N 44 112.490 112.490 107.614 4.876 25158 6098 1 16 . 1 1 44 44 GLY C C 44 173.717 173.717 173.882 -0.165 25158 6099 1 16 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.975 0.342 25158 6100 1 16 . 1 1 44 44 GLY H H 44 10.139 10.139 8.534 1.605 25158 6101 1 16 . 1 1 45 45 ARG N N 45 118.154 118.154 118.392 -0.238 25158 6102 1 16 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.734 0.054 25158 6103 1 16 . 1 1 45 45 ARG C C 45 175.602 175.602 173.981 1.621 25158 6104 1 16 . 1 1 45 45 ARG CA C 45 53.832 53.832 53.877 -0.045 25158 6105 1 16 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.360 1.304 25158 6106 1 16 . 1 1 45 45 ARG H H 45 7.994 7.994 8.642 -0.648 25158 6107 1 16 . 1 1 46 46 VAL N N 46 126.392 126.392 123.562 2.830 25158 6108 1 16 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.562 0.228 25158 6109 1 16 . 1 1 46 46 VAL C C 46 174.644 174.644 175.461 -0.817 25158 6110 1 16 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.984 -0.255 25158 6111 1 16 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.110 1.556 25158 6112 1 16 . 1 1 46 46 VAL H H 46 9.115 9.115 8.539 0.576 25158 6113 1 16 . 1 1 47 47 ASN N N 47 126.737 126.737 124.006 2.731 25158 6114 1 16 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.977 -0.102 25158 6115 1 16 . 1 1 47 47 ASN C C 47 176.467 176.467 176.387 0.080 25158 6116 1 16 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.496 0.544 25158 6117 1 16 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.971 -0.784 25158 6118 1 16 . 1 1 47 47 ASN H H 47 10.077 10.077 7.869 2.208 25158 6119 1 16 . 1 1 48 48 SER N N 48 113.409 113.409 116.018 -2.609 25158 6120 1 16 . 1 1 48 48 SER HA H 48 4.086 4.086 4.184 -0.098 25158 6121 1 16 . 1 1 48 48 SER C C 48 176.671 176.671 175.969 0.702 25158 6122 1 16 . 1 1 48 48 SER CA C 48 62.375 62.375 62.617 -0.242 25158 6123 1 16 . 1 1 48 48 SER CB C 48 62.375 62.375 62.794 -0.419 25158 6124 1 16 . 1 1 48 48 SER H H 48 8.936 8.936 8.771 0.165 25158 6125 1 16 . 1 1 49 49 THR N N 49 121.885 121.885 118.716 3.169 25158 6126 1 16 . 1 1 49 49 THR HA H 49 4.112 4.112 3.912 0.200 25158 6127 1 16 . 1 1 49 49 THR C C 49 177.320 177.320 176.496 0.824 25158 6128 1 16 . 1 1 49 49 THR CA C 49 66.713 66.713 66.641 0.071 25158 6129 1 16 . 1 1 49 49 THR CB C 49 67.787 67.787 68.446 -0.659 25158 6130 1 16 . 1 1 49 49 THR H H 49 8.124 8.124 8.150 -0.026 25158 6131 1 16 . 1 1 50 50 ASP N N 50 120.401 120.401 122.074 -1.673 25158 6132 1 16 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.379 -0.009 25158 6133 1 16 . 1 1 50 50 ASP C C 50 177.033 177.033 178.228 -1.195 25158 6134 1 16 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.247 1.573 25158 6135 1 16 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.145 1.563 25158 6136 1 16 . 1 1 50 50 ASP H H 50 7.560 7.560 7.899 -0.339 25158 6137 1 16 . 1 1 51 51 LEU N N 51 118.174 118.174 120.586 -2.412 25158 6138 1 16 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.062 0.126 25158 6139 1 16 . 1 1 51 51 LEU C C 51 177.441 177.441 178.597 -1.156 25158 6140 1 16 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.962 0.175 25158 6141 1 16 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.719 0.128 25158 6142 1 16 . 1 1 51 51 LEU H H 51 7.134 7.134 7.590 -0.456 25158 6143 1 16 . 1 1 52 52 GLY N N 52 105.596 105.596 106.559 -0.963 25158 6144 1 16 . 1 1 52 52 GLY C C 52 176.764 176.764 175.959 0.805 25158 6145 1 16 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.008 0.634 25158 6146 1 16 . 1 1 52 52 GLY H H 52 8.034 8.034 7.805 0.229 25158 6147 1 16 . 1 1 53 53 ILE N N 53 122.043 122.043 122.680 -0.637 25158 6148 1 16 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.725 -0.276 25158 6149 1 16 . 1 1 53 53 ILE C C 53 177.112 177.112 177.574 -0.462 25158 6150 1 16 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.466 0.922 25158 6151 1 16 . 1 1 53 53 ILE CB C 53 38.258 38.258 38.013 0.245 25158 6152 1 16 . 1 1 53 53 ILE H H 53 7.611 7.611 7.753 -0.142 25158 6153 1 16 . 1 1 54 54 LEU N N 54 120.787 120.787 120.968 -0.181 25158 6154 1 16 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.971 -0.030 25158 6155 1 16 . 1 1 54 54 LEU C C 54 175.340 175.340 178.338 -2.998 25158 6156 1 16 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.597 -0.402 25158 6157 1 16 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.831 -0.610 25158 6158 1 16 . 1 1 54 54 LEU H H 54 8.323 8.323 8.434 -0.111 25158 6159 1 16 . 1 1 55 55 LYS N N 55 116.833 116.833 119.320 -2.487 25158 6160 1 16 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.938 -0.054 25158 6161 1 16 . 1 1 55 55 LYS C C 55 179.067 179.067 179.154 -0.087 25158 6162 1 16 . 1 1 55 55 LYS CA C 55 60.651 60.651 60.110 0.541 25158 6163 1 16 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.174 -0.165 25158 6164 1 16 . 1 1 55 55 LYS H H 55 8.356 8.356 7.621 0.735 25158 6165 1 16 . 1 1 56 56 ARG N N 56 117.092 117.092 118.901 -1.809 25158 6166 1 16 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.020 -0.104 25158 6167 1 16 . 1 1 56 56 ARG C C 56 178.223 178.223 178.577 -0.354 25158 6168 1 16 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.386 0.965 25158 6169 1 16 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.126 0.654 25158 6170 1 16 . 1 1 56 56 ARG H H 56 7.543 7.543 7.617 -0.074 25158 6171 1 16 . 1 1 57 57 TYR N N 57 122.187 122.187 121.263 0.924 25158 6172 1 16 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.342 0.050 25158 6173 1 16 . 1 1 57 57 TYR C C 57 180.009 180.009 178.748 1.261 25158 6174 1 16 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.232 0.347 25158 6175 1 16 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.510 0.326 25158 6176 1 16 . 1 1 57 57 TYR H H 57 8.592 8.592 7.659 0.933 25158 6177 1 16 . 1 1 58 58 ILE N N 58 122.825 122.825 118.558 4.267 25158 6178 1 16 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.769 -0.089 25158 6179 1 16 . 1 1 58 58 ILE C C 58 178.186 178.186 177.372 0.814 25158 6180 1 16 . 1 1 58 58 ILE CA C 58 64.768 64.768 64.438 0.330 25158 6181 1 16 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.204 -0.484 25158 6182 1 16 . 1 1 58 58 ILE H H 58 8.779 8.779 7.980 0.799 25158 6183 1 16 . 1 1 59 59 LEU N N 59 118.552 118.552 119.852 -1.300 25158 6184 1 16 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.194 0.029 25158 6185 1 16 . 1 1 59 59 LEU C C 59 175.937 175.937 176.756 -0.819 25158 6186 1 16 . 1 1 59 59 LEU CA C 59 55.512 55.512 55.199 0.313 25158 6187 1 16 . 1 1 59 59 LEU CB C 59 42.426 42.426 42.611 -0.185 25158 6188 1 16 . 1 1 59 59 LEU H H 59 7.539 7.539 7.805 -0.266 25158 6189 1 16 . 1 1 60 60 LYS N N 60 113.650 113.650 118.341 -4.691 25158 6190 1 16 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.824 0.171 25158 6191 1 16 . 1 1 60 60 LYS C C 60 176.535 176.535 175.858 0.677 25158 6192 1 16 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.472 -0.181 25158 6193 1 16 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.002 -1.731 25158 6194 1 16 . 1 1 60 60 LYS H H 60 7.815 7.815 7.422 0.393 25158 6195 1 16 . 1 1 61 61 GLU N N 61 117.535 117.535 116.011 1.524 25158 6196 1 16 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.418 -0.274 25158 6197 1 16 . 1 1 61 61 GLU C C 61 176.992 176.992 176.892 0.100 25158 6198 1 16 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.413 0.276 25158 6199 1 16 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.193 -0.501 25158 6200 1 16 . 1 1 61 61 GLU H H 61 8.438 8.438 8.288 0.150 25158 6201 1 16 . 1 1 62 62 ILE N N 62 112.102 112.102 117.441 -5.339 25158 6202 1 16 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.475 -0.092 25158 6203 1 16 . 1 1 62 62 ILE C C 62 175.425 175.425 174.971 0.454 25158 6204 1 16 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.393 -0.467 25158 6205 1 16 . 1 1 62 62 ILE CB C 62 41.748 41.748 39.624 2.124 25158 6206 1 16 . 1 1 62 62 ILE H H 62 6.867 6.867 7.308 -0.441 25158 6207 1 16 . 1 1 63 63 ASP N N 63 119.719 119.719 124.519 -4.800 25158 6208 1 16 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.816 -0.142 25158 6209 1 16 . 1 1 63 63 ASP C C 63 176.202 176.202 176.098 0.104 25158 6210 1 16 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.874 -0.056 25158 6211 1 16 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.185 0.032 25158 6212 1 16 . 1 1 63 63 ASP H H 63 8.561 8.561 8.806 -0.245 25158 6213 1 16 . 1 1 64 64 THR N N 64 113.289 113.289 117.314 -4.025 25158 6214 1 16 . 1 1 64 64 THR HA H 64 4.712 4.712 4.403 0.309 25158 6215 1 16 . 1 1 64 64 THR C C 64 170.854 170.854 173.395 -2.541 25158 6216 1 16 . 1 1 64 64 THR CA C 64 61.269 61.269 63.283 -2.014 25158 6217 1 16 . 1 1 64 64 THR CB C 64 71.993 71.993 68.906 3.087 25158 6218 1 16 . 1 1 64 64 THR H H 64 7.410 7.410 8.111 -0.701 25158 6219 1 16 . 1 1 65 65 LEU N N 65 121.012 121.012 127.437 -6.425 25158 6220 1 16 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.697 -0.468 25158 6221 1 16 . 1 1 65 65 LEU C C 65 174.763 174.763 174.795 -0.032 25158 6222 1 16 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.189 -0.554 25158 6223 1 16 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.857 -0.337 25158 6224 1 16 . 1 1 65 65 LEU H H 65 7.877 7.877 8.304 -0.427 25158 6225 1 16 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.180 -0.188 25158 6226 1 16 . 1 1 66 66 PRO C C 66 174.419 174.419 175.029 -0.610 25158 6227 1 16 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.115 0.195 25158 6228 1 16 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.583 2.643 25158 6229 1 16 . 1 1 67 67 TYR N N 67 122.616 122.616 121.577 1.039 25158 6230 1 16 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.391 0.265 25158 6231 1 16 . 1 1 67 67 TYR C C 67 174.446 174.446 174.613 -0.167 25158 6232 1 16 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.034 -0.023 25158 6233 1 16 . 1 1 67 67 TYR CB C 67 41.081 41.081 38.485 2.596 25158 6234 1 16 . 1 1 67 67 TYR H H 67 8.662 8.662 8.595 0.067 25158 6235 1 16 . 1 1 68 68 LYS N N 68 126.223 126.223 129.385 -3.162 25158 6236 1 16 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.291 -0.023 25158 6237 1 16 . 1 1 68 68 LYS C C 68 174.748 174.748 174.959 -0.211 25158 6238 1 16 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.167 0.436 25158 6239 1 16 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.954 0.816 25158 6240 1 16 . 1 1 68 68 LYS H H 68 8.112 8.112 8.053 0.059 25158 6241 1 17 . 1 1 2 2 THR N N 2 116.700 116.700 114.719 1.981 25158 6242 1 17 . 1 1 2 2 THR HA H 2 4.313 4.313 4.312 0.001 25158 6243 1 17 . 1 1 2 2 THR C C 2 173.968 173.968 174.281 -0.313 25158 6244 1 17 . 1 1 2 2 THR CA C 2 62.326 62.326 60.979 1.347 25158 6245 1 17 . 1 1 2 2 THR CB C 2 70.154 70.154 69.906 0.248 25158 6246 1 17 . 1 1 2 2 THR H H 2 8.657 8.657 8.132 0.525 25158 6247 1 17 . 1 1 3 3 LYS N N 3 125.500 125.500 124.524 0.976 25158 6248 1 17 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.138 -0.073 25158 6249 1 17 . 1 1 3 3 LYS C C 3 174.926 174.926 175.440 -0.514 25158 6250 1 17 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.923 -0.084 25158 6251 1 17 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.763 1.014 25158 6252 1 17 . 1 1 3 3 LYS H H 3 8.318 8.318 8.314 0.004 25158 6253 1 17 . 1 1 4 4 LEU N N 4 127.473 127.473 126.112 1.361 25158 6254 1 17 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.302 0.181 25158 6255 1 17 . 1 1 4 4 LEU C C 4 174.734 174.734 174.908 -0.174 25158 6256 1 17 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.584 -0.325 25158 6257 1 17 . 1 1 4 4 LEU CB C 4 40.929 40.929 46.389 -5.460 25158 6258 1 17 . 1 1 4 4 LEU H H 4 7.726 7.726 7.922 -0.196 25158 6259 1 17 . 1 1 5 5 TYR N N 5 123.074 123.074 120.627 2.447 25158 6260 1 17 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.600 -0.977 25158 6261 1 17 . 1 1 5 5 TYR C C 5 175.406 175.406 176.877 -1.471 25158 6262 1 17 . 1 1 5 5 TYR CA C 5 61.812 61.812 57.683 4.129 25158 6263 1 17 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.168 1.942 25158 6264 1 17 . 1 1 5 5 TYR H H 5 7.816 7.816 8.342 -0.526 25158 6265 1 17 . 1 1 6 6 GLY N N 6 108.614 108.614 113.968 -5.354 25158 6266 1 17 . 1 1 6 6 GLY C C 6 172.585 172.585 173.614 -1.029 25158 6267 1 17 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.846 0.541 25158 6268 1 17 . 1 1 6 6 GLY H H 6 8.915 8.915 8.410 0.505 25158 6269 1 17 . 1 1 7 7 ASP N N 7 118.023 118.023 123.583 -5.560 25158 6270 1 17 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.754 0.230 25158 6271 1 17 . 1 1 7 7 ASP C C 7 177.806 177.806 177.883 -0.077 25158 6272 1 17 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.723 -1.531 25158 6273 1 17 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.554 -0.404 25158 6274 1 17 . 1 1 7 7 ASP H H 7 7.976 7.976 7.951 0.025 25158 6275 1 17 . 1 1 8 8 VAL N N 8 120.293 120.293 119.384 0.909 25158 6276 1 17 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.001 -0.018 25158 6277 1 17 . 1 1 8 8 VAL C C 8 175.717 175.717 176.943 -1.226 25158 6278 1 17 . 1 1 8 8 VAL CA C 8 63.446 63.446 64.307 -0.861 25158 6279 1 17 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.655 -0.384 25158 6280 1 17 . 1 1 8 8 VAL H H 8 8.156 8.156 8.422 -0.266 25158 6281 1 17 . 1 1 9 9 ASN N N 9 115.226 115.226 116.111 -0.885 25158 6282 1 17 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.558 0.431 25158 6283 1 17 . 1 1 9 9 ASN C C 9 174.626 174.626 175.196 -0.570 25158 6284 1 17 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.915 -1.965 25158 6285 1 17 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.238 -0.537 25158 6286 1 17 . 1 1 9 9 ASN H H 9 8.008 8.008 7.981 0.027 25158 6287 1 17 . 1 1 10 10 ASP N N 10 115.600 115.600 118.561 -2.961 25158 6288 1 17 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.570 -0.134 25158 6289 1 17 . 1 1 10 10 ASP C C 10 175.125 175.125 175.430 -0.305 25158 6290 1 17 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.216 1.019 25158 6291 1 17 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.645 0.555 25158 6292 1 17 . 1 1 10 10 ASP H H 10 7.374 7.374 8.106 -0.732 25158 6293 1 17 . 1 1 11 11 ASP N N 11 118.402 118.402 117.965 0.437 25158 6294 1 17 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.708 0.109 25158 6295 1 17 . 1 1 11 11 ASP C C 11 178.299 178.299 177.304 0.995 25158 6296 1 17 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.788 -0.967 25158 6297 1 17 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.740 -0.626 25158 6298 1 17 . 1 1 11 11 ASP H H 11 8.801 8.801 8.818 -0.017 25158 6299 1 17 . 1 1 12 12 GLY N N 12 112.353 112.353 108.160 4.193 25158 6300 1 17 . 1 1 12 12 GLY C C 12 173.284 173.284 173.687 -0.403 25158 6301 1 17 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.078 0.546 25158 6302 1 17 . 1 1 12 12 GLY H H 12 10.293 10.293 8.473 1.820 25158 6303 1 17 . 1 1 13 13 LYS N N 13 118.118 118.118 117.739 0.379 25158 6304 1 17 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.501 0.158 25158 6305 1 17 . 1 1 13 13 LYS C C 13 175.595 175.595 174.745 0.850 25158 6306 1 17 . 1 1 13 13 LYS CA C 13 53.758 53.758 54.688 -0.930 25158 6307 1 17 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.411 0.928 25158 6308 1 17 . 1 1 13 13 LYS H H 13 7.848 7.848 8.819 -0.971 25158 6309 1 17 . 1 1 14 14 VAL N N 14 126.591 126.591 124.138 2.453 25158 6310 1 17 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.261 0.494 25158 6311 1 17 . 1 1 14 14 VAL C C 14 175.052 175.052 175.554 -0.502 25158 6312 1 17 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.270 -0.200 25158 6313 1 17 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.073 0.382 25158 6314 1 17 . 1 1 14 14 VAL H H 14 9.109 9.109 8.638 0.471 25158 6315 1 17 . 1 1 15 15 ASN N N 15 126.287 126.287 126.551 -0.264 25158 6316 1 17 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.937 -0.122 25158 6317 1 17 . 1 1 15 15 ASN C C 15 176.340 176.340 175.732 0.608 25158 6318 1 17 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.578 0.697 25158 6319 1 17 . 1 1 15 15 ASN CB C 15 39.220 39.220 40.098 -0.878 25158 6320 1 17 . 1 1 15 15 ASN H H 15 10.071 10.071 9.411 0.660 25158 6321 1 17 . 1 1 16 16 SER N N 16 113.168 113.168 115.337 -2.169 25158 6322 1 17 . 1 1 16 16 SER HA H 16 4.047 4.047 4.256 -0.209 25158 6323 1 17 . 1 1 16 16 SER C C 16 176.197 176.197 175.700 0.497 25158 6324 1 17 . 1 1 16 16 SER CA C 16 62.681 62.681 61.383 1.298 25158 6325 1 17 . 1 1 16 16 SER CB C 16 62.681 62.681 62.873 -0.192 25158 6326 1 17 . 1 1 16 16 SER H H 16 8.825 8.825 8.775 0.050 25158 6327 1 17 . 1 1 17 17 THR N N 17 119.391 119.391 116.779 2.612 25158 6328 1 17 . 1 1 17 17 THR HA H 17 3.983 3.983 4.066 -0.083 25158 6329 1 17 . 1 1 17 17 THR C C 17 177.149 177.149 176.411 0.738 25158 6330 1 17 . 1 1 17 17 THR CA C 17 66.791 66.791 66.132 0.659 25158 6331 1 17 . 1 1 17 17 THR CB C 17 67.757 67.757 68.056 -0.299 25158 6332 1 17 . 1 1 17 17 THR H H 17 7.946 7.946 8.258 -0.312 25158 6333 1 17 . 1 1 18 18 ASP N N 18 120.318 120.318 121.404 -1.086 25158 6334 1 17 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.326 0.044 25158 6335 1 17 . 1 1 18 18 ASP C C 18 177.168 177.168 177.932 -0.764 25158 6336 1 17 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.749 1.165 25158 6337 1 17 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.602 1.560 25158 6338 1 17 . 1 1 18 18 ASP H H 18 7.995 7.995 7.875 0.120 25158 6339 1 17 . 1 1 19 19 ALA N N 19 120.191 120.191 123.205 -3.014 25158 6340 1 17 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.111 -0.063 25158 6341 1 17 . 1 1 19 19 ALA C C 19 179.549 179.549 179.067 0.482 25158 6342 1 17 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.117 0.296 25158 6343 1 17 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.640 -1.327 25158 6344 1 17 . 1 1 19 19 ALA H H 19 7.085 7.085 7.484 -0.399 25158 6345 1 17 . 1 1 20 20 VAL N N 20 120.613 120.613 119.405 1.208 25158 6346 1 17 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.687 -0.076 25158 6347 1 17 . 1 1 20 20 VAL C C 20 178.153 178.153 177.522 0.631 25158 6348 1 17 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.169 1.598 25158 6349 1 17 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.164 0.704 25158 6350 1 17 . 1 1 20 20 VAL H H 20 7.835 7.835 7.466 0.369 25158 6351 1 17 . 1 1 21 21 ALA N N 21 121.767 121.767 122.760 -0.993 25158 6352 1 17 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.050 0.012 25158 6353 1 17 . 1 1 21 21 ALA C C 21 179.298 179.298 179.623 -0.325 25158 6354 1 17 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.424 -0.180 25158 6355 1 17 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.161 -0.372 25158 6356 1 17 . 1 1 21 21 ALA H H 21 7.804 7.804 8.127 -0.323 25158 6357 1 17 . 1 1 22 22 LEU N N 22 117.555 117.555 119.263 -1.708 25158 6358 1 17 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.061 0.085 25158 6359 1 17 . 1 1 22 22 LEU C C 22 177.914 177.914 178.616 -0.702 25158 6360 1 17 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.421 0.272 25158 6361 1 17 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.636 -0.121 25158 6362 1 17 . 1 1 22 22 LEU H H 22 8.619 8.619 7.605 1.014 25158 6363 1 17 . 1 1 23 23 LYS N N 23 120.335 120.335 119.637 0.698 25158 6364 1 17 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.975 -0.056 25158 6365 1 17 . 