data_18135 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18135 _Entry.PDB_ID 2LMS 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 18135 _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 ASP N N 2 125.691 125.691 122.885 2.806 18135 2 1 1 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.657 0.053 18135 3 1 1 . 1 1 2 2 ASP C C 2 174.758 174.758 175.044 -0.286 18135 4 1 1 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.793 -1.950 18135 5 1 1 . 1 1 2 2 ASP CB C 2 39.321 39.321 39.419 -0.098 18135 6 1 1 . 1 1 2 2 ASP H H 2 8.773 8.773 8.673 0.100 18135 7 1 1 . 1 1 3 3 LEU N N 3 123.957 123.957 120.299 3.658 18135 8 1 1 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.793 -0.392 18135 9 1 1 . 1 1 3 3 LEU CA C 3 53.653 53.653 51.550 2.103 18135 10 1 1 . 1 1 3 3 LEU CB C 3 40.555 40.555 41.757 -1.202 18135 11 1 1 . 1 1 3 3 LEU H H 3 8.164 8.164 8.006 0.158 18135 12 1 1 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.552 -0.238 18135 13 1 1 . 1 1 4 4 PRO C C 4 176.213 176.213 176.702 -0.489 18135 14 1 1 . 1 1 4 4 PRO CA C 4 63.908 63.908 62.900 1.008 18135 15 1 1 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.113 1.780 18135 16 1 1 . 1 1 5 5 GLN N N 5 121.621 121.621 122.203 -0.582 18135 17 1 1 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.146 0.080 18135 18 1 1 . 1 1 5 5 GLN C C 5 176.995 176.995 176.447 0.548 18135 19 1 1 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.273 -1.563 18135 20 1 1 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.151 -0.201 18135 21 1 1 . 1 1 5 5 GLN H H 5 8.767 8.767 8.679 0.088 18135 22 1 1 . 1 1 6 6 THR N N 6 111.419 111.419 111.644 -0.225 18135 23 1 1 . 1 1 6 6 THR HA H 6 4.135 4.135 4.415 -0.280 18135 24 1 1 . 1 1 6 6 THR C C 6 174.695 174.695 175.476 -0.781 18135 25 1 1 . 1 1 6 6 THR CA C 6 62.661 62.661 63.457 -0.796 18135 26 1 1 . 1 1 6 6 THR CB C 6 69.365 69.365 68.468 0.897 18135 27 1 1 . 1 1 6 6 THR H H 6 7.865 7.865 8.523 -0.658 18135 28 1 1 . 1 1 7 7 HIS N N 7 119.137 119.137 119.509 -0.372 18135 29 1 1 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.638 -0.053 18135 30 1 1 . 1 1 7 7 HIS C C 7 174.980 174.980 175.484 -0.504 18135 31 1 1 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.532 -2.528 18135 32 1 1 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.723 -1.560 18135 33 1 1 . 1 1 7 7 HIS H H 7 8.567 8.567 8.588 -0.021 18135 34 1 1 . 1 1 8 8 SER N N 8 115.796 115.796 113.963 1.833 18135 35 1 1 . 1 1 8 8 SER HA H 8 4.363 4.363 4.433 -0.070 18135 36 1 1 . 1 1 8 8 SER C C 8 175.312 175.312 175.881 -0.569 18135 37 1 1 . 1 1 8 8 SER CA C 8 58.969 58.969 60.866 -1.897 18135 38 1 1 . 1 1 8 8 SER CB C 8 63.439 63.439 64.229 -0.790 18135 39 1 1 . 1 1 8 8 SER H H 8 8.180 8.180 7.952 0.228 18135 40 1 1 . 1 1 9 9 LEU N N 9 123.844 123.844 118.198 5.646 18135 41 1 1 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.672 -0.517 18135 42 1 1 . 1 1 9 9 LEU C C 9 178.568 178.568 178.250 0.318 18135 43 1 1 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.641 0.325 18135 44 1 1 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.431 -0.635 18135 45 1 1 . 1 1 9 9 LEU H H 9 8.404 8.404 7.658 0.746 18135 46 1 1 . 1 1 10 10 GLY N N 10 107.582 107.582 107.589 -0.007 18135 47 1 1 . 1 1 10 10 GLY C C 10 174.586 174.586 175.727 -1.141 18135 48 1 1 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.192 -0.287 18135 49 1 1 . 1 1 10 10 GLY H H 10 8.438 8.438 8.520 -0.082 18135 50 1 1 . 1 1 11 11 SER N N 11 118.806 118.806 116.920 1.886 18135 51 1 1 . 1 1 11 11 SER HA H 11 4.156 4.156 4.130 0.026 18135 52 1 1 . 1 1 11 11 SER C C 11 175.749 175.749 176.731 -0.982 18135 53 1 1 . 1 1 11 11 SER CA C 11 61.299 61.299 61.917 -0.618 18135 54 1 1 . 1 1 11 11 SER CB C 11 62.653 62.653 62.907 -0.254 18135 55 1 1 . 1 1 11 11 SER H H 11 8.249 8.249 8.336 -0.087 18135 56 1 1 . 1 1 12 12 ARG N N 12 121.986 121.986 122.018 -0.032 18135 57 1 1 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.092 -0.138 18135 58 1 1 . 1 1 12 12 ARG C C 12 178.283 178.283 178.589 -0.306 18135 59 1 1 . 1 1 12 12 ARG CA C 12 59.830 59.830 59.247 0.583 18135 60 1 1 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.039 -0.455 18135 61 1 1 . 1 1 12 12 ARG H H 12 8.027 8.027 8.058 -0.031 18135 62 1 1 . 1 1 13 13 ARG N N 13 119.432 119.432 118.597 0.835 18135 63 1 1 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.048 -0.209 18135 64 1 1 . 1 1 13 13 ARG C C 13 178.480 178.480 178.706 -0.226 18135 65 1 1 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.576 0.915 18135 66 1 1 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.642 0.440 18135 67 1 1 . 1 1 13 13 ARG H H 13 8.437 8.437 7.861 0.576 18135 68 1 1 . 1 1 14 14 THR N N 14 116.879 116.879 116.945 -0.066 18135 69 1 1 . 1 1 14 14 THR HA H 14 3.532 3.532 4.091 -0.559 18135 70 1 1 . 1 1 14 14 THR C C 14 175.584 175.584 177.015 -1.431 18135 71 1 1 . 1 1 14 14 THR CA C 14 68.036 68.036 66.523 1.512 18135 72 1 1 . 1 1 14 14 THR CB C 14 67.969 67.969 68.565 -0.596 18135 73 1 1 . 1 1 14 14 THR H H 14 7.957 7.957 8.167 -0.210 18135 74 1 1 . 1 1 15 15 LEU N N 15 120.252 120.252 122.617 -2.365 18135 75 1 1 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.983 -0.037 18135 76 1 1 . 1 1 15 15 LEU C C 15 178.652 178.652 178.949 -0.297 18135 77 1 1 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.263 -0.175 18135 78 1 1 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.794 -0.240 18135 79 1 1 . 1 1 15 15 LEU H H 15 7.550 7.550 8.213 -0.663 18135 80 1 1 . 1 1 16 16 MET N N 16 118.788 118.788 117.728 1.060 18135 81 1 1 . 1 1 16 16 MET HA H 16 4.023 4.023 3.951 0.072 18135 82 1 1 . 1 1 16 16 MET C C 16 178.718 178.718 178.692 0.026 18135 83 1 1 . 1 1 16 16 MET CA C 16 58.513 58.513 59.334 -0.821 18135 84 1 1 . 1 1 16 16 MET CB C 16 32.150 32.150 32.486 -0.336 18135 85 1 1 . 1 1 16 16 MET H H 16 7.985 7.985 8.340 -0.355 18135 86 1 1 . 1 1 17 17 LEU N N 17 120.644 120.644 119.687 0.957 18135 87 1 1 . 1 1 17 17 LEU HA H 17 3.972 3.972 4.006 -0.034 18135 88 1 1 . 1 1 17 17 LEU C C 17 178.238 178.238 179.224 -0.986 18135 89 1 1 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.509 -0.782 18135 90 1 1 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.247 0.888 18135 91 1 1 . 1 1 17 17 LEU H H 17 7.829 7.829 8.155 -0.326 18135 92 1 1 . 1 1 18 18 LEU N N 18 118.280 118.280 118.917 -0.637 18135 93 1 1 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.890 -0.384 18135 94 1 1 . 1 1 18 18 LEU C C 18 175.739 175.739 178.561 -2.822 18135 95 1 1 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.361 0.295 18135 96 1 1 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.493 0.749 18135 97 1 1 . 1 1 18 18 LEU H H 18 7.499 7.499 8.377 -0.878 18135 98 1 1 . 1 1 19 19 ALA N N 19 121.961 121.961 120.573 1.388 18135 99 1 1 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.148 -0.311 18135 100 1 1 . 1 1 19 19 ALA C C 19 180.736 180.736 178.328 2.408 18135 101 1 1 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.221 0.845 18135 102 1 1 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.240 -1.163 18135 103 1 1 . 1 1 19 19 ALA H H 19 7.950 7.950 7.805 0.145 18135 104 1 1 . 1 1 20 20 GLN N N 20 118.605 118.605 115.014 3.591 18135 105 1 1 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.185 -0.250 18135 106 1 1 . 1 1 20 20 GLN C C 20 176.945 176.945 177.680 -0.735 18135 107 1 1 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.513 0.502 18135 108 1 1 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.306 -0.832 18135 109 1 1 . 1 1 20 20 GLN H H 20 7.958 7.958 8.017 -0.059 18135 110 1 1 . 1 1 21 21 MET N N 21 116.693 116.693 117.009 -0.316 18135 111 1 1 . 1 1 21 21 MET HA H 21 3.861 3.861 4.476 -0.616 18135 112 1 1 . 1 1 21 21 MET C C 21 174.671 174.671 175.689 -1.018 18135 113 1 1 . 1 1 21 21 MET CA C 21 57.111 57.111 57.298 -0.187 18135 114 1 1 . 1 1 21 21 MET CB C 21 34.073 34.073 33.187 0.886 18135 115 1 1 . 1 1 21 21 MET H H 21 7.420 7.420 7.812 -0.392 18135 116 1 1 . 1 1 22 22 ARG N N 22 115.451 115.451 121.616 -6.165 18135 117 1 1 . 1 1 22 22 ARG HA H 22 3.853 3.853 4.131 -0.278 18135 118 1 1 . 1 1 22 22 ARG C C 22 175.950 175.950 174.539 1.411 18135 119 1 1 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.336 3.116 18135 120 1 1 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.392 1.122 18135 121 1 1 . 1 1 22 22 ARG H H 22 6.484 6.484 7.428 -0.944 18135 122 1 1 . 1 1 23 23 LYS N N 23 128.593 128.593 127.453 1.140 18135 123 1 1 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.617 -0.132 18135 124 1 1 . 1 1 23 23 LYS C C 23 176.643 176.643 174.815 1.828 18135 125 1 1 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.624 1.663 18135 126 1 1 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.852 4.409 18135 127 1 1 . 1 1 23 23 LYS H H 23 10.212 10.212 8.783 1.429 18135 128 1 1 . 1 1 24 24 ILE N N 24 118.605 118.605 122.947 -4.342 18135 129 1 1 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.387 0.097 18135 130 1 1 . 1 1 24 24 ILE C C 24 173.878 173.878 174.363 -0.485 18135 131 1 1 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.671 -1.074 18135 132 1 1 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.636 -0.180 18135 133 1 1 . 1 1 24 24 ILE H H 24 8.465 8.465 8.375 0.090 18135 134 1 1 . 1 1 25 25 SER N N 25 113.658 113.658 117.876 -4.218 18135 135 1 1 . 1 1 25 25 SER HA H 25 4.481 4.481 5.030 -0.549 18135 136 1 1 . 1 1 25 25 SER C C 25 176.359 176.359 175.850 0.509 18135 137 1 1 . 1 1 25 25 SER CA C 25 56.975 56.975 56.952 0.023 18135 138 1 1 . 1 1 25 25 SER CB C 25 64.759 64.759 64.043 0.716 18135 139 1 1 . 1 1 25 25 SER H H 25 8.104 8.104 8.549 -0.445 18135 140 1 1 . 1 1 26 26 LEU N N 26 127.566 127.566 125.867 1.699 18135 141 1 1 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.466 -0.589 18135 142 1 1 . 1 1 26 26 LEU C C 26 178.946 178.946 177.248 1.698 18135 143 1 1 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.253 0.425 18135 144 1 1 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.034 -0.315 18135 145 1 1 . 1 1 26 26 LEU H H 26 8.802 8.802 9.064 -0.262 18135 146 1 1 . 1 1 27 27 PHE N N 27 117.143 117.143 117.291 -0.148 18135 147 1 1 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.596 -0.358 18135 148 1 1 . 1 1 27 27 PHE C C 27 177.067 177.067 176.616 0.451 18135 149 1 1 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.612 1.478 18135 150 1 1 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.335 -0.073 18135 151 1 1 . 1 1 27 27 PHE H H 27 7.986 7.986 8.007 -0.021 18135 152 1 1 . 1 1 28 28 SER N N 28 115.200 115.200 116.053 -0.853 18135 153 1 1 . 1 1 28 28 SER HA H 28 4.505 4.505 4.369 0.136 18135 154 1 1 . 1 1 28 28 SER C C 28 174.533 174.533 174.625 -0.092 18135 155 1 1 . 1 1 28 28 SER CA C 28 59.447 59.447 61.049 -1.602 18135 156 1 1 . 1 1 28 28 SER CB C 28 63.790 63.790 63.648 0.143 18135 157 1 1 . 1 1 28 28 SER H H 28 7.929 7.929 8.092 -0.163 18135 158 1 1 . 1 1 29 29 CYS N N 29 119.870 119.870 119.099 0.771 18135 159 1 1 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.705 0.377 18135 160 1 1 . 1 1 29 29 CYS C C 29 176.475 176.475 174.223 2.252 18135 161 1 1 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.628 -5.198 18135 162 1 1 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.815 9.427 18135 163 1 1 . 1 1 29 29 CYS H H 29 7.865 7.865 8.325 -0.460 18135 164 1 1 . 1 1 30 30 LEU N N 30 122.259 122.259 123.415 -1.156 18135 165 1 1 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.346 -0.385 18135 166 1 1 . 1 1 30 30 LEU C C 30 179.774 179.774 177.510 2.264 18135 167 1 1 . 1 1 30 30 LEU CA C 30 58.303 58.303 55.900 2.403 18135 168 1 1 . 1 1 30 30 LEU CB C 30 41.576 41.576 41.739 -0.163 18135 169 1 1 . 1 1 30 30 LEU H H 30 7.812 7.812 8.580 -0.768 18135 170 1 1 . 1 1 31 31 LYS N N 31 117.731 117.731 112.359 5.372 18135 171 1 1 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.402 0.288 18135 172 1 1 . 1 1 31 31 LYS C C 31 176.692 176.692 175.867 0.825 18135 173 1 1 . 1 1 31 31 LYS CA C 31 54.077 54.077 56.353 -2.276 18135 174 1 1 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.426 0.161 18135 175 1 1 . 1 1 31 31 LYS H H 31 8.597 8.597 8.183 0.414 18135 176 1 1 . 1 1 32 32 ASP N N 32 117.841 117.841 118.277 -0.436 18135 177 1 1 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.769 -0.075 18135 178 1 1 . 1 1 32 32 ASP C C 32 175.505 175.505 177.081 -1.576 18135 179 1 1 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.602 -0.514 18135 180 1 1 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.995 -1.187 18135 181 1 1 . 1 1 32 32 ASP H H 32 7.808 7.808 7.483 0.325 18135 182 1 1 . 1 1 33 33 ARG N N 33 120.876 120.876 119.699 1.177 18135 183 1 1 . 1 1 33 33 ARG HA H 33 4.041 4.041 3.882 0.159 18135 184 1 1 . 1 1 33 33 ARG C C 33 175.286 175.286 176.057 -0.771 18135 185 1 1 . 1 1 33 33 ARG CA C 33 58.083 58.083 59.282 -1.198 18135 186 1 1 . 1 1 33 33 ARG CB C 33 30.013 30.013 29.506 0.507 18135 187 1 1 . 1 1 33 33 ARG H H 33 7.378 7.378 7.356 0.022 18135 188 1 1 . 1 1 34 34 HIS N N 34 120.555 120.555 119.417 1.138 18135 189 1 1 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.430 -0.218 18135 190 1 1 . 1 1 34 34 HIS C C 34 170.494 170.494 173.954 -3.460 18135 191 1 1 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.107 -2.500 18135 192 1 1 . 1 1 34 34 HIS CB C 34 31.488 31.488 28.525 2.963 18135 193 1 1 . 1 1 34 34 HIS H H 34 7.974 7.974 7.854 0.120 18135 194 1 1 . 1 1 35 35 ASP N N 35 125.061 125.061 122.260 2.801 18135 195 1 1 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.274 0.364 18135 196 1 1 . 1 1 35 35 ASP C C 35 175.943 175.943 174.676 1.267 18135 197 1 1 . 1 1 35 35 ASP CA C 35 52.369 52.369 53.489 -1.120 18135 198 1 1 . 1 1 35 35 ASP CB C 35 40.362 40.362 42.672 -2.310 18135 199 1 1 . 1 1 35 35 ASP H H 35 7.805 7.805 7.647 0.158 18135 200 1 1 . 1 1 36 36 PHE N N 36 122.860 122.860 113.771 9.089 18135 201 1 1 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.226 0.098 18135 202 1 1 . 1 1 36 36 PHE C C 36 176.643 176.643 175.253 1.390 18135 203 1 1 . 1 1 36 36 PHE CA C 36 59.639 59.639 57.966 1.673 18135 204 1 1 . 1 1 36 36 PHE CB C 36 40.691 40.691 36.832 3.859 18135 205 1 1 . 1 1 36 36 PHE H H 36 8.973 8.973 8.227 0.746 18135 206 1 1 . 1 1 37 37 GLY N N 37 111.856 111.856 108.406 3.450 18135 207 1 1 . 1 1 37 37 GLY C C 37 175.185 175.185 174.396 0.789 18135 208 1 1 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.859 3.284 18135 209 1 1 . 1 1 37 37 GLY H H 37 8.727 8.727 8.309 0.418 18135 210 1 1 . 1 1 38 38 PHE N N 38 123.178 123.178 123.373 -0.195 18135 211 1 1 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.806 -0.892 18135 212 1 1 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.342 2.462 18135 213 1 1 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.057 0.600 18135 214 1 1 . 1 1 38 38 PHE H H 38 9.169 9.169 7.461 1.708 18135 215 1 1 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.455 0.074 18135 216 1 1 . 1 1 39 39 PRO C C 39 174.634 174.634 177.327 -2.693 18135 217 1 1 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.692 -1.149 18135 218 1 1 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.294 -1.590 18135 219 1 1 . 1 1 40 40 GLN N N 40 123.608 123.608 123.311 0.297 18135 220 1 1 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.216 -0.597 18135 221 1 1 . 1 1 40 40 GLN C C 40 176.958 176.958 177.298 -0.340 18135 222 1 1 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.473 -1.400 18135 223 1 1 . 1 1 40 40 GLN CB C 40 28.817 28.817 28.244 0.573 18135 224 1 1 . 1 1 40 40 GLN H H 40 7.966 7.966 8.279 -0.313 18135 225 1 1 . 1 1 41 41 GLU N N 41 119.446 119.446 118.965 0.481 18135 226 1 1 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.115 0.022 18135 227 1 1 . 1 1 41 41 GLU C C 41 177.346 177.346 177.877 -0.531 18135 228 1 1 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.768 -0.839 18135 229 1 1 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.156 -1.323 18135 230 1 1 . 1 1 41 41 GLU H H 41 9.044 9.044 8.727 0.317 18135 231 1 1 . 1 1 42 42 GLU N N 42 117.196 117.196 117.621 -0.425 18135 232 1 1 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.336 -0.273 18135 233 1 1 . 1 1 42 42 GLU C C 42 174.886 174.886 177.824 -2.938 18135 234 1 1 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.887 -1.503 18135 235 1 1 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.124 -2.566 18135 236 1 1 . 1 1 42 42 GLU H H 42 7.646 7.646 7.879 -0.233 18135 237 1 1 . 1 1 43 43 PHE N N 43 115.527 115.527 122.026 -6.499 18135 238 1 1 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.624 -0.138 18135 239 1 1 . 1 1 43 43 PHE C C 43 175.615 175.615 175.841 -0.226 18135 240 1 1 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.739 -1.191 18135 241 1 1 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.155 -0.262 18135 242 1 1 . 1 1 43 43 PHE H H 43 7.601 7.601 8.745 -1.144 18135 243 1 1 . 1 1 44 44 GLY N N 44 107.243 107.243 108.877 -1.634 18135 244 1 1 . 1 1 44 44 GLY C C 44 174.032 174.032 174.144 -0.112 18135 245 1 1 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.900 -0.288 18135 246 1 1 . 1 1 44 44 GLY H H 44 7.733 7.733 7.862 -0.129 18135 247 1 1 . 1 1 45 45 ASN N N 45 117.599 117.599 121.747 -4.148 18135 248 1 1 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.969 -0.418 18135 249 1 1 . 1 1 45 45 ASN C C 45 175.894 175.894 174.807 1.087 18135 250 1 1 . 1 1 45 45 ASN CA C 45 53.849 53.849 53.224 0.625 18135 251 1 1 . 1 1 45 45 ASN CB C 45 38.419 38.419 40.498 -2.079 18135 252 1 1 . 1 1 45 45 ASN H H 45 8.343 8.343 7.672 0.671 18135 253 1 1 . 1 1 46 46 GLN N N 46 118.916 118.916 119.297 -0.381 18135 254 1 1 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.465 -0.383 18135 255 1 1 . 1 1 46 46 GLN C C 46 175.851 175.851 176.708 -0.857 18135 256 1 1 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.790 0.856 18135 257 1 1 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.954 -0.510 18135 258 1 1 . 1 1 46 46 GLN H H 46 8.652 8.652 8.709 -0.057 18135 259 1 1 . 1 1 47 47 PHE N N 47 119.511 119.511 117.670 1.841 18135 260 1 1 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.510 0.052 18135 261 1 1 . 1 1 47 47 PHE C C 47 176.258 176.258 175.394 0.864 18135 262 1 1 . 1 1 47 47 PHE CA C 47 57.920 57.920 57.820 0.100 18135 263 1 1 . 1 1 47 47 PHE CB C 47 39.858 39.858 38.742 1.116 18135 264 1 1 . 1 1 47 47 PHE H H 47 7.904 7.904 7.908 -0.004 18135 265 1 1 . 1 1 48 48 GLN N N 48 120.127 120.127 118.809 1.318 18135 266 1 1 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.193 0.182 18135 267 1 1 . 1 1 48 48 GLN C C 48 181.265 181.265 175.274 5.991 18135 268 1 1 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.373 1.203 18135 269 1 1 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.437 -0.969 18135 270 1 1 . 1 1 48 48 GLN H H 48 8.255 8.255 7.431 0.824 18135 271 1 1 . 1 1 49 49 LYS N N 49 121.777 121.777 123.506 -1.729 18135 272 1 1 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.064 0.039 18135 273 1 1 . 1 1 49 49 LYS C C 49 177.968 177.968 178.246 -0.278 18135 274 1 1 . 1 1 49 49 LYS CA C 49 58.149 58.149 59.163 -1.014 18135 275 1 1 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.436 -0.046 18135 276 1 1 . 1 1 49 49 LYS H H 49 8.426 8.426 8.553 -0.127 18135 277 1 1 . 1 1 50 50 ALA N N 50 120.573 120.573 119.572 1.001 18135 278 1 1 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.128 -0.058 18135 279 1 1 . 1 1 50 50 ALA C C 50 178.697 178.697 177.728 0.969 18135 280 1 1 . 1 1 50 50 ALA CA C 50 54.768 54.768 54.022 0.747 18135 281 1 1 . 1 1 50 50 ALA CB C 50 18.874 18.874 17.990 0.884 18135 282 1 1 . 1 1 50 50 ALA H H 50 8.578 8.578 8.183 0.395 18135 283 1 1 . 1 1 51 51 GLU N N 51 115.015 115.015 114.700 0.315 18135 284 1 1 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.248 0.018 18135 285 1 1 . 1 1 51 51 GLU C C 51 176.995 176.995 176.977 0.018 18135 286 1 1 . 1 1 51 51 GLU CA C 51 56.993 56.993 56.974 0.019 18135 287 1 1 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.001 -1.096 18135 288 1 1 . 1 1 51 51 GLU H H 51 7.907 7.907 8.293 -0.386 18135 289 1 1 . 1 1 52 52 THR N N 52 111.210 111.210 116.510 -5.300 18135 290 1 1 . 1 1 52 52 THR HA H 52 4.114 4.114 4.246 -0.132 18135 291 1 1 . 