1 1 23 23 LYS C C 23 177.731 177.731 179.161 -1.430 25158 6366 1 17 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.924 0.413 25158 6367 1 17 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.255 -0.158 25158 6368 1 17 . 1 1 23 23 LYS H H 23 8.230 8.230 8.011 0.219 25158 6369 1 17 . 1 1 24 24 ARG N N 24 116.831 116.831 118.190 -1.359 25158 6370 1 17 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.071 -0.112 25158 6371 1 17 . 1 1 24 24 ARG C C 24 178.616 178.616 179.341 -0.725 25158 6372 1 17 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.351 0.606 25158 6373 1 17 . 1 1 24 24 ARG CB C 24 29.563 29.563 29.971 -0.408 25158 6374 1 17 . 1 1 24 24 ARG H H 24 7.927 7.927 8.143 -0.216 25158 6375 1 17 . 1 1 25 25 TYR N N 25 120.960 120.960 121.916 -0.956 25158 6376 1 17 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.209 0.001 25158 6377 1 17 . 1 1 25 25 TYR C C 25 179.465 179.465 178.037 1.428 25158 6378 1 17 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.643 0.202 25158 6379 1 17 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.693 0.372 25158 6380 1 17 . 1 1 25 25 TYR H H 25 8.321 8.321 7.699 0.622 25158 6381 1 17 . 1 1 26 26 VAL N N 26 120.405 120.405 118.215 2.190 25158 6382 1 17 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.838 -0.064 25158 6383 1 17 . 1 1 26 26 VAL C C 26 177.826 177.826 177.300 0.526 25158 6384 1 17 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.172 0.268 25158 6385 1 17 . 1 1 26 26 VAL CB C 26 31.557 31.557 30.861 0.696 25158 6386 1 17 . 1 1 26 26 VAL H H 26 8.803 8.803 8.201 0.602 25158 6387 1 17 . 1 1 27 27 LEU N N 27 119.247 119.247 117.658 1.589 25158 6388 1 17 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.281 -0.005 25158 6389 1 17 . 1 1 27 27 LEU C C 27 176.753 176.753 176.385 0.368 25158 6390 1 17 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.746 0.929 25158 6391 1 17 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.035 -0.442 25158 6392 1 17 . 1 1 27 27 LEU H H 27 7.898 7.898 7.783 0.115 25158 6393 1 17 . 1 1 28 28 ARG N N 28 116.082 116.082 116.645 -0.563 25158 6394 1 17 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.859 0.255 25158 6395 1 17 . 1 1 28 28 ARG C C 28 176.521 176.521 176.171 0.350 25158 6396 1 17 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.029 -0.875 25158 6397 1 17 . 1 1 28 28 ARG CB C 28 27.471 27.471 26.807 0.664 25158 6398 1 17 . 1 1 28 28 ARG H H 28 7.993 7.993 8.183 -0.190 25158 6399 1 17 . 1 1 29 29 SER N N 29 113.579 113.579 115.396 -1.817 25158 6400 1 17 . 1 1 29 29 SER HA H 29 4.305 4.305 4.392 -0.087 25158 6401 1 17 . 1 1 29 29 SER C C 29 175.368 175.368 175.597 -0.229 25158 6402 1 17 . 1 1 29 29 SER CA C 29 59.699 59.699 60.444 -0.745 25158 6403 1 17 . 1 1 29 29 SER CB C 29 63.908 63.908 63.784 0.124 25158 6404 1 17 . 1 1 29 29 SER H H 29 8.094 8.094 8.499 -0.405 25158 6405 1 17 . 1 1 30 30 GLY N N 30 109.920 109.920 108.764 1.156 25158 6406 1 17 . 1 1 30 30 GLY C C 30 174.115 174.115 173.891 0.224 25158 6407 1 17 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.720 1.051 25158 6408 1 17 . 1 1 30 30 GLY H H 30 8.577 8.577 8.324 0.253 25158 6409 1 17 . 1 1 31 31 ILE N N 31 119.084 119.084 119.012 0.072 25158 6410 1 17 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.418 -0.060 25158 6411 1 17 . 1 1 31 31 ILE C C 31 174.392 174.392 174.860 -0.468 25158 6412 1 17 . 1 1 31 31 ILE CA C 31 60.246 60.246 59.839 0.407 25158 6413 1 17 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.850 -0.271 25158 6414 1 17 . 1 1 31 31 ILE H H 31 7.387 7.387 7.673 -0.286 25158 6415 1 17 . 1 1 32 32 SER N N 32 120.582 120.582 120.128 0.454 25158 6416 1 17 . 1 1 32 32 SER HA H 32 4.845 4.845 4.965 -0.120 25158 6417 1 17 . 1 1 32 32 SER C C 32 173.891 173.891 173.920 -0.029 25158 6418 1 17 . 1 1 32 32 SER CA C 32 57.603 57.603 57.246 0.357 25158 6419 1 17 . 1 1 32 32 SER CB C 32 63.849 63.849 63.747 0.102 25158 6420 1 17 . 1 1 32 32 SER H H 32 8.339 8.339 8.455 -0.116 25158 6421 1 17 . 1 1 33 33 ILE N N 33 116.629 116.629 120.777 -4.148 25158 6422 1 17 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.587 0.046 25158 6423 1 17 . 1 1 33 33 ILE C C 33 174.195 174.195 174.031 0.164 25158 6424 1 17 . 1 1 33 33 ILE CA C 33 59.112 59.112 58.972 0.140 25158 6425 1 17 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.445 2.137 25158 6426 1 17 . 1 1 33 33 ILE H H 33 7.873 7.873 8.180 -0.307 25158 6427 1 17 . 1 1 34 34 ASN N N 34 118.342 118.342 119.945 -1.603 25158 6428 1 17 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.872 -0.136 25158 6429 1 17 . 1 1 34 34 ASN C C 34 176.217 176.217 175.879 0.338 25158 6430 1 17 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.700 -0.514 25158 6431 1 17 . 1 1 34 34 ASN CB C 34 36.499 36.499 39.516 -3.017 25158 6432 1 17 . 1 1 34 34 ASN H H 34 8.839 8.839 8.190 0.649 25158 6433 1 17 . 1 1 35 35 THR N N 35 116.120 116.120 118.578 -2.458 25158 6434 1 17 . 1 1 35 35 THR HA H 35 3.559 3.559 4.013 -0.454 25158 6435 1 17 . 1 1 35 35 THR C C 35 177.347 177.347 175.934 1.413 25158 6436 1 17 . 1 1 35 35 THR CA C 35 64.686 64.686 65.358 -0.672 25158 6437 1 17 . 1 1 35 35 THR CB C 35 67.758 67.758 68.698 -0.940 25158 6438 1 17 . 1 1 35 35 THR H H 35 7.939 7.939 8.410 -0.471 25158 6439 1 17 . 1 1 36 36 ASP N N 36 123.528 123.528 121.856 1.672 25158 6440 1 17 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.358 0.062 25158 6441 1 17 . 1 1 36 36 ASP C C 36 177.752 177.752 177.514 0.238 25158 6442 1 17 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.182 -0.108 25158 6443 1 17 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.319 -0.422 25158 6444 1 17 . 1 1 36 36 ASP H H 36 7.980 7.980 8.816 -0.836 25158 6445 1 17 . 1 1 37 37 ASN N N 37 115.690 115.690 116.475 -0.785 25158 6446 1 17 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.715 -0.449 25158 6447 1 17 . 1 1 37 37 ASN C C 37 175.589 175.589 177.180 -1.591 25158 6448 1 17 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.951 -2.391 25158 6449 1 17 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.648 -0.685 25158 6450 1 17 . 1 1 37 37 ASN H H 37 7.251 7.251 8.259 -1.008 25158 6451 1 17 . 1 1 38 38 ALA N N 38 119.560 119.560 122.548 -2.988 25158 6452 1 17 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.029 0.051 25158 6453 1 17 . 1 1 38 38 ALA C C 38 173.638 173.638 177.335 -3.697 25158 6454 1 17 . 1 1 38 38 ALA CA C 38 52.220 52.220 53.981 -1.761 25158 6455 1 17 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.736 4.135 25158 6456 1 17 . 1 1 38 38 ALA H H 38 7.142 7.142 8.035 -0.893 25158 6457 1 17 . 1 1 39 39 ASP N N 39 115.003 115.003 119.329 -4.326 25158 6458 1 17 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.683 0.257 25158 6459 1 17 . 1 1 39 39 ASP C C 39 177.163 177.163 176.989 0.174 25158 6460 1 17 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.691 -2.520 25158 6461 1 17 . 1 1 39 39 ASP CB C 39 38.946 38.946 40.045 -1.099 25158 6462 1 17 . 1 1 39 39 ASP H H 39 7.096 7.096 7.929 -0.833 25158 6463 1 17 . 1 1 40 40 LEU N N 40 123.245 123.245 124.015 -0.770 25158 6464 1 17 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.307 -0.236 25158 6465 1 17 . 1 1 40 40 LEU C C 40 175.865 175.865 177.639 -1.774 25158 6466 1 17 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.847 0.746 25158 6467 1 17 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.025 -0.096 25158 6468 1 17 . 1 1 40 40 LEU H H 40 8.572 8.572 7.919 0.653 25158 6469 1 17 . 1 1 41 41 ASN N N 41 112.723 112.723 113.334 -0.611 25158 6470 1 17 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.960 0.039 25158 6471 1 17 . 1 1 41 41 ASN C C 41 173.846 173.846 175.329 -1.483 25158 6472 1 17 . 1 1 41 41 ASN CA C 41 51.233 51.233 51.758 -0.525 25158 6473 1 17 . 1 1 41 41 ASN CB C 41 37.395 37.395 38.975 -1.580 25158 6474 1 17 . 1 1 41 41 ASN H H 41 8.004 8.004 7.837 0.167 25158 6475 1 17 . 1 1 42 42 GLU N N 42 115.798 115.798 116.874 -1.076 25158 6476 1 17 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.271 -0.319 25158 6477 1 17 . 1 1 42 42 GLU C C 42 175.172 175.172 175.775 -0.603 25158 6478 1 17 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.793 -0.442 25158 6479 1 17 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.276 0.945 25158 6480 1 17 . 1 1 42 42 GLU H H 42 7.642 7.642 8.221 -0.579 25158 6481 1 17 . 1 1 43 43 ASP N N 43 117.453 117.453 116.923 0.530 25158 6482 1 17 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.526 0.313 25158 6483 1 17 . 1 1 43 43 ASP C C 43 178.129 178.129 177.108 1.021 25158 6484 1 17 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.851 -1.213 25158 6485 1 17 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.014 0.200 25158 6486 1 17 . 1 1 43 43 ASP H H 43 8.473 8.473 8.449 0.024 25158 6487 1 17 . 1 1 44 44 GLY N N 44 112.490 112.490 107.102 5.388 25158 6488 1 17 . 1 1 44 44 GLY C C 44 173.717 173.717 173.714 0.003 25158 6489 1 17 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.946 0.371 25158 6490 1 17 . 1 1 44 44 GLY H H 44 10.139 10.139 8.276 1.863 25158 6491 1 17 . 1 1 45 45 ARG N N 45 118.154 118.154 117.138 1.016 25158 6492 1 17 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.589 0.199 25158 6493 1 17 . 1 1 45 45 ARG C C 45 175.602 175.602 174.089 1.513 25158 6494 1 17 . 1 1 45 45 ARG CA C 45 53.832 53.832 55.238 -1.406 25158 6495 1 17 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.717 0.947 25158 6496 1 17 . 1 1 45 45 ARG H H 45 7.994 7.994 9.030 -1.036 25158 6497 1 17 . 1 1 46 46 VAL N N 46 126.392 126.392 123.465 2.927 25158 6498 1 17 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.601 0.189 25158 6499 1 17 . 1 1 46 46 VAL C C 46 174.644 174.644 175.697 -1.053 25158 6500 1 17 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.716 0.013 25158 6501 1 17 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.608 1.058 25158 6502 1 17 . 1 1 46 46 VAL H H 46 9.115 9.115 8.455 0.660 25158 6503 1 17 . 1 1 47 47 ASN N N 47 126.737 126.737 125.875 0.862 25158 6504 1 17 . 1 1 47 47 ASN HA H 47 4.875 4.875 5.028 -0.153 25158 6505 1 17 . 1 1 47 47 ASN C C 47 176.467 176.467 175.966 0.501 25158 6506 1 17 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.768 0.272 25158 6507 1 17 . 1 1 47 47 ASN CB C 47 39.187 39.187 40.060 -0.873 25158 6508 1 17 . 1 1 47 47 ASN H H 47 10.077 10.077 7.805 2.272 25158 6509 1 17 . 1 1 48 48 SER N N 48 113.409 113.409 114.633 -1.224 25158 6510 1 17 . 1 1 48 48 SER HA H 48 4.086 4.086 4.148 -0.062 25158 6511 1 17 . 1 1 48 48 SER C C 48 176.671 176.671 176.187 0.484 25158 6512 1 17 . 1 1 48 48 SER CA C 48 62.375 62.375 61.353 1.022 25158 6513 1 17 . 1 1 48 48 SER CB C 48 62.375 62.375 62.915 -0.540 25158 6514 1 17 . 1 1 48 48 SER H H 48 8.936 8.936 8.754 0.182 25158 6515 1 17 . 1 1 49 49 THR N N 49 121.885 121.885 117.902 3.983 25158 6516 1 17 . 1 1 49 49 THR HA H 49 4.112 4.112 3.922 0.190 25158 6517 1 17 . 1 1 49 49 THR C C 49 177.320 177.320 176.412 0.908 25158 6518 1 17 . 1 1 49 49 THR CA C 49 66.713 66.713 66.477 0.236 25158 6519 1 17 . 1 1 49 49 THR CB C 49 67.787 67.787 68.665 -0.877 25158 6520 1 17 . 1 1 49 49 THR H H 49 8.124 8.124 7.779 0.345 25158 6521 1 17 . 1 1 50 50 ASP N N 50 120.401 120.401 122.180 -1.779 25158 6522 1 17 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.394 -0.024 25158 6523 1 17 . 1 1 50 50 ASP C C 50 177.033 177.033 178.125 -1.092 25158 6524 1 17 . 1 1 50 50 ASP CA C 50 58.820 58.820 56.970 1.850 25158 6525 1 17 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.245 1.463 25158 6526 1 17 . 1 1 50 50 ASP H H 50 7.560 7.560 7.721 -0.161 25158 6527 1 17 . 1 1 51 51 LEU N N 51 118.174 118.174 120.626 -2.452 25158 6528 1 17 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.025 0.163 25158 6529 1 17 . 1 1 51 51 LEU C C 51 177.441 177.441 178.484 -1.043 25158 6530 1 17 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.250 -0.113 25158 6531 1 17 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.759 0.088 25158 6532 1 17 . 1 1 51 51 LEU H H 51 7.134 7.134 7.657 -0.523 25158 6533 1 17 . 1 1 52 52 GLY N N 52 105.596 105.596 106.473 -0.877 25158 6534 1 17 . 1 1 52 52 GLY C C 52 176.764 176.764 175.943 0.821 25158 6535 1 17 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.957 0.685 25158 6536 1 17 . 1 1 52 52 GLY H H 52 8.034 8.034 7.833 0.201 25158 6537 1 17 . 1 1 53 53 ILE N N 53 122.043 122.043 122.539 -0.496 25158 6538 1 17 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.725 -0.276 25158 6539 1 17 . 1 1 53 53 ILE C C 53 177.112 177.112 177.513 -0.401 25158 6540 1 17 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.211 1.177 25158 6541 1 17 . 1 1 53 53 ILE CB C 53 38.258 38.258 38.033 0.224 25158 6542 1 17 . 1 1 53 53 ILE H H 53 7.611 7.611 7.634 -0.023 25158 6543 1 17 . 1 1 54 54 LEU N N 54 120.787 120.787 121.605 -0.818 25158 6544 1 17 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.934 0.007 25158 6545 1 17 . 1 1 54 54 LEU C C 54 175.340 175.340 178.538 -3.198 25158 6546 1 17 . 1 1 54 54 LEU CA C 54 58.195 58.195 59.066 -0.870 25158 6547 1 17 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.957 -0.736 25158 6548 1 17 . 1 1 54 54 LEU H H 54 8.323 8.323 8.625 -0.302 25158 6549 1 17 . 1 1 55 55 LYS N N 55 116.833 116.833 118.963 -2.130 25158 6550 1 17 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.962 -0.078 25158 6551 1 17 . 1 1 55 55 LYS C C 55 179.067 179.067 179.163 -0.096 25158 6552 1 17 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.942 0.709 25158 6553 1 17 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.249 -0.240 25158 6554 1 17 . 1 1 55 55 LYS H H 55 8.356 8.356 7.633 0.723 25158 6555 1 17 . 1 1 56 56 ARG N N 56 117.092 117.092 118.903 -1.811 25158 6556 1 17 . 1 1 56 56 ARG HA H 56 3.916 3.916 3.994 -0.078 25158 6557 1 17 . 1 1 56 56 ARG C C 56 178.223 178.223 178.473 -0.250 25158 6558 1 17 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.345 1.006 25158 6559 1 17 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.138 0.642 25158 6560 1 17 . 1 1 56 56 ARG H H 56 7.543 7.543 7.637 -0.094 25158 6561 1 17 . 1 1 57 57 TYR N N 57 122.187 122.187 121.460 0.727 25158 6562 1 17 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.679 -0.287 25158 6563 1 17 . 1 1 57 57 TYR C C 57 180.009 180.009 178.499 1.510 25158 6564 1 17 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.019 0.560 25158 6565 1 17 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.704 0.132 25158 6566 1 17 . 1 1 57 57 TYR H H 57 8.592 8.592 7.755 0.837 25158 6567 1 17 . 1 1 58 58 ILE N N 58 122.825 122.825 117.132 5.693 25158 6568 1 17 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.912 -0.232 25158 6569 1 17 . 1 1 58 58 ILE C C 58 178.186 178.186 176.458 1.728 25158 6570 1 17 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.119 1.649 25158 6571 1 17 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.273 -0.553 25158 6572 1 17 . 1 1 58 58 ILE H H 58 8.779 8.779 7.513 1.266 25158 6573 1 17 . 1 1 59 59 LEU N N 59 118.552 118.552 119.121 -0.569 25158 6574 1 17 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.395 -0.172 25158 6575 1 17 . 1 1 59 59 LEU C C 59 175.937 175.937 176.001 -0.064 25158 6576 1 17 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.052 1.460 25158 6577 1 17 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.794 0.632 25158 6578 1 17 . 1 1 59 59 LEU H H 59 7.539 7.539 7.787 -0.248 25158 6579 1 17 . 1 1 60 60 LYS N N 60 113.650 113.650 118.436 -4.786 25158 6580 1 17 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.787 0.208 25158 6581 1 17 . 1 1 60 60 LYS C C 60 176.535 176.535 176.392 0.143 25158 6582 1 17 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.578 -0.287 25158 6583 1 17 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.625 -2.354 25158 6584 1 17 . 1 1 60 60 LYS H H 60 7.815 7.815 7.479 0.336 25158 6585 1 17 . 1 1 61 61 GLU N N 61 117.535 117.535 115.389 2.146 25158 6586 1 17 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.322 -0.178 25158 6587 1 17 . 1 1 61 61 GLU C C 61 176.992 176.992 176.774 0.218 25158 6588 1 17 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.766 -0.077 25158 6589 1 17 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.094 -0.402 25158 6590 1 17 . 1 1 61 61 GLU H H 61 8.438 8.438 8.368 0.070 25158 6591 1 17 . 1 1 62 62 ILE N N 62 112.102 112.102 114.901 -2.799 25158 6592 1 17 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.496 -0.113 25158 6593 1 17 . 1 1 62 62 ILE C C 62 175.425 175.425 174.236 1.189 25158 6594 1 17 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.651 -0.725 25158 6595 1 17 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.455 1.294 25158 6596 1 17 . 1 1 62 62 ILE H H 62 6.867 6.867 7.507 -0.640 25158 6597 1 17 . 1 1 63 63 ASP N N 63 119.719 119.719 124.577 -4.858 25158 6598 1 17 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.871 -0.197 25158 6599 1 17 . 1 1 63 63 ASP C C 63 176.202 176.202 175.772 0.430 25158 6600 1 17 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.562 1.256 25158 6601 1 17 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.583 0.634 25158 6602 1 17 . 1 1 63 63 ASP H H 63 8.561 8.561 8.843 -0.282 25158 6603 1 17 . 1 1 64 64 THR N N 64 113.289 113.289 116.735 -3.446 25158 6604 1 17 . 1 1 64 64 THR HA H 64 4.712 4.712 4.647 0.065 25158 6605 1 17 . 1 1 64 64 THR C C 64 170.854 170.854 173.150 -2.296 25158 6606 1 17 . 1 1 64 64 THR CA C 64 61.269 61.269 61.825 -0.556 25158 6607 1 17 . 1 1 64 64 THR CB C 64 71.993 71.993 68.923 3.070 25158 6608 1 17 . 1 1 64 64 THR H H 64 7.410 7.410 7.705 -0.295 25158 6609 1 17 . 1 1 65 65 LEU N N 65 121.012 121.012 126.665 -5.653 25158 6610 1 17 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.752 -0.523 25158 6611 1 17 . 1 1 65 65 LEU C C 65 174.763 174.763 175.002 -0.239 25158 6612 1 17 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.006 -0.371 25158 6613 1 17 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.486 1.034 25158 6614 1 17 . 1 1 65 65 LEU H H 65 7.877 7.877 8.411 -0.534 25158 6615 1 17 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.217 -0.225 25158 6616 1 17 . 1 1 66 66 PRO C C 66 174.419 174.419 175.093 -0.674 25158 6617 1 17 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.295 0.015 25158 6618 1 17 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.626 2.600 25158 6619 1 17 . 1 1 67 67 TYR N N 67 122.616 122.616 121.470 1.146 25158 6620 1 17 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.290 0.366 25158 6621 1 17 . 1 1 67 67 TYR C C 67 174.446 174.446 175.890 -1.444 25158 6622 1 17 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.316 -0.305 25158 6623 1 17 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.878 1.203 25158 6624 1 17 . 1 1 67 67 TYR H H 67 8.662 8.662 8.117 0.545 25158 6625 1 17 . 1 1 68 68 LYS N N 68 126.223 126.223 126.253 -0.030 25158 6626 1 17 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.164 0.104 25158 6627 1 17 . 1 1 68 68 LYS C C 68 174.748 174.748 174.926 -0.178 25158 6628 1 17 . 1 1 68 68 LYS CA C 68 55.603 55.603 54.541 1.062 25158 6629 1 17 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.019 1.751 25158 6630 1 17 . 1 1 68 68 LYS H H 68 8.112 8.112 7.982 0.130 25158 6631 1 18 . 