1 1 52 52 THR C C 52 175.271 175.271 175.345 -0.074 18135 292 1 1 . 1 1 52 52 THR CA C 52 63.611 63.611 65.073 -1.462 18135 293 1 1 . 1 1 52 52 THR CB C 52 69.673 69.673 69.233 0.440 18135 294 1 1 . 1 1 52 52 THR H H 52 7.863 7.863 7.723 0.140 18135 295 1 1 . 1 1 53 53 ILE N N 53 119.113 119.113 122.928 -3.815 18135 296 1 1 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.216 -0.352 18135 297 1 1 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.841 1.066 18135 298 1 1 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.203 -1.250 18135 299 1 1 . 1 1 53 53 ILE H H 53 8.341 8.341 7.620 0.721 18135 300 1 1 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.390 -0.104 18135 301 1 1 . 1 1 54 54 PRO C C 54 179.655 179.655 178.919 0.736 18135 302 1 1 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.185 -0.134 18135 303 1 1 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.421 0.464 18135 304 1 1 . 1 1 55 55 VAL N N 55 116.355 116.355 117.077 -0.722 18135 305 1 1 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.875 -0.194 18135 306 1 1 . 1 1 55 55 VAL C C 55 177.649 177.649 178.277 -0.628 18135 307 1 1 . 1 1 55 55 VAL CA C 55 65.837 65.837 66.217 -0.380 18135 308 1 1 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.080 0.391 18135 309 1 1 . 1 1 55 55 VAL H H 55 7.119 7.119 7.396 -0.277 18135 310 1 1 . 1 1 56 56 LEU N N 56 123.038 123.038 120.949 2.089 18135 311 1 1 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.088 0.222 18135 312 1 1 . 1 1 56 56 LEU C C 56 178.637 178.637 178.096 0.541 18135 313 1 1 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.483 -0.397 18135 314 1 1 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.290 1.028 18135 315 1 1 . 1 1 56 56 LEU H H 56 8.535 8.535 8.448 0.087 18135 316 1 1 . 1 1 57 57 HIS N N 57 117.041 117.041 118.409 -1.368 18135 317 1 1 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.029 -0.243 18135 318 1 1 . 1 1 57 57 HIS C C 57 175.640 175.640 177.377 -1.737 18135 319 1 1 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.709 0.822 18135 320 1 1 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.141 -1.932 18135 321 1 1 . 1 1 57 57 HIS H H 57 9.047 9.047 8.091 0.956 18135 322 1 1 . 1 1 58 58 GLU N N 58 119.521 119.521 118.745 0.776 18135 323 1 1 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.844 0.163 18135 324 1 1 . 1 1 58 58 GLU C C 58 179.029 179.029 179.039 -0.010 18135 325 1 1 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.417 -0.450 18135 326 1 1 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.405 -1.115 18135 327 1 1 . 1 1 58 58 GLU H H 58 7.860 7.860 8.218 -0.358 18135 328 1 1 . 1 1 59 59 MET N N 59 119.512 119.512 118.856 0.656 18135 329 1 1 . 1 1 59 59 MET HA H 59 4.074 4.074 4.313 -0.239 18135 330 1 1 . 1 1 59 59 MET C C 59 177.031 177.031 179.098 -2.067 18135 331 1 1 . 1 1 59 59 MET CA C 59 59.408 59.408 59.444 -0.036 18135 332 1 1 . 1 1 59 59 MET CB C 59 32.525 32.525 32.708 -0.183 18135 333 1 1 . 1 1 59 59 MET H H 59 8.442 8.442 7.985 0.457 18135 334 1 1 . 1 1 60 60 ILE N N 60 117.183 117.183 117.803 -0.620 18135 335 1 1 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.518 -0.101 18135 336 1 1 . 1 1 60 60 ILE C C 60 177.524 177.524 178.241 -0.717 18135 337 1 1 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.854 0.472 18135 338 1 1 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.045 -0.185 18135 339 1 1 . 1 1 60 60 ILE H H 60 8.338 8.338 7.781 0.557 18135 340 1 1 . 1 1 61 61 GLN N N 61 120.191 120.191 120.186 0.005 18135 341 1 1 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.955 -0.253 18135 342 1 1 . 1 1 61 61 GLN C C 61 178.270 178.270 177.749 0.521 18135 343 1 1 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.349 -0.562 18135 344 1 1 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.312 0.354 18135 345 1 1 . 1 1 61 61 GLN H H 61 8.234 8.234 8.112 0.122 18135 346 1 1 . 1 1 62 62 GLN N N 62 116.795 116.795 118.811 -2.016 18135 347 1 1 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.091 0.536 18135 348 1 1 . 1 1 62 62 GLN C C 62 179.685 179.685 178.408 1.277 18135 349 1 1 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.152 -0.144 18135 350 1 1 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.648 -3.306 18135 351 1 1 . 1 1 62 62 GLN H H 62 8.421 8.421 8.054 0.367 18135 352 1 1 . 1 1 63 63 ILE N N 63 122.797 122.797 120.161 2.636 18135 353 1 1 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.781 -0.132 18135 354 1 1 . 1 1 63 63 ILE C C 63 177.279 177.279 177.817 -0.538 18135 355 1 1 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.656 2.309 18135 356 1 1 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.748 -0.433 18135 357 1 1 . 1 1 63 63 ILE H H 63 8.164 8.164 7.632 0.532 18135 358 1 1 . 1 1 64 64 PHE N N 64 120.820 120.820 121.070 -0.250 18135 359 1 1 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.467 -0.751 18135 360 1 1 . 1 1 64 64 PHE C C 64 178.402 178.402 176.975 1.427 18135 361 1 1 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.254 0.898 18135 362 1 1 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.357 0.153 18135 363 1 1 . 1 1 64 64 PHE H H 64 8.405 8.405 7.931 0.474 18135 364 1 1 . 1 1 65 65 ASN N N 65 119.981 119.981 118.493 1.488 18135 365 1 1 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.502 0.561 18135 366 1 1 . 1 1 65 65 ASN C C 65 177.944 177.944 177.611 0.333 18135 367 1 1 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.078 -0.210 18135 368 1 1 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.075 -0.819 18135 369 1 1 . 1 1 65 65 ASN H H 65 8.812 8.812 7.625 1.187 18135 370 1 1 . 1 1 66 66 LEU N N 66 121.533 121.533 120.578 0.955 18135 371 1 1 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.145 0.078 18135 372 1 1 . 1 1 66 66 LEU C C 66 177.777 177.777 179.090 -1.313 18135 373 1 1 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.954 0.314 18135 374 1 1 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.484 0.123 18135 375 1 1 . 1 1 66 66 LEU H H 66 8.177 8.177 7.752 0.425 18135 376 1 1 . 1 1 67 67 PHE N N 67 110.842 110.842 114.069 -3.227 18135 377 1 1 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.602 0.278 18135 378 1 1 . 1 1 67 67 PHE C C 67 177.965 177.965 176.533 1.432 18135 379 1 1 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.508 1.026 18135 380 1 1 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.804 -0.188 18135 381 1 1 . 1 1 67 67 PHE H H 67 8.160 8.160 8.626 -0.466 18135 382 1 1 . 1 1 68 68 SER N N 68 119.131 119.131 113.836 5.295 18135 383 1 1 . 1 1 68 68 SER HA H 68 4.580 4.580 4.396 0.184 18135 384 1 1 . 1 1 68 68 SER C C 68 173.472 173.472 174.830 -1.358 18135 385 1 1 . 1 1 68 68 SER CA C 68 59.191 59.191 59.340 -0.149 18135 386 1 1 . 1 1 68 68 SER CB C 68 63.123 63.123 63.821 -0.698 18135 387 1 1 . 1 1 68 68 SER H H 68 8.016 8.016 7.818 0.198 18135 388 1 1 . 1 1 69 69 THR N N 69 111.353 111.353 116.112 -4.759 18135 389 1 1 . 1 1 69 69 THR HA H 69 4.345 4.345 4.451 -0.106 18135 390 1 1 . 1 1 69 69 THR C C 69 175.661 175.661 174.454 1.207 18135 391 1 1 . 1 1 69 69 THR CA C 69 61.411 61.411 60.834 0.577 18135 392 1 1 . 1 1 69 69 THR CB C 69 72.209 72.209 70.537 1.672 18135 393 1 1 . 1 1 69 69 THR H H 69 6.977 6.977 7.367 -0.390 18135 394 1 1 . 1 1 70 70 LYS N N 70 121.120 121.120 122.953 -1.833 18135 395 1 1 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.133 -0.044 18135 396 1 1 . 1 1 70 70 LYS C C 70 179.259 179.259 177.143 2.116 18135 397 1 1 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.792 -0.836 18135 398 1 1 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.329 -0.579 18135 399 1 1 . 1 1 70 70 LYS H H 70 9.065 9.065 8.609 0.456 18135 400 1 1 . 1 1 71 71 ASP N N 71 116.374 116.374 120.013 -3.639 18135 401 1 1 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.254 -0.079 18135 402 1 1 . 1 1 71 71 ASP C C 71 178.372 178.372 177.855 0.517 18135 403 1 1 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.519 -0.452 18135 404 1 1 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.501 -0.195 18135 405 1 1 . 1 1 71 71 ASP H H 71 7.518 7.518 7.852 -0.334 18135 406 1 1 . 1 1 72 72 SER N N 72 117.341 117.341 113.958 3.383 18135 407 1 1 . 1 1 72 72 SER HA H 72 3.715 3.715 3.268 0.447 18135 408 1 1 . 1 1 72 72 SER C C 72 176.897 176.897 176.183 0.714 18135 409 1 1 . 1 1 72 72 SER CA C 72 60.267 60.267 60.959 -0.692 18135 410 1 1 . 1 1 72 72 SER CB C 72 62.616 62.616 62.538 0.078 18135 411 1 1 . 1 1 72 72 SER H H 72 8.066 8.066 7.881 0.185 18135 412 1 1 . 1 1 73 73 SER N N 73 113.398 113.398 117.798 -4.400 18135 413 1 1 . 1 1 73 73 SER HA H 73 4.094 4.094 4.146 -0.052 18135 414 1 1 . 1 1 73 73 SER C C 73 174.855 174.855 175.207 -0.352 18135 415 1 1 . 1 1 73 73 SER CA C 73 61.385 61.385 60.605 0.779 18135 416 1 1 . 1 1 73 73 SER CB C 73 62.798 62.798 62.911 -0.113 18135 417 1 1 . 1 1 73 73 SER H H 73 7.982 7.982 7.873 0.109 18135 418 1 1 . 1 1 74 74 ALA N N 74 119.486 119.486 121.088 -1.602 18135 419 1 1 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.120 0.037 18135 420 1 1 . 1 1 74 74 ALA C C 74 177.626 177.626 177.889 -0.263 18135 421 1 1 . 1 1 74 74 ALA CA C 74 52.713 52.713 53.171 -0.458 18135 422 1 1 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.888 -0.141 18135 423 1 1 . 1 1 74 74 ALA H H 74 7.095 7.095 7.760 -0.665 18135 424 1 1 . 1 1 75 75 ALA N N 75 121.465 121.465 120.679 0.786 18135 425 1 1 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.804 -0.108 18135 426 1 1 . 1 1 75 75 ALA C C 75 177.197 177.197 176.390 0.807 18135 427 1 1 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.242 0.762 18135 428 1 1 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.527 -0.268 18135 429 1 1 . 1 1 75 75 ALA H H 75 7.159 7.159 7.083 0.076 18135 430 1 1 . 1 1 76 76 TRP N N 76 116.791 116.791 116.518 0.273 18135 431 1 1 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.748 0.302 18135 432 1 1 . 1 1 76 76 TRP C C 76 177.617 177.617 174.754 2.863 18135 433 1 1 . 1 1 76 76 TRP CA C 76 53.319 53.319 54.984 -1.665 18135 434 1 1 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.347 2.729 18135 435 1 1 . 1 1 76 76 TRP H H 76 7.080 7.080 7.058 0.022 18135 436 1 1 . 1 1 77 77 ASP N N 77 119.928 119.928 121.112 -1.184 18135 437 1 1 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.477 -0.120 18135 438 1 1 . 1 1 77 77 ASP C C 77 176.877 176.877 177.423 -0.546 18135 439 1 1 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.992 -1.174 18135 440 1 1 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.630 -0.015 18135 441 1 1 . 1 1 77 77 ASP H H 77 8.259 8.259 8.964 -0.705 18135 442 1 1 . 1 1 78 78 GLU N N 78 127.277 127.277 124.028 3.249 18135 443 1 1 . 1 1 78 78 GLU HA H 78 3.885 3.885 4.113 -0.228 18135 444 1 1 . 1 1 78 78 GLU C C 78 177.439 177.439 178.636 -1.197 18135 445 1 1 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.329 0.055 18135 446 1 1 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.918 -1.276 18135 447 1 1 . 1 1 78 78 GLU H H 78 8.920 8.920 8.736 0.184 18135 448 1 1 . 1 1 79 79 THR N N 79 115.422 115.422 118.442 -3.020 18135 449 1 1 . 1 1 79 79 THR HA H 79 3.907 3.907 4.004 -0.097 18135 450 1 1 . 1 1 79 79 THR C C 79 177.330 177.330 176.771 0.559 18135 451 1 1 . 1 1 79 79 THR CA C 79 66.263 66.263 66.193 0.070 18135 452 1 1 . 1 1 79 79 THR CB C 79 68.002 68.002 68.345 -0.343 18135 453 1 1 . 1 1 79 79 THR H H 79 8.124 8.124 8.501 -0.377 18135 454 1 1 . 1 1 80 80 LEU N N 80 121.791 121.791 121.977 -0.186 18135 455 1 1 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.162 -0.275 18135 456 1 1 . 1 1 80 80 LEU C C 80 179.018 179.018 179.122 -0.104 18135 457 1 1 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.871 -0.632 18135 458 1 1 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.186 0.466 18135 459 1 1 . 1 1 80 80 LEU H H 80 7.725 7.725 8.195 -0.470 18135 460 1 1 . 1 1 81 81 LEU N N 81 119.280 119.280 120.577 -1.297 18135 461 1 1 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.173 -0.684 18135 462 1 1 . 1 1 81 81 LEU C C 81 177.062 177.062 179.482 -2.420 18135 463 1 1 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.143 -0.434 18135 464 1 1 . 1 1 81 81 LEU CB C 81 40.948 40.948 40.440 0.508 18135 465 1 1 . 1 1 81 81 LEU H H 81 8.344 8.344 7.756 0.588 18135 466 1 1 . 1 1 82 82 ASP N N 82 115.357 115.357 120.056 -4.699 18135 467 1 1 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.292 -0.018 18135 468 1 1 . 1 1 82 82 ASP C C 82 179.018 179.018 178.527 0.491 18135 469 1 1 . 1 1 82 82 ASP CA C 82 56.815 56.815 58.016 -1.201 18135 470 1 1 . 1 1 82 82 ASP CB C 82 38.221 38.221 41.080 -2.859 18135 471 1 1 . 1 1 82 82 ASP H H 82 8.001 8.001 8.694 -0.693 18135 472 1 1 . 1 1 83 83 LYS N N 83 119.603 119.603 119.107 0.496 18135 473 1 1 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.804 0.178 18135 474 1 1 . 1 1 83 83 LYS C C 83 178.624 178.624 178.844 -0.220 18135 475 1 1 . 1 1 83 83 LYS CA C 83 59.745 59.745 59.532 0.213 18135 476 1 1 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.354 0.752 18135 477 1 1 . 1 1 83 83 LYS H H 83 7.342 7.342 7.606 -0.264 18135 478 1 1 . 1 1 84 84 PHE N N 84 123.933 123.933 121.407 2.526 18135 479 1 1 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.022 0.013 18135 480 1 1 . 1 1 84 84 PHE C C 84 177.210 177.210 176.952 0.258 18135 481 1 1 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.661 -1.318 18135 482 1 1 . 1 1 84 84 PHE CB C 84 39.316 39.316 39.143 0.173 18135 483 1 1 . 1 1 84 84 PHE H H 84 8.471 8.471 8.343 0.128 18135 484 1 1 . 1 1 85 85 TYR N N 85 118.387 118.387 117.631 0.756 18135 485 1 1 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.932 0.136 18135 486 1 1 . 1 1 85 85 TYR C C 85 178.104 178.104 177.556 0.548 18135 487 1 1 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.580 -1.003 18135 488 1 1 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.161 -0.184 18135 489 1 1 . 1 1 85 85 TYR H H 85 9.011 9.011 9.005 0.006 18135 490 1 1 . 1 1 86 86 THR N N 86 114.035 114.035 115.855 -1.820 18135 491 1 1 . 1 1 86 86 THR HA H 86 3.945 3.945 3.301 0.644 18135 492 1 1 . 1 1 86 86 THR C C 86 176.708 176.708 176.553 0.155 18135 493 1 1 . 1 1 86 86 THR CA C 86 66.759 66.759 67.007 -0.248 18135 494 1 1 . 1 1 86 86 THR CB C 86 68.853 68.853 67.974 0.879 18135 495 1 1 . 1 1 86 86 THR H H 86 7.609 7.609 7.757 -0.148 18135 496 1 1 . 1 1 87 87 GLU N N 87 120.790 120.790 121.280 -0.490 18135 497 1 1 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.956 0.091 18135 498 1 1 . 1 1 87 87 GLU C C 87 179.606 179.606 179.049 0.557 18135 499 1 1 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.016 -0.618 18135 500 1 1 . 1 1 87 87 GLU CB C 87 28.286 28.286 28.953 -0.668 18135 501 1 1 . 1 1 87 87 GLU H H 87 7.712 7.712 7.655 0.057 18135 502 1 1 . 1 1 88 88 LEU N N 88 120.729 120.729 120.020 0.709 18135 503 1 1 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.918 -0.190 18135 504 1 1 . 1 1 88 88 LEU C C 88 178.695 178.695 179.258 -0.563 18135 505 1 1 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.246 1.005 18135 506 1 1 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.076 1.511 18135 507 1 1 . 1 1 88 88 LEU H H 88 8.393 8.393 7.510 0.883 18135 508 1 1 . 1 1 89 89 TYR N N 89 118.654 118.654 118.903 -0.249 18135 509 1 1 . 1 1 89 89 TYR HA H 89 3.931 3.931 3.993 -0.062 18135 510 1 1 . 1 1 89 89 TYR C C 89 178.438 178.438 178.542 -0.104 18135 511 1 1 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.007 0.401 18135 512 1 1 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.338 0.529 18135 513 1 1 . 1 1 89 89 TYR H H 89 8.637 8.637 8.366 0.272 18135 514 1 1 . 1 1 90 90 GLN N N 90 118.263 118.263 116.441 1.822 18135 515 1 1 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.979 0.007 18135 516 1 1 . 1 1 90 90 GLN C C 90 178.411 178.411 178.802 -0.391 18135 517 1 1 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.640 0.142 18135 518 1 1 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.273 -0.126 18135 519 1 1 . 1 1 90 90 GLN H H 90 7.796 7.796 7.836 -0.040 18135 520 1 1 . 1 1 91 91 GLN N N 91 117.959 117.959 120.238 -2.279 18135 521 1 1 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.069 0.013 18135 522 1 1 . 1 1 91 91 GLN C C 91 178.705 178.705 178.528 0.177 18135 523 1 1 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.802 0.018 18135 524 1 1 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.366 0.807 18135 525 1 1 . 1 1 91 91 GLN H H 91 7.727 7.727 8.047 -0.320 18135 526 1 1 . 1 1 92 92 LEU N N 92 119.965 119.965 118.999 0.966 18135 527 1 1 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.959 -0.225 18135 528 1 1 . 1 1 92 92 LEU C C 92 178.984 178.984 178.768 0.216 18135 529 1 1 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.647 -0.155 18135 530 1 1 . 1 1 92 92 LEU CB C 92 41.379 41.379 41.004 0.375 18135 531 1 1 . 1 1 92 92 LEU H H 92 8.465 8.465 8.474 -0.009 18135 532 1 1 . 1 1 93 93 ASN N N 93 117.793 117.793 118.372 -0.579 18135 533 1 1 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.278 0.123 18135 534 1 1 . 1 1 93 93 ASN C C 93 178.309 178.309 177.169 1.140 18135 535 1 1 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.256 0.147 18135 536 1 1 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.222 0.416 18135 537 1 1 . 1 1 93 93 ASN H H 93 8.091 8.091 8.101 -0.010 18135 538 1 1 . 1 1 94 94 ASP N N 94 121.133 121.133 120.805 0.328 18135 539 1 1 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.393 0.012 18135 540 1 1 . 1 1 94 94 ASP C C 94 178.328 178.328 178.762 -0.434 18135 541 1 1 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.276 -0.729 18135 542 1 1 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.948 -2.299 18135 543 1 1 . 1 1 94 94 ASP H H 94 8.362 8.362 7.983 0.379 18135 544 1 1 . 1 1 95 95 LEU N N 95 119.160 119.160 120.331 -1.171 18135 545 1 1 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.828 0.211 18135 546 1 1 . 1 1 95 95 LEU C C 95 178.826 178.826 178.821 0.005 18135 547 1 1 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.566 -1.539 18135 548 1 1 . 1 1 95 95 LEU CB C 95 42.210 42.210 41.765 0.445 18135 549 1 1 . 1 1 95 95 LEU H H 95 8.143 8.143 8.532 -0.389 18135 550 1 1 . 1 1 96 96 GLU N N 96 118.813 118.813 118.898 -0.085 18135 551 1 1 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.691 0.270 18135 552 1 1 . 1 1 96 96 GLU C C 96 177.640 177.640 178.257 -0.617 18135 553 1 1 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.422 -1.708 18135 554 1 1 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.436 -1.298 18135 555 1 1 . 1 1 96 96 GLU H H 96 8.111 8.111 8.322 -0.211 18135 556 1 1 . 1 1 97 97 ALA N N 97 120.549 120.549 120.931 -0.382 18135 557 1 1 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.986 0.136 18135 558 1 1 . 1 1 97 97 ALA C C 97 179.126 179.126 180.302 -1.176 18135 559 1 1 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.710 -0.677 18135 560 1 1 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.893 0.087 18135 561 1 1 . 1 1 97 97 ALA H H 97 7.798 7.798 7.795 0.003 18135 562 1 1 . 1 1 98 98 CYS N N 98 115.510 115.510 117.255 -1.745 18135 563 1 1 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.170 0.280 18135 564 1 1 . 1 1 98 98 CYS C C 98 175.363 175.363 175.934 -0.571 18135 565 1 1 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.235 -5.069 18135 566 1 1 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.105 15.774 18135 567 1 1 . 1 1 98 98 CYS H H 98 7.597 7.597 7.837 -0.240 18135 568 1 1 . 1 1 99 99 VAL N N 99 121.713 121.713 118.927 2.786 18135 569 1 1 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.797 -0.003 18135 570 1 1 . 1 1 99 99 VAL C C 99 177.357 177.357 177.557 -0.200 18135 571 1 1 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.507 -0.924 18135 572 1 1 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.264 -0.233 18135 573 1 1 . 1 1 99 99 VAL H H 99 7.828 7.828 7.599 0.229 18135 574 1 1 . 1 1 100 100 ILE N N 100 122.333 122.333 117.321 5.012 18135 575 1 1 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.734 0.190 18135 576 1 1 . 1 1 100 100 ILE C C 100 176.827 176.827 176.658 0.169 18135 577 1 1 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.631 -1.393 18135 578 1 1 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.710 0.568 18135 579 1 1 . 1 1 100 100 ILE H H 100 8.067 8.067 8.160 -0.093 18135 580 1 1 . 1 1 101 101 GLN N N 101 121.864 121.864 117.307 4.557 18135 581 1 1 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.216 0.010 18135 582 1 1 . 1 1 101 101 GLN C C 101 176.438 176.438 178.006 -1.568 18135 583 1 1 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.513 -0.193 18135 584 1 1 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.131 -0.120 18135 585 1 1 . 1 1 101 101 GLN H H 101 8.062 8.062 7.431 0.631 18135 586 1 1 . 1 1 102 102 GLY N N 102 109.288 109.288 107.410 1.878 18135 587 1 1 . 1 1 102 102 GLY C C 102 173.855 173.855 175.290 -1.435 18135 588 1 1 . 1 1 102 102 GLY CA C 102 45.159 45.159 45.774 -0.615 18135 589 1 1 . 1 1 102 102 GLY H H 102 8.087 8.087 8.778 -0.691 18135 590 1 1 . 1 1 103 103 VAL N N 103 118.932 118.932 118.564 0.368 18135 591 1 1 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.813 0.261 18135 592 1 1 . 1 1 103 103 VAL C C 103 176.299 176.299 175.848 0.451 18135 593 1 1 . 1 1 103 103 VAL CA C 103 62.499 62.499 64.046 -1.547 18135 594 1 1 . 1 1 103 103 VAL CB C 103 32.854 32.854 32.022 0.832 18135 595 1 1 . 1 1 103 103 VAL H H 103 8.079 8.079 7.663 0.416 18135 596 1 1 . 1 1 104 104 GLY N N 104 112.028 112.028 106.808 5.220 18135 597 1 1 . 1 1 104 104 GLY C C 104 173.694 173.694 173.022 0.672 18135 598 1 1 . 1 1 104 104 GLY CA C 104 45.402 45.402 44.911 0.491 18135 599 1 1 . 1 1 104 104 GLY H H 104 8.446 8.446 7.474 0.972 18135 600 1 1 . 1 1 105 105 VAL N N 105 120.439 120.439 121.883 -1.444 18135 601 1 1 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.403 -0.215 18135 602 1 1 . 1 1 105 105 VAL C C 105 175.963 175.963 174.377 1.586 18135 603 1 1 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.458 1.678 18135 604 1 1 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.283 -1.469 18135 605 1 1 . 1 1 105 105 VAL H H 105 7.867 7.867 7.961 -0.094 18135 606 1 1 . 1 1 106 106 THR N N 106 116.366 116.366 117.430 -1.064 18135 607 1 1 . 1 1 106 106 THR HA H 106 4.548 4.548 4.600 -0.052 18135 608 1 1 . 1 1 106 106 THR C C 106 173.731 173.731 173.685 0.046 18135 609 1 1 . 1 1 106 106 THR CA C 106 59.419 59.419 60.169 -0.750 18135 610 1 1 . 1 1 106 106 THR CB C 106 79.536 79.536 70.727 8.809 18135 611 1 1 . 1 1 106 106 THR H H 106 8.565 8.565 8.069 0.496 18135 612 1 1 . 1 1 107 107 GLU N N 107 119.743 119.743 120.162 -0.419 18135 613 1 1 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.645 -0.183 18135 614 1 1 . 1 1 107 107 GLU C C 107 175.639 175.639 176.474 -0.835 18135 615 1 1 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.823 0.888 18135 616 1 1 . 1 1 107 107 GLU CB C 107 30.499 30.499 30.987 -0.488 18135 617 1 1 . 1 1 107 107 GLU H H 107 8.410 8.410 8.399 0.011 18135 618 1 1 . 1 1 108 108 THR N N 108 114.402 114.402 111.264 3.138 18135 619 1 1 . 1 1 108 108 THR HA H 108 4.448 4.448 4.778 -0.330 18135 620 1 1 . 1 1 108 108 THR CA C 108 60.348 60.348 58.566 1.782 18135 621 1 1 . 1 1 108 108 THR CB C 108 68.544 68.544 69.371 -0.827 18135 622 1 1 . 1 1 108 108 THR H H 108 8.155 8.155 8.556 -0.401 18135 623 1 1 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.417 -0.179 18135 624 1 1 . 1 1 109 109 PRO C C 109 178.666 178.666 177.590 1.076 18135 625 1 1 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.062 1.314 18135 626 1 1 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.959 -0.111 18135 627 1 1 . 1 1 110 110 LEU N N 110 118.566 118.566 118.499 0.067 18135 628 1 1 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.158 -0.042 18135 629 1 1 . 1 1 110 110 LEU C C 110 178.293 178.293 179.210 -0.917 18135 630 1 1 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.941 -1.255 18135 631 1 1 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.835 0.134 18135 632 1 1 . 1 1 110 110 LEU H H 110 8.016 8.016 7.829 0.187 18135 633 1 1 . 1 1 111 111 MET N N 111 118.982 118.982 116.070 2.912 18135 634 1 1 . 1 1 111 111 MET HA H 111 4.210 4.210 4.312 -0.102 18135 635 1 1 . 1 1 111 111 MET C C 111 178.720 178.720 177.792 0.928 18135 636 1 1 . 1 1 111 111 MET CA C 111 58.144 58.144 57.977 0.167 18135 637 1 1 . 1 1 111 111 MET CB C 111 32.374 32.374 33.093 -0.719 18135 638 1 1 . 1 1 111 111 MET H H 111 7.705 7.705 7.754 -0.049 18135 639 1 1 . 1 1 112 112 LYS N N 112 121.377 121.377 119.647 1.730 18135 640 1 1 . 1 1 112 112 LYS HA H 112 4.108 4.108 3.964 0.144 18135 641 1 1 . 1 1 112 112 LYS C C 112 178.000 178.000 178.284 -0.284 18135 642 1 1 . 1 1 112 112 LYS CA C 112 56.305 56.305 59.440 -3.135 18135 643 1 1 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.276 0.091 18135 644 1 1 . 1 1 112 112 LYS H H 112 8.257 8.257 7.725 0.532 18135 645 1 1 . 1 1 113 113 GLU N N 113 119.104 119.104 118.857 0.247 18135 646 1 1 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.990 0.076 18135 647 1 1 . 1 1 113 113 GLU C C 113 178.289 178.289 178.935 -0.646 18135 648 1 1 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.669 -1.416 18135 649 1 1 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.375 -1.237 18135 650 1 1 . 1 1 113 113 GLU H H 113 8.270 8.270 7.809 0.461 18135 651 1 1 . 1 1 114 114 ASP N N 114 119.224 119.224 119.883 -0.659 18135 652 1 1 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.406 -0.118 18135 653 1 1 . 1 1 114 114 ASP C C 114 178.365 178.365 178.445 -0.080 18135 654 1 1 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.601 -1.493 18135 655 1 1 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.374 -2.139 18135 656 1 1 . 1 1 114 114 ASP H H 114 8.618 8.618 7.738 0.880 18135 657 1 1 . 1 1 115 115 SER N N 115 118.195 118.195 116.005 2.190 18135 658 1 1 . 1 1 115 115 SER HA H 115 4.200 4.200 4.189 0.011 18135 659 1 1 . 1 1 115 115 SER C C 115 175.986 175.986 176.517 -0.531 18135 660 1 1 . 1 1 115 115 SER CA C 115 61.588 61.588 61.803 -0.215 18135 661 1 1 . 1 1 115 115 SER CB C 115 62.653 62.653 63.027 -0.374 18135 662 1 1 . 1 1 115 115 SER H H 115 8.181 8.181 7.545 0.636 18135 663 1 1 . 1 1 116 116 ILE N N 116 123.340 123.340 121.016 2.324 18135 664 1 1 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.877 -0.251 18135 665 1 1 . 1 1 116 116 ILE C C 116 178.367 178.367 178.097 0.270 18135 666 1 1 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.673 1.144 18135 667 1 1 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.691 0.726 18135 668 1 1 . 1 1 116 116 ILE H H 116 7.773 7.773 8.240 -0.467 18135 669 1 1 . 1 1 117 117 LEU N N 117 120.968 120.968 121.971 -1.003 18135 670 1 1 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.936 -0.031 18135 671 1 1 . 1 1 117 117 LEU C C 117 178.746 178.746 178.204 0.542 18135 672 1 1 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.537 -0.394 18135 673 1 1 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.600 -0.014 18135 674 1 1 . 1 1 117 117 LEU H H 117 8.406 8.406 7.792 0.614 18135 675 1 1 . 1 1 118 118 ALA N N 118 120.150 120.150 121.928 -1.778 18135 676 1 1 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.669 0.443 18135 677 1 1 . 1 1 118 118 ALA C C 118 181.633 181.633 178.766 2.867 18135 678 1 1 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.204 0.109 18135 679 1 1 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.312 -0.202 18135 680 1 1 . 1 1 118 118 ALA H H 118 7.894 7.894 8.576 -0.682 18135 681 1 1 . 1 1 119 119 VAL N N 119 118.873 118.873 115.964 2.909 18135 682 1 1 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.405 0.350 18135 683 1 1 . 1 1 119 119 VAL C C 119 177.896 177.896 177.664 0.232 18135 684 1 1 . 1 1 119 119 VAL CA C 119 67.181 67.181 64.989 2.192 18135 685 1 1 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.131 1.764 18135 686 1 1 . 1 1 119 119 VAL H H 119 7.572 7.572 7.863 -0.291 18135 687 1 1 . 1 1 120 120 ARG N N 120 121.436 121.436 120.448 0.988 18135 688 1 1 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.069 -0.042 18135 689 1 1 . 1 1 120 120 ARG C C 120 179.848 179.848 178.985 0.863 18135 690 1 1 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.861 1.406 18135 691 1 1 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.896 -0.201 18135 692 1 1 . 1 1 120 120 ARG H H 120 8.629 8.629 7.919 0.710 18135 693 1 1 . 1 1 121 121 LYS N N 121 119.589 119.589 119.508 0.081 18135 694 1 1 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.069 0.005 18135 695 1 1 . 1 1 121 121 LYS C C 121 178.331 178.331 179.315 -0.984 18135 696 1 1 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.299 1.141 18135 697 1 1 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.211 -0.104 18135 698 1 1 . 1 1 121 121 LYS H H 121 9.015 9.015 8.201 0.814 18135 699 1 1 . 1 1 122 122 TYR N N 122 121.546 121.546 119.511 2.035 18135 700 1 1 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.303 0.029 18135 701 1 1 . 1 1 122 122 TYR C C 122 176.527 176.527 178.378 -1.851 18135 702 1 1 . 1 1 122 122 TYR CA C 122 60.404 60.404 59.101 1.303 18135 703 1 1 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.371 0.354 18135 704 1 1 . 1 1 122 122 TYR H H 122 7.473 7.473 7.732 -0.259 18135 705 1 1 . 1 1 123 123 PHE N N 123 116.026 116.026 119.648 -3.622 18135 706 1 1 . 1 1 123 123 PHE HA H 123 3.740 3.740 4.068 -0.328 18135 707 1 1 . 1 1 123 123 PHE C C 123 179.005 179.005 177.619 1.386 18135 708 1 1 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.145 3.383 18135 709 1 1 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.959 0.372 18135 710 1 1 . 1 1 123 123 PHE H H 123 7.932 7.932 8.382 -0.450 18135 711 1 1 . 1 1 124 124 GLN N N 124 123.043 123.043 119.295 3.748 18135 712 1 1 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.455 0.724 18135 713 1 1 . 1 1 124 124 GLN C C 124 178.772 178.772 178.197 0.575 18135 714 1 1 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.676 -0.360 18135 715 1 1 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.381 -0.750 18135 716 1 1 . 1 1 124 124 GLN H H 124 8.470 8.470 8.563 -0.093 18135 717 1 1 . 1 1 125 125 ARG N N 125 120.342 120.342 119.658 0.684 18135 718 1 1 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.159 -0.081 18135 719 1 1 . 1 1 125 125 ARG C C 125 180.340 180.340 179.474 0.866 18135 720 1 1 . 1 1 125 125 ARG CA C 125 61.297 61.297 59.362 1.935 18135 721 1 1 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.263 0.062 18135 722 1 1 . 1 1 125 125 ARG H H 125 8.137 8.137 8.145 -0.008 18135 723 1 1 . 1 1 126 126 ILE N N 126 121.876 121.876 120.257 1.619 18135 724 1 1 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.556 -0.205 18135 725 1 1 . 1 1 126 126 ILE C C 126 176.857 176.857 177.668 -0.811 18135 726 1 1 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.869 0.963 18135 727 1 1 . 1 1 126 126 ILE CB C 126 37.284 37.284 37.000 0.284 18135 728 1 1 . 1 1 126 126 ILE H H 126 7.526 7.526 8.249 -0.723 18135 729 1 1 . 1 1 127 127 THR N N 127 115.613 115.613 115.141 0.472 18135 730 1 1 . 1 1 127 127 THR HA H 127 3.633 3.633 3.859 -0.226 18135 731 1 1 . 1 1 127 127 THR C C 127 176.645 176.645 176.821 -0.176 18135 732 1 1 . 1 1 127 127 THR CA C 127 67.294 67.294 66.493 0.801 18135 733 1 1 . 1 1 127 127 THR CB C 127 68.871 68.871 68.859 0.013 18135 734 1 1 . 1 1 127 127 THR H H 127 8.288 8.288 8.066 0.222 18135 735 1 1 . 1 1 128 128 LEU N N 128 122.627 122.627 122.213 0.414 18135 736 1 1 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.943 0.013 18135 737 1 1 . 1 1 128 128 LEU C C 128 178.331 178.331 177.659 0.672 18135 738 1 1 . 1 1 128 128 LEU CA C 128 58.088 58.088 58.051 0.037 18135 739 1 1 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.489 0.085 18135 740 1 1 . 1 1 128 128 LEU H H 128 8.263 8.263 8.250 0.013 18135 741 1 1 . 1 1 129 129 TYR N N 129 120.955 120.955 120.316 0.639 18135 742 1 1 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.143 -0.253 18135 743 1 1 . 1 1 129 129 TYR C C 129 176.040 176.040 177.589 -1.549 18135 744 1 1 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.313 0.180 18135 745 1 1 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.330 0.595 18135 746 1 1 . 1 1 129 129 TYR H H 129 7.518 7.518 7.988 -0.470 18135 747 1 1 . 1 1 130 130 LEU N N 130 119.155 119.155 116.593 2.562 18135 748 1 1 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.374 -0.529 18135 749 1 1 . 1 1 130 130 LEU C C 130 177.948 177.948 178.361 -0.413 18135 750 1 1 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.880 0.233 18135 751 1 1 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.553 1.033 18135 752 1 1 . 1 1 130 130 LEU H H 130 7.717 7.717 7.984 -0.267 18135 753 1 1 . 1 1 131 131 LYS N N 131 116.832 116.832 119.977 -3.145 18135 754 1 1 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.903 -0.495 18135 755 1 1 . 1 1 131 131 LYS C C 131 181.265 181.265 179.735 1.530 18135 756 1 1 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.739 -0.008 18135 757 1 1 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.023 0.650 18135 758 1 1 . 1 1 131 131 LYS H H 131 7.493 7.493 7.963 -0.469 18135 759 1 1 . 1 1 132 132 GLU N N 132 121.918 121.918 119.374 2.544 18135 760 1 1 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.056 -0.212 18135 761 1 1 . 1 1 132 132 GLU C C 132 178.377 178.377 177.605 0.772 18135 762 1 1 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.683 0.204 18135 763 1 1 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.591 -0.924 18135 764 1 1 . 1 1 132 132 GLU H H 132 8.430 8.430 7.856 0.574 18135 765 1 1 . 1 1 133 133 LYS N N 133 116.079 116.079 115.663 0.416 18135 766 1 1 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.262 -0.296 18135 767 1 1 . 1 1 133 133 LYS C C 133 175.282 175.282 175.511 -0.229 18135 768 1 1 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.555 -0.257 18135 769 1 1 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.993 0.005 18135 770 1 1 . 1 1 133 133 LYS H H 133 7.390 7.390 7.373 0.017 18135 771 1 1 . 1 1 134 134 LYS N N 134 117.759 117.759 114.992 2.767 18135 772 1 1 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.061 -0.479 18135 773 1 1 . 1 1 134 134 LYS C C 134 176.271 176.271 176.178 0.093 18135 774 1 1 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.780 0.528 18135 775 1 1 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.259 -0.457 18135 776 1 1 . 1 1 134 134 LYS H H 134 7.716 7.716 7.460 0.256 18135 777 1 1 . 1 1 135 135 TYR N N 135 110.598 110.598 113.301 -2.703 18135 778 1 1 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.950 -1.073 18135 779 1 1 . 1 1 135 135 TYR C C 135 174.148 174.148 175.389 -1.241 18135 780 1 1 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.179 0.536 18135 781 1 1 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.219 -0.513 18135 782 1 1 . 1 1 135 135 TYR H H 135 8.428 8.428 8.967 -0.539 18135 783 1 1 . 1 1 136 136 SER N N 136 113.712 113.712 115.317 -1.605 18135 784 1 1 . 1 1 136 136 SER HA H 136 4.553 4.553 4.383 0.170 18135 785 1 1 . 1 1 136 136 SER CA C 136 57.108 57.108 59.251 -2.143 18135 786 1 1 . 1 1 136 136 SER CB C 136 62.500 62.500 64.102 -1.602 18135 787 1 1 . 1 1 136 136 SER H H 136 6.744 6.744 7.382 -0.638 18135 788 1 1 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.363 -0.198 18135 789 1 1 . 1 1 137 137 PRO C C 137 180.675 180.675 177.340 3.335 18135 790 1 1 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.699 0.958 18135 791 1 1 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.809 0.174 18135 792 1 1 . 1 1 138 138 CYS N N 138 113.914 113.914 115.606 -1.692 18135 793 1 1 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.623 0.047 18135 794 1 1 . 1 1 138 138 CYS C C 138 176.015 176.015 176.419 -0.404 18135 795 1 1 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.618 -3.523 18135 796 1 1 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.226 10.553 18135 797 1 1 . 1 1 138 138 CYS H H 138 8.580 8.580 8.483 0.097 18135 798 1 1 . 1 1 139 139 ALA N N 139 125.290 125.290 123.948 1.342 18135 799 1 1 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.255 0.194 18135 800 1 1 . 1 1 139 139 ALA C C 139 180.149 180.149 179.299 0.850 18135 801 1 1 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.983 -0.206 18135 802 1 1 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.222 0.696 18135 803 1 1 . 1 1 139 139 ALA H H 139 8.087 8.087 8.059 0.028 18135 804 1 1 . 1 1 140 140 TRP N N 140 116.599 116.599 118.695 -2.096 18135 805 1 1 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.280 0.322 18135 806 1 1 . 1 1 140 140 TRP C C 140 179.137 179.137 178.521 0.616 18135 807 1 1 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.512 -0.978 18135 808 1 1 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.415 -0.157 18135 809 1 1 . 1 1 140 140 TRP H H 140 8.505 8.505 7.830 0.675 18135 810 1 1 . 1 1 141 141 GLU N N 141 121.578 121.578 119.529 2.049 18135 811 1 1 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.291 0.932 18135 812 1 1 . 1 1 141 141 GLU C C 141 177.886 177.886 178.876 -0.990 18135 813 1 1 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.941 -2.034 18135 814 1 1 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.510 -0.793 18135 815 1 1 . 1 1 141 141 GLU H H 141 8.182 8.182 8.123 0.059 18135 816 1 1 . 1 1 142 142 VAL N N 142 121.202 121.202 120.062 1.140 18135 817 1 1 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.590 0.040 18135 818 1 1 . 1 1 142 142 VAL C C 142 180.246 180.246 178.382 1.864 18135 819 1 1 . 1 1 142 142 VAL CA C 142 66.983 66.983 67.007 -0.024 18135 820 1 1 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.766 0.056 18135 821 1 1 . 1 1 142 142 VAL H H 142 8.623 8.623 8.035 0.588 18135 822 1 1 . 1 1 143 143 VAL N N 143 120.119 120.119 119.713 0.406 18135 823 1 1 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.343 -0.046 18135 824 1 1 . 1 1 143 143 VAL C C 143 176.407 176.407 178.086 -1.679 18135 825 1 1 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.666 1.312 18135 826 1 1 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.422 0.233 18135 827 1 1 . 1 1 143 143 VAL H H 143 8.323 8.323 8.466 -0.143 18135 828 1 1 . 1 1 144 144 ARG N N 144 124.102 124.102 119.855 4.247 18135 829 1 1 . 1 1 144 144 ARG HA H 144 3.697 3.697 3.951 -0.254 18135 830 1 1 . 1 1 144 144 ARG C C 144 178.127 178.127 177.783 0.344 18135 831 1 1 . 1 1 144 144 ARG CA C 144 61.001 61.001 58.398 2.603 18135 832 1 1 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.331 0.605 18135 833 1 1 . 1 1 144 144 ARG H H 144 9.619 9.619 8.256 1.363 18135 834 1 1 . 1 1 145 145 ALA N N 145 119.431 119.431 121.232 -1.801 18135 835 1 1 . 1 1 145 145 ALA HA H 145 3.851 3.851 3.968 -0.117 18135 836 1 1 . 1 1 145 145 ALA C C 145 180.763 180.763 179.820 0.943 18135 837 1 1 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.336 0.039 18135 838 1 1 . 1 1 145 145 ALA CB C 145 18.185 18.185 17.989 0.195 18135 839 1 1 . 1 1 145 145 ALA H H 145 8.867 8.867 8.347 0.520 18135 840 1 1 . 1 1 146 146 GLU N N 146 121.815 121.815 119.110 2.705 18135 841 1 1 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.140 0.071 18135 842 1 1 . 1 1 146 146 GLU C C 146 177.296 177.296 179.292 -1.996 18135 843 1 1 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.189 -0.810 18135 844 1 1 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.509 -1.375 18135 845 1 1 . 1 1 146 146 GLU H H 146 8.136 8.136 8.003 0.133 18135 846 1 1 . 1 1 147 147 ILE N N 147 119.542 119.542 120.739 -1.197 18135 847 1 1 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.628 0.342 18135 848 1 1 . 1 1 147 147 ILE C C 147 178.283 178.283 177.965 0.318 18135 849 1 1 . 1 1 147 147 ILE CA C 147 61.253 61.253 65.099 -3.846 18135 850 1 1 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.462 -2.123 18135 851 1 1 . 1 1 147 147 ILE H H 147 8.736 8.736 8.061 0.675 18135 852 1 1 . 1 1 148 148 MET N N 148 119.501 119.501 118.129 1.372 18135 853 1 1 . 1 1 148 148 MET HA H 148 3.801 3.801 4.179 -0.378 18135 854 1 1 . 1 1 148 148 MET C C 148 178.210 178.210 178.598 -0.388 18135 855 1 1 . 1 1 148 148 MET CA C 148 60.184 60.184 59.737 0.447 18135 856 1 1 . 1 1 148 148 MET CB C 148 32.914 32.914 31.996 0.918 18135 857 1 1 . 1 1 148 148 MET H H 148 8.440 8.440 8.113 0.327 18135 858 1 1 . 