1 1 2 2 THR N N 2 116.700 116.700 115.713 0.987 25158 6632 1 18 . 1 1 2 2 THR HA H 2 4.313 4.313 4.264 0.049 25158 6633 1 18 . 1 1 2 2 THR C C 2 173.968 173.968 174.305 -0.337 25158 6634 1 18 . 1 1 2 2 THR CA C 2 62.326 62.326 61.960 0.366 25158 6635 1 18 . 1 1 2 2 THR CB C 2 70.154 70.154 69.591 0.563 25158 6636 1 18 . 1 1 2 2 THR H H 2 8.657 8.657 7.970 0.687 25158 6637 1 18 . 1 1 3 3 LYS N N 3 125.500 125.500 123.865 1.635 25158 6638 1 18 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.300 -0.235 25158 6639 1 18 . 1 1 3 3 LYS C C 3 174.926 174.926 175.488 -0.562 25158 6640 1 18 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.653 0.186 25158 6641 1 18 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.657 1.119 25158 6642 1 18 . 1 1 3 3 LYS H H 3 8.318 8.318 8.332 -0.014 25158 6643 1 18 . 1 1 4 4 LEU N N 4 127.473 127.473 125.761 1.712 25158 6644 1 18 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.394 0.089 25158 6645 1 18 . 1 1 4 4 LEU C C 4 174.734 174.734 175.153 -0.419 25158 6646 1 18 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.415 -0.156 25158 6647 1 18 . 1 1 4 4 LEU CB C 4 40.929 40.929 44.323 -3.394 25158 6648 1 18 . 1 1 4 4 LEU H H 4 7.726 7.726 7.984 -0.258 25158 6649 1 18 . 1 1 5 5 TYR N N 5 123.074 123.074 124.727 -1.653 25158 6650 1 18 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.148 -0.525 25158 6651 1 18 . 1 1 5 5 TYR C C 5 175.406 175.406 177.219 -1.813 25158 6652 1 18 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.742 3.070 25158 6653 1 18 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.806 2.304 25158 6654 1 18 . 1 1 5 5 TYR H H 5 7.816 7.816 8.496 -0.680 25158 6655 1 18 . 1 1 6 6 GLY N N 6 108.614 108.614 113.686 -5.072 25158 6656 1 18 . 1 1 6 6 GLY C C 6 172.585 172.585 172.845 -0.260 25158 6657 1 18 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.903 0.484 25158 6658 1 18 . 1 1 6 6 GLY H H 6 8.915 8.915 8.244 0.671 25158 6659 1 18 . 1 1 7 7 ASP N N 7 118.023 118.023 119.873 -1.850 25158 6660 1 18 . 1 1 7 7 ASP HA H 7 4.984 4.984 5.401 -0.417 25158 6661 1 18 . 1 1 7 7 ASP C C 7 177.806 177.806 176.995 0.811 25158 6662 1 18 . 1 1 7 7 ASP CA C 7 52.192 52.192 52.043 0.149 25158 6663 1 18 . 1 1 7 7 ASP CB C 7 39.150 39.150 41.545 -2.395 25158 6664 1 18 . 1 1 7 7 ASP H H 7 7.976 7.976 7.724 0.252 25158 6665 1 18 . 1 1 8 8 VAL N N 8 120.293 120.293 119.514 0.779 25158 6666 1 18 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.173 -0.190 25158 6667 1 18 . 1 1 8 8 VAL C C 8 175.717 175.717 176.677 -0.960 25158 6668 1 18 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.067 0.379 25158 6669 1 18 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.912 -0.641 25158 6670 1 18 . 1 1 8 8 VAL H H 8 8.156 8.156 8.668 -0.512 25158 6671 1 18 . 1 1 9 9 ASN N N 9 115.226 115.226 117.523 -2.297 25158 6672 1 18 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.570 0.419 25158 6673 1 18 . 1 1 9 9 ASN C C 9 174.626 174.626 174.709 -0.083 25158 6674 1 18 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.785 -1.835 25158 6675 1 18 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.199 -0.498 25158 6676 1 18 . 1 1 9 9 ASN H H 9 8.008 8.008 7.895 0.113 25158 6677 1 18 . 1 1 10 10 ASP N N 10 115.600 115.600 115.908 -0.308 25158 6678 1 18 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.501 -0.065 25158 6679 1 18 . 1 1 10 10 ASP C C 10 175.125 175.125 175.421 -0.296 25158 6680 1 18 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.019 1.216 25158 6681 1 18 . 1 1 10 10 ASP CB C 10 40.200 40.200 38.477 1.723 25158 6682 1 18 . 1 1 10 10 ASP H H 10 7.374 7.374 8.215 -0.841 25158 6683 1 18 . 1 1 11 11 ASP N N 11 118.402 118.402 116.047 2.355 25158 6684 1 18 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.571 0.246 25158 6685 1 18 . 1 1 11 11 ASP C C 11 178.299 178.299 176.822 1.477 25158 6686 1 18 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.176 -0.355 25158 6687 1 18 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.789 -0.675 25158 6688 1 18 . 1 1 11 11 ASP H H 11 8.801 8.801 8.695 0.106 25158 6689 1 18 . 1 1 12 12 GLY N N 12 112.353 112.353 107.649 4.704 25158 6690 1 18 . 1 1 12 12 GLY C C 12 173.284 173.284 173.678 -0.394 25158 6691 1 18 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.138 0.486 25158 6692 1 18 . 1 1 12 12 GLY H H 12 10.293 10.293 8.485 1.808 25158 6693 1 18 . 1 1 13 13 LYS N N 13 118.118 118.118 117.486 0.632 25158 6694 1 18 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.505 0.154 25158 6695 1 18 . 1 1 13 13 LYS C C 13 175.595 175.595 174.429 1.166 25158 6696 1 18 . 1 1 13 13 LYS CA C 13 53.758 53.758 54.652 -0.894 25158 6697 1 18 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.362 0.977 25158 6698 1 18 . 1 1 13 13 LYS H H 13 7.848 7.848 8.342 -0.494 25158 6699 1 18 . 1 1 14 14 VAL N N 14 126.591 126.591 121.806 4.785 25158 6700 1 18 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.528 0.227 25158 6701 1 18 . 1 1 14 14 VAL C C 14 175.052 175.052 175.344 -0.292 25158 6702 1 18 . 1 1 14 14 VAL CA C 14 62.070 62.070 62.268 -0.198 25158 6703 1 18 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.316 0.139 25158 6704 1 18 . 1 1 14 14 VAL H H 14 9.109 9.109 8.605 0.504 25158 6705 1 18 . 1 1 15 15 ASN N N 15 126.287 126.287 125.867 0.420 25158 6706 1 18 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.954 -0.139 25158 6707 1 18 . 1 1 15 15 ASN C C 15 176.340 176.340 176.263 0.077 25158 6708 1 18 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.577 0.698 25158 6709 1 18 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.786 -2.566 25158 6710 1 18 . 1 1 15 15 ASN H H 15 10.071 10.071 9.330 0.741 25158 6711 1 18 . 1 1 16 16 SER N N 16 113.168 113.168 116.191 -3.023 25158 6712 1 18 . 1 1 16 16 SER HA H 16 4.047 4.047 4.243 -0.196 25158 6713 1 18 . 1 1 16 16 SER C C 16 176.197 176.197 175.890 0.307 25158 6714 1 18 . 1 1 16 16 SER CA C 16 62.681 62.681 61.385 1.296 25158 6715 1 18 . 1 1 16 16 SER CB C 16 62.681 62.681 62.853 -0.172 25158 6716 1 18 . 1 1 16 16 SER H H 16 8.825 8.825 8.761 0.064 25158 6717 1 18 . 1 1 17 17 THR N N 17 119.391 119.391 115.621 3.770 25158 6718 1 18 . 1 1 17 17 THR HA H 17 3.983 3.983 4.105 -0.122 25158 6719 1 18 . 1 1 17 17 THR C C 17 177.149 177.149 176.363 0.786 25158 6720 1 18 . 1 1 17 17 THR CA C 17 66.791 66.791 64.640 2.151 25158 6721 1 18 . 1 1 17 17 THR CB C 17 67.757 67.757 68.442 -0.685 25158 6722 1 18 . 1 1 17 17 THR H H 17 7.946 7.946 8.199 -0.253 25158 6723 1 18 . 1 1 18 18 ASP N N 18 120.318 120.318 121.103 -0.785 25158 6724 1 18 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.319 0.051 25158 6725 1 18 . 1 1 18 18 ASP C C 18 177.168 177.168 178.166 -0.998 25158 6726 1 18 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.881 1.033 25158 6727 1 18 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.570 1.592 25158 6728 1 18 . 1 1 18 18 ASP H H 18 7.995 7.995 7.970 0.025 25158 6729 1 18 . 1 1 19 19 ALA N N 19 120.191 120.191 123.321 -3.130 25158 6730 1 18 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.091 -0.043 25158 6731 1 18 . 1 1 19 19 ALA C C 19 179.549 179.549 179.171 0.378 25158 6732 1 18 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.165 0.248 25158 6733 1 18 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.550 -1.237 25158 6734 1 18 . 1 1 19 19 ALA H H 19 7.085 7.085 7.503 -0.418 25158 6735 1 18 . 1 1 20 20 VAL N N 20 120.613 120.613 118.822 1.791 25158 6736 1 18 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.635 -0.024 25158 6737 1 18 . 1 1 20 20 VAL C C 20 178.153 178.153 177.413 0.740 25158 6738 1 18 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.483 1.284 25158 6739 1 18 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.742 0.126 25158 6740 1 18 . 1 1 20 20 VAL H H 20 7.835 7.835 7.449 0.386 25158 6741 1 18 . 1 1 21 21 ALA N N 21 121.767 121.767 122.535 -0.768 25158 6742 1 18 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.053 0.009 25158 6743 1 18 . 1 1 21 21 ALA C C 21 179.298 179.298 179.527 -0.229 25158 6744 1 18 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.355 -0.111 25158 6745 1 18 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.219 -0.430 25158 6746 1 18 . 1 1 21 21 ALA H H 21 7.804 7.804 8.361 -0.557 25158 6747 1 18 . 1 1 22 22 LEU N N 22 117.555 117.555 119.127 -1.572 25158 6748 1 18 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.086 0.060 25158 6749 1 18 . 1 1 22 22 LEU C C 22 177.914 177.914 178.451 -0.537 25158 6750 1 18 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.416 0.277 25158 6751 1 18 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.647 -0.132 25158 6752 1 18 . 1 1 22 22 LEU H H 22 8.619 8.619 7.892 0.727 25158 6753 1 18 . 1 1 23 23 LYS N N 23 120.335 120.335 119.618 0.717 25158 6754 1 18 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.970 -0.051 25158 6755 1 18 . 1 1 23 23 LYS C C 23 177.731 177.731 179.080 -1.349 25158 6756 1 18 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.675 0.662 25158 6757 1 18 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.260 -0.162 25158 6758 1 18 . 1 1 23 23 LYS H H 23 8.230 8.230 7.714 0.516 25158 6759 1 18 . 1 1 24 24 ARG N N 24 116.831 116.831 117.998 -1.167 25158 6760 1 18 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.012 -0.053 25158 6761 1 18 . 1 1 24 24 ARG C C 24 178.616 178.616 178.575 0.041 25158 6762 1 18 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.319 0.638 25158 6763 1 18 . 1 1 24 24 ARG CB C 24 29.563 29.563 29.965 -0.402 25158 6764 1 18 . 1 1 24 24 ARG H H 24 7.927 7.927 7.815 0.112 25158 6765 1 18 . 1 1 25 25 TYR N N 25 120.960 120.960 120.656 0.304 25158 6766 1 18 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.276 -0.066 25158 6767 1 18 . 1 1 25 25 TYR C C 25 179.465 179.465 178.183 1.282 25158 6768 1 18 . 1 1 25 25 TYR CA C 25 61.845 61.845 60.910 0.935 25158 6769 1 18 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.246 0.819 25158 6770 1 18 . 1 1 25 25 TYR H H 25 8.321 8.321 7.735 0.586 25158 6771 1 18 . 1 1 26 26 VAL N N 26 120.405 120.405 114.891 5.514 25158 6772 1 18 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.760 0.014 25158 6773 1 18 . 1 1 26 26 VAL C C 26 177.826 177.826 176.458 1.368 25158 6774 1 18 . 1 1 26 26 VAL CA C 26 65.440 65.440 63.655 1.785 25158 6775 1 18 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.229 0.328 25158 6776 1 18 . 1 1 26 26 VAL H H 26 8.803 8.803 7.340 1.463 25158 6777 1 18 . 1 1 27 27 LEU N N 27 119.247 119.247 118.931 0.316 25158 6778 1 18 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.398 -0.122 25158 6779 1 18 . 1 1 27 27 LEU C C 27 176.753 176.753 176.384 0.369 25158 6780 1 18 . 1 1 27 27 LEU CA C 27 55.675 55.675 53.998 1.677 25158 6781 1 18 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.719 -0.126 25158 6782 1 18 . 1 1 27 27 LEU H H 27 7.898 7.898 7.287 0.611 25158 6783 1 18 . 1 1 28 28 ARG N N 28 116.082 116.082 116.433 -0.351 25158 6784 1 18 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.853 0.261 25158 6785 1 18 . 1 1 28 28 ARG C C 28 176.521 176.521 176.216 0.305 25158 6786 1 18 . 1 1 28 28 ARG CA C 28 56.154 56.154 56.931 -0.777 25158 6787 1 18 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.216 0.255 25158 6788 1 18 . 1 1 28 28 ARG H H 28 7.993 7.993 7.573 0.420 25158 6789 1 18 . 1 1 29 29 SER N N 29 113.579 113.579 114.945 -1.366 25158 6790 1 18 . 1 1 29 29 SER HA H 29 4.305 4.305 4.341 -0.036 25158 6791 1 18 . 1 1 29 29 SER C C 29 175.368 175.368 175.813 -0.445 25158 6792 1 18 . 1 1 29 29 SER CA C 29 59.699 59.699 60.338 -0.639 25158 6793 1 18 . 1 1 29 29 SER CB C 29 63.908 63.908 63.832 0.076 25158 6794 1 18 . 1 1 29 29 SER H H 29 8.094 8.094 8.304 -0.210 25158 6795 1 18 . 1 1 30 30 GLY N N 30 109.920 109.920 109.415 0.505 25158 6796 1 18 . 1 1 30 30 GLY C C 30 174.115 174.115 173.943 0.172 25158 6797 1 18 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.764 1.007 25158 6798 1 18 . 1 1 30 30 GLY H H 30 8.577 8.577 8.483 0.094 25158 6799 1 18 . 1 1 31 31 ILE N N 31 119.084 119.084 121.037 -1.953 25158 6800 1 18 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.342 0.016 25158 6801 1 18 . 1 1 31 31 ILE C C 31 174.392 174.392 174.975 -0.583 25158 6802 1 18 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.301 -0.055 25158 6803 1 18 . 1 1 31 31 ILE CB C 31 39.579 39.579 38.941 0.638 25158 6804 1 18 . 1 1 31 31 ILE H H 31 7.387 7.387 7.665 -0.278 25158 6805 1 18 . 1 1 32 32 SER N N 32 120.582 120.582 125.214 -4.632 25158 6806 1 18 . 1 1 32 32 SER HA H 32 4.845 4.845 4.525 0.320 25158 6807 1 18 . 1 1 32 32 SER C C 32 173.891 173.891 174.193 -0.302 25158 6808 1 18 . 1 1 32 32 SER CA C 32 57.603 57.603 58.941 -1.338 25158 6809 1 18 . 1 1 32 32 SER CB C 32 63.849 63.849 62.803 1.046 25158 6810 1 18 . 1 1 32 32 SER H H 32 8.339 8.339 8.674 -0.335 25158 6811 1 18 . 1 1 33 33 ILE N N 33 116.629 116.629 119.940 -3.311 25158 6812 1 18 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.486 0.147 25158 6813 1 18 . 1 1 33 33 ILE C C 33 174.195 174.195 174.468 -0.273 25158 6814 1 18 . 1 1 33 33 ILE CA C 33 59.112 59.112 58.634 0.478 25158 6815 1 18 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.500 2.082 25158 6816 1 18 . 1 1 33 33 ILE H H 33 7.873 7.873 7.588 0.285 25158 6817 1 18 . 1 1 34 34 ASN N N 34 118.342 118.342 120.182 -1.840 25158 6818 1 18 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.888 -0.152 25158 6819 1 18 . 1 1 34 34 ASN C C 34 176.217 176.217 176.579 -0.362 25158 6820 1 18 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.078 0.108 25158 6821 1 18 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.271 -1.772 25158 6822 1 18 . 1 1 34 34 ASN H H 34 8.839 8.839 8.137 0.702 25158 6823 1 18 . 1 1 35 35 THR N N 35 116.120 116.120 117.916 -1.796 25158 6824 1 18 . 1 1 35 35 THR HA H 35 3.559 3.559 4.028 -0.469 25158 6825 1 18 . 1 1 35 35 THR C C 35 177.347 177.347 176.251 1.096 25158 6826 1 18 . 1 1 35 35 THR CA C 35 64.686 64.686 66.059 -1.373 25158 6827 1 18 . 1 1 35 35 THR CB C 35 67.758 67.758 68.783 -1.025 25158 6828 1 18 . 1 1 35 35 THR H H 35 7.939 7.939 8.293 -0.354 25158 6829 1 18 . 1 1 36 36 ASP N N 36 123.528 123.528 122.570 0.958 25158 6830 1 18 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.400 0.020 25158 6831 1 18 . 1 1 36 36 ASP C C 36 177.752 177.752 177.391 0.361 25158 6832 1 18 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.127 -0.053 25158 6833 1 18 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.627 -0.729 25158 6834 1 18 . 1 1 36 36 ASP H H 36 7.980 7.980 8.126 -0.146 25158 6835 1 18 . 1 1 37 37 ASN N N 37 115.690 115.690 116.312 -0.622 25158 6836 1 18 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.544 -0.278 25158 6837 1 18 . 1 1 37 37 ASN C C 37 175.589 175.589 176.901 -1.312 25158 6838 1 18 . 1 1 37 37 ASN CA C 37 52.560 52.560 55.111 -2.551 25158 6839 1 18 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.422 -0.459 25158 6840 1 18 . 1 1 37 37 ASN H H 37 7.251 7.251 8.298 -1.047 25158 6841 1 18 . 1 1 38 38 ALA N N 38 119.560 119.560 123.006 -3.446 25158 6842 1 18 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.055 0.025 25158 6843 1 18 . 1 1 38 38 ALA C C 38 173.638 173.638 177.478 -3.840 25158 6844 1 18 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.149 -1.929 25158 6845 1 18 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.845 4.026 25158 6846 1 18 . 1 1 38 38 ALA H H 38 7.142 7.142 8.195 -1.053 25158 6847 1 18 . 1 1 39 39 ASP N N 39 115.003 115.003 120.016 -5.013 25158 6848 1 18 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.745 0.195 25158 6849 1 18 . 1 1 39 39 ASP C C 39 177.163 177.163 176.970 0.193 25158 6850 1 18 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.923 -2.752 25158 6851 1 18 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.993 -1.047 25158 6852 1 18 . 1 1 39 39 ASP H H 39 7.096 7.096 8.075 -0.979 25158 6853 1 18 . 1 1 40 40 LEU N N 40 123.245 123.245 123.973 -0.728 25158 6854 1 18 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.284 -0.213 25158 6855 1 18 . 1 1 40 40 LEU C C 40 175.865 175.865 177.588 -1.723 25158 6856 1 18 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.965 0.628 25158 6857 1 18 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.174 -0.245 25158 6858 1 18 . 1 1 40 40 LEU H H 40 8.572 8.572 7.955 0.617 25158 6859 1 18 . 1 1 41 41 ASN N N 41 112.723 112.723 113.963 -1.240 25158 6860 1 18 . 1 1 41 41 ASN HA H 41 4.999 4.999 5.037 -0.038 25158 6861 1 18 . 1 1 41 41 ASN C C 41 173.846 173.846 175.310 -1.464 25158 6862 1 18 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.110 -0.877 25158 6863 1 18 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.099 -1.704 25158 6864 1 18 . 1 1 41 41 ASN H H 41 8.004 8.004 7.865 0.139 25158 6865 1 18 . 1 1 42 42 GLU N N 42 115.798 115.798 116.006 -0.208 25158 6866 1 18 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.316 -0.364 25158 6867 1 18 . 1 1 42 42 GLU C C 42 175.172 175.172 175.851 -0.679 25158 6868 1 18 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.723 -0.372 25158 6869 1 18 . 1 1 42 42 GLU CB C 42 28.221 28.221 26.886 1.335 25158 6870 1 18 . 1 1 42 42 GLU H H 42 7.642 7.642 8.582 -0.940 25158 6871 1 18 . 1 1 43 43 ASP N N 43 117.453 117.453 118.361 -0.908 25158 6872 1 18 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.557 0.282 25158 6873 1 18 . 1 1 43 43 ASP C C 43 178.129 178.129 177.792 0.337 25158 6874 1 18 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.163 -1.526 25158 6875 1 18 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.139 0.075 25158 6876 1 18 . 1 1 43 43 ASP H H 43 8.473 8.473 8.883 -0.410 25158 6877 1 18 . 1 1 44 44 GLY N N 44 112.490 112.490 107.545 4.945 25158 6878 1 18 . 1 1 44 44 GLY C C 44 173.717 173.717 173.811 -0.094 25158 6879 1 18 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.918 0.399 25158 6880 1 18 . 1 1 44 44 GLY H H 44 10.139 10.139 8.086 2.053 25158 6881 1 18 . 1 1 45 45 ARG N N 45 118.154 118.154 117.708 0.446 25158 6882 1 18 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.626 0.162 25158 6883 1 18 . 1 1 45 45 ARG C C 45 175.602 175.602 174.130 1.472 25158 6884 1 18 . 1 1 45 45 ARG CA C 45 53.832 53.832 55.068 -1.236 25158 6885 1 18 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.568 1.097 25158 6886 1 18 . 1 1 45 45 ARG H H 45 7.994 7.994 9.137 -1.143 25158 6887 1 18 . 1 1 46 46 VAL N N 46 126.392 126.392 123.902 2.490 25158 6888 1 18 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.418 0.372 25158 6889 1 18 . 1 1 46 46 VAL C C 46 174.644 174.644 175.181 -0.537 25158 6890 1 18 . 1 1 46 46 VAL CA C 46 61.729 61.729 62.227 -0.498 25158 6891 1 18 . 1 1 46 46 VAL CB C 46 31.666 31.666 31.019 0.647 25158 6892 1 18 . 1 1 46 46 VAL H H 46 9.115 9.115 8.532 0.583 25158 6893 1 18 . 1 1 47 47 ASN N N 47 126.737 126.737 125.512 1.225 25158 6894 1 18 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.916 -0.041 25158 6895 1 18 . 1 1 47 47 ASN C C 47 176.467 176.467 175.908 0.559 25158 6896 1 18 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.621 0.419 25158 6897 1 18 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.309 -0.121 25158 6898 1 18 . 1 1 47 47 ASN H H 47 10.077 10.077 7.730 2.347 25158 6899 1 18 . 1 1 48 48 SER N N 48 113.409 113.409 114.249 -0.840 25158 6900 1 18 . 