1 1 149 149 ARG N N 149 119.734 119.734 120.093 -0.359 18135 859 1 1 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.040 -0.125 18135 860 1 1 . 1 1 149 149 ARG C C 149 178.978 178.978 179.025 -0.047 18135 861 1 1 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.575 0.288 18135 862 1 1 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.765 0.516 18135 863 1 1 . 1 1 149 149 ARG H H 149 7.648 7.648 8.253 -0.605 18135 864 1 1 . 1 1 150 150 SER N N 150 118.109 118.109 115.615 2.494 18135 865 1 1 . 1 1 150 150 SER HA H 150 3.339 3.339 3.859 -0.520 18135 866 1 1 . 1 1 150 150 SER C C 150 177.292 177.292 176.250 1.042 18135 867 1 1 . 1 1 150 150 SER CA C 150 61.316 61.316 61.888 -0.572 18135 868 1 1 . 1 1 150 150 SER CB C 150 60.288 60.288 62.443 -2.155 18135 869 1 1 . 1 1 150 150 SER H H 150 9.194 9.194 8.646 0.548 18135 870 1 1 . 1 1 151 151 PHE N N 151 125.265 125.265 124.223 1.042 18135 871 1 1 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.224 -0.188 18135 872 1 1 . 1 1 151 151 PHE C C 151 178.696 178.696 177.509 1.187 18135 873 1 1 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.572 1.848 18135 874 1 1 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.566 0.320 18135 875 1 1 . 1 1 151 151 PHE H H 151 9.455 9.455 8.228 1.227 18135 876 1 1 . 1 1 152 152 SER N N 152 115.963 115.963 116.014 -0.051 18135 877 1 1 . 1 1 152 152 SER HA H 152 3.880 3.880 3.759 0.121 18135 878 1 1 . 1 1 152 152 SER C C 152 175.858 175.858 176.846 -0.988 18135 879 1 1 . 1 1 152 152 SER CA C 152 62.388 62.388 61.502 0.886 18135 880 1 1 . 1 1 152 152 SER CB C 152 62.519 62.519 63.221 -0.702 18135 881 1 1 . 1 1 152 152 SER H H 152 7.839 7.839 8.452 -0.613 18135 882 1 1 . 1 1 153 153 LEU N N 153 121.365 121.365 122.407 -1.042 18135 883 1 1 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.146 -0.065 18135 884 1 1 . 1 1 153 153 LEU C C 153 179.515 179.515 179.249 0.266 18135 885 1 1 . 1 1 153 153 LEU CA C 153 57.883 57.883 58.138 -0.255 18135 886 1 1 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.344 0.998 18135 887 1 1 . 1 1 153 153 LEU H H 153 7.775 7.775 8.239 -0.464 18135 888 1 1 . 1 1 154 154 SER N N 154 113.950 113.950 113.991 -0.041 18135 889 1 1 . 1 1 154 154 SER HA H 154 3.781 3.781 4.392 -0.611 18135 890 1 1 . 1 1 154 154 SER C C 154 174.312 174.312 176.507 -2.195 18135 891 1 1 . 1 1 154 154 SER CA C 154 61.366 61.366 61.510 -0.144 18135 892 1 1 . 1 1 154 154 SER CB C 154 63.242 63.242 63.458 -0.216 18135 893 1 1 . 1 1 154 154 SER H H 154 7.874 7.874 8.643 -0.769 18135 894 1 1 . 1 1 155 155 THR N N 155 109.346 109.346 110.475 -1.129 18135 895 1 1 . 1 1 155 155 THR HA H 155 4.060 4.060 4.313 -0.253 18135 896 1 1 . 1 1 155 155 THR C C 155 174.798 174.798 175.704 -0.906 18135 897 1 1 . 1 1 155 155 THR CA C 155 62.275 62.275 63.919 -1.644 18135 898 1 1 . 1 1 155 155 THR CB C 155 69.342 69.342 69.269 0.074 18135 899 1 1 . 1 1 155 155 THR H H 155 7.176 7.176 7.868 -0.692 18135 900 1 1 . 1 1 156 156 ASN N N 156 119.785 119.785 121.108 -1.323 18135 901 1 1 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.851 -0.324 18135 902 1 1 . 1 1 156 156 ASN C C 156 175.528 175.528 174.742 0.786 18135 903 1 1 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.879 1.058 18135 904 1 1 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.822 0.516 18135 905 1 1 . 1 1 156 156 ASN H H 156 7.749 7.749 7.991 -0.242 18135 906 1 1 . 1 1 157 157 LEU N N 157 120.552 120.552 121.512 -0.960 18135 907 1 1 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.495 -0.240 18135 908 1 1 . 1 1 157 157 LEU C C 157 174.702 174.702 178.367 -3.665 18135 909 1 1 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.732 -1.058 18135 910 1 1 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.150 0.202 18135 911 1 1 . 1 1 157 157 LEU H H 157 8.097 8.097 7.618 0.479 18135 912 1 1 . 1 1 158 158 GLN N N 158 119.860 119.860 117.752 2.108 18135 913 1 1 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.279 -0.099 18135 914 1 1 . 1 1 158 158 GLN C C 158 176.434 176.434 176.050 0.384 18135 915 1 1 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.434 1.464 18135 916 1 1 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.593 -0.583 18135 917 1 1 . 1 1 158 158 GLN H H 158 8.230 8.230 7.956 0.274 18135 918 1 1 . 1 1 159 159 GLU N N 159 120.461 120.461 117.583 2.878 18135 919 1 1 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.071 0.148 18135 920 1 1 . 1 1 159 159 GLU C C 159 175.251 175.251 175.496 -0.245 18135 921 1 1 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.263 -0.568 18135 922 1 1 . 1 1 159 159 GLU CB C 159 28.981 28.981 29.104 -0.123 18135 923 1 1 . 1 1 159 159 GLU H H 159 8.300 8.300 8.741 -0.441 18135 924 1 1 . 1 1 160 160 SER N N 160 115.719 115.719 112.113 3.606 18135 925 1 1 . 1 1 160 160 SER HA H 160 4.372 4.372 4.602 -0.230 18135 926 1 1 . 1 1 160 160 SER C C 160 174.188 174.188 175.877 -1.689 18135 927 1 1 . 1 1 160 160 SER CA C 160 58.481 58.481 57.513 0.968 18135 928 1 1 . 1 1 160 160 SER CB C 160 63.731 63.731 63.358 0.373 18135 929 1 1 . 1 1 160 160 SER H H 160 8.113 8.113 8.287 -0.174 18135 930 1 1 . 1 1 161 161 LEU N N 161 123.794 123.794 122.797 0.997 18135 931 1 1 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.106 0.174 18135 932 1 1 . 1 1 161 161 LEU C C 161 177.293 177.293 176.786 0.507 18135 933 1 1 . 1 1 161 161 LEU CA C 161 55.190 55.190 56.843 -1.653 18135 934 1 1 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.179 0.105 18135 935 1 1 . 1 1 161 161 LEU H H 161 8.032 8.032 8.047 -0.015 18135 936 1 1 . 1 1 162 162 ARG N N 162 120.715 120.715 117.681 3.034 18135 937 1 1 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.373 -0.204 18135 938 1 1 . 1 1 162 162 ARG C C 162 176.288 176.288 174.869 1.419 18135 939 1 1 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.364 1.681 18135 940 1 1 . 1 1 162 162 ARG CB C 162 30.935 30.935 30.868 0.067 18135 941 1 1 . 1 1 162 162 ARG H H 162 8.094 8.094 7.880 0.214 18135 942 1 1 . 1 1 163 163 SER N N 163 116.670 116.670 121.099 -4.429 18135 943 1 1 . 1 1 163 163 SER HA H 163 4.372 4.372 4.352 0.020 18135 944 1 1 . 1 1 163 163 SER C C 163 174.184 174.184 175.009 -0.825 18135 945 1 1 . 1 1 163 163 SER CA C 163 58.481 58.481 59.164 -0.683 18135 946 1 1 . 1 1 163 163 SER CB C 163 63.745 63.745 63.317 0.428 18135 947 1 1 . 1 1 163 163 SER H H 163 8.191 8.191 8.645 -0.454 18135 948 1 1 . 1 1 164 164 LYS N N 164 123.100 123.100 128.577 -5.477 18135 949 1 1 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.357 -0.080 18135 950 1 1 . 1 1 164 164 LYS C C 164 175.617 175.617 176.416 -0.799 18135 951 1 1 . 1 1 164 164 LYS CA C 164 56.313 56.313 55.713 0.600 18135 952 1 1 . 1 1 164 164 LYS CB C 164 32.965 32.965 31.563 1.402 18135 953 1 1 . 1 1 164 164 LYS H H 164 8.251 8.251 8.516 -0.265 18135 954 1 2 . 1 1 2 2 ASP N N 2 125.691 125.691 120.473 5.218 18135 955 1 2 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.490 0.220 18135 956 1 2 . 1 1 2 2 ASP C C 2 174.758 174.758 175.957 -1.199 18135 957 1 2 . 1 1 2 2 ASP CA C 2 52.843 52.843 55.277 -2.434 18135 958 1 2 . 1 1 2 2 ASP CB C 2 39.321 39.321 40.764 -1.443 18135 959 1 2 . 1 1 2 2 ASP H H 2 8.773 8.773 8.599 0.174 18135 960 1 2 . 1 1 3 3 LEU N N 3 123.957 123.957 117.993 5.964 18135 961 1 2 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.317 0.084 18135 962 1 2 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.346 0.306 18135 963 1 2 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.099 0.456 18135 964 1 2 . 1 1 3 3 LEU H H 3 8.164 8.164 7.426 0.738 18135 965 1 2 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.428 -0.114 18135 966 1 2 . 1 1 4 4 PRO C C 4 176.213 176.213 176.291 -0.078 18135 967 1 2 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.203 0.705 18135 968 1 2 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.111 1.783 18135 969 1 2 . 1 1 5 5 GLN N N 5 121.621 121.621 121.632 -0.011 18135 970 1 2 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.168 0.058 18135 971 1 2 . 1 1 5 5 GLN C C 5 176.995 176.995 176.860 0.135 18135 972 1 2 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.191 -1.481 18135 973 1 2 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.497 -0.545 18135 974 1 2 . 1 1 5 5 GLN H H 5 8.767 8.767 8.689 0.078 18135 975 1 2 . 1 1 6 6 THR N N 6 111.419 111.419 110.516 0.903 18135 976 1 2 . 1 1 6 6 THR HA H 6 4.135 4.135 4.424 -0.289 18135 977 1 2 . 1 1 6 6 THR C C 6 174.695 174.695 175.302 -0.607 18135 978 1 2 . 1 1 6 6 THR CA C 6 62.661 62.661 63.138 -0.477 18135 979 1 2 . 1 1 6 6 THR CB C 6 69.365 69.365 69.004 0.361 18135 980 1 2 . 1 1 6 6 THR H H 6 7.865 7.865 8.539 -0.674 18135 981 1 2 . 1 1 7 7 HIS N N 7 119.137 119.137 120.183 -1.046 18135 982 1 2 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.571 0.014 18135 983 1 2 . 1 1 7 7 HIS C C 7 174.980 174.980 176.149 -1.169 18135 984 1 2 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.758 -2.754 18135 985 1 2 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.793 -1.630 18135 986 1 2 . 1 1 7 7 HIS H H 7 8.567 8.567 8.529 0.038 18135 987 1 2 . 1 1 8 8 SER N N 8 115.796 115.796 115.367 0.429 18135 988 1 2 . 1 1 8 8 SER HA H 8 4.363 4.363 4.386 -0.023 18135 989 1 2 . 1 1 8 8 SER C C 8 175.312 175.312 175.946 -0.634 18135 990 1 2 . 1 1 8 8 SER CA C 8 58.969 58.969 61.437 -2.468 18135 991 1 2 . 1 1 8 8 SER CB C 8 63.439 63.439 63.284 0.155 18135 992 1 2 . 1 1 8 8 SER H H 8 8.180 8.180 7.970 0.210 18135 993 1 2 . 1 1 9 9 LEU N N 9 123.844 123.844 118.395 5.449 18135 994 1 2 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.698 -0.543 18135 995 1 2 . 1 1 9 9 LEU C C 9 178.568 178.568 178.421 0.147 18135 996 1 2 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.712 0.254 18135 997 1 2 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.216 -0.420 18135 998 1 2 . 1 1 9 9 LEU H H 9 8.404 8.404 7.737 0.667 18135 999 1 2 . 1 1 10 10 GLY N N 10 107.582 107.582 107.935 -0.353 18135 1000 1 2 . 1 1 10 10 GLY C C 10 174.586 174.586 175.722 -1.136 18135 1001 1 2 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.529 -0.624 18135 1002 1 2 . 1 1 10 10 GLY H H 10 8.438 8.438 8.679 -0.241 18135 1003 1 2 . 1 1 11 11 SER N N 11 118.806 118.806 117.667 1.139 18135 1004 1 2 . 1 1 11 11 SER HA H 11 4.156 4.156 4.095 0.061 18135 1005 1 2 . 1 1 11 11 SER C C 11 175.749 175.749 176.538 -0.789 18135 1006 1 2 . 1 1 11 11 SER CA C 11 61.299 61.299 61.919 -0.619 18135 1007 1 2 . 1 1 11 11 SER CB C 11 62.653 62.653 62.496 0.157 18135 1008 1 2 . 1 1 11 11 SER H H 11 8.249 8.249 8.345 -0.096 18135 1009 1 2 . 1 1 12 12 ARG N N 12 121.986 121.986 122.616 -0.630 18135 1010 1 2 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.136 -0.182 18135 1011 1 2 . 1 1 12 12 ARG C C 12 178.283 178.283 178.176 0.107 18135 1012 1 2 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.441 1.389 18135 1013 1 2 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.020 -0.437 18135 1014 1 2 . 1 1 12 12 ARG H H 12 8.027 8.027 8.057 -0.030 18135 1015 1 2 . 1 1 13 13 ARG N N 13 119.432 119.432 118.895 0.537 18135 1016 1 2 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.027 -0.188 18135 1017 1 2 . 1 1 13 13 ARG C C 13 178.480 178.480 178.628 -0.148 18135 1018 1 2 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.856 0.635 18135 1019 1 2 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.959 0.123 18135 1020 1 2 . 1 1 13 13 ARG H H 13 8.437 8.437 8.084 0.353 18135 1021 1 2 . 1 1 14 14 THR N N 14 116.879 116.879 116.314 0.565 18135 1022 1 2 . 1 1 14 14 THR HA H 14 3.532 3.532 4.187 -0.655 18135 1023 1 2 . 1 1 14 14 THR C C 14 175.584 175.584 177.158 -1.574 18135 1024 1 2 . 1 1 14 14 THR CA C 14 68.036 68.036 66.602 1.434 18135 1025 1 2 . 1 1 14 14 THR CB C 14 67.969 67.969 68.487 -0.518 18135 1026 1 2 . 1 1 14 14 THR H H 14 7.957 7.957 8.260 -0.303 18135 1027 1 2 . 1 1 15 15 LEU N N 15 120.252 120.252 123.036 -2.784 18135 1028 1 2 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.097 -0.151 18135 1029 1 2 . 1 1 15 15 LEU C C 15 178.652 178.652 179.031 -0.379 18135 1030 1 2 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.361 -0.273 18135 1031 1 2 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.893 -0.339 18135 1032 1 2 . 1 1 15 15 LEU H H 15 7.550 7.550 8.115 -0.565 18135 1033 1 2 . 1 1 16 16 MET N N 16 118.788 118.788 117.215 1.573 18135 1034 1 2 . 1 1 16 16 MET HA H 16 4.023 4.023 4.066 -0.043 18135 1035 1 2 . 1 1 16 16 MET C C 16 178.718 178.718 179.030 -0.312 18135 1036 1 2 . 1 1 16 16 MET CA C 16 58.513 58.513 58.219 0.294 18135 1037 1 2 . 1 1 16 16 MET CB C 16 32.150 32.150 31.491 0.659 18135 1038 1 2 . 1 1 16 16 MET H H 16 7.985 7.985 8.558 -0.573 18135 1039 1 2 . 1 1 17 17 LEU N N 17 120.644 120.644 119.838 0.806 18135 1040 1 2 . 1 1 17 17 LEU HA H 17 3.972 3.972 4.076 -0.104 18135 1041 1 2 . 1 1 17 17 LEU C C 17 178.238 178.238 179.439 -1.201 18135 1042 1 2 . 1 1 17 17 LEU CA C 17 57.727 57.727 57.914 -0.187 18135 1043 1 2 . 1 1 17 17 LEU CB C 17 42.135 42.135 40.748 1.387 18135 1044 1 2 . 1 1 17 17 LEU H H 17 7.829 7.829 8.312 -0.483 18135 1045 1 2 . 1 1 18 18 LEU N N 18 118.280 118.280 119.648 -1.368 18135 1046 1 2 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.718 -0.212 18135 1047 1 2 . 1 1 18 18 LEU C C 18 175.739 175.739 178.656 -2.917 18135 1048 1 2 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.639 0.017 18135 1049 1 2 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.438 0.804 18135 1050 1 2 . 1 1 18 18 LEU H H 18 7.499 7.499 8.424 -0.925 18135 1051 1 2 . 1 1 19 19 ALA N N 19 121.961 121.961 120.565 1.396 18135 1052 1 2 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.174 -0.337 18135 1053 1 2 . 1 1 19 19 ALA C C 19 180.736 180.736 178.621 2.115 18135 1054 1 2 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.123 0.943 18135 1055 1 2 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.254 -1.177 18135 1056 1 2 . 1 1 19 19 ALA H H 19 7.950 7.950 7.727 0.223 18135 1057 1 2 . 1 1 20 20 GLN N N 20 118.605 118.605 116.389 2.216 18135 1058 1 2 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.202 -0.267 18135 1059 1 2 . 1 1 20 20 GLN C C 20 176.945 176.945 177.266 -0.321 18135 1060 1 2 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.369 0.646 18135 1061 1 2 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.176 -0.702 18135 1062 1 2 . 1 1 20 20 GLN H H 20 7.958 7.958 8.006 -0.048 18135 1063 1 2 . 1 1 21 21 MET N N 21 116.693 116.693 118.244 -1.551 18135 1064 1 2 . 1 1 21 21 MET HA H 21 3.861 3.861 4.407 -0.546 18135 1065 1 2 . 1 1 21 21 MET C C 21 174.671 174.671 174.696 -0.025 18135 1066 1 2 . 1 1 21 21 MET CA C 21 57.111 57.111 56.860 0.251 18135 1067 1 2 . 1 1 21 21 MET CB C 21 34.073 34.073 33.172 0.901 18135 1068 1 2 . 1 1 21 21 MET H H 21 7.420 7.420 7.710 -0.290 18135 1069 1 2 . 1 1 22 22 ARG N N 22 115.451 115.451 118.883 -3.432 18135 1070 1 2 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.842 0.011 18135 1071 1 2 . 1 1 22 22 ARG C C 22 175.950 175.950 174.809 1.141 18135 1072 1 2 . 1 1 22 22 ARG CA C 22 58.452 58.452 54.846 3.606 18135 1073 1 2 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.510 1.004 18135 1074 1 2 . 1 1 22 22 ARG H H 22 6.484 6.484 7.614 -1.130 18135 1075 1 2 . 1 1 23 23 LYS N N 23 128.593 128.593 123.744 4.849 18135 1076 1 2 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.600 -0.115 18135 1077 1 2 . 1 1 23 23 LYS C C 23 176.643 176.643 174.880 1.763 18135 1078 1 2 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.642 1.645 18135 1079 1 2 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.065 4.196 18135 1080 1 2 . 1 1 23 23 LYS H H 23 10.212 10.212 8.761 1.451 18135 1081 1 2 . 1 1 24 24 ILE N N 24 118.605 118.605 122.410 -3.805 18135 1082 1 2 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.464 0.020 18135 1083 1 2 . 1 1 24 24 ILE C C 24 173.878 173.878 174.873 -0.995 18135 1084 1 2 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.539 -0.942 18135 1085 1 2 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.490 -0.034 18135 1086 1 2 . 1 1 24 24 ILE H H 24 8.465 8.465 8.438 0.027 18135 1087 1 2 . 1 1 25 25 SER N N 25 113.658 113.658 117.906 -4.248 18135 1088 1 2 . 1 1 25 25 SER HA H 25 4.481 4.481 4.910 -0.429 18135 1089 1 2 . 1 1 25 25 SER C C 25 176.359 176.359 175.486 0.873 18135 1090 1 2 . 1 1 25 25 SER CA C 25 56.975 56.975 57.259 -0.284 18135 1091 1 2 . 1 1 25 25 SER CB C 25 64.759 64.759 64.410 0.349 18135 1092 1 2 . 1 1 25 25 SER H H 25 8.104 8.104 8.704 -0.600 18135 1093 1 2 . 1 1 26 26 LEU N N 26 127.566 127.566 126.322 1.244 18135 1094 1 2 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.276 -0.399 18135 1095 1 2 . 1 1 26 26 LEU C C 26 178.946 178.946 178.550 0.396 18135 1096 1 2 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.940 -0.262 18135 1097 1 2 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.276 -0.557 18135 1098 1 2 . 1 1 26 26 LEU H H 26 8.802 8.802 9.199 -0.397 18135 1099 1 2 . 1 1 27 27 PHE N N 27 117.143 117.143 116.472 0.671 18135 1100 1 2 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.601 -0.363 18135 1101 1 2 . 1 1 27 27 PHE C C 27 177.067 177.067 176.702 0.365 18135 1102 1 2 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.437 1.653 18135 1103 1 2 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.512 -0.250 18135 1104 1 2 . 1 1 27 27 PHE H H 27 7.986 7.986 8.105 -0.119 18135 1105 1 2 . 1 1 28 28 SER N N 28 115.200 115.200 116.152 -0.952 18135 1106 1 2 . 1 1 28 28 SER HA H 28 4.505 4.505 4.382 0.123 18135 1107 1 2 . 1 1 28 28 SER C C 28 174.533 174.533 174.542 -0.009 18135 1108 1 2 . 1 1 28 28 SER CA C 28 59.447 59.447 60.248 -0.801 18135 1109 1 2 . 1 1 28 28 SER CB C 28 63.790 63.790 63.528 0.262 18135 1110 1 2 . 1 1 28 28 SER H H 28 7.929 7.929 8.216 -0.287 18135 1111 1 2 . 1 1 29 29 CYS N N 29 119.870 119.870 119.098 0.772 18135 1112 1 2 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.674 0.408 18135 1113 1 2 . 1 1 29 29 CYS C C 29 176.475 176.475 174.586 1.889 18135 1114 1 2 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.129 -4.699 18135 1115 1 2 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.477 9.765 18135 1116 1 2 . 1 1 29 29 CYS H H 29 7.865 7.865 8.339 -0.474 18135 1117 1 2 . 1 1 30 30 LEU N N 30 122.259 122.259 123.315 -1.056 18135 1118 1 2 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.268 -0.307 18135 1119 1 2 . 1 1 30 30 LEU C C 30 179.774 179.774 177.856 1.918 18135 1120 1 2 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.419 1.884 18135 1121 1 2 . 1 1 30 30 LEU CB C 30 41.576 41.576 41.520 0.056 18135 1122 1 2 . 1 1 30 30 LEU H H 30 7.812 7.812 8.693 -0.881 18135 1123 1 2 . 1 1 31 31 LYS N N 31 117.731 117.731 115.589 2.142 18135 1124 1 2 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.360 0.330 18135 1125 1 2 . 1 1 31 31 LYS C C 31 176.692 176.692 175.728 0.964 18135 1126 1 2 . 1 1 31 31 LYS CA C 31 54.077 54.077 56.288 -2.211 18135 1127 1 2 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.453 -0.866 18135 1128 1 2 . 1 1 31 31 LYS H H 31 8.597 8.597 7.994 0.603 18135 1129 1 2 . 1 1 32 32 ASP N N 32 117.841 117.841 120.456 -2.615 18135 1130 1 2 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.785 -0.091 18135 1131 1 2 . 1 1 32 32 ASP C C 32 175.505 175.505 175.570 -0.065 18135 1132 1 2 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.810 -0.722 18135 1133 1 2 . 1 1 32 32 ASP CB C 32 41.808 41.808 43.985 -2.177 18135 1134 1 2 . 1 1 32 32 ASP H H 32 7.808 7.808 7.598 0.210 18135 1135 1 2 . 1 1 33 33 ARG N N 33 120.876 120.876 121.547 -0.671 18135 1136 1 2 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.199 -0.158 18135 1137 1 2 . 1 1 33 33 ARG C C 33 175.286 175.286 175.507 -0.221 18135 1138 1 2 . 1 1 33 33 ARG CA C 33 58.083 58.083 55.564 2.519 18135 1139 1 2 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.636 -0.623 18135 1140 1 2 . 1 1 33 33 ARG H H 33 7.378 7.378 7.427 -0.049 18135 1141 1 2 . 1 1 34 34 HIS N N 34 120.555 120.555 117.853 2.702 18135 1142 1 2 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.488 -0.276 18135 1143 1 2 . 1 1 34 34 HIS C C 34 170.494 170.494 173.836 -3.342 18135 1144 1 2 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.797 -3.190 18135 1145 1 2 . 1 1 34 34 HIS CB C 34 31.488 31.488 27.614 3.874 18135 1146 1 2 . 1 1 34 34 HIS H H 34 7.974 7.974 8.964 -0.990 18135 1147 1 2 . 1 1 35 35 ASP N N 35 125.061 125.061 120.846 4.215 18135 1148 1 2 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.480 0.158 18135 1149 1 2 . 1 1 35 35 ASP C C 35 175.943 175.943 176.572 -0.629 18135 1150 1 2 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.327 -1.958 18135 1151 1 2 . 1 1 35 35 ASP CB C 35 40.362 40.362 42.111 -1.749 18135 1152 1 2 . 1 1 35 35 ASP H H 35 7.805 7.805 8.110 -0.305 18135 1153 1 2 . 1 1 36 36 PHE N N 36 122.860 122.860 119.735 3.125 18135 1154 1 2 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.291 0.034 18135 1155 1 2 . 1 1 36 36 PHE C C 36 176.643 176.643 177.272 -0.629 18135 1156 1 2 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.982 0.657 18135 1157 1 2 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.185 1.506 18135 1158 1 2 . 1 1 36 36 PHE H H 36 8.973 8.973 6.995 1.978 18135 1159 1 2 . 1 1 37 37 GLY N N 37 111.856 111.856 108.816 3.040 18135 1160 1 2 . 1 1 37 37 GLY C C 37 175.185 175.185 174.654 0.531 18135 1161 1 2 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.661 3.482 18135 1162 1 2 . 1 1 37 37 GLY H H 37 8.727 8.727 7.877 0.850 18135 1163 1 2 . 1 1 38 38 PHE N N 38 123.178 123.178 118.981 4.197 18135 1164 1 2 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.634 -0.720 18135 1165 1 2 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.412 2.392 18135 1166 1 2 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.134 0.523 18135 1167 1 2 . 1 1 38 38 PHE H H 38 9.169 9.169 7.107 2.062 18135 1168 1 2 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.447 0.082 18135 1169 1 2 . 1 1 39 39 PRO C C 39 174.634 174.634 177.287 -2.653 18135 1170 1 2 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.602 -1.059 18135 1171 1 2 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.616 -1.912 18135 1172 1 2 . 1 1 40 40 GLN N N 40 123.608 123.608 123.333 0.275 18135 1173 1 2 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.235 -0.616 18135 1174 1 2 . 1 1 40 40 GLN C C 40 176.958 176.958 177.377 -0.419 18135 1175 1 2 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.130 -1.058 18135 1176 1 2 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.686 1.131 18135 1177 1 2 . 1 1 40 40 GLN H H 40 7.966 7.966 8.432 -0.466 18135 1178 1 2 . 1 1 41 41 GLU N N 41 119.446 119.446 120.451 -1.005 18135 1179 1 2 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.155 -0.018 18135 1180 1 2 . 1 1 41 41 GLU C C 41 177.346 177.346 177.815 -0.469 18135 1181 1 2 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.121 -1.192 18135 1182 1 2 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.191 -1.358 18135 1183 1 2 . 1 1 41 41 GLU H H 41 9.044 9.044 8.668 0.376 18135 1184 1 2 . 1 1 42 42 GLU N N 42 117.196 117.196 117.015 0.181 18135 1185 1 2 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.318 -0.255 18135 1186 1 2 . 1 1 42 42 GLU C C 42 174.886 174.886 178.044 -3.158 18135 1187 1 2 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.877 -1.493 18135 1188 1 2 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.826 -2.268 18135 1189 1 2 . 1 1 42 42 GLU H H 42 7.646 7.646 7.848 -0.202 18135 1190 1 2 . 1 1 43 43 PHE N N 43 115.527 115.527 123.105 -7.578 18135 1191 1 2 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.622 -0.136 18135 1192 1 2 . 1 1 43 43 PHE C C 43 175.615 175.615 176.078 -0.463 18135 1193 1 2 . 1 1 43 43 PHE CA C 43 57.548 57.548 59.014 -1.466 18135 1194 1 2 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.251 -0.358 18135 1195 1 2 . 1 1 43 43 PHE H H 43 7.601 7.601 8.620 -1.019 18135 1196 1 2 . 1 1 44 44 GLY N N 44 107.243 107.243 108.037 -0.794 18135 1197 1 2 . 1 1 44 44 GLY C C 44 174.032 174.032 173.909 0.123 18135 1198 1 2 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.651 -0.039 18135 1199 1 2 . 1 1 44 44 GLY H H 44 7.733 7.733 7.791 -0.058 18135 1200 1 2 . 1 1 45 45 ASN N N 45 117.599 117.599 120.645 -3.046 18135 1201 1 2 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.753 -0.202 18135 1202 1 2 . 1 1 45 45 ASN C C 45 175.894 175.894 174.900 0.994 18135 1203 1 2 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.496 1.353 18135 1204 1 2 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.615 -1.196 18135 1205 1 2 . 1 1 45 45 ASN H H 45 8.343 8.343 7.709 0.634 18135 1206 1 2 . 1 1 46 46 GLN N N 46 118.916 118.916 118.543 0.373 18135 1207 1 2 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.504 -0.422 18135 1208 1 2 . 1 1 46 46 GLN C C 46 175.851 175.851 175.867 -0.016 18135 1209 1 2 . 1 1 46 46 GLN CA C 46 56.646 56.646 54.906 1.740 18135 1210 1 2 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.508 0.936 18135 1211 1 2 . 1 1 46 46 GLN H H 46 8.652 8.652 8.256 0.396 18135 1212 1 2 . 1 1 47 47 PHE N N 47 119.511 119.511 119.867 -0.356 18135 1213 1 2 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.460 0.102 18135 1214 1 2 . 1 1 47 47 PHE C C 47 176.258 176.258 175.794 0.464 18135 1215 1 2 . 1 1 47 47 PHE CA C 47 57.920 57.920 59.050 -1.130 18135 1216 1 2 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.615 0.243 18135 1217 1 2 . 1 1 47 47 PHE H H 47 7.904 7.904 8.377 -0.473 18135 1218 1 2 . 1 1 48 48 GLN N N 48 120.127 120.127 117.530 2.597 18135 1219 1 2 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.558 -0.183 18135 1220 1 2 . 1 1 48 48 GLN C C 48 181.265 181.265 175.307 5.958 18135 1221 1 2 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.178 1.398 18135 1222 1 2 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.174 -0.706 18135 1223 1 2 . 1 1 48 48 GLN H H 48 8.255 8.255 7.751 0.504 18135 1224 1 2 . 1 1 49 49 LYS N N 49 121.777 121.777 120.937 0.840 18135 1225 1 2 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.372 -0.269 18135 1226 1 2 . 1 1 49 49 LYS C C 49 177.968 177.968 177.664 0.304 18135 1227 1 2 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.564 -0.415 18135 1228 1 2 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.346 0.044 18135 1229 1 2 . 1 1 49 49 LYS H H 49 8.426 8.426 8.556 -0.130 18135 1230 1 2 . 1 1 50 50 ALA N N 50 120.573 120.573 119.591 0.982 18135 1231 1 2 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.295 -0.225 18135 1232 1 2 . 1 1 50 50 ALA C C 50 178.697 178.697 177.619 1.078 18135 1233 1 2 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.190 1.578 18135 1234 1 2 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.823 0.051 18135 1235 1 2 . 1 1 50 50 ALA H H 50 8.578 8.578 7.816 0.762 18135 1236 1 2 . 1 1 51 51 GLU N N 51 115.015 115.015 115.764 -0.749 18135 1237 1 2 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.223 0.043 18135 1238 1 2 . 1 1 51 51 GLU C C 51 176.995 176.995 177.320 -0.325 18135 1239 1 2 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.315 -0.322 18135 1240 1 2 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.219 -1.314 18135 1241 1 2 . 1 1 51 51 GLU H H 51 7.907 7.907 8.124 -0.217 18135 1242 1 2 . 1 1 52 52 THR N N 52 111.210 111.210 114.843 -3.633 18135 1243 1 2 . 1 1 52 52 THR HA H 52 4.114 4.114 4.444 -0.330 18135 1244 1 2 . 1 1 52 52 THR C C 52 175.271 175.271 175.818 -0.547 18135 1245 1 2 . 1 1 52 52 THR CA C 52 63.611 63.611 65.219 -1.608 18135 1246 1 2 . 1 1 52 52 THR CB C 52 69.673 69.673 69.233 0.440 18135 1247 1 2 . 1 1 52 52 THR H H 52 7.863 7.863 7.369 0.494 18135 1248 1 2 . 1 1 53 53 ILE N N 53 119.113 119.113 122.412 -3.299 18135 1249 1 2 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.084 -0.220 18135 1250 1 2 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.970 0.937 18135 1251 1 2 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.247 -1.294 18135 1252 1 2 . 1 1 53 53 ILE H H 53 8.341 8.341 8.121 0.220 18135 1253 1 2 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.401 -0.115 18135 1254 1 2 . 1 1 54 54 PRO C C 54 179.655 179.655 178.972 0.683 18135 1255 1 2 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.068 -0.017 18135 1256 1 2 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.373 0.512 18135 1257 1 2 . 1 1 55 55 VAL N N 55 116.355 116.355 116.399 -0.044 18135 1258 1 2 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.906 -0.225 18135 1259 1 2 . 1 1 55 55 VAL C C 55 177.649 177.649 178.081 -0.432 18135 1260 1 2 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.182 0.655 18135 1261 1 2 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.335 1.136 18135 1262 1 2 . 1 1 55 55 VAL H H 55 7.119 7.119 7.573 -0.454 18135 1263 1 2 . 1 1 56 56 LEU N N 56 123.038 123.038 121.671 1.367 18135 1264 1 2 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.076 0.234 18135 1265 1 2 . 1 1 56 56 LEU C C 56 178.637 178.637 177.925 0.712 18135 1266 1 2 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.504 -0.418 18135 1267 1 2 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.487 0.831 18135 1268 1 2 . 1 1 56 56 LEU H H 56 8.535 8.535 8.533 0.002 18135 1269 1 2 . 1 1 57 57 HIS N N 57 117.041 117.041 118.470 -1.429 18135 1270 1 2 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.033 -0.247 18135 1271 1 2 . 1 1 57 57 HIS C C 57 175.640 175.640 177.373 -1.733 18135 1272 1 2 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.727 0.804 18135 1273 1 2 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.126 -1.917 18135 1274 1 2 . 1 1 57 57 HIS H H 57 9.047 9.047 8.107 0.940 18135 1275 1 2 . 1 1 58 58 GLU N N 58 119.521 119.521 118.816 0.705 18135 1276 1 2 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.815 0.192 18135 1277 1 2 . 1 1 58 58 GLU C C 58 179.029 179.029 179.063 -0.034 18135 1278 1 2 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.374 -0.407 18135 1279 1 2 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.418 -1.128 18135 1280 1 2 . 1 1 58 58 GLU H H 58 7.860 7.860 8.157 -0.297 18135 1281 1 2 . 1 1 59 59 MET N N 59 119.512 119.512 119.027 0.485 18135 1282 1 2 . 1 1 59 59 MET HA H 59 4.074 4.074 4.337 -0.263 18135 1283 1 2 . 1 1 59 59 MET C C 59 177.031 177.031 179.252 -2.221 18135 1284 1 2 . 1 1 59 59 MET CA C 59 59.408 59.408 58.471 0.937 18135 1285 1 2 . 1 1 59 59 MET CB C 59 32.525 32.525 32.391 0.134 18135 1286 1 2 . 1 1 59 59 MET H H 59 8.442 8.442 7.997 0.445 18135 1287 1 2 . 1 1 60 60 ILE N N 60 117.183 117.183 118.242 -1.059 18135 1288 1 2 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.496 -0.079 18135 1289 1 2 . 1 1 60 60 ILE C C 60 177.524 177.524 178.242 -0.718 18135 1290 1 2 . 1 1 60 60 ILE CA C 60 65.326 65.326 65.138 0.188 18135 1291 1 2 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.166 -0.306 18135 1292 1 2 . 1 1 60 60 ILE H H 60 8.338 8.338 7.804 0.534 18135 1293 1 2 . 1 1 61 61 GLN N N 61 120.191 120.191 119.706 0.485 18135 1294 1 2 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.937 -0.235 18135 1295 1 2 . 1 1 61 61 GLN C C 61 178.270 178.270 177.780 0.490 18135 1296 1 2 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.461 -0.675 18135 1297 1 2 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.248 0.418 18135 1298 1 2 . 1 1 61 61 GLN H H 61 8.234 8.234 8.218 0.016 18135 1299 1 2 . 1 1 62 62 GLN N N 62 116.795 116.795 119.011 -2.216 18135 1300 1 2 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.233 0.394 18135 1301 1 2 . 1 1 62 62 GLN C C 62 179.685 179.685 178.322 1.363 18135 1302 1 2 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.412 -0.404 18135 1303 1 2 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.884 -3.542 18135 1304 1 2 . 1 1 62 62 GLN H H 62 8.421 8.421 8.095 0.326 18135 1305 1 2 . 1 1 63 63 ILE N N 63 122.797 122.797 120.107 2.690 18135 1306 1 2 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.870 -0.221 18135 1307 1 2 . 1 1 63 63 ILE C C 63 177.279 177.279 177.828 -0.549 18135 1308 1 2 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.956 2.009 18135 1309 1 2 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.803 -0.488 18135 1310 1 2 . 1 1 63 63 ILE H H 63 8.164 8.164 7.604 0.560 18135 1311 1 2 . 1 1 64 64 PHE N N 64 120.820 120.820 121.167 -0.347 18135 1312 1 2 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.501 -0.785 18135 1313 1 2 . 1 1 64 64 PHE C C 64 178.402 178.402 176.992 1.410 18135 1314 1 2 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.205 0.947 18135 1315 1 2 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.456 0.054 18135 1316 1 2 . 1 1 64 64 PHE H H 64 8.405 8.405 7.923 0.482 18135 1317 1 2 . 1 1 65 65 ASN N N 65 119.981 119.981 117.975 2.006 18135 1318 1 2 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.499 0.564 18135 1319 1 2 . 1 1 65 65 ASN C C 65 177.944 177.944 177.008 0.936 18135 1320 1 2 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.882 -0.014 18135 1321 1 2 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.028 -0.772 18135 1322 1 2 . 1 1 65 65 ASN H H 65 8.812 8.812 7.655 1.157 18135 1323 1 2 . 1 1 66 66 LEU N N 66 121.533 121.533 119.575 1.958 18135 1324 1 2 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.174 0.049 18135 1325 1 2 . 1 1 66 66 LEU C C 66 177.777 177.777 179.281 -1.504 18135 1326 1 2 . 1 1 66 66 LEU CA C 66 58.268 58.268 58.119 0.149 18135 1327 1 2 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.589 0.018 18135 1328 1 2 . 1 1 66 66 LEU H H 66 8.177 8.177 7.730 0.447 18135 1329 1 2 . 1 1 67 67 PHE N N 67 110.842 110.842 114.602 -3.760 18135 1330 1 2 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.569 0.311 18135 1331 1 2 . 1 1 67 67 PHE C C 67 177.965 177.965 176.734 1.231 18135 1332 1 2 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.892 0.642 18135 1333 1 2 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.769 -0.153 18135 1334 1 2 . 1 1 67 67 PHE H H 67 8.160 8.160 8.696 -0.536 18135 1335 1 2 . 1 1 68 68 SER N N 68 119.131 119.131 112.945 6.186 18135 1336 1 2 . 1 1 68 68 SER HA H 68 4.580 4.580 4.470 0.110 18135 1337 1 2 . 1 1 68 68 SER C C 68 173.472 173.472 174.791 -1.319 18135 1338 1 2 . 1 1 68 68 SER CA C 68 59.191 59.191 59.094 0.097 18135 1339 1 2 . 1 1 68 68 SER CB C 68 63.123 63.123 63.977 -0.854 18135 1340 1 2 . 1 1 68 68 SER H H 68 8.016 8.016 7.781 0.235 18135 1341 1 2 . 1 1 69 69 THR N N 69 111.353 111.353 115.640 -4.287 18135 1342 1 2 . 1 1 69 69 THR HA H 69 4.345 4.345 4.494 -0.149 18135 1343 1 2 . 1 1 69 69 THR C C 69 175.661 175.661 174.200 1.461 18135 1344 1 2 . 1 1 69 69 THR CA C 69 61.411 61.411 60.434 0.977 18135 1345 1 2 . 1 1 69 69 THR CB C 69 72.209 72.209 70.626 1.583 18135 1346 1 2 . 1 1 69 69 THR H H 69 6.977 6.977 7.509 -0.532 18135 1347 1 2 . 1 1 70 70 LYS N N 70 121.120 121.120 122.975 -1.855 18135 1348 1 2 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.139 -0.050 18135 1349 1 2 . 1 1 70 70 LYS C C 70 179.259 179.259 177.242 2.017 18135 1350 1 2 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.623 -0.666 18135 1351 1 2 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.409 -0.659 18135 1352 1 2 . 1 1 70 70 LYS H H 70 9.065 9.065 8.625 0.440 18135 1353 1 2 . 1 1 71 71 ASP N N 71 116.374 116.374 119.573 -3.199 18135 1354 1 2 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.305 -0.130 18135 1355 1 2 . 1 1 71 71 ASP C C 71 178.372 178.372 176.889 1.483 18135 1356 1 2 . 1 1 71 71 ASP CA C 71 57.067 57.067 56.753 0.314 18135 1357 1 2 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.284 0.022 18135 1358 1 2 . 1 1 71 71 ASP H H 71 7.518 7.518 7.801 -0.283 18135 1359 1 2 . 1 1 72 72 SER N N 72 117.341 117.341 114.543 2.798 18135 1360 1 2 . 1 1 72 72 SER HA H 72 3.715 3.715 3.435 0.280 18135 1361 1 2 . 1 1 72 72 SER C C 72 176.897 176.897 176.145 0.752 18135 1362 1 2 . 1 1 72 72 SER CA C 72 60.267 60.267 60.264 0.003 18135 1363 1 2 . 1 1 72 72 SER CB C 72 62.616 62.616 63.084 -0.468 18135 1364 1 2 . 1 1 72 72 SER H H 72 8.066 8.066 8.066 -0.000 18135 1365 1 2 . 1 1 73 73 SER N N 73 113.398 113.398 117.011 -3.613 18135 1366 1 2 . 1 1 73 73 SER HA H 73 4.094 4.094 4.087 0.007 18135 1367 1 2 . 1 1 73 73 SER C C 73 174.855 174.855 174.741 0.114 18135 1368 1 2 . 1 1 73 73 SER CA C 73 61.385 61.385 60.487 0.898 18135 1369 1 2 . 1 1 73 73 SER CB C 73 62.798 62.798 63.057 -0.259 18135 1370 1 2 . 1 1 73 73 SER H H 73 7.982 7.982 7.888 0.094 18135 1371 1 2 . 1 1 74 74 ALA N N 74 119.486 119.486 119.395 0.091 18135 1372 1 2 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.186 -0.029 18135 1373 1 2 . 1 1 74 74 ALA C C 74 177.626 177.626 177.238 0.388 18135 1374 1 2 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.587 0.126 18135 1375 1 2 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.895 -0.148 18135 1376 1 2 . 1 1 74 74 ALA H H 74 7.095 7.095 7.502 -0.407 18135 1377 1 2 . 1 1 75 75 ALA N N 75 121.465 121.465 121.623 -0.158 18135 1378 1 2 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.793 -0.097 18135 1379 1 2 . 1 1 75 75 ALA C C 75 177.197 177.197 175.905 1.292 18135 1380 1 2 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.943 1.061 18135 1381 1 2 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.296 -1.036 18135 1382 1 2 . 1 1 75 75 ALA H H 75 7.159 7.159 7.568 -0.409 18135 1383 1 2 . 1 1 76 76 TRP N N 76 116.791 116.791 116.716 0.075 18135 1384 1 2 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.702 0.348 18135 1385 1 2 . 1 1 76 76 TRP C C 76 177.617 177.617 174.644 2.973 18135 1386 1 2 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.340 -2.021 18135 1387 1 2 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.935 2.141 18135 1388 1 2 . 1 1 76 76 TRP H H 76 7.080 7.080 7.198 -0.118 18135 1389 1 2 . 1 1 77 77 ASP N N 77 119.928 119.928 121.225 -1.297 18135 1390 1 2 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.560 -0.203 18135 1391 1 2 . 1 1 77 77 ASP C C 77 176.877 176.877 177.710 -0.833 18135 1392 1 2 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.525 -0.707 18135 1393 1 2 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.741 0.874 18135 1394 1 2 . 1 1 77 77 ASP H H 77 8.259 8.259 8.785 -0.526 18135 1395 1 2 . 1 1 78 78 GLU N N 78 127.277 127.277 126.678 0.599 18135 1396 1 2 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.984 -0.099 18135 1397 1 2 . 1 1 78 78 GLU C C 78 177.439 177.439 178.263 -0.824 18135 1398 1 2 . 1 1 78 78 GLU CA C 78 59.384 59.384 60.145 -0.761 18135 1399 1 2 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.068 -0.426 18135 1400 1 2 . 1 1 78 78 GLU H H 78 8.920 8.920 8.905 0.015 18135 1401 1 2 . 1 1 79 79 THR N N 79 115.422 115.422 116.793 -1.371 18135 1402 1 2 . 1 1 79 79 THR HA H 79 3.907 3.907 4.074 -0.167 18135 1403 1 2 . 1 1 79 79 THR C C 79 177.330 177.330 176.608 0.722 18135 1404 1 2 . 1 1 79 79 THR CA C 79 66.263 66.263 65.955 0.308 18135 1405 1 2 . 1 1 79 79 THR CB C 79 68.002 68.002 68.369 -0.367 18135 1406 1 2 . 1 1 79 79 THR H H 79 8.124 8.124 8.251 -0.127 18135 1407 1 2 . 1 1 80 80 LEU N N 80 121.791 121.791 122.490 -0.699 18135 1408 1 2 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.180 -0.293 18135 1409 1 2 . 1 1 80 80 LEU C C 80 179.018 179.018 179.208 -0.190 18135 1410 1 2 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.690 -0.451 18135 1411 1 2 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.126 0.526 18135 1412 1 2 . 1 1 80 80 LEU H H 80 7.725 7.725 8.038 -0.313 18135 1413 1 2 . 1 1 81 81 LEU N N 81 119.280 119.280 120.740 -1.460 18135 1414 1 2 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.147 -0.658 18135 1415 1 2 . 1 1 81 81 LEU C C 81 177.062 177.062 178.823 -1.761 18135 1416 1 2 . 1 1 81 81 LEU CA C 81 57.709 57.709 59.047 -1.338 18135 1417 1 2 . 1 1 81 81 LEU CB C 81 40.948 40.948 41.999 -1.051 18135 1418 1 2 . 1 1 81 81 LEU H H 81 8.344 8.344 8.693 -0.349 18135 1419 1 2 . 1 1 82 82 ASP N N 82 115.357 115.357 119.916 -4.559 18135 1420 1 2 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.472 -0.198 18135 1421 1 2 . 1 1 82 82 ASP C C 82 179.018 179.018 178.917 0.101 18135 1422 1 2 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.467 -0.652 18135 1423 1 2 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.301 -2.080 18135 1424 1 2 . 1 1 82 82 ASP H H 82 8.001 8.001 8.604 -0.603 18135 1425 1 2 . 1 1 83 83 LYS N N 83 119.603 119.603 119.108 0.495 18135 1426 1 2 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.912 0.070 18135 1427 1 2 . 