1 1 48 48 SER HA H 48 4.086 4.086 4.189 -0.103 25158 6901 1 18 . 1 1 48 48 SER C C 48 176.671 176.671 176.308 0.363 25158 6902 1 18 . 1 1 48 48 SER CA C 48 62.375 62.375 61.667 0.708 25158 6903 1 18 . 1 1 48 48 SER CB C 48 62.375 62.375 62.724 -0.349 25158 6904 1 18 . 1 1 48 48 SER H H 48 8.936 8.936 8.745 0.191 25158 6905 1 18 . 1 1 49 49 THR N N 49 121.885 121.885 119.250 2.635 25158 6906 1 18 . 1 1 49 49 THR HA H 49 4.112 4.112 3.953 0.159 25158 6907 1 18 . 1 1 49 49 THR C C 49 177.320 177.320 176.506 0.814 25158 6908 1 18 . 1 1 49 49 THR CA C 49 66.713 66.713 66.388 0.325 25158 6909 1 18 . 1 1 49 49 THR CB C 49 67.787 67.787 68.416 -0.629 25158 6910 1 18 . 1 1 49 49 THR H H 49 8.124 8.124 7.887 0.237 25158 6911 1 18 . 1 1 50 50 ASP N N 50 120.401 120.401 122.270 -1.869 25158 6912 1 18 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.390 -0.020 25158 6913 1 18 . 1 1 50 50 ASP C C 50 177.033 177.033 178.352 -1.319 25158 6914 1 18 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.193 1.627 25158 6915 1 18 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.157 1.551 25158 6916 1 18 . 1 1 50 50 ASP H H 50 7.560 7.560 7.916 -0.356 25158 6917 1 18 . 1 1 51 51 LEU N N 51 118.174 118.174 120.608 -2.434 25158 6918 1 18 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.071 0.117 25158 6919 1 18 . 1 1 51 51 LEU C C 51 177.441 177.441 178.429 -0.988 25158 6920 1 18 . 1 1 51 51 LEU CA C 51 58.137 58.137 57.961 0.176 25158 6921 1 18 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.651 0.195 25158 6922 1 18 . 1 1 51 51 LEU H H 51 7.134 7.134 7.680 -0.546 25158 6923 1 18 . 1 1 52 52 GLY N N 52 105.596 105.596 106.854 -1.258 25158 6924 1 18 . 1 1 52 52 GLY C C 52 176.764 176.764 176.134 0.630 25158 6925 1 18 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.030 0.612 25158 6926 1 18 . 1 1 52 52 GLY H H 52 8.034 8.034 7.814 0.220 25158 6927 1 18 . 1 1 53 53 ILE N N 53 122.043 122.043 122.723 -0.680 25158 6928 1 18 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.683 -0.234 25158 6929 1 18 . 1 1 53 53 ILE C C 53 177.112 177.112 177.555 -0.443 25158 6930 1 18 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.432 0.956 25158 6931 1 18 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.932 0.326 25158 6932 1 18 . 1 1 53 53 ILE H H 53 7.611 7.611 7.704 -0.093 25158 6933 1 18 . 1 1 54 54 LEU N N 54 120.787 120.787 121.158 -0.371 25158 6934 1 18 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.984 -0.043 25158 6935 1 18 . 1 1 54 54 LEU C C 54 175.340 175.340 178.293 -2.953 25158 6936 1 18 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.654 -0.459 25158 6937 1 18 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.969 -0.748 25158 6938 1 18 . 1 1 54 54 LEU H H 54 8.323 8.323 8.338 -0.015 25158 6939 1 18 . 1 1 55 55 LYS N N 55 116.833 116.833 118.792 -1.959 25158 6940 1 18 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.956 -0.072 25158 6941 1 18 . 1 1 55 55 LYS C C 55 179.067 179.067 179.304 -0.237 25158 6942 1 18 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.636 1.015 25158 6943 1 18 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.325 -0.316 25158 6944 1 18 . 1 1 55 55 LYS H H 55 8.356 8.356 7.770 0.586 25158 6945 1 18 . 1 1 56 56 ARG N N 56 117.092 117.092 118.295 -1.203 25158 6946 1 18 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.380 -0.464 25158 6947 1 18 . 1 1 56 56 ARG C C 56 178.223 178.223 178.609 -0.386 25158 6948 1 18 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.178 1.173 25158 6949 1 18 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.223 0.557 25158 6950 1 18 . 1 1 56 56 ARG H H 56 7.543 7.543 7.690 -0.147 25158 6951 1 18 . 1 1 57 57 TYR N N 57 122.187 122.187 122.020 0.167 25158 6952 1 18 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.694 -0.302 25158 6953 1 18 . 1 1 57 57 TYR C C 57 180.009 180.009 178.446 1.563 25158 6954 1 18 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.009 0.570 25158 6955 1 18 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.623 0.213 25158 6956 1 18 . 1 1 57 57 TYR H H 57 8.592 8.592 7.866 0.726 25158 6957 1 18 . 1 1 58 58 ILE N N 58 122.825 122.825 117.650 5.175 25158 6958 1 18 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.868 -0.188 25158 6959 1 18 . 1 1 58 58 ILE C C 58 178.186 178.186 176.575 1.611 25158 6960 1 18 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.489 1.279 25158 6961 1 18 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.370 -0.650 25158 6962 1 18 . 1 1 58 58 ILE H H 58 8.779 8.779 7.923 0.856 25158 6963 1 18 . 1 1 59 59 LEU N N 59 118.552 118.552 119.026 -0.474 25158 6964 1 18 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.398 -0.175 25158 6965 1 18 . 1 1 59 59 LEU C C 59 175.937 175.937 175.673 0.264 25158 6966 1 18 . 1 1 59 59 LEU CA C 59 55.512 55.512 53.943 1.569 25158 6967 1 18 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.125 1.301 25158 6968 1 18 . 1 1 59 59 LEU H H 59 7.539 7.539 7.482 0.057 25158 6969 1 18 . 1 1 60 60 LYS N N 60 113.650 113.650 116.880 -3.230 25158 6970 1 18 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.784 0.211 25158 6971 1 18 . 1 1 60 60 LYS C C 60 176.535 176.535 176.433 0.102 25158 6972 1 18 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.747 -0.456 25158 6973 1 18 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.062 -1.792 25158 6974 1 18 . 1 1 60 60 LYS H H 60 7.815 7.815 7.676 0.139 25158 6975 1 18 . 1 1 61 61 GLU N N 61 117.535 117.535 116.387 1.148 25158 6976 1 18 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.252 -0.108 25158 6977 1 18 . 1 1 61 61 GLU C C 61 176.992 176.992 176.493 0.499 25158 6978 1 18 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.856 -0.167 25158 6979 1 18 . 1 1 61 61 GLU CB C 61 30.692 30.692 30.984 -0.292 25158 6980 1 18 . 1 1 61 61 GLU H H 61 8.438 8.438 8.177 0.261 25158 6981 1 18 . 1 1 62 62 ILE N N 62 112.102 112.102 113.749 -1.647 25158 6982 1 18 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.462 -0.079 25158 6983 1 18 . 1 1 62 62 ILE C C 62 175.425 175.425 174.025 1.400 25158 6984 1 18 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.621 -0.695 25158 6985 1 18 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.980 0.768 25158 6986 1 18 . 1 1 62 62 ILE H H 62 6.867 6.867 7.393 -0.526 25158 6987 1 18 . 1 1 63 63 ASP N N 63 119.719 119.719 124.082 -4.363 25158 6988 1 18 . 1 1 63 63 ASP HA H 63 4.674 4.674 5.008 -0.334 25158 6989 1 18 . 1 1 63 63 ASP C C 63 176.202 176.202 175.971 0.231 25158 6990 1 18 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.984 0.834 25158 6991 1 18 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.846 0.371 25158 6992 1 18 . 1 1 63 63 ASP H H 63 8.561 8.561 8.799 -0.238 25158 6993 1 18 . 1 1 64 64 THR N N 64 113.289 113.289 117.131 -3.842 25158 6994 1 18 . 1 1 64 64 THR HA H 64 4.712 4.712 4.557 0.155 25158 6995 1 18 . 1 1 64 64 THR C C 64 170.854 170.854 173.183 -2.329 25158 6996 1 18 . 1 1 64 64 THR CA C 64 61.269 61.269 62.021 -0.752 25158 6997 1 18 . 1 1 64 64 THR CB C 64 71.993 71.993 69.214 2.779 25158 6998 1 18 . 1 1 64 64 THR H H 64 7.410 7.410 7.702 -0.292 25158 6999 1 18 . 1 1 65 65 LEU N N 65 121.012 121.012 126.805 -5.793 25158 7000 1 18 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.782 -0.553 25158 7001 1 18 . 1 1 65 65 LEU C C 65 174.763 174.763 174.889 -0.126 25158 7002 1 18 . 1 1 65 65 LEU CA C 65 51.635 51.635 52.064 -0.429 25158 7003 1 18 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.583 0.937 25158 7004 1 18 . 1 1 65 65 LEU H H 65 7.877 7.877 8.364 -0.487 25158 7005 1 18 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.151 -0.159 25158 7006 1 18 . 1 1 66 66 PRO C C 66 174.419 174.419 175.047 -0.628 25158 7007 1 18 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.217 0.093 25158 7008 1 18 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.479 2.747 25158 7009 1 18 . 1 1 67 67 TYR N N 67 122.616 122.616 122.501 0.115 25158 7010 1 18 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.270 0.386 25158 7011 1 18 . 1 1 67 67 TYR C C 67 174.446 174.446 175.094 -0.648 25158 7012 1 18 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.821 -0.810 25158 7013 1 18 . 1 1 67 67 TYR CB C 67 41.081 41.081 38.975 2.106 25158 7014 1 18 . 1 1 67 67 TYR H H 67 8.662 8.662 8.316 0.346 25158 7015 1 18 . 1 1 68 68 LYS N N 68 126.223 126.223 129.252 -3.029 25158 7016 1 18 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.249 0.019 25158 7017 1 18 . 1 1 68 68 LYS C C 68 174.748 174.748 173.957 0.791 25158 7018 1 18 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.361 0.242 25158 7019 1 18 . 1 1 68 68 LYS CB C 68 32.770 32.770 32.472 0.298 25158 7020 1 18 . 1 1 68 68 LYS H H 68 8.112 8.112 8.331 -0.219 25158 7021 1 19 . 1 1 2 2 THR N N 2 116.700 116.700 115.311 1.389 25158 7022 1 19 . 1 1 2 2 THR HA H 2 4.313 4.313 4.490 -0.177 25158 7023 1 19 . 1 1 2 2 THR C C 2 173.968 173.968 172.838 1.130 25158 7024 1 19 . 1 1 2 2 THR CA C 2 62.326 62.326 61.750 0.576 25158 7025 1 19 . 1 1 2 2 THR CB C 2 70.154 70.154 71.226 -1.072 25158 7026 1 19 . 1 1 2 2 THR H H 2 8.657 8.657 8.014 0.643 25158 7027 1 19 . 1 1 3 3 LYS N N 3 125.500 125.500 126.636 -1.136 25158 7028 1 19 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.262 -0.197 25158 7029 1 19 . 1 1 3 3 LYS C C 3 174.926 174.926 175.419 -0.493 25158 7030 1 19 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.596 0.243 25158 7031 1 19 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.745 1.032 25158 7032 1 19 . 1 1 3 3 LYS H H 3 8.318 8.318 8.534 -0.216 25158 7033 1 19 . 1 1 4 4 LEU N N 4 127.473 127.473 125.036 2.437 25158 7034 1 19 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.530 -0.047 25158 7035 1 19 . 1 1 4 4 LEU C C 4 174.734 174.734 175.374 -0.640 25158 7036 1 19 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.359 -0.100 25158 7037 1 19 . 1 1 4 4 LEU CB C 4 40.929 40.929 45.443 -4.514 25158 7038 1 19 . 1 1 4 4 LEU H H 4 7.726 7.726 7.948 -0.222 25158 7039 1 19 . 1 1 5 5 TYR N N 5 123.074 123.074 124.716 -1.642 25158 7040 1 19 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.387 -0.764 25158 7041 1 19 . 1 1 5 5 TYR C C 5 175.406 175.406 176.903 -1.497 25158 7042 1 19 . 1 1 5 5 TYR CA C 5 61.812 61.812 59.010 2.802 25158 7043 1 19 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.029 2.080 25158 7044 1 19 . 1 1 5 5 TYR H H 5 7.816 7.816 8.751 -0.935 25158 7045 1 19 . 1 1 6 6 GLY N N 6 108.614 108.614 114.953 -6.339 25158 7046 1 19 . 1 1 6 6 GLY C C 6 172.585 172.585 173.848 -1.263 25158 7047 1 19 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.782 0.605 25158 7048 1 19 . 1 1 6 6 GLY H H 6 8.915 8.915 8.557 0.358 25158 7049 1 19 . 1 1 7 7 ASP N N 7 118.023 118.023 121.758 -3.735 25158 7050 1 19 . 1 1 7 7 ASP HA H 7 4.984 4.984 5.106 -0.122 25158 7051 1 19 . 1 1 7 7 ASP C C 7 177.806 177.806 177.078 0.728 25158 7052 1 19 . 1 1 7 7 ASP CA C 7 52.192 52.192 51.757 0.435 25158 7053 1 19 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.971 -0.821 25158 7054 1 19 . 1 1 7 7 ASP H H 7 7.976 7.976 8.064 -0.088 25158 7055 1 19 . 1 1 8 8 VAL N N 8 120.293 120.293 119.186 1.107 25158 7056 1 19 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.143 -0.160 25158 7057 1 19 . 1 1 8 8 VAL C C 8 175.717 175.717 176.852 -1.135 25158 7058 1 19 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.474 -0.028 25158 7059 1 19 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.299 -0.028 25158 7060 1 19 . 1 1 8 8 VAL H H 8 8.156 8.156 7.885 0.271 25158 7061 1 19 . 1 1 9 9 ASN N N 9 115.226 115.226 115.971 -0.745 25158 7062 1 19 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.588 0.401 25158 7063 1 19 . 1 1 9 9 ASN C C 9 174.626 174.626 175.160 -0.534 25158 7064 1 19 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.871 -1.921 25158 7065 1 19 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.396 -0.695 25158 7066 1 19 . 1 1 9 9 ASN H H 9 8.008 8.008 8.258 -0.250 25158 7067 1 19 . 1 1 10 10 ASP N N 10 115.600 115.600 119.556 -3.956 25158 7068 1 19 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.552 -0.116 25158 7069 1 19 . 1 1 10 10 ASP C C 10 175.125 175.125 175.464 -0.339 25158 7070 1 19 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.190 1.045 25158 7071 1 19 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.681 0.519 25158 7072 1 19 . 1 1 10 10 ASP H H 10 7.374 7.374 8.084 -0.710 25158 7073 1 19 . 1 1 11 11 ASP N N 11 118.402 118.402 118.035 0.367 25158 7074 1 19 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.799 0.018 25158 7075 1 19 . 1 1 11 11 ASP C C 11 178.299 178.299 177.314 0.985 25158 7076 1 19 . 1 1 11 11 ASP CA C 11 52.821 52.821 52.928 -0.107 25158 7077 1 19 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.465 -0.352 25158 7078 1 19 . 1 1 11 11 ASP H H 11 8.801 8.801 9.044 -0.243 25158 7079 1 19 . 1 1 12 12 GLY N N 12 112.353 112.353 107.985 4.368 25158 7080 1 19 . 1 1 12 12 GLY C C 12 173.284 173.284 173.927 -0.643 25158 7081 1 19 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.294 0.330 25158 7082 1 19 . 1 1 12 12 GLY H H 12 10.293 10.293 8.420 1.873 25158 7083 1 19 . 1 1 13 13 LYS N N 13 118.118 118.118 119.014 -0.896 25158 7084 1 19 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.511 0.148 25158 7085 1 19 . 1 1 13 13 LYS C C 13 175.595 175.595 174.695 0.900 25158 7086 1 19 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.501 -1.742 25158 7087 1 19 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.410 0.929 25158 7088 1 19 . 1 1 13 13 LYS H H 13 7.848 7.848 8.382 -0.534 25158 7089 1 19 . 1 1 14 14 VAL N N 14 126.591 126.591 126.166 0.425 25158 7090 1 19 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.527 0.228 25158 7091 1 19 . 1 1 14 14 VAL C C 14 175.052 175.052 175.310 -0.258 25158 7092 1 19 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.888 0.182 25158 7093 1 19 . 1 1 14 14 VAL CB C 14 31.455 31.455 31.466 -0.011 25158 7094 1 19 . 1 1 14 14 VAL H H 14 9.109 9.109 8.619 0.490 25158 7095 1 19 . 1 1 15 15 ASN N N 15 126.287 126.287 126.254 0.033 25158 7096 1 19 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.927 -0.112 25158 7097 1 19 . 1 1 15 15 ASN C C 15 176.340 176.340 176.145 0.195 25158 7098 1 19 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.271 1.004 25158 7099 1 19 . 1 1 15 15 ASN CB C 15 39.220 39.220 39.708 -0.487 25158 7100 1 19 . 1 1 15 15 ASN H H 15 10.071 10.071 9.121 0.950 25158 7101 1 19 . 1 1 16 16 SER N N 16 113.168 113.168 114.318 -1.150 25158 7102 1 19 . 1 1 16 16 SER HA H 16 4.047 4.047 4.168 -0.121 25158 7103 1 19 . 1 1 16 16 SER C C 16 176.197 176.197 175.881 0.316 25158 7104 1 19 . 1 1 16 16 SER CA C 16 62.681 62.681 62.389 0.292 25158 7105 1 19 . 1 1 16 16 SER CB C 16 62.681 62.681 62.784 -0.103 25158 7106 1 19 . 1 1 16 16 SER H H 16 8.825 8.825 8.777 0.048 25158 7107 1 19 . 1 1 17 17 THR N N 17 119.391 119.391 117.477 1.914 25158 7108 1 19 . 1 1 17 17 THR HA H 17 3.983 3.983 4.031 -0.048 25158 7109 1 19 . 1 1 17 17 THR C C 17 177.149 177.149 176.638 0.511 25158 7110 1 19 . 1 1 17 17 THR CA C 17 66.791 66.791 66.438 0.353 25158 7111 1 19 . 1 1 17 17 THR CB C 17 67.757 67.757 68.079 -0.322 25158 7112 1 19 . 1 1 17 17 THR H H 17 7.946 7.946 8.304 -0.358 25158 7113 1 19 . 1 1 18 18 ASP N N 18 120.318 120.318 121.125 -0.807 25158 7114 1 19 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.448 -0.078 25158 7115 1 19 . 1 1 18 18 ASP C C 18 177.168 177.168 177.877 -0.709 25158 7116 1 19 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.450 1.464 25158 7117 1 19 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.543 1.619 25158 7118 1 19 . 1 1 18 18 ASP H H 18 7.995 7.995 8.019 -0.024 25158 7119 1 19 . 1 1 19 19 ALA N N 19 120.191 120.191 123.265 -3.074 25158 7120 1 19 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.096 -0.049 25158 7121 1 19 . 1 1 19 19 ALA C C 19 179.549 179.549 179.232 0.317 25158 7122 1 19 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.038 0.375 25158 7123 1 19 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.554 -1.241 25158 7124 1 19 . 1 1 19 19 ALA H H 19 7.085 7.085 7.418 -0.333 25158 7125 1 19 . 1 1 20 20 VAL N N 20 120.613 120.613 119.389 1.224 25158 7126 1 19 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.641 -0.030 25158 7127 1 19 . 1 1 20 20 VAL C C 20 178.153 178.153 177.450 0.703 25158 7128 1 19 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.688 1.079 25158 7129 1 19 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.677 0.191 25158 7130 1 19 . 1 1 20 20 VAL H H 20 7.835 7.835 7.751 0.084 25158 7131 1 19 . 1 1 21 21 ALA N N 21 121.767 121.767 121.853 -0.086 25158 7132 1 19 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.092 -0.030 25158 7133 1 19 . 1 1 21 21 ALA C C 21 179.298 179.298 179.558 -0.260 25158 7134 1 19 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.257 -0.013 25158 7135 1 19 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.227 -0.438 25158 7136 1 19 . 1 1 21 21 ALA H H 21 7.804 7.804 8.253 -0.449 25158 7137 1 19 . 1 1 22 22 LEU N N 22 117.555 117.555 119.546 -1.991 25158 7138 1 19 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.046 0.100 25158 7139 1 19 . 1 1 22 22 LEU C C 22 177.914 177.914 178.526 -0.612 25158 7140 1 19 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.558 0.135 25158 7141 1 19 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.758 -0.243 25158 7142 1 19 . 1 1 22 22 LEU H H 22 8.619 8.619 7.718 0.900 25158 7143 1 19 . 1 1 23 23 LYS N N 23 120.335 120.335 119.331 1.004 25158 7144 1 19 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.966 -0.047 25158 7145 1 19 . 1 1 23 23 LYS C C 23 177.731 177.731 179.092 -1.361 25158 7146 1 19 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.789 0.548 25158 7147 1 19 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.194 -0.096 25158 7148 1 19 . 1 1 23 23 LYS H H 23 8.230 8.230 7.787 0.443 25158 7149 1 19 . 1 1 24 24 ARG N N 24 116.831 116.831 118.115 -1.284 25158 7150 1 19 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.014 -0.055 25158 7151 1 19 . 1 1 24 24 ARG C C 24 178.616 178.616 178.400 0.216 25158 7152 1 19 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.226 0.731 25158 7153 1 19 . 1 1 24 24 ARG CB C 24 29.563 29.563 29.823 -0.260 25158 7154 1 19 . 1 1 24 24 ARG H H 24 7.927 7.927 7.602 0.325 25158 7155 1 19 . 1 1 25 25 TYR N N 25 120.960 120.960 121.476 -0.516 25158 7156 1 19 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.248 -0.038 25158 7157 1 19 . 1 1 25 25 TYR C C 25 179.465 179.465 178.593 0.872 25158 7158 1 19 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.908 -0.063 25158 7159 1 19 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.515 0.550 25158 7160 1 19 . 1 1 25 25 TYR H H 25 8.321 8.321 7.603 0.718 25158 7161 1 19 . 1 1 26 26 VAL N N 26 120.405 120.405 119.215 1.190 25158 7162 1 19 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.826 -0.052 25158 7163 1 19 . 1 1 26 26 VAL C C 26 177.826 177.826 177.418 0.408 25158 7164 1 19 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.974 -0.534 25158 7165 1 19 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.776 -0.219 25158 7166 1 19 . 1 1 26 26 VAL H H 26 8.803 8.803 8.190 0.613 25158 7167 1 19 . 1 1 27 27 LEU N N 27 119.247 119.247 117.959 1.288 25158 7168 1 19 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.374 -0.098 25158 7169 1 19 . 1 1 27 27 LEU C C 27 176.753 176.753 176.080 0.673 25158 7170 1 19 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.626 1.049 25158 7171 1 19 . 1 1 27 27 LEU CB C 27 41.593 41.593 42.044 -0.451 25158 7172 1 19 . 1 1 27 27 LEU H H 27 7.898 7.898 7.644 0.254 25158 7173 1 19 . 1 1 28 28 ARG N N 28 116.082 116.082 117.115 -1.033 25158 7174 1 19 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.795 0.319 25158 7175 1 19 . 1 1 28 28 ARG C C 28 176.521 176.521 176.069 0.452 25158 7176 1 19 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.012 -0.858 25158 7177 1 19 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.782 -0.311 25158 7178 1 19 . 1 1 28 28 ARG H H 28 7.993 7.993 7.995 -0.002 25158 7179 1 19 . 1 1 29 29 SER N N 29 113.579 113.579 114.765 -1.186 25158 7180 1 19 . 1 1 29 29 SER HA H 29 4.305 4.305 4.314 -0.009 25158 7181 1 19 . 1 1 29 29 SER C C 29 175.368 175.368 175.625 -0.257 25158 7182 1 19 . 1 1 29 29 SER CA C 29 59.699 59.699 60.346 -0.647 25158 7183 1 19 . 1 1 29 29 SER CB C 29 63.908 63.908 64.010 -0.102 25158 7184 1 19 . 1 1 29 29 SER H H 29 8.094 8.094 8.418 -0.324 25158 7185 1 19 . 1 1 30 30 GLY N N 30 109.920 109.920 109.452 0.468 25158 7186 1 19 . 1 1 30 30 GLY C C 30 174.115 174.115 173.882 0.233 25158 7187 1 19 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.597 1.174 25158 7188 1 19 . 1 1 30 30 GLY H H 30 8.577 8.577 8.293 0.284 25158 7189 1 19 . 1 1 31 31 ILE N N 31 119.084 119.084 119.814 -0.730 25158 7190 1 19 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.388 -0.030 25158 7191 1 19 . 1 1 31 31 ILE C C 31 174.392 174.392 175.005 -0.613 25158 7192 1 19 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.159 0.087 25158 7193 1 19 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.737 -0.158 25158 7194 1 19 . 1 1 31 31 ILE H H 31 7.387 7.387 7.600 -0.213 25158 7195 1 19 . 1 1 32 32 SER N N 32 120.582 120.582 121.953 -1.371 25158 7196 1 19 . 1 1 32 32 SER HA H 32 4.845 4.845 4.856 -0.011 25158 7197 1 19 . 1 1 32 32 SER C C 32 173.891 173.891 174.121 -0.230 25158 7198 1 19 . 1 1 32 32 SER CA C 32 57.603 57.603 57.943 -0.340 25158 7199 1 19 . 1 1 32 32 SER CB C 32 63.849 63.849 63.632 0.217 25158 7200 1 19 . 1 1 32 32 SER H H 32 8.339 8.339 8.518 -0.179 25158 7201 1 19 . 1 1 33 33 ILE N N 33 116.629 116.629 120.135 -3.506 25158 7202 1 19 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.578 0.055 25158 7203 1 19 . 1 1 33 33 ILE C C 33 174.195 174.195 173.980 0.215 25158 7204 1 19 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.172 -0.060 25158 7205 1 19 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.515 2.067 25158 7206 1 19 . 1 1 33 33 ILE H H 33 7.873 7.873 8.110 -0.237 25158 7207 1 19 . 1 1 34 34 ASN N N 34 118.342 118.342 120.197 -1.855 25158 7208 1 19 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.896 -0.160 25158 7209 1 19 . 1 1 34 34 ASN C C 34 176.217 176.217 175.989 0.228 25158 7210 1 19 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.662 -0.476 25158 7211 1 19 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.526 -2.027 25158 7212 1 19 . 1 1 34 34 ASN H H 34 8.839 8.839 8.305 0.534 25158 7213 1 19 . 1 1 35 35 THR N N 35 116.120 116.120 116.843 -0.723 25158 7214 1 19 . 1 1 35 35 THR HA H 35 3.559 3.559 3.940 -0.381 25158 7215 1 19 . 1 1 35 35 THR C C 35 177.347 177.347 175.609 1.738 25158 7216 1 19 . 1 1 35 35 THR CA C 35 64.686 64.686 65.691 -1.005 25158 7217 1 19 . 1 1 35 35 THR CB C 35 67.758 67.758 69.100 -1.341 25158 7218 1 19 . 1 1 35 35 THR H H 35 7.939 7.939 8.231 -0.292 25158 7219 1 19 . 1 1 36 36 ASP N N 36 123.528 123.528 122.458 1.070 25158 7220 1 19 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.406 0.014 25158 7221 1 19 . 1 1 36 36 ASP C C 36 177.752 177.752 177.091 0.661 25158 7222 1 19 . 1 1 36 36 ASP CA C 36 57.074 57.074 56.934 0.140 25158 7223 1 19 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.271 -0.373 25158 7224 1 19 . 1 1 36 36 ASP H H 36 7.980 7.980 8.873 -0.893 25158 7225 1 19 . 1 1 37 37 ASN N N 37 115.690 115.690 116.476 -0.786 25158 7226 1 19 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.583 -0.317 25158 7227 1 19 . 1 1 37 37 ASN C C 37 175.589 175.589 176.752 -1.163 25158 7228 1 19 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.499 -1.939 25158 7229 1 19 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.438 -0.475 25158 7230 1 19 . 1 1 37 37 ASN H H 37 7.251 7.251 8.371 -1.120 25158 7231 1 19 . 1 1 38 38 ALA N N 38 119.560 119.560 123.679 -4.119 25158 7232 1 19 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.060 0.020 25158 7233 1 19 . 1 1 38 38 ALA C C 38 173.638 173.638 178.026 -4.388 25158 7234 1 19 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.157 -1.937 25158 7235 1 19 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.724 4.147 25158 7236 1 19 . 1 1 38 38 ALA H H 38 7.142 7.142 7.867 -0.725 25158 7237 1 19 . 1 1 39 39 ASP N N 39 115.003 115.003 119.724 -4.721 25158 7238 1 19 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.722 0.218 25158 7239 1 19 . 1 1 39 39 ASP C C 39 177.163 177.163 177.079 0.084 25158 7240 1 19 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.885 -2.714 25158 7241 1 19 . 1 1 39 39 ASP CB C 39 38.946 38.946 40.001 -1.055 25158 7242 1 19 . 1 1 39 39 ASP H H 39 7.096 7.096 7.780 -0.684 25158 7243 1 19 . 1 1 40 40 LEU N N 40 123.245 123.245 124.873 -1.628 25158 7244 1 19 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.224 -0.153 25158 7245 1 19 . 1 1 40 40 LEU C C 40 175.865 175.865 177.658 -1.793 25158 7246 1 19 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.551 0.042 25158 7247 1 19 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.355 -0.426 25158 7248 1 19 . 1 1 40 40 LEU H H 40 8.572 8.572 7.930 0.642 25158 7249 1 19 . 1 1 41 41 ASN N N 41 112.723 112.723 114.125 -1.402 25158 7250 1 19 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.762 0.237 25158 7251 1 19 . 1 1 41 41 ASN C C 41 173.846 173.846 175.247 -1.401 25158 7252 1 19 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.184 -0.951 25158 7253 1 19 . 1 1 41 41 ASN CB C 41 37.395 37.395 38.729 -1.334 25158 7254 1 19 . 1 1 41 41 ASN H H 41 8.004 8.004 7.845 0.159 25158 7255 1 19 . 1 1 42 42 GLU N N 42 115.798 115.798 116.216 -0.418 25158 7256 1 19 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.298 -0.346 25158 7257 1 19 . 1 1 42 42 GLU C C 42 175.172 175.172 175.645 -0.473 25158 7258 1 19 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.720 -0.369 25158 7259 1 19 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.311 0.910 25158 7260 1 19 . 1 1 42 42 GLU H H 42 7.642 7.642 8.470 -0.828 25158 7261 1 19 . 1 1 43 43 ASP N N 43 117.453 117.453 117.015 0.438 25158 7262 1 19 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.526 0.313 25158 7263 1 19 . 1 1 43 43 ASP C C 43 178.129 178.129 177.202 0.927 25158 7264 1 19 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.723 -1.085 25158 7265 1 19 . 1 1 43 43 ASP CB C 43 41.214 41.214 40.888 0.326 25158 7266 1 19 . 1 1 43 43 ASP H H 43 8.473 8.473 8.728 -0.255 25158 7267 1 19 . 1 1 44 44 GLY N N 44 112.490 112.490 107.531 4.959 25158 7268 1 19 . 1 1 44 44 GLY C C 44 173.717 173.717 173.617 0.100 25158 7269 1 19 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.808 0.509 25158 7270 1 19 . 1 1 44 44 GLY H H 44 10.139 10.139 8.865 1.274 25158 7271 1 19 . 1 1 45 45 ARG N N 45 118.154 118.154 118.336 -0.182 25158 7272 1 19 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.655 0.133 25158 7273 1 19 . 1 1 45 45 ARG C C 45 175.602 175.602 174.268 1.334 25158 7274 1 19 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.546 -0.714 25158 7275 1 19 . 1 1 45 45 ARG CB C 45 33.664 33.664 33.087 0.577 25158 7276 1 19 . 1 1 45 45 ARG H H 45 7.994 7.994 8.506 -0.512 25158 7277 1 19 . 1 1 46 46 VAL N N 46 126.392 126.392 123.180 3.212 25158 7278 1 19 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.469 0.321 25158 7279 1 19 . 1 1 46 46 VAL C C 46 174.644 174.644 175.319 -0.675 25158 7280 1 19 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.977 -0.248 25158 7281 1 19 . 1 1 46 46 VAL CB C 46 31.666 31.666 31.024 0.642 25158 7282 1 19 . 1 1 46 46 VAL H H 46 9.115 9.115 8.475 0.640 25158 7283 1 19 . 1 1 47 47 ASN N N 47 126.737 126.737 125.865 0.872 25158 7284 1 19 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.934 -0.059 25158 7285 1 19 . 1 1 47 47 ASN C C 47 176.467 176.467 175.754 0.713 25158 7286 1 19 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.369 0.671 25158 7287 1 19 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.410 -0.223 25158 7288 1 19 . 1 1 47 47 ASN H H 47 10.077 10.077 7.875 2.202 25158 7289 1 19 . 1 1 48 48 SER N N 48 113.409 113.409 114.672 -1.263 25158 7290 1 19 . 1 1 48 48 SER HA H 48 4.086 4.086 4.147 -0.061 25158 7291 1 19 . 1 1 48 48 SER C C 48 176.671 176.671 176.100 0.571 25158 7292 1 19 . 1 1 48 48 SER CA C 48 62.375 62.375 61.896 0.479 25158 7293 1 19 . 1 1 48 48 SER CB C 48 62.375 62.375 62.845 -0.470 25158 7294 1 19 . 1 1 48 48 SER H H 48 8.936 8.936 8.793 0.143 25158 7295 1 19 . 1 1 49 49 THR N N 49 121.885 121.885 118.131 3.754 25158 7296 1 19 . 1 1 49 49 THR HA H 49 4.112 4.112 3.901 0.211 25158 7297 1 19 . 1 1 49 49 THR C C 49 177.320 177.320 176.334 0.986 25158 7298 1 19 . 1 1 49 49 THR CA C 49 66.713 66.713 66.588 0.125 25158 7299 1 19 . 1 1 49 49 THR CB C 49 67.787 67.787 68.453 -0.666 25158 7300 1 19 . 1 1 49 49 THR H H 49 8.124 8.124 7.614 0.510 25158 7301 1 19 . 1 1 50 50 ASP N N 50 120.401 120.401 122.077 -1.676 25158 7302 1 19 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.353 0.017 25158 7303 1 19 . 1 1 50 50 ASP C C 50 177.033 177.033 178.169 -1.136 25158 7304 1 19 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.187 1.633 25158 7305 1 19 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.170 1.538 25158 7306 1 19 . 1 1 50 50 ASP H H 50 7.560 7.560 7.694 -0.134 25158 7307 1 19 . 1 1 51 51 LEU N N 51 118.174 118.174 120.716 -2.542 25158 7308 1 19 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.036 0.152 25158 7309 1 19 . 1 1 51 51 LEU C C 51 177.441 177.441 178.554 -1.113 25158 7310 1 19 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.203 -0.066 25158 7311 1 19 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.806 0.041 25158 7312 1 19 . 1 1 51 51 LEU H H 51 7.134 7.134 7.561 -0.427 25158 7313 1 19 . 1 1 52 52 GLY N N 52 105.596 105.596 106.251 -0.655 25158 7314 1 19 . 1 1 52 52 GLY C C 52 176.764 176.764 175.885 0.879 25158 7315 1 19 . 1 1 52 52 GLY CA C 52 47.642 47.642 47.005 0.637 25158 7316 1 19 . 1 1 52 52 GLY H H 52 8.034 8.034 7.728 0.306 25158 7317 1 19 . 1 1 53 53 ILE N N 53 122.043 122.043 122.621 -0.578 25158 7318 1 19 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.811 -0.362 25158 7319 1 19 . 1 1 53 53 ILE C C 53 177.112 177.112 177.494 -0.382 25158 7320 1 19 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.532 0.856 25158 7321 1 19 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.937 0.321 25158 7322 1 19 . 1 1 53 53 ILE H H 53 7.611 7.611 7.451 0.160 25158 7323 1 19 . 1 1 54 54 LEU N N 54 120.787 120.787 121.233 -0.446 25158 7324 1 19 . 1 1 54 54 LEU HA H 54 3.941 3.941 4.074 -0.133 25158 7325 1 19 . 1 1 54 54 LEU C C 54 175.340 175.340 178.568 -3.228 25158 7326 1 19 . 1 1 54 54 LEU CA C 54 58.195 58.195 57.944 0.251 25158 7327 1 19 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.009 0.212 25158 7328 1 19 . 1 1 54 54 LEU H H 54 8.323 8.323 8.535 -0.212 25158 7329 1 19 . 1 1 55 55 LYS N N 55 116.833 116.833 119.358 -2.525 25158 7330 1 19 . 1 1 55 55 LYS HA H 55 3.884 3.884 4.056 -0.172 25158 7331 1 19 . 1 1 55 55 LYS C C 55 179.067 179.067 178.954 0.113 25158 7332 1 19 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.642 1.009 25158 7333 1 19 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.440 -0.431 25158 7334 1 19 . 1 1 55 55 LYS H H 55 8.356 8.356 7.570 0.786 25158 7335 1 19 . 1 1 56 56 ARG N N 56 117.092 117.092 119.612 -2.520 25158 7336 1 19 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.300 -0.384 25158 7337 1 19 . 1 1 56 56 ARG C C 56 178.223 178.223 178.827 -0.604 25158 7338 1 19 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.467 0.884 25158 7339 1 19 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.187 0.593 25158 7340 1 19 . 1 1 56 56 ARG H H 56 7.543 7.543 7.756 -0.213 25158 7341 1 19 . 1 1 57 57 TYR N N 57 122.187 122.187 121.411 0.776 25158 7342 1 19 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.524 -0.132 25158 7343 1 19 . 1 1 57 57 TYR C C 57 180.009 180.009 178.559 1.450 25158 7344 1 19 . 1 1 57 57 TYR CA C 57 61.579 61.579 60.628 0.951 25158 7345 1 19 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.467 0.369 25158 7346 1 19 . 1 1 57 57 TYR H H 57 8.592 8.592 8.212 0.380 25158 7347 1 19 . 1 1 58 58 ILE N N 58 122.825 122.825 117.950 4.875 25158 7348 1 19 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.666 0.014 25158 7349 1 19 . 1 1 58 58 ILE C C 58 178.186 178.186 177.107 1.079 25158 7350 1 19 . 1 1 58 58 ILE CA C 58 64.768 64.768 64.123 0.645 25158 7351 1 19 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.104 -0.384 25158 7352 1 19 . 1 1 58 58 ILE H H 58 8.779 8.779 7.600 1.179 25158 7353 1 19 . 1 1 59 59 LEU N N 59 118.552 118.552 118.060 0.492 25158 7354 1 19 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.318 -0.095 25158 7355 1 19 . 1 1 59 59 LEU C C 59 175.937 175.937 175.919 0.018 25158 7356 1 19 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.500 1.012 25158 7357 1 19 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.682 0.744 25158 7358 1 19 . 1 1 59 59 LEU H H 59 7.539 7.539 7.535 0.004 25158 7359 1 19 . 1 1 60 60 LYS N N 60 113.650 113.650 115.661 -2.011 25158 7360 1 19 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.867 0.128 25158 7361 1 19 . 1 1 60 60 LYS C C 60 176.535 176.535 176.217 0.318 25158 7362 1 19 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.722 -0.431 25158 7363 1 19 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.318 -1.047 25158 7364 1 19 . 1 1 60 60 LYS H H 60 7.815 7.815 7.555 0.260 25158 7365 1 19 . 1 1 61 61 GLU N N 61 117.535 117.535 116.794 0.741 25158 7366 1 19 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.289 -0.145 25158 7367 1 19 . 1 1 61 61 GLU C C 61 176.992 176.992 176.525 0.467 25158 7368 1 19 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.883 -0.194 25158 7369 1 19 . 1 1 61 61 GLU CB C 61 30.692 30.692 30.997 -0.305 25158 7370 1 19 . 1 1 61 61 GLU H H 61 8.438 8.438 8.216 0.222 25158 7371 1 19 . 1 1 62 62 ILE N N 62 112.102 112.102 116.079 -3.977 25158 7372 1 19 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.561 -0.178 25158 7373 1 19 . 1 1 62 62 ILE C C 62 175.425 175.425 174.728 0.697 25158 7374 1 19 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.085 -0.159 25158 7375 1 19 . 1 1 62 62 ILE CB C 62 41.748 41.748 39.611 2.137 25158 7376 1 19 . 1 1 62 62 ILE H H 62 6.867 6.867 7.370 -0.503 25158 7377 1 19 . 1 1 63 63 ASP N N 63 119.719 119.719 123.076 -3.357 25158 7378 1 19 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.909 -0.235 25158 7379 1 19 . 1 1 63 63 ASP C C 63 176.202 176.202 175.899 0.303 25158 7380 1 19 . 1 1 63 63 ASP CA C 63 54.818 54.818 53.003 1.815 25158 7381 1 19 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.048 1.169 25158 7382 1 19 . 1 1 63 63 ASP H H 63 8.561 8.561 8.847 -0.286 25158 7383 1 19 . 1 1 64 64 THR N N 64 113.289 113.289 116.885 -3.596 25158 7384 1 19 . 1 1 64 64 THR HA H 64 4.712 4.712 4.568 0.144 25158 7385 1 19 . 1 1 64 64 THR C C 64 170.854 170.854 173.143 -2.289 25158 7386 1 19 . 1 1 64 64 THR CA C 64 61.269 61.269 62.020 -0.751 25158 7387 1 19 . 1 1 64 64 THR CB C 64 71.993 71.993 69.057 2.936 25158 7388 1 19 . 1 1 64 64 THR H H 64 7.410 7.410 7.740 -0.330 25158 7389 1 19 . 1 1 65 65 LEU N N 65 121.012 121.012 126.864 -5.852 25158 7390 1 19 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.666 -0.437 25158 7391 1 19 . 1 1 65 65 LEU C C 65 174.763 174.763 175.038 -0.275 25158 7392 1 19 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.664 -0.030 25158 7393 1 19 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.989 0.531 25158 7394 1 19 . 1 1 65 65 LEU H H 65 7.877 7.877 8.408 -0.531 25158 7395 1 19 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.030 -0.038 25158 7396 1 19 . 1 1 66 66 PRO C C 66 174.419 174.419 175.034 -0.615 25158 7397 1 19 . 1 1 66 66 PRO CA C 66 62.310 62.310 61.968 0.342 25158 7398 1 19 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.414 2.812 25158 7399 1 19 . 1 1 67 67 TYR N N 67 122.616 122.616 121.604 1.012 25158 7400 1 19 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.242 0.414 25158 7401 1 19 . 1 1 67 67 TYR C C 67 174.446 174.446 175.043 -0.597 25158 7402 1 19 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.697 -0.686 25158 7403 1 19 . 1 1 67 67 TYR CB C 67 41.081 41.081 38.237 2.844 25158 7404 1 19 . 1 1 67 67 TYR H H 67 8.662 8.662 7.987 0.675 25158 7405 1 19 . 1 1 68 68 LYS N N 68 126.223 126.223 129.020 -2.797 25158 7406 1 19 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.312 -0.044 25158 7407 1 19 . 1 1 68 68 LYS C C 68 174.748 174.748 174.701 0.047 25158 7408 1 19 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.192 0.411 25158 7409 1 19 . 1 1 68 68 LYS CB C 68 32.770 32.770 31.878 0.892 25158 7410 1 19 . 1 1 68 68 LYS H H 68 8.112 8.112 8.156 -0.044 25158 7411 1 20 . 1 1 2 2 THR N N 2 116.700 116.700 116.476 0.224 25158 7412 1 20 . 1 1 2 2 THR HA H 2 4.313 4.313 4.342 -0.029 25158 7413 1 20 . 1 1 2 2 THR C C 2 173.968 173.968 174.953 -0.985 25158 7414 1 20 . 1 1 2 2 THR CA C 2 62.326 62.326 61.596 0.730 25158 7415 1 20 . 1 1 2 2 THR CB C 2 70.154 70.154 69.881 0.273 25158 7416 1 20 . 1 1 2 2 THR H H 2 8.657 8.657 8.294 0.363 25158 7417 1 20 . 1 1 3 3 LYS N N 3 125.500 125.500 124.110 1.390 25158 7418 1 20 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.364 -0.299 25158 7419 1 20 . 1 1 3 3 LYS C C 3 174.926 174.926 175.471 -0.545 25158 7420 1 20 . 1 1 3 3 LYS CA C 3 56.839 56.839 55.857 0.982 25158 7421 1 20 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.586 1.191 25158 7422 1 20 . 1 1 3 3 LYS H H 3 8.318 8.318 8.308 0.010 25158 7423 1 20 . 1 1 4 4 LEU N N 4 127.473 127.473 125.333 2.140 25158 7424 1 20 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.405 0.078 25158 7425 1 20 . 1 1 4 4 LEU C C 4 174.734 174.734 175.417 -0.683 25158 7426 1 20 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.675 -0.416 25158 7427 1 20 . 1 1 4 4 LEU CB C 4 40.929 40.929 44.401 -3.472 25158 7428 1 20 . 1 1 4 4 LEU H H 4 7.726 7.726 7.735 -0.009 25158 7429 1 20 . 1 1 5 5 TYR N N 5 123.074 123.074 125.335 -2.261 25158 7430 1 20 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.458 -0.835 25158 7431 1 20 . 1 1 5 5 TYR C C 5 175.406 175.406 176.763 -1.357 25158 7432 1 20 . 1 1 5 5 TYR CA C 5 61.812 61.812 59.132 2.680 25158 7433 1 20 . 1 1 5 5 TYR CB C 5 39.110 39.110 36.589 2.521 25158 7434 1 20 . 1 1 5 5 TYR H H 5 7.816 7.816 8.681 -0.865 25158 7435 1 20 . 1 1 6 6 GLY N N 6 108.614 108.614 114.606 -5.992 25158 7436 1 20 . 