1 1 83 83 LYS C C 83 178.624 178.624 178.932 -0.308 18135 1428 1 2 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.942 0.803 18135 1429 1 2 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.394 0.712 18135 1430 1 2 . 1 1 83 83 LYS H H 83 7.342 7.342 7.722 -0.380 18135 1431 1 2 . 1 1 84 84 PHE N N 84 123.933 123.933 121.824 2.109 18135 1432 1 2 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.032 0.003 18135 1433 1 2 . 1 1 84 84 PHE C C 84 177.210 177.210 176.983 0.227 18135 1434 1 2 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.854 -1.511 18135 1435 1 2 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.950 0.366 18135 1436 1 2 . 1 1 84 84 PHE H H 84 8.471 8.471 8.454 0.017 18135 1437 1 2 . 1 1 85 85 TYR N N 85 118.387 118.387 117.873 0.514 18135 1438 1 2 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.763 0.305 18135 1439 1 2 . 1 1 85 85 TYR C C 85 178.104 178.104 177.314 0.790 18135 1440 1 2 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.802 -1.225 18135 1441 1 2 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.012 -0.035 18135 1442 1 2 . 1 1 85 85 TYR H H 85 9.011 9.011 8.964 0.047 18135 1443 1 2 . 1 1 86 86 THR N N 86 114.035 114.035 116.488 -2.453 18135 1444 1 2 . 1 1 86 86 THR HA H 86 3.945 3.945 3.209 0.736 18135 1445 1 2 . 1 1 86 86 THR C C 86 176.708 176.708 176.429 0.279 18135 1446 1 2 . 1 1 86 86 THR CA C 86 66.759 66.759 66.942 -0.183 18135 1447 1 2 . 1 1 86 86 THR CB C 86 68.853 68.853 68.080 0.773 18135 1448 1 2 . 1 1 86 86 THR H H 86 7.609 7.609 7.405 0.204 18135 1449 1 2 . 1 1 87 87 GLU N N 87 120.790 120.790 121.387 -0.597 18135 1450 1 2 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.906 0.141 18135 1451 1 2 . 1 1 87 87 GLU C C 87 179.606 179.606 178.834 0.772 18135 1452 1 2 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.463 -1.065 18135 1453 1 2 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.230 -0.944 18135 1454 1 2 . 1 1 87 87 GLU H H 87 7.712 7.712 7.595 0.117 18135 1455 1 2 . 1 1 88 88 LEU N N 88 120.729 120.729 119.897 0.832 18135 1456 1 2 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.916 -0.188 18135 1457 1 2 . 1 1 88 88 LEU C C 88 178.695 178.695 179.262 -0.567 18135 1458 1 2 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.125 1.126 18135 1459 1 2 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.005 1.582 18135 1460 1 2 . 1 1 88 88 LEU H H 88 8.393 8.393 7.500 0.893 18135 1461 1 2 . 1 1 89 89 TYR N N 89 118.654 118.654 119.143 -0.489 18135 1462 1 2 . 1 1 89 89 TYR HA H 89 3.931 3.931 3.938 -0.007 18135 1463 1 2 . 1 1 89 89 TYR C C 89 178.438 178.438 178.628 -0.190 18135 1464 1 2 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.035 0.372 18135 1465 1 2 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.317 0.550 18135 1466 1 2 . 1 1 89 89 TYR H H 89 8.637 8.637 8.189 0.448 18135 1467 1 2 . 1 1 90 90 GLN N N 90 118.263 118.263 116.447 1.816 18135 1468 1 2 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.969 0.017 18135 1469 1 2 . 1 1 90 90 GLN C C 90 178.411 178.411 178.724 -0.313 18135 1470 1 2 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.662 0.120 18135 1471 1 2 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.304 -0.157 18135 1472 1 2 . 1 1 90 90 GLN H H 90 7.796 7.796 7.812 -0.016 18135 1473 1 2 . 1 1 91 91 GLN N N 91 117.959 117.959 120.232 -2.273 18135 1474 1 2 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.053 0.029 18135 1475 1 2 . 1 1 91 91 GLN C C 91 178.705 178.705 178.508 0.197 18135 1476 1 2 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.871 -0.051 18135 1477 1 2 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.338 0.835 18135 1478 1 2 . 1 1 91 91 GLN H H 91 7.727 7.727 8.042 -0.315 18135 1479 1 2 . 1 1 92 92 LEU N N 92 119.965 119.965 118.348 1.617 18135 1480 1 2 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.985 -0.251 18135 1481 1 2 . 1 1 92 92 LEU C C 92 178.984 178.984 178.651 0.333 18135 1482 1 2 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.967 -0.475 18135 1483 1 2 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.859 0.520 18135 1484 1 2 . 1 1 92 92 LEU H H 92 8.465 8.465 8.465 -0.000 18135 1485 1 2 . 1 1 93 93 ASN N N 93 117.793 117.793 118.383 -0.590 18135 1486 1 2 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.267 0.134 18135 1487 1 2 . 1 1 93 93 ASN C C 93 178.309 178.309 177.160 1.149 18135 1488 1 2 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.207 0.196 18135 1489 1 2 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.202 0.437 18135 1490 1 2 . 1 1 93 93 ASN H H 93 8.091 8.091 8.019 0.072 18135 1491 1 2 . 1 1 94 94 ASP N N 94 121.133 121.133 120.771 0.362 18135 1492 1 2 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.379 0.026 18135 1493 1 2 . 1 1 94 94 ASP C C 94 178.328 178.328 178.724 -0.396 18135 1494 1 2 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.178 -0.631 18135 1495 1 2 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.867 -2.218 18135 1496 1 2 . 1 1 94 94 ASP H H 94 8.362 8.362 8.003 0.359 18135 1497 1 2 . 1 1 95 95 LEU N N 95 119.160 119.160 121.195 -2.035 18135 1498 1 2 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.839 0.200 18135 1499 1 2 . 1 1 95 95 LEU C C 95 178.826 178.826 178.354 0.472 18135 1500 1 2 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.226 -1.199 18135 1501 1 2 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.119 0.091 18135 1502 1 2 . 1 1 95 95 LEU H H 95 8.143 8.143 8.493 -0.350 18135 1503 1 2 . 1 1 96 96 GLU N N 96 118.813 118.813 118.784 0.029 18135 1504 1 2 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.738 0.223 18135 1505 1 2 . 1 1 96 96 GLU C C 96 177.640 177.640 178.290 -0.650 18135 1506 1 2 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.460 -1.746 18135 1507 1 2 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.450 -1.312 18135 1508 1 2 . 1 1 96 96 GLU H H 96 8.111 8.111 8.338 -0.227 18135 1509 1 2 . 1 1 97 97 ALA N N 97 120.549 120.549 121.110 -0.561 18135 1510 1 2 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.976 0.146 18135 1511 1 2 . 1 1 97 97 ALA C C 97 179.126 179.126 180.330 -1.204 18135 1512 1 2 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.755 -0.722 18135 1513 1 2 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.872 0.108 18135 1514 1 2 . 1 1 97 97 ALA H H 97 7.798 7.798 7.769 0.029 18135 1515 1 2 . 1 1 98 98 CYS N N 98 115.510 115.510 117.388 -1.878 18135 1516 1 2 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.158 0.292 18135 1517 1 2 . 1 1 98 98 CYS C C 98 175.363 175.363 176.162 -0.799 18135 1518 1 2 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.402 -5.236 18135 1519 1 2 . 1 1 98 98 CYS CB C 98 41.879 41.879 25.882 15.997 18135 1520 1 2 . 1 1 98 98 CYS H H 98 7.597 7.597 7.928 -0.331 18135 1521 1 2 . 1 1 99 99 VAL N N 99 121.713 121.713 118.942 2.771 18135 1522 1 2 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.817 -0.023 18135 1523 1 2 . 1 1 99 99 VAL C C 99 177.357 177.357 177.665 -0.308 18135 1524 1 2 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.481 -0.897 18135 1525 1 2 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.307 -0.276 18135 1526 1 2 . 1 1 99 99 VAL H H 99 7.828 7.828 7.466 0.362 18135 1527 1 2 . 1 1 100 100 ILE N N 100 122.333 122.333 118.196 4.137 18135 1528 1 2 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.721 0.203 18135 1529 1 2 . 1 1 100 100 ILE C C 100 176.827 176.827 176.602 0.225 18135 1530 1 2 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.562 -1.324 18135 1531 1 2 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.666 0.612 18135 1532 1 2 . 1 1 100 100 ILE H H 100 8.067 8.067 8.196 -0.129 18135 1533 1 2 . 1 1 101 101 GLN N N 101 121.864 121.864 117.549 4.315 18135 1534 1 2 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.203 0.023 18135 1535 1 2 . 1 1 101 101 GLN C C 101 176.438 176.438 178.095 -1.657 18135 1536 1 2 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.587 -0.267 18135 1537 1 2 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.124 -0.113 18135 1538 1 2 . 1 1 101 101 GLN H H 101 8.062 8.062 7.414 0.648 18135 1539 1 2 . 1 1 102 102 GLY N N 102 109.288 109.288 109.992 -0.704 18135 1540 1 2 . 1 1 102 102 GLY C C 102 173.855 173.855 175.377 -1.522 18135 1541 1 2 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.168 -1.009 18135 1542 1 2 . 1 1 102 102 GLY H H 102 8.087 8.087 8.856 -0.769 18135 1543 1 2 . 1 1 103 103 VAL N N 103 118.932 118.932 119.661 -0.729 18135 1544 1 2 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.845 0.229 18135 1545 1 2 . 1 1 103 103 VAL C C 103 176.299 176.299 175.909 0.390 18135 1546 1 2 . 1 1 103 103 VAL CA C 103 62.499 62.499 64.017 -1.518 18135 1547 1 2 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.602 1.252 18135 1548 1 2 . 1 1 103 103 VAL H H 103 8.079 8.079 7.646 0.433 18135 1549 1 2 . 1 1 104 104 GLY N N 104 112.028 112.028 107.876 4.152 18135 1550 1 2 . 1 1 104 104 GLY C C 104 173.694 173.694 173.230 0.464 18135 1551 1 2 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.087 0.314 18135 1552 1 2 . 1 1 104 104 GLY H H 104 8.446 8.446 7.668 0.778 18135 1553 1 2 . 1 1 105 105 VAL N N 105 120.439 120.439 120.836 -0.397 18135 1554 1 2 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.318 -0.130 18135 1555 1 2 . 1 1 105 105 VAL C C 105 175.963 175.963 174.300 1.663 18135 1556 1 2 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.989 1.147 18135 1557 1 2 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.353 -1.539 18135 1558 1 2 . 1 1 105 105 VAL H H 105 7.867 7.867 8.006 -0.139 18135 1559 1 2 . 1 1 106 106 THR N N 106 116.366 116.366 114.080 2.286 18135 1560 1 2 . 1 1 106 106 THR HA H 106 4.548 4.548 4.597 -0.049 18135 1561 1 2 . 1 1 106 106 THR C C 106 173.731 173.731 173.394 0.337 18135 1562 1 2 . 1 1 106 106 THR CA C 106 59.419 59.419 60.648 -1.229 18135 1563 1 2 . 1 1 106 106 THR CB C 106 79.536 79.536 71.122 8.414 18135 1564 1 2 . 1 1 106 106 THR H H 106 8.565 8.565 8.004 0.561 18135 1565 1 2 . 1 1 107 107 GLU N N 107 119.743 119.743 121.308 -1.565 18135 1566 1 2 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.772 -0.310 18135 1567 1 2 . 1 1 107 107 GLU C C 107 175.639 175.639 176.127 -0.488 18135 1568 1 2 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.654 1.057 18135 1569 1 2 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.671 -1.172 18135 1570 1 2 . 1 1 107 107 GLU H H 107 8.410 8.410 8.577 -0.167 18135 1571 1 2 . 1 1 108 108 THR N N 108 114.402 114.402 113.232 1.170 18135 1572 1 2 . 1 1 108 108 THR HA H 108 4.448 4.448 4.673 -0.225 18135 1573 1 2 . 1 1 108 108 THR CA C 108 60.348 60.348 59.070 1.278 18135 1574 1 2 . 1 1 108 108 THR CB C 108 68.544 68.544 68.419 0.125 18135 1575 1 2 . 1 1 108 108 THR H H 108 8.155 8.155 8.065 0.090 18135 1576 1 2 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.393 -0.155 18135 1577 1 2 . 1 1 109 109 PRO C C 109 178.666 178.666 177.728 0.938 18135 1578 1 2 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.062 1.314 18135 1579 1 2 . 1 1 109 109 PRO CB C 109 31.848 31.848 32.060 -0.212 18135 1580 1 2 . 1 1 110 110 LEU N N 110 118.566 118.566 118.014 0.552 18135 1581 1 2 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.120 -0.004 18135 1582 1 2 . 1 1 110 110 LEU C C 110 178.293 178.293 179.122 -0.829 18135 1583 1 2 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.593 -0.907 18135 1584 1 2 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.365 0.604 18135 1585 1 2 . 1 1 110 110 LEU H H 110 8.016 8.016 7.780 0.236 18135 1586 1 2 . 1 1 111 111 MET N N 111 118.982 118.982 116.324 2.658 18135 1587 1 2 . 1 1 111 111 MET HA H 111 4.210 4.210 4.275 -0.065 18135 1588 1 2 . 1 1 111 111 MET C C 111 178.720 178.720 177.773 0.947 18135 1589 1 2 . 1 1 111 111 MET CA C 111 58.144 58.144 57.170 0.973 18135 1590 1 2 . 1 1 111 111 MET CB C 111 32.374 32.374 32.041 0.333 18135 1591 1 2 . 1 1 111 111 MET H H 111 7.705 7.705 8.225 -0.520 18135 1592 1 2 . 1 1 112 112 LYS N N 112 121.377 121.377 119.619 1.758 18135 1593 1 2 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.249 -0.141 18135 1594 1 2 . 1 1 112 112 LYS C C 112 178.000 178.000 178.462 -0.462 18135 1595 1 2 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.275 -1.970 18135 1596 1 2 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.196 0.171 18135 1597 1 2 . 1 1 112 112 LYS H H 112 8.257 8.257 7.481 0.776 18135 1598 1 2 . 1 1 113 113 GLU N N 113 119.104 119.104 118.609 0.495 18135 1599 1 2 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.040 0.026 18135 1600 1 2 . 1 1 113 113 GLU C C 113 178.289 178.289 178.134 0.155 18135 1601 1 2 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.066 -0.813 18135 1602 1 2 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.007 -0.869 18135 1603 1 2 . 1 1 113 113 GLU H H 113 8.270 8.270 7.627 0.643 18135 1604 1 2 . 1 1 114 114 ASP N N 114 119.224 119.224 119.125 0.099 18135 1605 1 2 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.561 -0.273 18135 1606 1 2 . 1 1 114 114 ASP C C 114 178.365 178.365 177.993 0.372 18135 1607 1 2 . 1 1 114 114 ASP CA C 114 56.108 56.108 56.754 -0.646 18135 1608 1 2 . 1 1 114 114 ASP CB C 114 38.235 38.235 41.058 -2.823 18135 1609 1 2 . 1 1 114 114 ASP H H 114 8.618 8.618 7.610 1.008 18135 1610 1 2 . 1 1 115 115 SER N N 115 118.195 118.195 117.036 1.159 18135 1611 1 2 . 1 1 115 115 SER HA H 115 4.200 4.200 4.133 0.067 18135 1612 1 2 . 1 1 115 115 SER C C 115 175.986 175.986 176.677 -0.691 18135 1613 1 2 . 1 1 115 115 SER CA C 115 61.588 61.588 61.189 0.399 18135 1614 1 2 . 1 1 115 115 SER CB C 115 62.653 62.653 63.198 -0.545 18135 1615 1 2 . 1 1 115 115 SER H H 115 8.181 8.181 7.530 0.651 18135 1616 1 2 . 1 1 116 116 ILE N N 116 123.340 123.340 121.842 1.498 18135 1617 1 2 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.854 -0.228 18135 1618 1 2 . 1 1 116 116 ILE C C 116 178.367 178.367 178.395 -0.028 18135 1619 1 2 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.124 1.693 18135 1620 1 2 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.511 0.906 18135 1621 1 2 . 1 1 116 116 ILE H H 116 7.773 7.773 8.306 -0.533 18135 1622 1 2 . 1 1 117 117 LEU N N 117 120.968 120.968 121.404 -0.436 18135 1623 1 2 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.921 -0.016 18135 1624 1 2 . 1 1 117 117 LEU C C 117 178.746 178.746 178.089 0.657 18135 1625 1 2 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.438 -0.295 18135 1626 1 2 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.643 -0.057 18135 1627 1 2 . 1 1 117 117 LEU H H 117 8.406 8.406 7.271 1.135 18135 1628 1 2 . 1 1 118 118 ALA N N 118 120.150 120.150 121.975 -1.825 18135 1629 1 2 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.569 0.543 18135 1630 1 2 . 1 1 118 118 ALA C C 118 181.633 181.633 178.657 2.976 18135 1631 1 2 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.136 0.177 18135 1632 1 2 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.310 -0.200 18135 1633 1 2 . 1 1 118 118 ALA H H 118 7.894 7.894 8.158 -0.264 18135 1634 1 2 . 1 1 119 119 VAL N N 119 118.873 118.873 115.529 3.344 18135 1635 1 2 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.385 0.370 18135 1636 1 2 . 1 1 119 119 VAL C C 119 177.896 177.896 177.530 0.366 18135 1637 1 2 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.228 0.953 18135 1638 1 2 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.151 0.743 18135 1639 1 2 . 1 1 119 119 VAL H H 119 7.572 7.572 7.771 -0.199 18135 1640 1 2 . 1 1 120 120 ARG N N 120 121.436 121.436 120.635 0.801 18135 1641 1 2 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.008 0.019 18135 1642 1 2 . 1 1 120 120 ARG C C 120 179.848 179.848 178.837 1.011 18135 1643 1 2 . 1 1 120 120 ARG CA C 120 61.267 61.267 60.044 1.223 18135 1644 1 2 . 1 1 120 120 ARG CB C 120 29.695 29.695 30.052 -0.357 18135 1645 1 2 . 1 1 120 120 ARG H H 120 8.629 8.629 7.874 0.755 18135 1646 1 2 . 1 1 121 121 LYS N N 121 119.589 119.589 119.503 0.086 18135 1647 1 2 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.899 0.175 18135 1648 1 2 . 1 1 121 121 LYS C C 121 178.331 178.331 179.470 -1.139 18135 1649 1 2 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.811 0.629 18135 1650 1 2 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.207 -0.100 18135 1651 1 2 . 1 1 121 121 LYS H H 121 9.015 9.015 8.264 0.751 18135 1652 1 2 . 1 1 122 122 TYR N N 122 121.546 121.546 118.690 2.856 18135 1653 1 2 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.118 0.214 18135 1654 1 2 . 1 1 122 122 TYR C C 122 176.527 176.527 178.138 -1.611 18135 1655 1 2 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.792 1.612 18135 1656 1 2 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.237 0.488 18135 1657 1 2 . 1 1 122 122 TYR H H 122 7.473 7.473 7.811 -0.338 18135 1658 1 2 . 1 1 123 123 PHE N N 123 116.026 116.026 119.735 -3.709 18135 1659 1 2 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.986 -0.246 18135 1660 1 2 . 1 1 123 123 PHE C C 123 179.005 179.005 177.653 1.352 18135 1661 1 2 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.471 3.057 18135 1662 1 2 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.852 0.479 18135 1663 1 2 . 1 1 123 123 PHE H H 123 7.932 7.932 8.377 -0.445 18135 1664 1 2 . 1 1 124 124 GLN N N 124 123.043 123.043 118.329 4.714 18135 1665 1 2 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.380 0.799 18135 1666 1 2 . 1 1 124 124 GLN C C 124 178.772 178.772 178.600 0.172 18135 1667 1 2 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.652 -0.336 18135 1668 1 2 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.226 -0.595 18135 1669 1 2 . 1 1 124 124 GLN H H 124 8.470 8.470 8.649 -0.179 18135 1670 1 2 . 1 1 125 125 ARG N N 125 120.342 120.342 119.247 1.095 18135 1671 1 2 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.168 -0.090 18135 1672 1 2 . 1 1 125 125 ARG C C 125 180.340 180.340 179.362 0.978 18135 1673 1 2 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.702 2.595 18135 1674 1 2 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.824 0.501 18135 1675 1 2 . 1 1 125 125 ARG H H 125 8.137 8.137 8.291 -0.154 18135 1676 1 2 . 1 1 126 126 ILE N N 126 121.876 121.876 121.296 0.580 18135 1677 1 2 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.687 -0.336 18135 1678 1 2 . 1 1 126 126 ILE C C 126 176.857 176.857 177.749 -0.892 18135 1679 1 2 . 1 1 126 126 ILE CA C 126 65.832 65.832 65.096 0.736 18135 1680 1 2 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.871 0.413 18135 1681 1 2 . 1 1 126 126 ILE H H 126 7.526 7.526 8.405 -0.879 18135 1682 1 2 . 1 1 127 127 THR N N 127 115.613 115.613 115.287 0.326 18135 1683 1 2 . 1 1 127 127 THR HA H 127 3.633 3.633 3.853 -0.220 18135 1684 1 2 . 1 1 127 127 THR C C 127 176.645 176.645 177.053 -0.408 18135 1685 1 2 . 1 1 127 127 THR CA C 127 67.294 67.294 66.670 0.624 18135 1686 1 2 . 1 1 127 127 THR CB C 127 68.871 68.871 68.895 -0.024 18135 1687 1 2 . 1 1 127 127 THR H H 127 8.288 8.288 8.184 0.104 18135 1688 1 2 . 1 1 128 128 LEU N N 128 122.627 122.627 122.085 0.542 18135 1689 1 2 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.958 -0.002 18135 1690 1 2 . 1 1 128 128 LEU C C 128 178.331 178.331 177.514 0.817 18135 1691 1 2 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.687 0.401 18135 1692 1 2 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.279 0.295 18135 1693 1 2 . 1 1 128 128 LEU H H 128 8.263 8.263 8.117 0.146 18135 1694 1 2 . 1 1 129 129 TYR N N 129 120.955 120.955 120.291 0.664 18135 1695 1 2 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.019 -0.129 18135 1696 1 2 . 1 1 129 129 TYR C C 129 176.040 176.040 177.271 -1.231 18135 1697 1 2 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.820 -0.327 18135 1698 1 2 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.271 0.654 18135 1699 1 2 . 1 1 129 129 TYR H H 129 7.518 7.518 8.245 -0.727 18135 1700 1 2 . 1 1 130 130 LEU N N 130 119.155 119.155 116.417 2.738 18135 1701 1 2 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.341 -0.496 18135 1702 1 2 . 1 1 130 130 LEU C C 130 177.948 177.948 178.322 -0.374 18135 1703 1 2 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.845 0.268 18135 1704 1 2 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.570 1.016 18135 1705 1 2 . 1 1 130 130 LEU H H 130 7.717 7.717 7.975 -0.258 18135 1706 1 2 . 