1 1 6 6 GLY C C 6 172.585 172.585 174.048 -1.463 25158 7437 1 20 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.736 0.651 25158 7438 1 20 . 1 1 6 6 GLY H H 6 8.915 8.915 8.808 0.107 25158 7439 1 20 . 1 1 7 7 ASP N N 7 118.023 118.023 124.458 -6.435 25158 7440 1 20 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.784 0.200 25158 7441 1 20 . 1 1 7 7 ASP C C 7 177.806 177.806 177.569 0.237 25158 7442 1 20 . 1 1 7 7 ASP CA C 7 52.192 52.192 53.309 -1.117 25158 7443 1 20 . 1 1 7 7 ASP CB C 7 39.150 39.150 39.601 -0.451 25158 7444 1 20 . 1 1 7 7 ASP H H 7 7.976 7.976 8.124 -0.148 25158 7445 1 20 . 1 1 8 8 VAL N N 8 120.293 120.293 119.515 0.778 25158 7446 1 20 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.142 -0.159 25158 7447 1 20 . 1 1 8 8 VAL C C 8 175.717 175.717 176.919 -1.202 25158 7448 1 20 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.569 -0.124 25158 7449 1 20 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.309 -0.038 25158 7450 1 20 . 1 1 8 8 VAL H H 8 8.156 8.156 8.465 -0.309 25158 7451 1 20 . 1 1 9 9 ASN N N 9 115.226 115.226 115.724 -0.498 25158 7452 1 20 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.603 0.386 25158 7453 1 20 . 1 1 9 9 ASN C C 9 174.626 174.626 175.222 -0.596 25158 7454 1 20 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.674 -1.724 25158 7455 1 20 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.378 -0.677 25158 7456 1 20 . 1 1 9 9 ASN H H 9 8.008 8.008 8.317 -0.309 25158 7457 1 20 . 1 1 10 10 ASP N N 10 115.600 115.600 118.574 -2.974 25158 7458 1 20 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.573 -0.137 25158 7459 1 20 . 1 1 10 10 ASP C C 10 175.125 175.125 175.523 -0.398 25158 7460 1 20 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.202 1.033 25158 7461 1 20 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.508 0.692 25158 7462 1 20 . 1 1 10 10 ASP H H 10 7.374 7.374 8.076 -0.702 25158 7463 1 20 . 1 1 11 11 ASP N N 11 118.402 118.402 117.438 0.964 25158 7464 1 20 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.710 0.107 25158 7465 1 20 . 1 1 11 11 ASP C C 11 178.299 178.299 177.434 0.865 25158 7466 1 20 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.803 -0.982 25158 7467 1 20 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.649 -0.535 25158 7468 1 20 . 1 1 11 11 ASP H H 11 8.801 8.801 9.110 -0.309 25158 7469 1 20 . 1 1 12 12 GLY N N 12 112.353 112.353 108.409 3.944 25158 7470 1 20 . 1 1 12 12 GLY C C 12 173.284 173.284 173.551 -0.267 25158 7471 1 20 . 1 1 12 12 GLY CA C 12 45.624 45.624 44.883 0.741 25158 7472 1 20 . 1 1 12 12 GLY H H 12 10.293 10.293 8.554 1.739 25158 7473 1 20 . 1 1 13 13 LYS N N 13 118.118 118.118 120.980 -2.862 25158 7474 1 20 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.681 -0.022 25158 7475 1 20 . 1 1 13 13 LYS C C 13 175.595 175.595 175.021 0.574 25158 7476 1 20 . 1 1 13 13 LYS CA C 13 53.758 53.758 54.711 -0.953 25158 7477 1 20 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.449 0.890 25158 7478 1 20 . 1 1 13 13 LYS H H 13 7.848 7.848 8.780 -0.932 25158 7479 1 20 . 1 1 14 14 VAL N N 14 126.591 126.591 124.703 1.888 25158 7480 1 20 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.141 0.614 25158 7481 1 20 . 1 1 14 14 VAL C C 14 175.052 175.052 175.163 -0.111 25158 7482 1 20 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.817 0.253 25158 7483 1 20 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.477 0.978 25158 7484 1 20 . 1 1 14 14 VAL H H 14 9.109 9.109 8.439 0.670 25158 7485 1 20 . 1 1 15 15 ASN N N 15 126.287 126.287 125.904 0.383 25158 7486 1 20 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.948 -0.133 25158 7487 1 20 . 1 1 15 15 ASN C C 15 176.340 176.340 176.460 -0.120 25158 7488 1 20 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.535 0.740 25158 7489 1 20 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.721 -2.501 25158 7490 1 20 . 1 1 15 15 ASN H H 15 10.071 10.071 8.582 1.489 25158 7491 1 20 . 1 1 16 16 SER N N 16 113.168 113.168 116.088 -2.920 25158 7492 1 20 . 1 1 16 16 SER HA H 16 4.047 4.047 4.208 -0.161 25158 7493 1 20 . 1 1 16 16 SER C C 16 176.197 176.197 175.676 0.521 25158 7494 1 20 . 1 1 16 16 SER CA C 16 62.681 62.681 61.891 0.791 25158 7495 1 20 . 1 1 16 16 SER CB C 16 62.681 62.681 62.903 -0.222 25158 7496 1 20 . 1 1 16 16 SER H H 16 8.825 8.825 8.806 0.019 25158 7497 1 20 . 1 1 17 17 THR N N 17 119.391 119.391 115.408 3.983 25158 7498 1 20 . 1 1 17 17 THR HA H 17 3.983 3.983 4.052 -0.069 25158 7499 1 20 . 1 1 17 17 THR C C 17 177.149 177.149 176.444 0.705 25158 7500 1 20 . 1 1 17 17 THR CA C 17 66.791 66.791 65.555 1.236 25158 7501 1 20 . 1 1 17 17 THR CB C 17 67.757 67.757 68.435 -0.678 25158 7502 1 20 . 1 1 17 17 THR H H 17 7.946 7.946 8.185 -0.239 25158 7503 1 20 . 1 1 18 18 ASP N N 18 120.318 120.318 121.103 -0.785 25158 7504 1 20 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.427 -0.057 25158 7505 1 20 . 1 1 18 18 ASP C C 18 177.168 177.168 177.708 -0.540 25158 7506 1 20 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.737 1.177 25158 7507 1 20 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.508 1.653 25158 7508 1 20 . 1 1 18 18 ASP H H 18 7.995 7.995 7.869 0.126 25158 7509 1 20 . 1 1 19 19 ALA N N 19 120.191 120.191 122.437 -2.246 25158 7510 1 20 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.179 -0.131 25158 7511 1 20 . 1 1 19 19 ALA C C 19 179.549 179.549 179.378 0.171 25158 7512 1 20 . 1 1 19 19 ALA CA C 19 55.413 55.413 54.976 0.437 25158 7513 1 20 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.530 -1.217 25158 7514 1 20 . 1 1 19 19 ALA H H 19 7.085 7.085 7.476 -0.391 25158 7515 1 20 . 1 1 20 20 VAL N N 20 120.613 120.613 119.009 1.604 25158 7516 1 20 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.694 -0.083 25158 7517 1 20 . 1 1 20 20 VAL C C 20 178.153 178.153 177.355 0.798 25158 7518 1 20 . 1 1 20 20 VAL CA C 20 66.767 66.767 64.946 1.821 25158 7519 1 20 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.545 0.323 25158 7520 1 20 . 1 1 20 20 VAL H H 20 7.835 7.835 7.506 0.329 25158 7521 1 20 . 1 1 21 21 ALA N N 21 121.767 121.767 121.389 0.378 25158 7522 1 20 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.160 -0.098 25158 7523 1 20 . 1 1 21 21 ALA C C 21 179.298 179.298 179.499 -0.201 25158 7524 1 20 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.024 0.220 25158 7525 1 20 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.274 -0.485 25158 7526 1 20 . 1 1 21 21 ALA H H 21 7.804 7.804 7.799 0.005 25158 7527 1 20 . 1 1 22 22 LEU N N 22 117.555 117.555 120.389 -2.834 25158 7528 1 20 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.093 0.053 25158 7529 1 20 . 1 1 22 22 LEU C C 22 177.914 177.914 178.254 -0.340 25158 7530 1 20 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.717 -0.024 25158 7531 1 20 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.734 -0.219 25158 7532 1 20 . 1 1 22 22 LEU H H 22 8.619 8.619 7.639 0.980 25158 7533 1 20 . 1 1 23 23 LYS N N 23 120.335 120.335 119.234 1.101 25158 7534 1 20 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.937 -0.018 25158 7535 1 20 . 1 1 23 23 LYS C C 23 177.731 177.731 179.256 -1.525 25158 7536 1 20 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.704 0.633 25158 7537 1 20 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.234 -0.136 25158 7538 1 20 . 1 1 23 23 LYS H H 23 8.230 8.230 7.791 0.439 25158 7539 1 20 . 1 1 24 24 ARG N N 24 116.831 116.831 118.063 -1.232 25158 7540 1 20 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.088 -0.129 25158 7541 1 20 . 1 1 24 24 ARG C C 24 178.616 178.616 178.312 0.304 25158 7542 1 20 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.594 0.363 25158 7543 1 20 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.222 -0.659 25158 7544 1 20 . 1 1 24 24 ARG H H 24 7.927 7.927 7.639 0.288 25158 7545 1 20 . 1 1 25 25 TYR N N 25 120.960 120.960 120.999 -0.039 25158 7546 1 20 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.299 -0.089 25158 7547 1 20 . 1 1 25 25 TYR C C 25 179.465 179.465 178.242 1.223 25158 7548 1 20 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.024 0.821 25158 7549 1 20 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.075 0.990 25158 7550 1 20 . 1 1 25 25 TYR H H 25 8.321 8.321 7.476 0.845 25158 7551 1 20 . 1 1 26 26 VAL N N 26 120.405 120.405 117.917 2.488 25158 7552 1 20 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.656 0.118 25158 7553 1 20 . 1 1 26 26 VAL C C 26 177.826 177.826 176.514 1.312 25158 7554 1 20 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.749 -0.309 25158 7555 1 20 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.734 -0.177 25158 7556 1 20 . 1 1 26 26 VAL H H 26 8.803 8.803 8.196 0.607 25158 7557 1 20 . 1 1 27 27 LEU N N 27 119.247 119.247 117.152 2.095 25158 7558 1 20 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.368 -0.092 25158 7559 1 20 . 1 1 27 27 LEU C C 27 176.753 176.753 176.056 0.697 25158 7560 1 20 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.181 1.494 25158 7561 1 20 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.843 -0.250 25158 7562 1 20 . 1 1 27 27 LEU H H 27 7.898 7.898 7.313 0.585 25158 7563 1 20 . 1 1 28 28 ARG N N 28 116.082 116.082 117.879 -1.797 25158 7564 1 20 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.834 0.280 25158 7565 1 20 . 1 1 28 28 ARG C C 28 176.521 176.521 176.321 0.200 25158 7566 1 20 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.169 -1.015 25158 7567 1 20 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.159 0.312 25158 7568 1 20 . 1 1 28 28 ARG H H 28 7.993 7.993 7.579 0.414 25158 7569 1 20 . 1 1 29 29 SER N N 29 113.579 113.579 115.756 -2.177 25158 7570 1 20 . 1 1 29 29 SER HA H 29 4.305 4.305 4.307 -0.002 25158 7571 1 20 . 1 1 29 29 SER C C 29 175.368 175.368 175.577 -0.209 25158 7572 1 20 . 1 1 29 29 SER CA C 29 59.699 59.699 60.410 -0.711 25158 7573 1 20 . 1 1 29 29 SER CB C 29 63.908 63.908 63.924 -0.016 25158 7574 1 20 . 1 1 29 29 SER H H 29 8.094 8.094 8.479 -0.385 25158 7575 1 20 . 1 1 30 30 GLY N N 30 109.920 109.920 109.116 0.804 25158 7576 1 20 . 1 1 30 30 GLY C C 30 174.115 174.115 173.576 0.539 25158 7577 1 20 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.831 0.940 25158 7578 1 20 . 1 1 30 30 GLY H H 30 8.577 8.577 8.545 0.032 25158 7579 1 20 . 1 1 31 31 ILE N N 31 119.084 119.084 119.719 -0.635 25158 7580 1 20 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.367 -0.009 25158 7581 1 20 . 1 1 31 31 ILE C C 31 174.392 174.392 174.737 -0.345 25158 7582 1 20 . 1 1 31 31 ILE CA C 31 60.246 60.246 59.995 0.251 25158 7583 1 20 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.345 0.234 25158 7584 1 20 . 1 1 31 31 ILE H H 31 7.387 7.387 7.868 -0.481 25158 7585 1 20 . 1 1 32 32 SER N N 32 120.582 120.582 125.199 -4.617 25158 7586 1 20 . 1 1 32 32 SER HA H 32 4.845 4.845 4.503 0.342 25158 7587 1 20 . 1 1 32 32 SER C C 32 173.891 173.891 174.024 -0.133 25158 7588 1 20 . 1 1 32 32 SER CA C 32 57.603 57.603 58.946 -1.343 25158 7589 1 20 . 1 1 32 32 SER CB C 32 63.849 63.849 63.298 0.551 25158 7590 1 20 . 1 1 32 32 SER H H 32 8.339 8.339 8.626 -0.287 25158 7591 1 20 . 1 1 33 33 ILE N N 33 116.629 116.629 120.214 -3.585 25158 7592 1 20 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.400 0.233 25158 7593 1 20 . 1 1 33 33 ILE C C 33 174.195 174.195 174.204 -0.009 25158 7594 1 20 . 1 1 33 33 ILE CA C 33 59.112 59.112 58.742 0.370 25158 7595 1 20 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.767 1.815 25158 7596 1 20 . 1 1 33 33 ILE H H 33 7.873 7.873 7.532 0.341 25158 7597 1 20 . 1 1 34 34 ASN N N 34 118.342 118.342 119.508 -1.166 25158 7598 1 20 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.780 -0.044 25158 7599 1 20 . 1 1 34 34 ASN C C 34 176.217 176.217 175.929 0.288 25158 7600 1 20 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.853 -0.667 25158 7601 1 20 . 1 1 34 34 ASN CB C 34 36.499 36.499 39.503 -3.004 25158 7602 1 20 . 1 1 34 34 ASN H H 34 8.839 8.839 8.577 0.262 25158 7603 1 20 . 1 1 35 35 THR N N 35 116.120 116.120 118.506 -2.386 25158 7604 1 20 . 1 1 35 35 THR HA H 35 3.559 3.559 4.137 -0.578 25158 7605 1 20 . 1 1 35 35 THR C C 35 177.347 177.347 176.007 1.340 25158 7606 1 20 . 1 1 35 35 THR CA C 35 64.686 64.686 65.123 -0.437 25158 7607 1 20 . 1 1 35 35 THR CB C 35 67.758 67.758 68.754 -0.996 25158 7608 1 20 . 1 1 35 35 THR H H 35 7.939 7.939 8.376 -0.437 25158 7609 1 20 . 1 1 36 36 ASP N N 36 123.528 123.528 121.866 1.662 25158 7610 1 20 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.326 0.094 25158 7611 1 20 . 1 1 36 36 ASP C C 36 177.752 177.752 177.140 0.612 25158 7612 1 20 . 1 1 36 36 ASP CA C 36 57.074 57.074 58.026 -0.952 25158 7613 1 20 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.774 -0.876 25158 7614 1 20 . 1 1 36 36 ASP H H 36 7.980 7.980 8.743 -0.763 25158 7615 1 20 . 1 1 37 37 ASN N N 37 115.690 115.690 116.435 -0.745 25158 7616 1 20 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.566 -0.300 25158 7617 1 20 . 1 1 37 37 ASN C C 37 175.589 175.589 177.372 -1.783 25158 7618 1 20 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.712 -2.151 25158 7619 1 20 . 1 1 37 37 ASN CB C 37 37.963 37.963 37.905 0.058 25158 7620 1 20 . 1 1 37 37 ASN H H 37 7.251 7.251 8.319 -1.068 25158 7621 1 20 . 1 1 38 38 ALA N N 38 119.560 119.560 123.456 -3.896 25158 7622 1 20 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.095 -0.015 25158 7623 1 20 . 1 1 38 38 ALA C C 38 173.638 173.638 178.042 -4.404 25158 7624 1 20 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.091 -1.871 25158 7625 1 20 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.770 4.101 25158 7626 1 20 . 1 1 38 38 ALA H H 38 7.142 7.142 7.670 -0.528 25158 7627 1 20 . 1 1 39 39 ASP N N 39 115.003 115.003 119.104 -4.101 25158 7628 1 20 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.638 0.302 25158 7629 1 20 . 1 1 39 39 ASP C C 39 177.163 177.163 177.094 0.069 25158 7630 1 20 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.878 -2.707 25158 7631 1 20 . 1 1 39 39 ASP CB C 39 38.946 38.946 40.176 -1.230 25158 7632 1 20 . 1 1 39 39 ASP H H 39 7.096 7.096 7.782 -0.686 25158 7633 1 20 . 1 1 40 40 LEU N N 40 123.245 123.245 125.393 -2.148 25158 7634 1 20 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.248 -0.177 25158 7635 1 20 . 1 1 40 40 LEU C C 40 175.865 175.865 177.269 -1.404 25158 7636 1 20 . 1 1 40 40 LEU CA C 40 56.593 56.593 55.949 0.644 25158 7637 1 20 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.270 -0.341 25158 7638 1 20 . 1 1 40 40 LEU H H 40 8.572 8.572 8.604 -0.032 25158 7639 1 20 . 1 1 41 41 ASN N N 41 112.723 112.723 113.834 -1.111 25158 7640 1 20 . 1 1 41 41 ASN HA H 41 4.999 4.999 5.029 -0.030 25158 7641 1 20 . 1 1 41 41 ASN C C 41 173.846 173.846 174.949 -1.103 25158 7642 1 20 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.071 -0.838 25158 7643 1 20 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.148 -1.753 25158 7644 1 20 . 1 1 41 41 ASN H H 41 8.004 8.004 7.876 0.128 25158 7645 1 20 . 1 1 42 42 GLU N N 42 115.798 115.798 115.264 0.534 25158 7646 1 20 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.227 -0.275 25158 7647 1 20 . 1 1 42 42 GLU C C 42 175.172 175.172 175.733 -0.561 25158 7648 1 20 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.646 -0.295 25158 7649 1 20 . 1 1 42 42 GLU CB C 42 28.221 28.221 26.882 1.339 25158 7650 1 20 . 1 1 42 42 GLU H H 42 7.642 7.642 8.235 -0.593 25158 7651 1 20 . 1 1 43 43 ASP N N 43 117.453 117.453 117.075 0.378 25158 7652 1 20 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.530 0.309 25158 7653 1 20 . 1 1 43 43 ASP C C 43 178.129 178.129 177.150 0.979 25158 7654 1 20 . 1 1 43 43 ASP CA C 43 52.638 52.638 53.807 -1.169 25158 7655 1 20 . 1 1 43 43 ASP CB C 43 41.214 41.214 40.850 0.364 25158 7656 1 20 . 1 1 43 43 ASP H H 43 8.473 8.473 9.044 -0.571 25158 7657 1 20 . 1 1 44 44 GLY N N 44 112.490 112.490 107.379 5.111 25158 7658 1 20 . 1 1 44 44 GLY C C 44 173.717 173.717 173.782 -0.065 25158 7659 1 20 . 1 1 44 44 GLY CA C 44 45.317 45.317 45.078 0.239 25158 7660 1 20 . 1 1 44 44 GLY H H 44 10.139 10.139 8.985 1.154 25158 7661 1 20 . 1 1 45 45 ARG N N 45 118.154 118.154 117.306 0.848 25158 7662 1 20 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.616 0.172 25158 7663 1 20 . 1 1 45 45 ARG C C 45 175.602 175.602 174.029 1.573 25158 7664 1 20 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.394 -0.562 25158 7665 1 20 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.574 1.090 25158 7666 1 20 . 1 1 45 45 ARG H H 45 7.994 7.994 9.149 -1.155 25158 7667 1 20 . 1 1 46 46 VAL N N 46 126.392 126.392 121.649 4.743 25158 7668 1 20 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.701 0.089 25158 7669 1 20 . 1 1 46 46 VAL C C 46 174.644 174.644 175.036 -0.392 25158 7670 1 20 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.371 0.358 25158 7671 1 20 . 1 1 46 46 VAL CB C 46 31.666 31.666 31.893 -0.227 25158 7672 1 20 . 1 1 46 46 VAL H H 46 9.115 9.115 8.672 0.443 25158 7673 1 20 . 1 1 47 47 ASN N N 47 126.737 126.737 125.929 0.808 25158 7674 1 20 . 1 1 47 47 ASN HA H 47 4.875 4.875 5.050 -0.175 25158 7675 1 20 . 1 1 47 47 ASN C C 47 176.467 176.467 175.737 0.730 25158 7676 1 20 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.858 0.182 25158 7677 1 20 . 1 1 47 47 ASN CB C 47 39.187 39.187 40.275 -1.088 25158 7678 1 20 . 1 1 47 47 ASN H H 47 10.077 10.077 8.141 1.936 25158 7679 1 20 . 1 1 48 48 SER N N 48 113.409 113.409 115.473 -2.064 25158 7680 1 20 . 1 1 48 48 SER HA H 48 4.086 4.086 4.196 -0.110 25158 7681 1 20 . 1 1 48 48 SER C C 48 176.671 176.671 176.039 0.632 25158 7682 1 20 . 1 1 48 48 SER CA C 48 62.375 62.375 61.193 1.182 25158 7683 1 20 . 1 1 48 48 SER CB C 48 62.375 62.375 63.151 -0.776 25158 7684 1 20 . 1 1 48 48 SER H H 48 8.936 8.936 8.721 0.215 25158 7685 1 20 . 1 1 49 49 THR N N 49 121.885 121.885 117.534 4.351 25158 7686 1 20 . 1 1 49 49 THR HA H 49 4.112 4.112 3.990 0.122 25158 7687 1 20 . 1 1 49 49 THR C C 49 177.320 177.320 176.570 0.750 25158 7688 1 20 . 1 1 49 49 THR CA C 49 66.713 66.713 66.242 0.471 25158 7689 1 20 . 1 1 49 49 THR CB C 49 67.787 67.787 67.986 -0.199 25158 7690 1 20 . 1 1 49 49 THR H H 49 8.124 8.124 8.218 -0.094 25158 7691 1 20 . 1 1 50 50 ASP N N 50 120.401 120.401 121.986 -1.585 25158 7692 1 20 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.322 0.048 25158 7693 1 20 . 1 1 50 50 ASP C C 50 177.033 177.033 178.141 -1.108 25158 7694 1 20 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.715 1.105 25158 7695 1 20 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.459 1.249 25158 7696 1 20 . 1 1 50 50 ASP H H 50 7.560 7.560 7.649 -0.089 25158 7697 1 20 . 1 1 51 51 LEU N N 51 118.174 118.174 119.690 -1.516 25158 7698 1 20 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.074 0.114 25158 7699 1 20 . 1 1 51 51 LEU C C 51 177.441 177.441 178.501 -1.060 25158 7700 1 20 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.122 0.015 25158 7701 1 20 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.823 0.024 25158 7702 1 20 . 1 1 51 51 LEU H H 51 7.134 7.134 7.669 -0.535 25158 7703 1 20 . 1 1 52 52 GLY N N 52 105.596 105.596 106.481 -0.885 25158 7704 1 20 . 1 1 52 52 GLY C C 52 176.764 176.764 175.855 0.909 25158 7705 1 20 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.732 0.910 25158 7706 1 20 . 1 1 52 52 GLY H H 52 8.034 8.034 7.532 0.502 25158 7707 1 20 . 1 1 53 53 ILE N N 53 122.043 122.043 123.099 -1.056 25158 7708 1 20 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.555 -0.106 25158 7709 1 20 . 1 1 53 53 ILE C C 53 177.112 177.112 177.723 -0.611 25158 7710 1 20 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.940 0.448 25158 7711 1 20 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.848 0.410 25158 7712 1 20 . 1 1 53 53 ILE H H 53 7.611 7.611 7.755 -0.144 25158 7713 1 20 . 1 1 54 54 LEU N N 54 120.787 120.787 120.000 0.787 25158 7714 1 20 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.962 -0.021 25158 7715 1 20 . 1 1 54 54 LEU C C 54 175.340 175.340 178.638 -3.298 25158 7716 1 20 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.558 -0.363 25158 7717 1 20 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.848 -0.627 25158 7718 1 20 . 1 1 54 54 LEU H H 54 8.323 8.323 8.507 -0.184 25158 7719 1 20 . 1 1 55 55 LYS N N 55 116.833 116.833 119.353 -2.520 25158 7720 1 20 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.970 -0.086 25158 7721 1 20 . 1 1 55 55 LYS C C 55 179.067 179.067 179.296 -0.229 25158 7722 1 20 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.815 0.836 25158 7723 1 20 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.180 -0.171 25158 7724 1 20 . 1 1 55 55 LYS H H 55 8.356 8.356 7.558 0.798 25158 7725 1 20 . 1 1 56 56 ARG N N 56 117.092 117.092 118.707 -1.615 25158 7726 1 20 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.334 -0.418 25158 7727 1 20 . 1 1 56 56 ARG C C 56 178.223 178.223 178.717 -0.494 25158 7728 1 20 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.275 1.076 25158 7729 1 20 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.168 0.612 25158 7730 1 20 . 1 1 56 56 ARG H H 56 7.543 7.543 7.762 -0.219 25158 7731 1 20 . 1 1 57 57 TYR N N 57 122.187 122.187 121.776 0.411 25158 7732 1 20 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.724 -0.332 25158 7733 1 20 . 1 1 57 57 TYR C C 57 180.009 180.009 178.678 1.331 25158 7734 1 20 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.032 0.547 25158 7735 1 20 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.666 0.170 25158 7736 1 20 . 1 1 57 57 TYR H H 57 8.592 8.592 7.663 0.929 25158 7737 1 20 . 1 1 58 58 ILE N N 58 122.825 122.825 117.749 5.076 25158 7738 1 20 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.844 -0.164 25158 7739 1 20 . 1 1 58 58 ILE C C 58 178.186 178.186 176.597 1.589 25158 7740 1 20 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.652 1.116 25158 7741 1 20 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.236 -0.516 25158 7742 1 20 . 1 1 58 58 ILE H H 58 8.779 8.779 7.829 0.950 25158 7743 1 20 . 1 1 59 59 LEU N N 59 118.552 118.552 118.164 0.388 25158 7744 1 20 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.380 -0.157 25158 7745 1 20 . 1 1 59 59 LEU C C 59 175.937 175.937 176.037 -0.100 25158 7746 1 20 . 1 1 59 59 LEU CA C 59 55.512 55.512 53.950 1.562 25158 7747 1 20 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.365 1.061 25158 7748 1 20 . 1 1 59 59 LEU H H 59 7.539 7.539 7.693 -0.154 25158 7749 1 20 . 1 1 60 60 LYS N N 60 113.650 113.650 117.739 -4.089 25158 7750 1 20 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.827 0.168 25158 7751 1 20 . 1 1 60 60 LYS C C 60 176.535 176.535 176.256 0.279 25158 7752 1 20 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.467 -0.176 25158 7753 1 20 . 1 1 60 60 LYS CB C 60 28.271 28.271 30.389 -2.118 25158 7754 1 20 . 1 1 60 60 LYS H H 60 7.815 7.815 7.633 0.182 25158 7755 1 20 . 1 1 61 61 GLU N N 61 117.535 117.535 115.960 1.575 25158 7756 1 20 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.310 -0.166 25158 7757 1 20 . 1 1 61 61 GLU C C 61 176.992 176.992 176.469 0.523 25158 7758 1 20 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.823 -0.134 25158 7759 1 20 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.225 -0.533 25158 7760 1 20 . 1 1 61 61 GLU H H 61 8.438 8.438 8.376 0.062 25158 7761 1 20 . 1 1 62 62 ILE N N 62 112.102 112.102 114.393 -2.291 25158 7762 1 20 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.544 -0.161 25158 7763 1 20 . 1 1 62 62 ILE C C 62 175.425 175.425 174.281 1.144 25158 7764 1 20 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.296 -0.370 25158 7765 1 20 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.818 0.930 25158 7766 1 20 . 1 1 62 62 ILE H H 62 6.867 6.867 7.558 -0.691 25158 7767 1 20 . 1 1 63 63 ASP N N 63 119.719 119.719 124.456 -4.737 25158 7768 1 20 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.882 -0.208 25158 7769 1 20 . 1 1 63 63 ASP C C 63 176.202 176.202 176.495 -0.293 25158 7770 1 20 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.555 0.263 25158 7771 1 20 . 1 1 63 63 ASP CB C 63 42.217 42.217 42.089 0.128 25158 7772 1 20 . 1 1 63 63 ASP H H 63 8.561 8.561 8.821 -0.260 25158 7773 1 20 . 1 1 64 64 THR N N 64 113.289 113.289 117.947 -4.658 25158 7774 1 20 . 1 1 64 64 THR HA H 64 4.712 4.712 4.334 0.378 25158 7775 1 20 . 1 1 64 64 THR C C 64 170.854 170.854 173.288 -2.434 25158 7776 1 20 . 1 1 64 64 THR CA C 64 61.269 61.269 63.046 -1.777 25158 7777 1 20 . 1 1 64 64 THR CB C 64 71.993 71.993 68.857 3.136 25158 7778 1 20 . 1 1 64 64 THR H H 64 7.410 7.410 7.852 -0.442 25158 7779 1 20 . 1 1 65 65 LEU N N 65 121.012 121.012 127.568 -6.556 25158 7780 1 20 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.629 -0.400 25158 7781 1 20 . 1 1 65 65 LEU C C 65 174.763 174.763 174.841 -0.078 25158 7782 1 20 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.544 0.091 25158 7783 1 20 . 1 1 65 65 LEU CB C 65 44.520 44.520 44.404 0.117 25158 7784 1 20 . 1 1 65 65 LEU H H 65 7.877 7.877 8.327 -0.450 25158 7785 1 20 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.134 -0.142 25158 7786 1 20 . 1 1 66 66 PRO C C 66 174.419 174.419 175.345 -0.926 25158 7787 1 20 . 1 1 66 66 PRO CA C 66 62.310 62.310 61.761 0.549 25158 7788 1 20 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.200 3.026 25158 7789 1 20 . 1 1 67 67 TYR N N 67 122.616 122.616 121.934 0.682 25158 7790 1 20 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.273 0.383 25158 7791 1 20 . 1 1 67 67 TYR C C 67 174.446 174.446 175.598 -1.152 25158 7792 1 20 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.338 -0.327 25158 7793 1 20 . 1 1 67 67 TYR CB C 67 41.081 41.081 38.559 2.522 25158 7794 1 20 . 1 1 67 67 TYR H H 67 8.662 8.662 8.336 0.326 25158 7795 1 20 . 1 1 68 68 LYS N N 68 126.223 126.223 128.504 -2.281 25158 7796 1 20 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.105 0.163 25158 7797 1 20 . 1 1 68 68 LYS C C 68 174.748 174.748 175.488 -0.740 25158 7798 1 20 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.252 0.352 25158 7799 1 20 . 1 1 68 68 LYS CB C 68 32.770 32.770 30.457 2.312 25158 7800 1 20 . 1 1 68 68 LYS H H 68 8.112 8.112 8.235 -0.123 25158 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 66 2.745 0.695 2.676 25158 2 1 1 "Average Difference" HA 72 0.263 -0.018 0.265 25158 3 1 1 "Average Difference" C 67 1.053 0.151 1.050 25158 4 1 1 "Average Difference" CA 67 1.029 0.012 1.037 25158 5 1 1 "Average Difference" CB 62 1.301 -0.112 1.307 25158 6 1 1 "Average Difference" HN 66 0.578 -0.061 0.580 25158 7 1 2 "Average Difference" N 66 2.556 0.652 2.490 25158 8 1 2 "Average Difference" HA 72 0.243 0.016 0.244 25158 9 1 2 "Average Difference" C 67 1.091 0.199 1.081 25158 10 1 2 "Average Difference" CA 67 0.981 -0.079 0.985 25158 11 1 2 "Average Difference" CB 62 1.312 -0.085 1.320 25158 12 1 2 "Average Difference" HN 66 0.619 -0.091 0.617 25158 13 1 3 "Average Difference" N 66 2.452 0.617 2.391 25158 14 1 3 "Average Difference" HA 72 0.239 -0.005 0.241 25158 15 1 3 "Average Difference" C 67 1.041 0.148 1.038 25158 16 1 3 "Average Difference" CA 67 1.018 -0.046 1.025 25158 17 1 3 "Average Difference" CB 62 1.336 -0.062 1.345 25158 18 1 3 "Average Difference" HN 66 0.576 -0.075 0.575 25158 19 1 4 "Average Difference" N 66 2.736 0.715 2.661 25158 20 1 4 "Average Difference" HA 72 0.257 -0.009 0.259 25158 21 1 4 "Average Difference" C 67 1.063 0.182 1.055 25158 22 1 4 "Average Difference" CA 67 1.003 -0.039 1.010 25158 23 1 4 "Average Difference" CB 62 1.327 -0.137 1.331 25158 24 1 4 "Average Difference" HN 66 0.624 -0.057 0.626 25158 25 1 5 "Average Difference" N 66 2.437 0.450 2.414 25158 26 1 5 "Average Difference" HA 72 0.263 0.011 0.265 25158 27 1 5 "Average Difference" C 67 1.010 0.113 1.011 25158 28 1 5 "Average Difference" CA 67 0.993 -0.095 0.996 25158 29 1 5 "Average Difference" CB 62 1.369 -0.084 1.377 25158 30 1 5 "Average Difference" HN 66 0.629 -0.105 0.624 25158 31 1 6 "Average Difference" N 66 2.560 0.641 2.498 25158 32 1 6 "Average Difference" HA 72 0.256 -0.001 0.258 25158 33 1 6 "Average Difference" C 67 1.020 0.147 1.017 25158 34 1 6 "Average Difference" CA 67 1.025 -0.075 1.030 25158 35 1 6 "Average Difference" CB 62 1.384 -0.152 1.387 25158 36 1 6 "Average Difference" HN 66 0.566 -0.049 0.568 25158 37 1 7 "Average Difference" N 66 2.693 0.663 2.630 25158 38 1 7 "Average Difference" HA 72 0.265 -0.004 0.267 25158 39 1 7 "Average Difference" C 67 1.028 0.190 1.017 25158 40 1 7 "Average Difference" CA 67 1.023 -0.014 1.031 25158 41 1 7 "Average Difference" CB 62 1.359 -0.148 1.362 25158 42 1 7 "Average Difference" HN 66 0.638 -0.071 0.639 25158 43 1 8 "Average Difference" N 66 2.657 0.523 2.625 25158 44 1 8 "Average Difference" HA 72 0.250 -0.003 0.252 25158 45 1 8 "Average Difference" C 67 1.045 0.152 1.041 25158 46 1 8 "Average Difference" CA 67 0.988 -0.038 0.995 25158 47 1 8 "Average Difference" CB 62 1.358 -0.126 1.363 25158 48 1 8 "Average Difference" HN 66 0.558 -0.060 0.559 25158 49 1 9 "Average Difference" N 66 2.488 0.480 2.460 25158 50 1 9 "Average Difference" HA 72 0.269 0.013 0.270 25158 51 1 9 "Average Difference" C 67 1.058 0.141 1.056 25158 52 1 9 "Average Difference" CA 67 1.088 -0.078 1.094 25158 53 1 9 "Average Difference" CB 62 1.358 -0.189 1.356 25158 54 1 9 "Average Difference" HN 66 0.678 -0.097 0.676 25158 55 1 10 "Average Difference" N 66 2.699 0.315 2.701 25158 56 1 10 "Average Difference" HA 72 0.260 0.005 0.261 25158 57 1 10 "Average Difference" C 67 1.061 0.163 1.056 25158 58 1 10 "Average Difference" CA 67 0.931 -0.079 0.935 25158 59 1 10 "Average Difference" CB 62 1.361 -0.099 1.368 25158 60 1 10 "Average Difference" HN 66 0.680 -0.108 0.677 25158 61 1 11 "Average Difference" N 66 2.819 0.577 2.781 25158 62 1 11 "Average Difference" HA 72 0.272 -0.011 0.273 25158 63 1 11 "Average Difference" C 67 1.065 0.144 1.064 25158 64 1 11 "Average Difference" CA 67 1.086 -0.077 1.091 25158 65 1 11 "Average Difference" CB 62 1.405 -0.130 1.411 25158 66 1 11 "Average Difference" HN 66 0.608 -0.064 0.609 25158 67 1 12 "Average Difference" N 66 2.386 0.576 2.333 25158 68 1 12 "Average Difference" HA 72 0.265 0.000 0.267 25158 69 1 12 "Average Difference" C 67 1.021 0.140 1.019 25158 70 1 12 "Average Difference" CA 67 1.103 -0.063 1.110 25158 71 1 12 "Average Difference" CB 62 1.339 -0.083 1.347 25158 72 1 12 "Average Difference" HN 66 0.648 -0.097 0.645 25158 73 1 13 "Average Difference" N 66 2.498 0.473 2.472 25158 74 1 13 "Average Difference" HA 72 0.254 -0.014 0.255 25158 75 1 13 "Average Difference" C 67 0.992 0.144 0.989 25158 76 1 13 "Average Difference" CA 67 1.063 -0.050 1.070 25158 77 1 13 "Average Difference" CB 62 1.318 -0.051 1.327 25158 78 1 13 "Average Difference" HN 66 0.610 -0.111 0.605 25158 79 1 14 "Average Difference" N 66 2.506 0.471 2.481 25158 80 1 14 "Average Difference" HA 72 0.267 0.000 0.269 25158 81 1 14 "Average Difference" C 67 1.076 0.165 1.072 25158 82 1 14 "Average Difference" CA 67 1.050 -0.075 1.055 25158 83 1 14 "Average Difference" CB 62 1.368 -0.041 1.378 25158 84 1 14 "Average Difference" HN 66 0.675 -0.145 0.665 25158 85 1 15 "Average Difference" N 66 2.398 0.514 2.360 25158 86 1 15 "Average Difference" HA 72 0.259 0.016 0.260 25158 87 1 15 "Average Difference" C 67 1.010 0.144 1.007 25158 88 1 15 "Average Difference" CA 67 0.986 -0.111 0.987 25158 89 1 15 "Average Difference" CB 62 1.393 -0.136 1.398 25158 90 1 15 "Average Difference" HN 66 0.666 -0.105 0.663 25158 91 1 16 "Average Difference" N 66 2.717 0.788 2.621 25158 92 1 16 "Average Difference" HA 72 0.250 -0.007 0.251 25158 93 1 16 "Average Difference" C 67 0.992 0.197 0.979 25158 94 1 16 "Average Difference" CA 67 0.937 -0.033 0.944 25158 95 1 16 "Average Difference" CB 62 1.384 -0.088 1.392 25158 96 1 16 "Average Difference" HN 66 0.628 -0.071 0.628 25158 97 1 17 "Average Difference" N 66 2.527 0.454 2.505 25158 98 1 17 "Average Difference" HA 72 0.266 0.003 0.268 25158 99 1 17 "Average Difference" C 67 1.053 0.178 1.045 25158 100 1 17 "Average Difference" CA 67 1.083 -0.127 1.084 25158 101 1 17 "Average Difference" CB 62 1.383 -0.116 1.389 25158 102 1 17 "Average Difference" HN 66 0.660 -0.065 0.662 25158 103 1 18 "Average Difference" N 66 2.551 0.482 2.524 25158 104 1 18 "Average Difference" HA 72 0.255 0.007 0.257 25158 105 1 18 "Average Difference" C 67 1.038 0.129 1.038 25158 106 1 18 "Average Difference" CA 67 1.075 -0.148 1.073 25158 107 1 18 "Average Difference" CB 62 1.313 -0.157 1.315 25158 108 1 18 "Average Difference" HN 66 0.690 -0.097 0.688 25158 109 1 19 "Average Difference" N 66 2.413 0.688 2.330 25158 110 1 19 "Average Difference" HA 72 0.249 0.009 0.250 25158 111 1 19 "Average Difference" C 67 1.059 0.140 1.058 25158 112 1 19 "Average Difference" CA 67 0.939 -0.101 0.941 25158 113 1 19 "Average Difference" CB 62 1.300 -0.169 1.300 25158 114 1 19 "Average Difference" HN 66 0.626 -0.076 0.626 25158 115 1 20 "Average Difference" N 66 2.768 0.663 2.708 25158 116 1 20 "Average Difference" HA 72 0.267 0.001 0.269 25158 117 1 20 "Average Difference" C 67 1.095 0.185 1.087 25158 118 1 20 "Average Difference" CA 67 0.997 -0.101 0.999 25158 119 1 20 "Average Difference" CB 62 1.376 -0.143 1.379 25158 120 1 20 "Average Difference" HN 66 0.631 -0.041 0.634 25158 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 25158 _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 THR N N 2 116.700 116.700 115.527 1.173 25158 2 1 . 1 1 2 2 THR HA H 2 4.313 4.313 4.418 -0.105 25158 3 1 . 1 1 2 2 THR C C 2 173.968 173.968 174.013 -0.045 25158 4 1 . 1 1 2 2 THR CA C 2 62.326 62.326 61.455 0.871 25158 5 1 . 1 1 2 2 THR CB C 2 70.154 70.154 70.112 0.042 25158 6 1 . 1 1 2 2 THR H H 2 8.657 8.657 8.223 0.434 25158 7 1 . 1 1 3 3 LYS N N 3 125.500 125.500 124.761 0.739 25158 8 1 . 1 1 3 3 LYS HA H 3 4.065 4.065 4.274 -0.209 25158 9 1 . 1 1 3 3 LYS C C 3 174.926 174.926 175.431 -0.505 25158 10 1 . 1 1 3 3 LYS CA C 3 56.839 56.839 56.535 0.304 25158 11 1 . 1 1 3 3 LYS CB C 3 32.777 32.777 31.638 1.139 25158 12 1 . 1 1 3 3 LYS H H 3 8.318 8.318 8.382 -0.064 25158 13 1 . 1 1 4 4 LEU N N 4 127.473 127.473 125.381 2.092 25158 14 1 . 1 1 4 4 LEU HA H 4 4.483 4.483 4.403 0.080 25158 15 1 . 1 1 4 4 LEU C C 4 174.734 174.734 175.240 -0.506 25158 16 1 . 1 1 4 4 LEU CA C 4 53.259 53.259 53.478 -0.219 25158 17 1 . 1 1 4 4 LEU CB C 4 40.929 40.929 45.266 -4.337 25158 18 1 . 1 1 4 4 LEU H H 4 7.726 7.726 7.882 -0.156 25158 19 1 . 1 1 5 5 TYR N N 5 123.074 123.074 123.533 -0.459 25158 20 1 . 1 1 5 5 TYR HA H 5 3.623 3.623 4.373 -0.750 25158 21 1 . 1 1 5 5 TYR C C 5 175.406 175.406 176.884 -1.478 25158 22 1 . 1 1 5 5 TYR CA C 5 61.812 61.812 58.788 3.024 25158 23 1 . 1 1 5 5 TYR CB C 5 39.110 39.110 37.044 2.066 25158 24 1 . 1 1 5 5 TYR H H 5 7.816 7.816 8.521 -0.705 25158 25 1 . 1 1 6 6 GLY N N 6 108.614 108.614 114.289 -5.675 25158 26 1 . 1 1 6 6 GLY C C 6 172.585 172.585 173.436 -0.851 25158 27 1 . 1 1 6 6 GLY CA C 6 45.387 45.387 44.878 0.509 25158 28 1 . 1 1 6 6 GLY H H 6 8.915 8.915 8.501 0.414 25158 29 1 . 1 1 7 7 ASP N N 7 118.023 118.023 122.322 -4.299 25158 30 1 . 1 1 7 7 ASP HA H 7 4.984 4.984 4.968 0.016 25158 31 1 . 1 1 7 7 ASP C C 7 177.806 177.806 177.336 0.470 25158 32 1 . 1 1 7 7 ASP CA C 7 52.192 52.192 52.926 -0.734 25158 33 1 . 1 1 7 7 ASP CB C 7 39.150 39.150 40.379 -1.229 25158 34 1 . 1 1 7 7 ASP H H 7 7.976 7.976 7.830 0.146 25158 35 1 . 1 1 8 8 VAL N N 8 120.293 120.293 119.586 0.707 25158 36 1 . 1 1 8 8 VAL HA H 8 3.983 3.983 4.132 -0.149 25158 37 1 . 1 1 8 8 VAL C C 8 175.717 175.717 176.800 -1.083 25158 38 1 . 1 1 8 8 VAL CA C 8 63.446 63.446 63.707 -0.261 25158 39 1 . 1 1 8 8 VAL CB C 8 31.271 31.271 31.806 -0.535 25158 40 1 . 1 1 8 8 VAL H H 8 8.156 8.156 8.255 -0.099 25158 41 1 . 1 1 9 9 ASN N N 9 115.226 115.226 116.236 -1.010 25158 42 1 . 1 1 9 9 ASN HA H 9 4.989 4.989 4.581 0.408 25158 43 1 . 1 1 9 9 ASN C C 9 174.626 174.626 175.136 -0.510 25158 44 1 . 1 1 9 9 ASN CA C 9 50.950 50.950 52.981 -2.031 25158 45 1 . 1 1 9 9 ASN CB C 9 37.701 37.701 38.305 -0.604 25158 46 1 . 1 1 9 9 ASN H H 9 8.008 8.008 8.102 -0.094 25158 47 1 . 1 1 10 10 ASP N N 10 115.600 115.600 117.830 -2.230 25158 48 1 . 1 1 10 10 ASP HA H 10 4.436 4.436 4.539 -0.103 25158 49 1 . 1 1 10 10 ASP C C 10 175.125 175.125 175.349 -0.224 25158 50 1 . 1 1 10 10 ASP CA C 10 56.235 56.235 55.309 0.926 25158 51 1 . 1 1 10 10 ASP CB C 10 40.200 40.200 39.232 0.968 25158 52 1 . 1 1 10 10 ASP H H 10 7.374 7.374 8.130 -0.756 25158 53 1 . 1 1 11 11 ASP N N 11 118.402 118.402 116.734 1.668 25158 54 1 . 1 1 11 11 ASP HA H 11 4.817 4.817 4.655 0.162 25158 55 1 . 1 1 11 11 ASP C C 11 178.299 178.299 177.194 1.105 25158 56 1 . 1 1 11 11 ASP CA C 11 52.821 52.821 53.392 -0.571 25158 57 1 . 1 1 11 11 ASP CB C 11 41.114 41.114 41.866 -0.752 25158 58 1 . 1 1 11 11 ASP H H 11 8.801 8.801 8.895 -0.094 25158 59 1 . 1 1 12 12 GLY N N 12 112.353 112.353 107.957 4.396 25158 60 1 . 1 1 12 12 GLY C C 12 173.284 173.284 173.770 -0.486 25158 61 1 . 1 1 12 12 GLY CA C 12 45.624 45.624 45.150 0.474 25158 62 1 . 1 1 12 12 GLY H H 12 10.293 10.293 8.500 1.793 25158 63 1 . 1 1 13 13 LYS N N 13 118.118 118.118 118.937 -0.819 25158 64 1 . 1 1 13 13 LYS HA H 13 4.659 4.659 4.536 0.123 25158 65 1 . 1 1 13 13 LYS C C 13 175.595 175.595 174.657 0.938 25158 66 1 . 1 1 13 13 LYS CA C 13 53.758 53.758 55.228 -1.470 25158 67 1 . 1 1 13 13 LYS CB C 13 36.339 36.339 35.521 0.818 25158 68 1 . 1 1 13 13 LYS H H 13 7.848 7.848 8.460 -0.612 25158 69 1 . 1 1 14 14 VAL N N 14 126.591 126.591 124.053 2.538 25158 70 1 . 1 1 14 14 VAL HA H 14 4.755 4.755 4.399 0.356 25158 71 1 . 1 1 14 14 VAL C C 14 175.052 175.052 175.313 -0.261 25158 72 1 . 1 1 14 14 VAL CA C 14 62.070 62.070 61.949 0.121 25158 73 1 . 1 1 14 14 VAL CB C 14 31.455 31.455 30.962 0.492 25158 74 1 . 1 1 14 14 VAL H H 14 9.109 9.109 8.536 0.573 25158 75 1 . 1 1 15 15 ASN N N 15 126.287 126.287 126.005 0.282 25158 76 1 . 1 1 15 15 ASN HA H 15 4.815 4.815 4.956 -0.141 25158 77 1 . 1 1 15 15 ASN C C 15 176.340 176.340 176.282 0.058 25158 78 1 . 1 1 15 15 ASN CA C 15 52.275 52.275 51.617 0.658 25158 79 1 . 1 1 15 15 ASN CB C 15 39.220 39.220 41.253 -2.033 25158 80 1 . 1 1 15 15 ASN H H 15 10.071 10.071 8.934 1.137 25158 81 1 . 1 1 16 16 SER N N 16 113.168 113.168 115.848 -2.679 25158 82 1 . 1 1 16 16 SER HA H 16 4.047 4.047 4.255 -0.208 25158 83 1 . 1 1 16 16 SER C C 16 176.197 176.197 175.923 0.274 25158 84 1 . 1 1 16 16 SER CA C 16 62.681 62.681 61.499 1.182 25158 85 1 . 1 1 16 16 SER CB C 16 62.681 62.681 62.966 -0.285 25158 86 1 . 