1 1 131 131 LYS N N 131 116.832 116.832 119.876 -3.044 18135 1707 1 2 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.770 -0.362 18135 1708 1 2 . 1 1 131 131 LYS C C 131 181.265 181.265 179.706 1.559 18135 1709 1 2 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.612 0.119 18135 1710 1 2 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.019 0.653 18135 1711 1 2 . 1 1 131 131 LYS H H 131 7.493 7.493 7.894 -0.401 18135 1712 1 2 . 1 1 132 132 GLU N N 132 121.918 121.918 119.349 2.569 18135 1713 1 2 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.099 -0.255 18135 1714 1 2 . 1 1 132 132 GLU C C 132 178.377 178.377 177.994 0.383 18135 1715 1 2 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.597 0.290 18135 1716 1 2 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.437 -0.770 18135 1717 1 2 . 1 1 132 132 GLU H H 132 8.430 8.430 7.986 0.444 18135 1718 1 2 . 1 1 133 133 LYS N N 133 116.079 116.079 116.814 -0.735 18135 1719 1 2 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.305 -0.339 18135 1720 1 2 . 1 1 133 133 LYS C C 133 175.282 175.282 175.556 -0.274 18135 1721 1 2 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.320 -0.022 18135 1722 1 2 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.498 0.500 18135 1723 1 2 . 1 1 133 133 LYS H H 133 7.390 7.390 7.303 0.087 18135 1724 1 2 . 1 1 134 134 LYS N N 134 117.759 117.759 116.971 0.788 18135 1725 1 2 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.030 -0.448 18135 1726 1 2 . 1 1 134 134 LYS C C 134 176.271 176.271 175.902 0.369 18135 1727 1 2 . 1 1 134 134 LYS CA C 134 57.308 57.308 57.186 0.122 18135 1728 1 2 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.518 -0.716 18135 1729 1 2 . 1 1 134 134 LYS H H 134 7.716 7.716 7.516 0.200 18135 1730 1 2 . 1 1 135 135 TYR N N 135 110.598 110.598 113.043 -2.445 18135 1731 1 2 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.947 -1.070 18135 1732 1 2 . 1 1 135 135 TYR C C 135 174.148 174.148 175.653 -1.505 18135 1733 1 2 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.299 0.416 18135 1734 1 2 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.263 -0.557 18135 1735 1 2 . 1 1 135 135 TYR H H 135 8.428 8.428 8.694 -0.266 18135 1736 1 2 . 1 1 136 136 SER N N 136 113.712 113.712 115.506 -1.794 18135 1737 1 2 . 1 1 136 136 SER HA H 136 4.553 4.553 4.392 0.161 18135 1738 1 2 . 1 1 136 136 SER CA C 136 57.108 57.108 58.686 -1.578 18135 1739 1 2 . 1 1 136 136 SER CB C 136 62.500 62.500 64.016 -1.516 18135 1740 1 2 . 1 1 136 136 SER H H 136 6.744 6.744 7.560 -0.816 18135 1741 1 2 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.422 -0.257 18135 1742 1 2 . 1 1 137 137 PRO C C 137 180.675 180.675 177.363 3.312 18135 1743 1 2 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.743 0.914 18135 1744 1 2 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.697 0.286 18135 1745 1 2 . 1 1 138 138 CYS N N 138 113.914 113.914 116.024 -2.110 18135 1746 1 2 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.632 0.038 18135 1747 1 2 . 1 1 138 138 CYS C C 138 176.015 176.015 176.084 -0.069 18135 1748 1 2 . 1 1 138 138 CYS CA C 138 57.095 57.095 59.689 -2.594 18135 1749 1 2 . 1 1 138 138 CYS CB C 138 36.779 36.779 25.946 10.833 18135 1750 1 2 . 1 1 138 138 CYS H H 138 8.580 8.580 8.444 0.136 18135 1751 1 2 . 1 1 139 139 ALA N N 139 125.290 125.290 124.637 0.653 18135 1752 1 2 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.181 0.268 18135 1753 1 2 . 1 1 139 139 ALA C C 139 180.149 180.149 179.226 0.923 18135 1754 1 2 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.941 -0.163 18135 1755 1 2 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.055 0.863 18135 1756 1 2 . 1 1 139 139 ALA H H 139 8.087 8.087 8.059 0.028 18135 1757 1 2 . 1 1 140 140 TRP N N 140 116.599 116.599 118.610 -2.011 18135 1758 1 2 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.321 0.281 18135 1759 1 2 . 1 1 140 140 TRP C C 140 179.137 179.137 178.606 0.531 18135 1760 1 2 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.469 -0.935 18135 1761 1 2 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.463 -0.205 18135 1762 1 2 . 1 1 140 140 TRP H H 140 8.505 8.505 7.853 0.652 18135 1763 1 2 . 1 1 141 141 GLU N N 141 121.578 121.578 119.715 1.863 18135 1764 1 2 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.266 0.957 18135 1765 1 2 . 1 1 141 141 GLU C C 141 177.886 177.886 178.938 -1.052 18135 1766 1 2 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.996 -2.089 18135 1767 1 2 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.535 -0.818 18135 1768 1 2 . 1 1 141 141 GLU H H 141 8.182 8.182 8.068 0.114 18135 1769 1 2 . 1 1 142 142 VAL N N 142 121.202 121.202 119.962 1.240 18135 1770 1 2 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.664 -0.034 18135 1771 1 2 . 1 1 142 142 VAL C C 142 180.246 180.246 178.411 1.835 18135 1772 1 2 . 1 1 142 142 VAL CA C 142 66.983 66.983 67.234 -0.251 18135 1773 1 2 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.441 0.381 18135 1774 1 2 . 1 1 142 142 VAL H H 142 8.623 8.623 8.079 0.544 18135 1775 1 2 . 1 1 143 143 VAL N N 143 120.119 120.119 119.644 0.475 18135 1776 1 2 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.755 -0.458 18135 1777 1 2 . 1 1 143 143 VAL C C 143 176.407 176.407 178.429 -2.022 18135 1778 1 2 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.865 1.113 18135 1779 1 2 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.580 0.075 18135 1780 1 2 . 1 1 143 143 VAL H H 143 8.323 8.323 8.479 -0.156 18135 1781 1 2 . 1 1 144 144 ARG N N 144 124.102 124.102 119.655 4.447 18135 1782 1 2 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.088 -0.391 18135 1783 1 2 . 1 1 144 144 ARG C C 144 178.127 178.127 178.438 -0.311 18135 1784 1 2 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.267 1.734 18135 1785 1 2 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.475 0.461 18135 1786 1 2 . 1 1 144 144 ARG H H 144 9.619 9.619 8.303 1.316 18135 1787 1 2 . 1 1 145 145 ALA N N 145 119.431 119.431 121.667 -2.236 18135 1788 1 2 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.075 -0.224 18135 1789 1 2 . 1 1 145 145 ALA C C 145 180.763 180.763 180.144 0.619 18135 1790 1 2 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.381 -0.006 18135 1791 1 2 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.030 0.155 18135 1792 1 2 . 1 1 145 145 ALA H H 145 8.867 8.867 8.318 0.549 18135 1793 1 2 . 1 1 146 146 GLU N N 146 121.815 121.815 118.123 3.692 18135 1794 1 2 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.167 0.044 18135 1795 1 2 . 1 1 146 146 GLU C C 146 177.296 177.296 179.344 -2.048 18135 1796 1 2 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.358 -0.979 18135 1797 1 2 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.453 -1.319 18135 1798 1 2 . 1 1 146 146 GLU H H 146 8.136 8.136 8.123 0.013 18135 1799 1 2 . 1 1 147 147 ILE N N 147 119.542 119.542 121.534 -1.992 18135 1800 1 2 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.887 0.083 18135 1801 1 2 . 1 1 147 147 ILE C C 147 178.283 178.283 178.497 -0.214 18135 1802 1 2 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.180 -2.927 18135 1803 1 2 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.549 -2.210 18135 1804 1 2 . 1 1 147 147 ILE H H 147 8.736 8.736 8.364 0.372 18135 1805 1 2 . 1 1 148 148 MET N N 148 119.501 119.501 118.621 0.880 18135 1806 1 2 . 1 1 148 148 MET HA H 148 3.801 3.801 4.200 -0.399 18135 1807 1 2 . 1 1 148 148 MET C C 148 178.210 178.210 178.737 -0.527 18135 1808 1 2 . 1 1 148 148 MET CA C 148 60.184 60.184 60.028 0.156 18135 1809 1 2 . 1 1 148 148 MET CB C 148 32.914 32.914 31.986 0.928 18135 1810 1 2 . 1 1 148 148 MET H H 148 8.440 8.440 8.576 -0.136 18135 1811 1 2 . 1 1 149 149 ARG N N 149 119.734 119.734 120.283 -0.549 18135 1812 1 2 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.259 -0.344 18135 1813 1 2 . 1 1 149 149 ARG C C 149 178.978 178.978 179.268 -0.290 18135 1814 1 2 . 1 1 149 149 ARG CA C 149 59.863 59.863 58.846 1.017 18135 1815 1 2 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.820 0.460 18135 1816 1 2 . 1 1 149 149 ARG H H 149 7.648 7.648 8.440 -0.792 18135 1817 1 2 . 1 1 150 150 SER N N 150 118.109 118.109 116.225 1.884 18135 1818 1 2 . 1 1 150 150 SER HA H 150 3.339 3.339 3.962 -0.623 18135 1819 1 2 . 1 1 150 150 SER C C 150 177.292 177.292 176.735 0.557 18135 1820 1 2 . 1 1 150 150 SER CA C 150 61.316 61.316 61.226 0.090 18135 1821 1 2 . 1 1 150 150 SER CB C 150 60.288 60.288 62.628 -2.340 18135 1822 1 2 . 1 1 150 150 SER H H 150 9.194 9.194 8.283 0.911 18135 1823 1 2 . 1 1 151 151 PHE N N 151 125.265 125.265 124.255 1.010 18135 1824 1 2 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.224 -0.188 18135 1825 1 2 . 1 1 151 151 PHE C C 151 178.696 178.696 177.004 1.692 18135 1826 1 2 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.738 1.682 18135 1827 1 2 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.968 -0.082 18135 1828 1 2 . 1 1 151 151 PHE H H 151 9.455 9.455 8.369 1.086 18135 1829 1 2 . 1 1 152 152 SER N N 152 115.963 115.963 116.341 -0.378 18135 1830 1 2 . 1 1 152 152 SER HA H 152 3.880 3.880 3.776 0.104 18135 1831 1 2 . 1 1 152 152 SER C C 152 175.858 175.858 176.826 -0.968 18135 1832 1 2 . 1 1 152 152 SER CA C 152 62.388 62.388 60.682 1.706 18135 1833 1 2 . 1 1 152 152 SER CB C 152 62.519 62.519 63.539 -1.020 18135 1834 1 2 . 1 1 152 152 SER H H 152 7.839 7.839 8.311 -0.472 18135 1835 1 2 . 1 1 153 153 LEU N N 153 121.365 121.365 123.440 -2.075 18135 1836 1 2 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.110 -0.029 18135 1837 1 2 . 1 1 153 153 LEU C C 153 179.515 179.515 179.403 0.112 18135 1838 1 2 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.725 0.158 18135 1839 1 2 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.060 1.282 18135 1840 1 2 . 1 1 153 153 LEU H H 153 7.775 7.775 8.386 -0.611 18135 1841 1 2 . 1 1 154 154 SER N N 154 113.950 113.950 114.809 -0.859 18135 1842 1 2 . 1 1 154 154 SER HA H 154 3.781 3.781 4.471 -0.690 18135 1843 1 2 . 1 1 154 154 SER C C 154 174.312 174.312 176.013 -1.701 18135 1844 1 2 . 1 1 154 154 SER CA C 154 61.366 61.366 61.185 0.181 18135 1845 1 2 . 1 1 154 154 SER CB C 154 63.242 63.242 63.409 -0.167 18135 1846 1 2 . 1 1 154 154 SER H H 154 7.874 7.874 8.542 -0.668 18135 1847 1 2 . 1 1 155 155 THR N N 155 109.346 109.346 110.804 -1.458 18135 1848 1 2 . 1 1 155 155 THR HA H 155 4.060 4.060 4.379 -0.319 18135 1849 1 2 . 1 1 155 155 THR C C 155 174.798 174.798 176.315 -1.517 18135 1850 1 2 . 1 1 155 155 THR CA C 155 62.275 62.275 64.618 -2.343 18135 1851 1 2 . 1 1 155 155 THR CB C 155 69.342 69.342 69.016 0.326 18135 1852 1 2 . 1 1 155 155 THR H H 155 7.176 7.176 7.820 -0.644 18135 1853 1 2 . 1 1 156 156 ASN N N 156 119.785 119.785 120.642 -0.857 18135 1854 1 2 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.814 -0.287 18135 1855 1 2 . 1 1 156 156 ASN C C 156 175.528 175.528 174.790 0.738 18135 1856 1 2 . 1 1 156 156 ASN CA C 156 53.937 53.937 53.297 0.640 18135 1857 1 2 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.442 0.896 18135 1858 1 2 . 1 1 156 156 ASN H H 156 7.749 7.749 8.002 -0.253 18135 1859 1 2 . 1 1 157 157 LEU N N 157 120.552 120.552 120.584 -0.032 18135 1860 1 2 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.524 -0.269 18135 1861 1 2 . 1 1 157 157 LEU C C 157 174.702 174.702 178.039 -3.337 18135 1862 1 2 . 1 1 157 157 LEU CA C 157 55.674 55.674 55.981 -0.307 18135 1863 1 2 . 1 1 157 157 LEU CB C 157 42.351 42.351 41.991 0.360 18135 1864 1 2 . 1 1 157 157 LEU H H 157 8.097 8.097 7.828 0.269 18135 1865 1 2 . 1 1 158 158 GLN N N 158 119.860 119.860 118.682 1.178 18135 1866 1 2 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.216 -0.036 18135 1867 1 2 . 1 1 158 158 GLN C C 158 176.434 176.434 175.936 0.498 18135 1868 1 2 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.610 1.287 18135 1869 1 2 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.234 -0.224 18135 1870 1 2 . 1 1 158 158 GLN H H 158 8.230 8.230 7.989 0.241 18135 1871 1 2 . 1 1 159 159 GLU N N 159 120.461 120.461 117.836 2.625 18135 1872 1 2 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.059 0.160 18135 1873 1 2 . 1 1 159 159 GLU C C 159 175.251 175.251 175.469 -0.218 18135 1874 1 2 . 1 1 159 159 GLU CA C 159 56.695 56.695 56.902 -0.207 18135 1875 1 2 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.887 0.094 18135 1876 1 2 . 1 1 159 159 GLU H H 159 8.300 8.300 8.561 -0.261 18135 1877 1 2 . 1 1 160 160 SER N N 160 115.719 115.719 113.578 2.141 18135 1878 1 2 . 1 1 160 160 SER HA H 160 4.372 4.372 4.584 -0.212 18135 1879 1 2 . 1 1 160 160 SER C C 160 174.188 174.188 174.184 0.004 18135 1880 1 2 . 1 1 160 160 SER CA C 160 58.481 58.481 58.144 0.337 18135 1881 1 2 . 1 1 160 160 SER CB C 160 63.731 63.731 63.289 0.442 18135 1882 1 2 . 1 1 160 160 SER H H 160 8.113 8.113 8.382 -0.269 18135 1883 1 2 . 1 1 161 161 LEU N N 161 123.794 123.794 121.485 2.309 18135 1884 1 2 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.563 -0.283 18135 1885 1 2 . 1 1 161 161 LEU C C 161 177.293 177.293 176.532 0.761 18135 1886 1 2 . 1 1 161 161 LEU CA C 161 55.190 55.190 54.102 1.088 18135 1887 1 2 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.737 -0.453 18135 1888 1 2 . 1 1 161 161 LEU H H 161 8.032 8.032 7.645 0.387 18135 1889 1 2 . 1 1 162 162 ARG N N 162 120.715 120.715 121.904 -1.189 18135 1890 1 2 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.300 -0.131 18135 1891 1 2 . 1 1 162 162 ARG C C 162 176.288 176.288 175.259 1.029 18135 1892 1 2 . 1 1 162 162 ARG CA C 162 57.046 57.046 56.816 0.230 18135 1893 1 2 . 1 1 162 162 ARG CB C 162 30.935 30.935 30.696 0.239 18135 1894 1 2 . 1 1 162 162 ARG H H 162 8.094 8.094 8.521 -0.427 18135 1895 1 2 . 1 1 163 163 SER N N 163 116.670 116.670 117.078 -0.408 18135 1896 1 2 . 1 1 163 163 SER HA H 163 4.372 4.372 4.692 -0.320 18135 1897 1 2 . 1 1 163 163 SER C C 163 174.184 174.184 174.766 -0.582 18135 1898 1 2 . 1 1 163 163 SER CA C 163 58.481 58.481 57.442 1.039 18135 1899 1 2 . 1 1 163 163 SER CB C 163 63.745 63.745 63.736 0.009 18135 1900 1 2 . 1 1 163 163 SER H H 163 8.191 8.191 8.345 -0.154 18135 1901 1 2 . 1 1 164 164 LYS N N 164 123.100 123.100 123.215 -0.115 18135 1902 1 2 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.185 0.092 18135 1903 1 2 . 1 1 164 164 LYS C C 164 175.617 175.617 176.660 -1.043 18135 1904 1 2 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.722 -1.409 18135 1905 1 2 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.654 0.311 18135 1906 1 2 . 1 1 164 164 LYS H H 164 8.251 8.251 8.700 -0.449 18135 1907 1 3 . 1 1 2 2 ASP N N 2 125.691 125.691 119.925 5.766 18135 1908 1 3 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.560 0.150 18135 1909 1 3 . 1 1 2 2 ASP C C 2 174.758 174.758 175.887 -1.129 18135 1910 1 3 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.456 -1.613 18135 1911 1 3 . 1 1 2 2 ASP CB C 2 39.321 39.321 40.644 -1.323 18135 1912 1 3 . 1 1 2 2 ASP H H 2 8.773 8.773 8.506 0.267 18135 1913 1 3 . 1 1 3 3 LEU N N 3 123.957 123.957 118.186 5.771 18135 1914 1 3 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.343 0.058 18135 1915 1 3 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.293 0.360 18135 1916 1 3 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.133 0.422 18135 1917 1 3 . 1 1 3 3 LEU H H 3 8.164 8.164 7.405 0.759 18135 1918 1 3 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.471 -0.157 18135 1919 1 3 . 1 1 4 4 PRO C C 4 176.213 176.213 176.289 -0.076 18135 1920 1 3 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.224 0.684 18135 1921 1 3 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.091 1.803 18135 1922 1 3 . 1 1 5 5 GLN N N 5 121.621 121.621 121.380 0.241 18135 1923 1 3 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.163 0.063 18135 1924 1 3 . 1 1 5 5 GLN C C 5 176.995 176.995 176.843 0.152 18135 1925 1 3 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.130 -1.420 18135 1926 1 3 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.389 -0.438 18135 1927 1 3 . 1 1 5 5 GLN H H 5 8.767 8.767 8.690 0.077 18135 1928 1 3 . 1 1 6 6 THR N N 6 111.419 111.419 110.717 0.702 18135 1929 1 3 . 1 1 6 6 THR HA H 6 4.135 4.135 4.424 -0.289 18135 1930 1 3 . 1 1 6 6 THR C C 6 174.695 174.695 174.843 -0.148 18135 1931 1 3 . 1 1 6 6 THR CA C 6 62.661 62.661 63.033 -0.372 18135 1932 1 3 . 1 1 6 6 THR CB C 6 69.365 69.365 68.776 0.589 18135 1933 1 3 . 1 1 6 6 THR H H 6 7.865 7.865 8.451 -0.586 18135 1934 1 3 . 1 1 7 7 HIS N N 7 119.137 119.137 118.705 0.432 18135 1935 1 3 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.653 -0.068 18135 1936 1 3 . 1 1 7 7 HIS C C 7 174.980 174.980 175.289 -0.309 18135 1937 1 3 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.545 -2.541 18135 1938 1 3 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.973 -1.810 18135 1939 1 3 . 1 1 7 7 HIS H H 7 8.567 8.567 8.474 0.093 18135 1940 1 3 . 1 1 8 8 SER N N 8 115.796 115.796 113.711 2.085 18135 1941 1 3 . 1 1 8 8 SER HA H 8 4.363 4.363 4.471 -0.108 18135 1942 1 3 . 1 1 8 8 SER C C 8 175.312 175.312 176.300 -0.988 18135 1943 1 3 . 1 1 8 8 SER CA C 8 58.969 58.969 59.928 -0.959 18135 1944 1 3 . 1 1 8 8 SER CB C 8 63.439 63.439 63.660 -0.221 18135 1945 1 3 . 1 1 8 8 SER H H 8 8.180 8.180 7.938 0.242 18135 1946 1 3 . 1 1 9 9 LEU N N 9 123.844 123.844 118.183 5.661 18135 1947 1 3 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.727 -0.572 18135 1948 1 3 . 1 1 9 9 LEU C C 9 178.568 178.568 178.406 0.162 18135 1949 1 3 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.730 0.236 18135 1950 1 3 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.365 -0.569 18135 1951 1 3 . 1 1 9 9 LEU H H 9 8.404 8.404 7.842 0.562 18135 1952 1 3 . 1 1 10 10 GLY N N 10 107.582 107.582 108.032 -0.450 18135 1953 1 3 . 1 1 10 10 GLY C C 10 174.586 174.586 176.425 -1.839 18135 1954 1 3 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.398 -0.492 18135 1955 1 3 . 1 1 10 10 GLY H H 10 8.438 8.438 8.621 -0.183 18135 1956 1 3 . 1 1 11 11 SER N N 11 118.806 118.806 118.245 0.561 18135 1957 1 3 . 1 1 11 11 SER HA H 11 4.156 4.156 4.138 0.018 18135 1958 1 3 . 1 1 11 11 SER C C 11 175.749 175.749 176.912 -1.163 18135 1959 1 3 . 1 1 11 11 SER CA C 11 61.299 61.299 62.161 -0.862 18135 1960 1 3 . 1 1 11 11 SER CB C 11 62.653 62.653 62.617 0.035 18135 1961 1 3 . 1 1 11 11 SER H H 11 8.249 8.249 7.704 0.545 18135 1962 1 3 . 1 1 12 12 ARG N N 12 121.986 121.986 120.206 1.780 18135 1963 1 3 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.172 -0.218 18135 1964 1 3 . 1 1 12 12 ARG C C 12 178.283 178.283 178.494 -0.211 18135 1965 1 3 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.329 1.501 18135 1966 1 3 . 1 1 12 12 ARG CB C 12 29.584 29.584 29.765 -0.181 18135 1967 1 3 . 1 1 12 12 ARG H H 12 8.027 8.027 7.906 0.121 18135 1968 1 3 . 1 1 13 13 ARG N N 13 119.432 119.432 120.199 -0.767 18135 1969 1 3 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.092 -0.253 18135 1970 1 3 . 1 1 13 13 ARG C C 13 178.480 178.480 178.480 0.000 18135 1971 1 3 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.593 0.898 18135 1972 1 3 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.568 0.514 18135 1973 1 3 . 1 1 13 13 ARG H H 13 8.437 8.437 8.237 0.200 18135 1974 1 3 . 1 1 14 14 THR N N 14 116.879 116.879 116.563 0.316 18135 1975 1 3 . 1 1 14 14 THR HA H 14 3.532 3.532 4.133 -0.601 18135 1976 1 3 . 1 1 14 14 THR C C 14 175.584 175.584 177.163 -1.579 18135 1977 1 3 . 1 1 14 14 THR CA C 14 68.036 68.036 66.471 1.565 18135 1978 1 3 . 1 1 14 14 THR CB C 14 67.969 67.969 68.650 -0.680 18135 1979 1 3 . 1 1 14 14 THR H H 14 7.957 7.957 8.292 -0.335 18135 1980 1 3 . 1 1 15 15 LEU N N 15 120.252 120.252 122.678 -2.426 18135 1981 1 3 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.073 -0.127 18135 1982 1 3 . 1 1 15 15 LEU C C 15 178.652 178.652 178.838 -0.186 18135 1983 1 3 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.341 -0.253 18135 1984 1 3 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.913 -0.360 18135 1985 1 3 . 1 1 15 15 LEU H H 15 7.550 7.550 8.135 -0.585 18135 1986 1 3 . 1 1 16 16 MET N N 16 118.788 118.788 117.518 1.270 18135 1987 1 3 . 