1 1 16 16 SER H H 16 8.825 8.825 8.800 0.025 25158 87 1 . 1 1 17 17 THR N N 17 119.391 119.391 116.904 2.487 25158 88 1 . 1 1 17 17 THR HA H 17 3.983 3.983 4.062 -0.079 25158 89 1 . 1 1 17 17 THR C C 17 177.149 177.149 176.394 0.755 25158 90 1 . 1 1 17 17 THR CA C 17 66.791 66.791 66.132 0.659 25158 91 1 . 1 1 17 17 THR CB C 17 67.757 67.757 68.313 -0.556 25158 92 1 . 1 1 17 17 THR H H 17 7.946 7.946 8.252 -0.306 25158 93 1 . 1 1 18 18 ASP N N 18 120.318 120.318 121.245 -0.927 25158 94 1 . 1 1 18 18 ASP HA H 18 4.370 4.370 4.428 -0.058 25158 95 1 . 1 1 18 18 ASP C C 18 177.168 177.168 177.817 -0.649 25158 96 1 . 1 1 18 18 ASP CA C 18 58.914 58.914 57.544 1.370 25158 97 1 . 1 1 18 18 ASP CB C 18 42.162 42.162 40.460 1.702 25158 98 1 . 1 1 18 18 ASP H H 18 7.995 7.995 7.886 0.109 25158 99 1 . 1 1 19 19 ALA N N 19 120.191 120.191 123.138 -2.947 25158 100 1 . 1 1 19 19 ALA HA H 19 4.048 4.048 4.098 -0.050 25158 101 1 . 1 1 19 19 ALA C C 19 179.549 179.549 179.227 0.322 25158 102 1 . 1 1 19 19 ALA CA C 19 55.413 55.413 55.148 0.265 25158 103 1 . 1 1 19 19 ALA CB C 19 17.313 17.313 18.526 -1.214 25158 104 1 . 1 1 19 19 ALA H H 19 7.085 7.085 7.456 -0.371 25158 105 1 . 1 1 20 20 VAL N N 20 120.613 120.613 118.791 1.822 25158 106 1 . 1 1 20 20 VAL HA H 20 3.611 3.611 3.693 -0.082 25158 107 1 . 1 1 20 20 VAL C C 20 178.153 178.153 177.407 0.746 25158 108 1 . 1 1 20 20 VAL CA C 20 66.767 66.767 65.312 1.455 25158 109 1 . 1 1 20 20 VAL CB C 20 31.868 31.868 31.528 0.340 25158 110 1 . 1 1 20 20 VAL H H 20 7.835 7.835 7.552 0.283 25158 111 1 . 1 1 21 21 ALA N N 21 121.767 121.767 122.455 -0.688 25158 112 1 . 1 1 21 21 ALA HA H 21 4.062 4.062 4.097 -0.035 25158 113 1 . 1 1 21 21 ALA C C 21 179.298 179.298 179.547 -0.249 25158 114 1 . 1 1 21 21 ALA CA C 21 55.244 55.244 55.224 0.020 25158 115 1 . 1 1 21 21 ALA CB C 21 17.789 17.789 18.257 -0.468 25158 116 1 . 1 1 21 21 ALA H H 21 7.804 7.804 7.879 -0.075 25158 117 1 . 1 1 22 22 LEU N N 22 117.555 117.555 119.542 -1.987 25158 118 1 . 1 1 22 22 LEU HA H 22 4.146 4.146 4.086 0.060 25158 119 1 . 1 1 22 22 LEU C C 22 177.914 177.914 178.446 -0.532 25158 120 1 . 1 1 22 22 LEU CA C 22 57.693 57.693 57.473 0.220 25158 121 1 . 1 1 22 22 LEU CB C 22 41.515 41.515 41.730 -0.215 25158 122 1 . 1 1 22 22 LEU H H 22 8.619 8.619 7.839 0.780 25158 123 1 . 1 1 23 23 LYS N N 23 120.335 120.335 119.423 0.912 25158 124 1 . 1 1 23 23 LYS HA H 23 3.919 3.919 3.976 -0.057 25158 125 1 . 1 1 23 23 LYS C C 23 177.731 177.731 179.112 -1.381 25158 126 1 . 1 1 23 23 LYS CA C 23 60.337 60.337 59.733 0.604 25158 127 1 . 1 1 23 23 LYS CB C 23 32.098 32.098 32.207 -0.109 25158 128 1 . 1 1 23 23 LYS H H 23 8.230 8.230 7.814 0.416 25158 129 1 . 1 1 24 24 ARG N N 24 116.831 116.831 118.168 -1.337 25158 130 1 . 1 1 24 24 ARG HA H 24 3.959 3.959 4.040 -0.081 25158 131 1 . 1 1 24 24 ARG C C 24 178.616 178.616 178.618 -0.002 25158 132 1 . 1 1 24 24 ARG CA C 24 59.957 59.957 59.360 0.597 25158 133 1 . 1 1 24 24 ARG CB C 24 29.563 29.563 30.032 -0.469 25158 134 1 . 1 1 24 24 ARG H H 24 7.927 7.927 7.704 0.223 25158 135 1 . 1 1 25 25 TYR N N 25 120.960 120.960 121.291 -0.331 25158 136 1 . 1 1 25 25 TYR HA H 25 4.210 4.210 4.237 -0.027 25158 137 1 . 1 1 25 25 TYR C C 25 179.465 179.465 178.367 1.099 25158 138 1 . 1 1 25 25 TYR CA C 25 61.845 61.845 61.408 0.437 25158 139 1 . 1 1 25 25 TYR CB C 25 39.065 39.065 38.430 0.635 25158 140 1 . 1 1 25 25 TYR H H 25 8.321 8.321 7.630 0.691 25158 141 1 . 1 1 26 26 VAL N N 26 120.405 120.405 118.119 2.286 25158 142 1 . 1 1 26 26 VAL HA H 26 3.774 3.774 3.778 -0.004 25158 143 1 . 1 1 26 26 VAL C C 26 177.826 177.826 177.148 0.678 25158 144 1 . 1 1 26 26 VAL CA C 26 65.440 65.440 65.444 -0.004 25158 145 1 . 1 1 26 26 VAL CB C 26 31.557 31.557 31.593 -0.036 25158 146 1 . 1 1 26 26 VAL H H 26 8.803 8.803 8.017 0.786 25158 147 1 . 1 1 27 27 LEU N N 27 119.247 119.247 118.116 1.131 25158 148 1 . 1 1 27 27 LEU HA H 27 4.276 4.276 4.322 -0.046 25158 149 1 . 1 1 27 27 LEU C C 27 176.753 176.753 176.215 0.538 25158 150 1 . 1 1 27 27 LEU CA C 27 55.675 55.675 54.515 1.160 25158 151 1 . 1 1 27 27 LEU CB C 27 41.593 41.593 41.992 -0.399 25158 152 1 . 1 1 27 27 LEU H H 27 7.898 7.898 7.493 0.405 25158 153 1 . 1 1 28 28 ARG N N 28 116.082 116.082 117.309 -1.227 25158 154 1 . 1 1 28 28 ARG HA H 28 4.114 4.114 3.850 0.263 25158 155 1 . 1 1 28 28 ARG C C 28 176.521 176.521 176.073 0.448 25158 156 1 . 1 1 28 28 ARG CA C 28 56.154 56.154 57.023 -0.869 25158 157 1 . 1 1 28 28 ARG CB C 28 27.471 27.471 27.181 0.290 25158 158 1 . 1 1 28 28 ARG H H 28 7.993 7.993 7.772 0.221 25158 159 1 . 1 1 29 29 SER N N 29 113.579 113.579 115.002 -1.423 25158 160 1 . 1 1 29 29 SER HA H 29 4.305 4.305 4.400 -0.095 25158 161 1 . 1 1 29 29 SER C C 29 175.368 175.368 175.372 -0.004 25158 162 1 . 1 1 29 29 SER CA C 29 59.699 59.699 59.673 0.027 25158 163 1 . 1 1 29 29 SER CB C 29 63.908 63.908 63.820 0.088 25158 164 1 . 1 1 29 29 SER H H 29 8.094 8.094 8.164 -0.070 25158 165 1 . 1 1 30 30 GLY N N 30 109.920 109.920 109.244 0.676 25158 166 1 . 1 1 30 30 GLY C C 30 174.115 174.115 173.860 0.255 25158 167 1 . 1 1 30 30 GLY CA C 30 45.771 45.771 44.938 0.832 25158 168 1 . 1 1 30 30 GLY H H 30 8.577 8.577 8.344 0.233 25158 169 1 . 1 1 31 31 ILE N N 31 119.084 119.084 119.665 -0.581 25158 170 1 . 1 1 31 31 ILE HA H 31 4.358 4.358 4.335 0.023 25158 171 1 . 1 1 31 31 ILE C C 31 174.392 174.392 175.008 -0.616 25158 172 1 . 1 1 31 31 ILE CA C 31 60.246 60.246 60.344 -0.098 25158 173 1 . 1 1 31 31 ILE CB C 31 39.579 39.579 39.498 0.081 25158 174 1 . 1 1 31 31 ILE H H 31 7.387 7.387 7.714 -0.327 25158 175 1 . 1 1 32 32 SER N N 32 120.582 120.582 123.332 -2.750 25158 176 1 . 1 1 32 32 SER HA H 32 4.845 4.845 4.762 0.083 25158 177 1 . 1 1 32 32 SER C C 32 173.891 173.891 174.052 -0.161 25158 178 1 . 1 1 32 32 SER CA C 32 57.603 57.603 58.110 -0.508 25158 179 1 . 1 1 32 32 SER CB C 32 63.849 63.849 63.401 0.448 25158 180 1 . 1 1 32 32 SER H H 32 8.339 8.339 8.552 -0.213 25158 181 1 . 1 1 33 33 ILE N N 33 116.629 116.629 120.398 -3.769 25158 182 1 . 1 1 33 33 ILE HA H 33 4.633 4.633 4.536 0.097 25158 183 1 . 1 1 33 33 ILE C C 33 174.195 174.195 174.059 0.136 25158 184 1 . 1 1 33 33 ILE CA C 33 59.112 59.112 59.102 0.010 25158 185 1 . 1 1 33 33 ILE CB C 33 42.582 42.582 40.556 2.026 25158 186 1 . 1 1 33 33 ILE H H 33 7.873 7.873 7.929 -0.056 25158 187 1 . 1 1 34 34 ASN N N 34 118.342 118.342 120.061 -1.719 25158 188 1 . 1 1 34 34 ASN HA H 34 4.736 4.736 4.890 -0.154 25158 189 1 . 1 1 34 34 ASN C C 34 176.217 176.217 176.047 0.170 25158 190 1 . 1 1 34 34 ASN CA C 34 52.186 52.186 52.529 -0.343 25158 191 1 . 1 1 34 34 ASN CB C 34 36.499 36.499 38.795 -2.296 25158 192 1 . 1 1 34 34 ASN H H 34 8.839 8.839 8.257 0.582 25158 193 1 . 1 1 35 35 THR N N 35 116.120 116.120 117.615 -1.495 25158 194 1 . 1 1 35 35 THR HA H 35 3.559 3.559 3.984 -0.425 25158 195 1 . 1 1 35 35 THR C C 35 177.347 177.347 176.062 1.285 25158 196 1 . 1 1 35 35 THR CA C 35 64.686 64.686 65.734 -1.048 25158 197 1 . 1 1 35 35 THR CB C 35 67.758 67.758 68.878 -1.120 25158 198 1 . 1 1 35 35 THR H H 35 7.939 7.939 8.280 -0.341 25158 199 1 . 1 1 36 36 ASP N N 36 123.528 123.528 121.899 1.629 25158 200 1 . 1 1 36 36 ASP HA H 36 4.420 4.420 4.380 0.040 25158 201 1 . 1 1 36 36 ASP C C 36 177.752 177.752 177.434 0.318 25158 202 1 . 1 1 36 36 ASP CA C 36 57.074 57.074 57.364 -0.290 25158 203 1 . 1 1 36 36 ASP CB C 36 39.898 39.898 40.594 -0.696 25158 204 1 . 1 1 36 36 ASP H H 36 7.980 7.980 8.656 -0.676 25158 205 1 . 1 1 37 37 ASN N N 37 115.690 115.690 116.597 -0.907 25158 206 1 . 1 1 37 37 ASN HA H 37 4.266 4.266 4.567 -0.301 25158 207 1 . 1 1 37 37 ASN C C 37 175.589 175.589 177.029 -1.440 25158 208 1 . 1 1 37 37 ASN CA C 37 52.560 52.560 54.919 -2.359 25158 209 1 . 1 1 37 37 ASN CB C 37 37.963 37.963 38.333 -0.370 25158 210 1 . 1 1 37 37 ASN H H 37 7.251 7.251 8.209 -0.958 25158 211 1 . 1 1 38 38 ALA N N 38 119.560 119.560 122.990 -3.429 25158 212 1 . 1 1 38 38 ALA HA H 38 4.080 4.080 4.042 0.038 25158 213 1 . 1 1 38 38 ALA C C 38 173.638 173.638 177.503 -3.865 25158 214 1 . 1 1 38 38 ALA CA C 38 52.220 52.220 54.020 -1.800 25158 215 1 . 1 1 38 38 ALA CB C 38 22.871 22.871 18.747 4.124 25158 216 1 . 1 1 38 38 ALA H H 38 7.142 7.142 7.982 -0.840 25158 217 1 . 1 1 39 39 ASP N N 39 115.003 115.003 119.518 -4.515 25158 218 1 . 1 1 39 39 ASP HA H 39 4.940 4.940 4.643 0.297 25158 219 1 . 1 1 39 39 ASP C C 39 177.163 177.163 176.871 0.292 25158 220 1 . 1 1 39 39 ASP CA C 39 52.171 52.171 54.826 -2.655 25158 221 1 . 1 1 39 39 ASP CB C 39 38.946 38.946 39.995 -1.049 25158 222 1 . 1 1 39 39 ASP H H 39 7.096 7.096 7.869 -0.773 25158 223 1 . 1 1 40 40 LEU N N 40 123.245 123.245 124.456 -1.211 25158 224 1 . 1 1 40 40 LEU HA H 40 4.071 4.071 4.294 -0.223 25158 225 1 . 1 1 40 40 LEU C C 40 175.865 175.865 177.634 -1.769 25158 226 1 . 1 1 40 40 LEU CA C 40 56.593 56.593 56.089 0.504 25158 227 1 . 1 1 40 40 LEU CB C 40 41.929 41.929 42.210 -0.281 25158 228 1 . 1 1 40 40 LEU H H 40 8.572 8.572 8.021 0.551 25158 229 1 . 1 1 41 41 ASN N N 41 112.723 112.723 113.932 -1.209 25158 230 1 . 1 1 41 41 ASN HA H 41 4.999 4.999 4.975 0.025 25158 231 1 . 1 1 41 41 ASN C C 41 173.846 173.846 175.340 -1.494 25158 232 1 . 1 1 41 41 ASN CA C 41 51.233 51.233 52.054 -0.821 25158 233 1 . 1 1 41 41 ASN CB C 41 37.395 37.395 39.136 -1.741 25158 234 1 . 1 1 41 41 ASN H H 41 8.004 8.004 7.909 0.095 25158 235 1 . 1 1 42 42 GLU N N 42 115.798 115.798 115.806 -0.008 25158 236 1 . 1 1 42 42 GLU HA H 42 3.952 3.952 4.280 -0.328 25158 237 1 . 1 1 42 42 GLU C C 42 175.172 175.172 175.684 -0.512 25158 238 1 . 1 1 42 42 GLU CA C 42 57.351 57.351 57.622 -0.271 25158 239 1 . 1 1 42 42 GLU CB C 42 28.221 28.221 27.108 1.113 25158 240 1 . 1 1 42 42 GLU H H 42 7.642 7.642 8.510 -0.868 25158 241 1 . 1 1 43 43 ASP N N 43 117.453 117.453 117.332 0.121 25158 242 1 . 1 1 43 43 ASP HA H 43 4.839 4.839 4.532 0.307 25158 243 1 . 1 1 43 43 ASP C C 43 178.129 178.129 177.478 0.650 25158 244 1 . 1 1 43 43 ASP CA C 43 52.638 52.638 54.016 -1.378 25158 245 1 . 1 1 43 43 ASP CB C 43 41.214 41.214 41.080 0.134 25158 246 1 . 1 1 43 43 ASP H H 43 8.473 8.473 8.738 -0.265 25158 247 1 . 1 1 44 44 GLY N N 44 112.490 112.490 107.679 4.811 25158 248 1 . 1 1 44 44 GLY C C 44 173.717 173.717 173.701 0.016 25158 249 1 . 1 1 44 44 GLY CA C 44 45.317 45.317 44.938 0.379 25158 250 1 . 1 1 44 44 GLY H H 44 10.139 10.139 8.483 1.656 25158 251 1 . 1 1 45 45 ARG N N 45 118.154 118.154 117.783 0.371 25158 252 1 . 1 1 45 45 ARG HA H 45 4.788 4.788 4.653 0.135 25158 253 1 . 1 1 45 45 ARG C C 45 175.602 175.602 174.127 1.475 25158 254 1 . 1 1 45 45 ARG CA C 45 53.832 53.832 54.570 -0.738 25158 255 1 . 1 1 45 45 ARG CB C 45 33.664 33.664 32.742 0.922 25158 256 1 . 1 1 45 45 ARG H H 45 7.994 7.994 8.790 -0.796 25158 257 1 . 1 1 46 46 VAL N N 46 126.392 126.392 123.075 3.317 25158 258 1 . 1 1 46 46 VAL HA H 46 4.790 4.790 4.489 0.301 25158 259 1 . 1 1 46 46 VAL C C 46 174.644 174.644 175.424 -0.780 25158 260 1 . 1 1 46 46 VAL CA C 46 61.729 61.729 61.995 -0.266 25158 261 1 . 1 1 46 46 VAL CB C 46 31.666 31.666 30.695 0.971 25158 262 1 . 1 1 46 46 VAL H H 46 9.115 9.115 8.544 0.571 25158 263 1 . 1 1 47 47 ASN N N 47 126.737 126.737 126.133 0.604 25158 264 1 . 1 1 47 47 ASN HA H 47 4.875 4.875 4.989 -0.114 25158 265 1 . 1 1 47 47 ASN C C 47 176.467 176.467 175.898 0.569 25158 266 1 . 1 1 47 47 ASN CA C 47 52.040 52.040 51.514 0.526 25158 267 1 . 1 1 47 47 ASN CB C 47 39.187 39.187 39.665 -0.478 25158 268 1 . 1 1 47 47 ASN H H 47 10.077 10.077 8.442 1.635 25158 269 1 . 1 1 48 48 SER N N 48 113.409 113.409 114.709 -1.300 25158 270 1 . 1 1 48 48 SER HA H 48 4.086 4.086 4.176 -0.090 25158 271 1 . 1 1 48 48 SER C C 48 176.671 176.671 176.122 0.549 25158 272 1 . 1 1 48 48 SER CA C 48 62.375 62.375 61.713 0.662 25158 273 1 . 1 1 48 48 SER CB C 48 62.375 62.375 62.836 -0.461 25158 274 1 . 1 1 48 48 SER H H 48 8.936 8.936 8.747 0.189 25158 275 1 . 1 1 49 49 THR N N 49 121.885 121.885 118.316 3.569 25158 276 1 . 1 1 49 49 THR HA H 49 4.112 4.112 3.945 0.167 25158 277 1 . 1 1 49 49 THR C C 49 177.320 177.320 176.490 0.830 25158 278 1 . 1 1 49 49 THR CA C 49 66.713 66.713 66.493 0.220 25158 279 1 . 1 1 49 49 THR CB C 49 67.787 67.787 68.328 -0.541 25158 280 1 . 1 1 49 49 THR H H 49 8.124 8.124 7.944 0.180 25158 281 1 . 1 1 50 50 ASP N N 50 120.401 120.401 122.116 -1.715 25158 282 1 . 1 1 50 50 ASP HA H 50 4.370 4.370 4.353 0.017 25158 283 1 . 1 1 50 50 ASP C C 50 177.033 177.033 178.275 -1.242 25158 284 1 . 1 1 50 50 ASP CA C 50 58.820 58.820 57.408 1.412 25158 285 1 . 1 1 50 50 ASP CB C 50 41.708 41.708 40.273 1.435 25158 286 1 . 1 1 50 50 ASP H H 50 7.560 7.560 7.876 -0.316 25158 287 1 . 1 1 51 51 LEU N N 51 118.174 118.174 120.602 -2.427 25158 288 1 . 1 1 51 51 LEU HA H 51 4.188 4.188 4.042 0.146 25158 289 1 . 1 1 51 51 LEU C C 51 177.441 177.441 178.560 -1.119 25158 290 1 . 1 1 51 51 LEU CA C 51 58.137 58.137 58.009 0.128 25158 291 1 . 1 1 51 51 LEU CB C 51 41.847 41.847 41.640 0.207 25158 292 1 . 1 1 51 51 LEU H H 51 7.134 7.134 7.600 -0.466 25158 293 1 . 1 1 52 52 GLY N N 52 105.596 105.596 106.559 -0.963 25158 294 1 . 1 1 52 52 GLY C C 52 176.764 176.764 175.993 0.771 25158 295 1 . 1 1 52 52 GLY CA C 52 47.642 47.642 46.983 0.659 25158 296 1 . 1 1 52 52 GLY H H 52 8.034 8.034 7.764 0.270 25158 297 1 . 1 1 53 53 ILE N N 53 122.043 122.043 122.735 -0.692 25158 298 1 . 1 1 53 53 ILE HA H 53 3.449 3.449 3.671 -0.222 25158 299 1 . 1 1 53 53 ILE C C 53 177.112 177.112 177.520 -0.408 25158 300 1 . 1 1 53 53 ILE CA C 53 65.388 65.388 64.583 0.805 25158 301 1 . 1 1 53 53 ILE CB C 53 38.258 38.258 37.905 0.353 25158 302 1 . 1 1 53 53 ILE H H 53 7.611 7.611 7.671 -0.060 25158 303 1 . 1 1 54 54 LEU N N 54 120.787 120.787 121.149 -0.362 25158 304 1 . 1 1 54 54 LEU HA H 54 3.941 3.941 3.985 -0.044 25158 305 1 . 1 1 54 54 LEU C C 54 175.340 175.340 178.449 -3.109 25158 306 1 . 1 1 54 54 LEU CA C 54 58.195 58.195 58.619 -0.424 25158 307 1 . 1 1 54 54 LEU CB C 54 41.221 41.221 41.721 -0.500 25158 308 1 . 1 1 54 54 LEU H H 54 8.323 8.323 8.301 0.022 25158 309 1 . 1 1 55 55 LYS N N 55 116.833 116.833 118.978 -2.145 25158 310 1 . 1 1 55 55 LYS HA H 55 3.884 3.884 3.964 -0.080 25158 311 1 . 1 1 55 55 LYS C C 55 179.067 179.067 179.171 -0.104 25158 312 1 . 1 1 55 55 LYS CA C 55 60.651 60.651 59.852 0.799 25158 313 1 . 1 1 55 55 LYS CB C 55 32.009 32.009 32.248 -0.239 25158 314 1 . 1 1 55 55 LYS H H 55 8.356 8.356 7.685 0.671 25158 315 1 . 1 1 56 56 ARG N N 56 117.092 117.092 118.953 -1.861 25158 316 1 . 1 1 56 56 ARG HA H 56 3.916 3.916 4.121 -0.205 25158 317 1 . 1 1 56 56 ARG C C 56 178.223 178.223 178.586 -0.363 25158 318 1 . 1 1 56 56 ARG CA C 56 60.351 60.351 59.407 0.944 25158 319 1 . 1 1 56 56 ARG CB C 56 30.780 30.780 30.183 0.597 25158 320 1 . 1 1 56 56 ARG H H 56 7.543 7.543 7.813 -0.270 25158 321 1 . 1 1 57 57 TYR N N 57 122.187 122.187 121.452 0.735 25158 322 1 . 1 1 57 57 TYR HA H 57 4.392 4.392 4.577 -0.185 25158 323 1 . 1 1 57 57 TYR C C 57 180.009 180.009 178.511 1.498 25158 324 1 . 1 1 57 57 TYR CA C 57 61.579 61.579 61.005 0.574 25158 325 1 . 1 1 57 57 TYR CB C 57 38.836 38.836 38.566 0.270 25158 326 1 . 1 1 57 57 TYR H H 57 8.592 8.592 7.895 0.697 25158 327 1 . 1 1 58 58 ILE N N 58 122.825 122.825 117.485 5.340 25158 328 1 . 1 1 58 58 ILE HA H 58 3.680 3.680 3.809 -0.129 25158 329 1 . 1 1 58 58 ILE C C 58 178.186 178.186 176.725 1.461 25158 330 1 . 1 1 58 58 ILE CA C 58 64.768 64.768 63.737 1.031 25158 331 1 . 1 1 58 58 ILE CB C 58 37.720 37.720 38.223 -0.503 25158 332 1 . 1 1 58 58 ILE H H 58 8.779 8.779 7.769 1.010 25158 333 1 . 1 1 59 59 LEU N N 59 118.552 118.552 118.739 -0.187 25158 334 1 . 1 1 59 59 LEU HA H 59 4.223 4.223 4.347 -0.124 25158 335 1 . 1 1 59 59 LEU C C 59 175.937 175.937 175.942 -0.005 25158 336 1 . 1 1 59 59 LEU CA C 59 55.512 55.512 54.231 1.281 25158 337 1 . 1 1 59 59 LEU CB C 59 42.426 42.426 41.593 0.833 25158 338 1 . 1 1 59 59 LEU H H 59 7.539 7.539 7.594 -0.055 25158 339 1 . 1 1 60 60 LYS N N 60 113.650 113.650 117.193 -3.543 25158 340 1 . 1 1 60 60 LYS HA H 60 3.995 3.995 3.819 0.176 25158 341 1 . 1 1 60 60 LYS C C 60 176.535 176.535 176.215 0.320 25158 342 1 . 1 1 60 60 LYS CA C 60 57.291 57.291 57.630 -0.339 25158 343 1 . 1 1 60 60 LYS CB C 60 28.271 28.271 29.974 -1.703 25158 344 1 . 1 1 60 60 LYS H H 60 7.815 7.815 7.516 0.299 25158 345 1 . 1 1 61 61 GLU N N 61 117.535 117.535 116.106 1.429 25158 346 1 . 1 1 61 61 GLU HA H 61 4.144 4.144 4.310 -0.166 25158 347 1 . 1 1 61 61 GLU C C 61 176.992 176.992 176.579 0.413 25158 348 1 . 1 1 61 61 GLU CA C 61 57.689 57.689 57.779 -0.090 25158 349 1 . 1 1 61 61 GLU CB C 61 30.692 30.692 31.078 -0.386 25158 350 1 . 1 1 61 61 GLU H H 61 8.438 8.438 8.243 0.195 25158 351 1 . 1 1 62 62 ILE N N 62 112.102 112.102 115.358 -3.256 25158 352 1 . 1 1 62 62 ILE HA H 62 4.383 4.383 4.506 -0.123 25158 353 1 . 1 1 62 62 ILE C C 62 175.425 175.425 174.593 0.832 25158 354 1 . 1 1 62 62 ILE CA C 62 59.926 59.926 60.303 -0.377 25158 355 1 . 1 1 62 62 ILE CB C 62 41.748 41.748 40.393 1.355 25158 356 1 . 1 1 62 62 ILE H H 62 6.867 6.867 7.398 -0.531 25158 357 1 . 1 1 63 63 ASP N N 63 119.719 119.719 123.920 -4.201 25158 358 1 . 1 1 63 63 ASP HA H 63 4.674 4.674 4.892 -0.218 25158 359 1 . 1 1 63 63 ASP C C 63 176.202 176.202 176.087 0.115 25158 360 1 . 1 1 63 63 ASP CA C 63 54.818 54.818 54.169 0.649 25158 361 1 . 1 1 63 63 ASP CB C 63 42.217 42.217 41.944 0.273 25158 362 1 . 1 1 63 63 ASP H H 63 8.561 8.561 8.827 -0.266 25158 363 1 . 1 1 64 64 THR N N 64 113.289 113.289 117.289 -4.000 25158 364 1 . 1 1 64 64 THR HA H 64 4.712 4.712 4.484 0.228 25158 365 1 . 1 1 64 64 THR C C 64 170.854 170.854 173.240 -2.386 25158 366 1 . 1 1 64 64 THR CA C 64 61.269 61.269 62.484 -1.215 25158 367 1 . 1 1 64 64 THR CB C 64 71.993 71.993 69.031 2.962 25158 368 1 . 1 1 64 64 THR H H 64 7.410 7.410 7.831 -0.421 25158 369 1 . 1 1 65 65 LEU N N 65 121.012 121.012 127.085 -6.073 25158 370 1 . 1 1 65 65 LEU HA H 65 4.229 4.229 4.717 -0.488 25158 371 1 . 1 1 65 65 LEU C C 65 174.763 174.763 174.947 -0.184 25158 372 1 . 1 1 65 65 LEU CA C 65 51.635 51.635 51.933 -0.298 25158 373 1 . 1 1 65 65 LEU CB C 65 44.520 44.520 43.912 0.608 25158 374 1 . 1 1 65 65 LEU H H 65 7.877 7.877 8.374 -0.497 25158 375 1 . 1 1 66 66 PRO HA H 66 3.992 3.992 4.198 -0.206 25158 376 1 . 1 1 66 66 PRO C C 66 174.419 174.419 175.016 -0.597 25158 377 1 . 1 1 66 66 PRO CA C 66 62.310 62.310 62.185 0.125 25158 378 1 . 1 1 66 66 PRO CB C 66 35.226 35.226 32.317 2.909 25158 379 1 . 1 1 67 67 TYR N N 67 122.616 122.616 121.350 1.266 25158 380 1 . 1 1 67 67 TYR HA H 67 4.656 4.656 4.325 0.331 25158 381 1 . 1 1 67 67 TYR C C 67 174.446 174.446 175.418 -0.972 25158 382 1 . 1 1 67 67 TYR CA C 67 58.011 58.011 58.677 -0.666 25158 383 1 . 1 1 67 67 TYR CB C 67 41.081 41.081 39.265 1.816 25158 384 1 . 1 1 67 67 TYR H H 67 8.662 8.662 8.197 0.465 25158 385 1 . 1 1 68 68 LYS N N 68 126.223 126.223 127.710 -1.488 25158 386 1 . 1 1 68 68 LYS HA H 68 4.268 4.268 4.234 0.034 25158 387 1 . 1 1 68 68 LYS C C 68 174.748 174.748 174.795 -0.047 25158 388 1 . 1 1 68 68 LYS CA C 68 55.603 55.603 55.135 0.468 25158 389 1 . 1 1 68 68 LYS CB C 68 32.770 32.770 32.031 0.739 25158 390 1 . 1 1 68 68 LYS H H 68 8.112 8.112 8.047 0.065 25158 stop_ save_