1 1 16 16 MET HA H 16 4.023 4.023 3.979 0.044 18135 1988 1 3 . 1 1 16 16 MET C C 16 178.718 178.718 178.742 -0.024 18135 1989 1 3 . 1 1 16 16 MET CA C 16 58.513 58.513 59.363 -0.850 18135 1990 1 3 . 1 1 16 16 MET CB C 16 32.150 32.150 32.309 -0.159 18135 1991 1 3 . 1 1 16 16 MET H H 16 7.985 7.985 8.448 -0.463 18135 1992 1 3 . 1 1 17 17 LEU N N 17 120.644 120.644 119.427 1.217 18135 1993 1 3 . 1 1 17 17 LEU HA H 17 3.972 3.972 4.026 -0.054 18135 1994 1 3 . 1 1 17 17 LEU C C 17 178.238 178.238 179.437 -1.199 18135 1995 1 3 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.061 -0.334 18135 1996 1 3 . 1 1 17 17 LEU CB C 17 42.135 42.135 40.812 1.323 18135 1997 1 3 . 1 1 17 17 LEU H H 17 7.829 7.829 8.188 -0.359 18135 1998 1 3 . 1 1 18 18 LEU N N 18 118.280 118.280 119.634 -1.354 18135 1999 1 3 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.720 -0.214 18135 2000 1 3 . 1 1 18 18 LEU C C 18 175.739 175.739 178.644 -2.905 18135 2001 1 3 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.728 -0.072 18135 2002 1 3 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.396 0.846 18135 2003 1 3 . 1 1 18 18 LEU H H 18 7.499 7.499 8.457 -0.958 18135 2004 1 3 . 1 1 19 19 ALA N N 19 121.961 121.961 120.641 1.320 18135 2005 1 3 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.113 -0.276 18135 2006 1 3 . 1 1 19 19 ALA C C 19 180.736 180.736 178.900 1.836 18135 2007 1 3 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.300 0.766 18135 2008 1 3 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.126 -1.049 18135 2009 1 3 . 1 1 19 19 ALA H H 19 7.950 7.950 7.747 0.203 18135 2010 1 3 . 1 1 20 20 GLN N N 20 118.605 118.605 115.698 2.907 18135 2011 1 3 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.186 -0.252 18135 2012 1 3 . 1 1 20 20 GLN C C 20 176.945 176.945 177.175 -0.230 18135 2013 1 3 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.281 0.734 18135 2014 1 3 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.264 -0.790 18135 2015 1 3 . 1 1 20 20 GLN H H 20 7.958 7.958 8.011 -0.053 18135 2016 1 3 . 1 1 21 21 MET N N 21 116.693 116.693 117.925 -1.232 18135 2017 1 3 . 1 1 21 21 MET HA H 21 3.861 3.861 4.378 -0.517 18135 2018 1 3 . 1 1 21 21 MET C C 21 174.671 174.671 175.261 -0.590 18135 2019 1 3 . 1 1 21 21 MET CA C 21 57.111 57.111 56.611 0.500 18135 2020 1 3 . 1 1 21 21 MET CB C 21 34.073 34.073 33.430 0.643 18135 2021 1 3 . 1 1 21 21 MET H H 21 7.420 7.420 7.848 -0.428 18135 2022 1 3 . 1 1 22 22 ARG N N 22 115.451 115.451 119.809 -4.358 18135 2023 1 3 . 1 1 22 22 ARG HA H 22 3.853 3.853 4.041 -0.188 18135 2024 1 3 . 1 1 22 22 ARG C C 22 175.950 175.950 175.090 0.860 18135 2025 1 3 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.000 3.452 18135 2026 1 3 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.698 0.816 18135 2027 1 3 . 1 1 22 22 ARG H H 22 6.484 6.484 7.189 -0.705 18135 2028 1 3 . 1 1 23 23 LYS N N 23 128.593 128.593 123.082 5.511 18135 2029 1 3 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.608 -0.123 18135 2030 1 3 . 1 1 23 23 LYS C C 23 176.643 176.643 175.435 1.208 18135 2031 1 3 . 1 1 23 23 LYS CA C 23 57.287 57.287 56.171 1.116 18135 2032 1 3 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.161 4.100 18135 2033 1 3 . 1 1 23 23 LYS H H 23 10.212 10.212 8.735 1.477 18135 2034 1 3 . 1 1 24 24 ILE N N 24 118.605 118.605 122.499 -3.894 18135 2035 1 3 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.431 0.053 18135 2036 1 3 . 1 1 24 24 ILE C C 24 173.878 173.878 174.558 -0.680 18135 2037 1 3 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.293 -0.696 18135 2038 1 3 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.268 0.188 18135 2039 1 3 . 1 1 24 24 ILE H H 24 8.465 8.465 8.552 -0.087 18135 2040 1 3 . 1 1 25 25 SER N N 25 113.658 113.658 118.181 -4.523 18135 2041 1 3 . 1 1 25 25 SER HA H 25 4.481 4.481 4.989 -0.508 18135 2042 1 3 . 1 1 25 25 SER C C 25 176.359 176.359 175.683 0.676 18135 2043 1 3 . 1 1 25 25 SER CA C 25 56.975 56.975 57.101 -0.126 18135 2044 1 3 . 1 1 25 25 SER CB C 25 64.759 64.759 64.177 0.582 18135 2045 1 3 . 1 1 25 25 SER H H 25 8.104 8.104 8.652 -0.548 18135 2046 1 3 . 1 1 26 26 LEU N N 26 127.566 127.566 125.293 2.273 18135 2047 1 3 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.445 -0.568 18135 2048 1 3 . 1 1 26 26 LEU C C 26 178.946 178.946 177.565 1.381 18135 2049 1 3 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.315 0.363 18135 2050 1 3 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.969 -0.250 18135 2051 1 3 . 1 1 26 26 LEU H H 26 8.802 8.802 9.033 -0.231 18135 2052 1 3 . 1 1 27 27 PHE N N 27 117.143 117.143 116.513 0.630 18135 2053 1 3 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.638 -0.400 18135 2054 1 3 . 1 1 27 27 PHE C C 27 177.067 177.067 176.749 0.318 18135 2055 1 3 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.612 1.478 18135 2056 1 3 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.460 -0.198 18135 2057 1 3 . 1 1 27 27 PHE H H 27 7.986 7.986 7.953 0.033 18135 2058 1 3 . 1 1 28 28 SER N N 28 115.200 115.200 115.856 -0.656 18135 2059 1 3 . 1 1 28 28 SER HA H 28 4.505 4.505 4.425 0.080 18135 2060 1 3 . 1 1 28 28 SER C C 28 174.533 174.533 174.285 0.248 18135 2061 1 3 . 1 1 28 28 SER CA C 28 59.447 59.447 60.336 -0.889 18135 2062 1 3 . 1 1 28 28 SER CB C 28 63.790 63.790 63.481 0.309 18135 2063 1 3 . 1 1 28 28 SER H H 28 7.929 7.929 8.145 -0.216 18135 2064 1 3 . 1 1 29 29 CYS N N 29 119.870 119.870 118.911 0.959 18135 2065 1 3 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.638 0.444 18135 2066 1 3 . 1 1 29 29 CYS C C 29 176.475 176.475 174.137 2.338 18135 2067 1 3 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.758 -5.328 18135 2068 1 3 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.346 9.896 18135 2069 1 3 . 1 1 29 29 CYS H H 29 7.865 7.865 8.425 -0.560 18135 2070 1 3 . 1 1 30 30 LEU N N 30 122.259 122.259 123.214 -0.955 18135 2071 1 3 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.318 -0.357 18135 2072 1 3 . 1 1 30 30 LEU C C 30 179.774 179.774 178.334 1.440 18135 2073 1 3 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.346 1.958 18135 2074 1 3 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.146 -0.570 18135 2075 1 3 . 1 1 30 30 LEU H H 30 7.812 7.812 8.512 -0.700 18135 2076 1 3 . 1 1 31 31 LYS N N 31 117.731 117.731 116.056 1.675 18135 2077 1 3 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.207 0.483 18135 2078 1 3 . 1 1 31 31 LYS C C 31 176.692 176.692 176.272 0.420 18135 2079 1 3 . 1 1 31 31 LYS CA C 31 54.077 54.077 56.869 -2.792 18135 2080 1 3 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.214 -0.627 18135 2081 1 3 . 1 1 31 31 LYS H H 31 8.597 8.597 8.235 0.362 18135 2082 1 3 . 1 1 32 32 ASP N N 32 117.841 117.841 117.386 0.455 18135 2083 1 3 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.737 -0.043 18135 2084 1 3 . 1 1 32 32 ASP C C 32 175.505 175.505 176.015 -0.510 18135 2085 1 3 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.815 -0.727 18135 2086 1 3 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.143 -0.335 18135 2087 1 3 . 1 1 32 32 ASP H H 32 7.808 7.808 8.290 -0.482 18135 2088 1 3 . 1 1 33 33 ARG N N 33 120.876 120.876 120.416 0.460 18135 2089 1 3 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.237 -0.196 18135 2090 1 3 . 1 1 33 33 ARG C C 33 175.286 175.286 175.615 -0.329 18135 2091 1 3 . 1 1 33 33 ARG CA C 33 58.083 58.083 56.311 1.772 18135 2092 1 3 . 1 1 33 33 ARG CB C 33 30.013 30.013 31.061 -1.048 18135 2093 1 3 . 1 1 33 33 ARG H H 33 7.378 7.378 7.285 0.093 18135 2094 1 3 . 1 1 34 34 HIS N N 34 120.555 120.555 116.549 4.006 18135 2095 1 3 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.310 -0.098 18135 2096 1 3 . 1 1 34 34 HIS C C 34 170.494 170.494 173.462 -2.968 18135 2097 1 3 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.377 -2.770 18135 2098 1 3 . 1 1 34 34 HIS CB C 34 31.488 31.488 29.090 2.398 18135 2099 1 3 . 1 1 34 34 HIS H H 34 7.974 7.974 8.718 -0.744 18135 2100 1 3 . 1 1 35 35 ASP N N 35 125.061 125.061 120.149 4.912 18135 2101 1 3 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.372 0.266 18135 2102 1 3 . 1 1 35 35 ASP C C 35 175.943 175.943 176.122 -0.179 18135 2103 1 3 . 1 1 35 35 ASP CA C 35 52.369 52.369 53.964 -1.595 18135 2104 1 3 . 1 1 35 35 ASP CB C 35 40.362 40.362 40.954 -0.592 18135 2105 1 3 . 1 1 35 35 ASP H H 35 7.805 7.805 7.861 -0.056 18135 2106 1 3 . 1 1 36 36 PHE N N 36 122.860 122.860 119.570 3.290 18135 2107 1 3 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.317 0.008 18135 2108 1 3 . 1 1 36 36 PHE C C 36 176.643 176.643 176.307 0.336 18135 2109 1 3 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.347 1.292 18135 2110 1 3 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.034 1.657 18135 2111 1 3 . 1 1 36 36 PHE H H 36 8.973 8.973 7.231 1.742 18135 2112 1 3 . 1 1 37 37 GLY N N 37 111.856 111.856 107.492 4.364 18135 2113 1 3 . 1 1 37 37 GLY C C 37 175.185 175.185 174.208 0.977 18135 2114 1 3 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.931 3.212 18135 2115 1 3 . 1 1 37 37 GLY H H 37 8.727 8.727 7.787 0.940 18135 2116 1 3 . 1 1 38 38 PHE N N 38 123.178 123.178 121.063 2.115 18135 2117 1 3 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.724 -0.810 18135 2118 1 3 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.632 2.172 18135 2119 1 3 . 1 1 38 38 PHE CB C 38 38.657 38.657 37.903 0.754 18135 2120 1 3 . 1 1 38 38 PHE H H 38 9.169 9.169 7.028 2.141 18135 2121 1 3 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.553 -0.024 18135 2122 1 3 . 1 1 39 39 PRO C C 39 174.634 174.634 177.146 -2.512 18135 2123 1 3 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.620 -1.077 18135 2124 1 3 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.922 -2.218 18135 2125 1 3 . 1 1 40 40 GLN N N 40 123.608 123.608 123.943 -0.335 18135 2126 1 3 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.219 -0.600 18135 2127 1 3 . 1 1 40 40 GLN C C 40 176.958 176.958 177.736 -0.778 18135 2128 1 3 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.911 -0.838 18135 2129 1 3 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.870 0.947 18135 2130 1 3 . 1 1 40 40 GLN H H 40 7.966 7.966 8.390 -0.424 18135 2131 1 3 . 1 1 41 41 GLU N N 41 119.446 119.446 119.760 -0.314 18135 2132 1 3 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.104 0.033 18135 2133 1 3 . 1 1 41 41 GLU C C 41 177.346 177.346 177.778 -0.432 18135 2134 1 3 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.865 -0.936 18135 2135 1 3 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.267 -1.434 18135 2136 1 3 . 1 1 41 41 GLU H H 41 9.044 9.044 8.741 0.303 18135 2137 1 3 . 1 1 42 42 GLU N N 42 117.196 117.196 117.593 -0.397 18135 2138 1 3 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.292 -0.229 18135 2139 1 3 . 1 1 42 42 GLU C C 42 174.886 174.886 177.875 -2.989 18135 2140 1 3 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.699 -1.315 18135 2141 1 3 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.086 -2.528 18135 2142 1 3 . 1 1 42 42 GLU H H 42 7.646 7.646 7.889 -0.243 18135 2143 1 3 . 1 1 43 43 PHE N N 43 115.527 115.527 121.810 -6.283 18135 2144 1 3 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.597 -0.111 18135 2145 1 3 . 1 1 43 43 PHE C C 43 175.615 175.615 175.836 -0.221 18135 2146 1 3 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.822 -1.274 18135 2147 1 3 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.335 -0.442 18135 2148 1 3 . 1 1 43 43 PHE H H 43 7.601 7.601 8.238 -0.637 18135 2149 1 3 . 1 1 44 44 GLY N N 44 107.243 107.243 108.662 -1.419 18135 2150 1 3 . 1 1 44 44 GLY C C 44 174.032 174.032 174.150 -0.118 18135 2151 1 3 . 1 1 44 44 GLY CA C 44 45.612 45.612 46.022 -0.410 18135 2152 1 3 . 1 1 44 44 GLY H H 44 7.733 7.733 7.796 -0.063 18135 2153 1 3 . 1 1 45 45 ASN N N 45 117.599 117.599 121.264 -3.665 18135 2154 1 3 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.752 -0.201 18135 2155 1 3 . 1 1 45 45 ASN C C 45 175.894 175.894 174.488 1.406 18135 2156 1 3 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.881 0.968 18135 2157 1 3 . 1 1 45 45 ASN CB C 45 38.419 38.419 40.044 -1.625 18135 2158 1 3 . 1 1 45 45 ASN H H 45 8.343 8.343 7.674 0.669 18135 2159 1 3 . 1 1 46 46 GLN N N 46 118.916 118.916 119.286 -0.370 18135 2160 1 3 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.560 -0.478 18135 2161 1 3 . 1 1 46 46 GLN C C 46 175.851 175.851 177.003 -1.152 18135 2162 1 3 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.386 1.260 18135 2163 1 3 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.415 0.029 18135 2164 1 3 . 1 1 46 46 GLN H H 46 8.652 8.652 8.596 0.056 18135 2165 1 3 . 1 1 47 47 PHE N N 47 119.511 119.511 120.127 -0.616 18135 2166 1 3 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.373 0.189 18135 2167 1 3 . 1 1 47 47 PHE C C 47 176.258 176.258 175.851 0.407 18135 2168 1 3 . 1 1 47 47 PHE CA C 47 57.920 57.920 59.068 -1.147 18135 2169 1 3 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.715 0.143 18135 2170 1 3 . 1 1 47 47 PHE H H 47 7.904 7.904 7.888 0.016 18135 2171 1 3 . 1 1 48 48 GLN N N 48 120.127 120.127 117.504 2.623 18135 2172 1 3 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.522 -0.147 18135 2173 1 3 . 1 1 48 48 GLN C C 48 181.265 181.265 175.392 5.873 18135 2174 1 3 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.829 0.747 18135 2175 1 3 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.506 -1.038 18135 2176 1 3 . 1 1 48 48 GLN H H 48 8.255 8.255 8.074 0.181 18135 2177 1 3 . 1 1 49 49 LYS N N 49 121.777 121.777 123.201 -1.424 18135 2178 1 3 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.308 -0.205 18135 2179 1 3 . 1 1 49 49 LYS C C 49 177.968 177.968 176.809 1.159 18135 2180 1 3 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.252 -0.103 18135 2181 1 3 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.217 0.173 18135 2182 1 3 . 1 1 49 49 LYS H H 49 8.426 8.426 8.719 -0.293 18135 2183 1 3 . 1 1 50 50 ALA N N 50 120.573 120.573 120.782 -0.209 18135 2184 1 3 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.352 -0.282 18135 2185 1 3 . 1 1 50 50 ALA C C 50 178.697 178.697 177.696 1.001 18135 2186 1 3 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.219 1.549 18135 2187 1 3 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.847 0.027 18135 2188 1 3 . 1 1 50 50 ALA H H 50 8.578 8.578 7.789 0.789 18135 2189 1 3 . 1 1 51 51 GLU N N 51 115.015 115.015 115.489 -0.474 18135 2190 1 3 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.259 0.007 18135 2191 1 3 . 1 1 51 51 GLU C C 51 176.995 176.995 177.132 -0.137 18135 2192 1 3 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.163 -0.170 18135 2193 1 3 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.094 -1.189 18135 2194 1 3 . 1 1 51 51 GLU H H 51 7.907 7.907 8.208 -0.301 18135 2195 1 3 . 1 1 52 52 THR N N 52 111.210 111.210 114.601 -3.391 18135 2196 1 3 . 1 1 52 52 THR HA H 52 4.114 4.114 4.331 -0.217 18135 2197 1 3 . 1 1 52 52 THR C C 52 175.271 175.271 175.775 -0.504 18135 2198 1 3 . 1 1 52 52 THR CA C 52 63.611 63.611 65.757 -2.146 18135 2199 1 3 . 1 1 52 52 THR CB C 52 69.673 69.673 68.899 0.774 18135 2200 1 3 . 1 1 52 52 THR H H 52 7.863 7.863 7.502 0.361 18135 2201 1 3 . 1 1 53 53 ILE N N 53 119.113 119.113 122.270 -3.157 18135 2202 1 3 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.077 -0.213 18135 2203 1 3 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.998 0.909 18135 2204 1 3 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.263 -1.310 18135 2205 1 3 . 1 1 53 53 ILE H H 53 8.341 8.341 8.147 0.194 18135 2206 1 3 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.362 -0.076 18135 2207 1 3 . 1 1 54 54 PRO C C 54 179.655 179.655 179.011 0.644 18135 2208 1 3 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.183 -0.132 18135 2209 1 3 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.376 0.509 18135 2210 1 3 . 1 1 55 55 VAL N N 55 116.355 116.355 116.125 0.230 18135 2211 1 3 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.842 -0.161 18135 2212 1 3 . 1 1 55 55 VAL C C 55 177.649 177.649 178.094 -0.445 18135 2213 1 3 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.809 0.028 18135 2214 1 3 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.245 0.226 18135 2215 1 3 . 1 1 55 55 VAL H H 55 7.119 7.119 7.386 -0.267 18135 2216 1 3 . 1 1 56 56 LEU N N 56 123.038 123.038 121.461 1.577 18135 2217 1 3 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.075 0.235 18135 2218 1 3 . 1 1 56 56 LEU C C 56 178.637 178.637 177.960 0.677 18135 2219 1 3 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.267 -0.181 18135 2220 1 3 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.505 0.813 18135 2221 1 3 . 1 1 56 56 LEU H H 56 8.535 8.535 8.531 0.004 18135 2222 1 3 . 1 1 57 57 HIS N N 57 117.041 117.041 118.513 -1.472 18135 2223 1 3 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.034 -0.248 18135 2224 1 3 . 1 1 57 57 HIS C C 57 175.640 175.640 177.412 -1.772 18135 2225 1 3 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.742 0.789 18135 2226 1 3 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.131 -1.922 18135 2227 1 3 . 1 1 57 57 HIS H H 57 9.047 9.047 8.134 0.913 18135 2228 1 3 . 1 1 58 58 GLU N N 58 119.521 119.521 118.570 0.951 18135 2229 1 3 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.790 0.217 18135 2230 1 3 . 1 1 58 58 GLU C C 58 179.029 179.029 178.677 0.352 18135 2231 1 3 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.449 -0.482 18135 2232 1 3 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.433 -1.143 18135 2233 1 3 . 1 1 58 58 GLU H H 58 7.860 7.860 8.176 -0.316 18135 2234 1 3 . 1 1 59 59 MET N N 59 119.512 119.512 120.341 -0.829 18135 2235 1 3 . 1 1 59 59 MET HA H 59 4.074 4.074 4.260 -0.186 18135 2236 1 3 . 1 1 59 59 MET C C 59 177.031 177.031 178.810 -1.779 18135 2237 1 3 . 1 1 59 59 MET CA C 59 59.408 59.408 59.528 -0.120 18135 2238 1 3 . 1 1 59 59 MET CB C 59 32.525 32.525 32.919 -0.393 18135 2239 1 3 . 1 1 59 59 MET H H 59 8.442 8.442 8.056 0.386 18135 2240 1 3 . 1 1 60 60 ILE N N 60 117.183 117.183 118.160 -0.977 18135 2241 1 3 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.503 -0.086 18135 2242 1 3 . 1 1 60 60 ILE C C 60 177.524 177.524 178.160 -0.636 18135 2243 1 3 . 1 1 60 60 ILE CA C 60 65.326 65.326 65.034 0.291 18135 2244 1 3 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.252 -0.392 18135 2245 1 3 . 1 1 60 60 ILE H H 60 8.338 8.338 7.761 0.577 18135 2246 1 3 . 1 1 61 61 GLN N N 61 120.191 120.191 119.737 0.454 18135 2247 1 3 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.951 -0.249 18135 2248 1 3 . 1 1 61 61 GLN C C 61 178.270 178.270 177.776 0.494 18135 2249 1 3 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.466 -0.680 18135 2250 1 3 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.274 0.392 18135 2251 1 3 . 1 1 61 61 GLN H H 61 8.234 8.234 8.185 0.049 18135 2252 1 3 . 1 1 62 62 GLN N N 62 116.795 116.795 119.022 -2.227 18135 2253 1 3 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.163 0.464 18135 2254 1 3 . 1 1 62 62 GLN C C 62 179.685 179.685 178.319 1.366 18135 2255 1 3 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.409 -0.401 18135 2256 1 3 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.919 -3.577 18135 2257 1 3 . 1 1 62 62 GLN H H 62 8.421 8.421 8.222 0.199 18135 2258 1 3 . 1 1 63 63 ILE N N 63 122.797 122.797 120.075 2.722 18135 2259 1 3 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.889 -0.240 18135 2260 1 3 . 1 1 63 63 ILE C C 63 177.279 177.279 177.900 -0.621 18135 2261 1 3 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.823 2.142 18135 2262 1 3 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.845 -0.530 18135 2263 1 3 . 1 1 63 63 ILE H H 63 8.164 8.164 7.581 0.583 18135 2264 1 3 . 1 1 64 64 PHE N N 64 120.820 120.820 121.129 -0.309 18135 2265 1 3 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.486 -0.770 18135 2266 1 3 . 1 1 64 64 PHE C C 64 178.402 178.402 176.944 1.458 18135 2267 1 3 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.122 1.030 18135 2268 1 3 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.603 -0.093 18135 2269 1 3 . 1 1 64 64 PHE H H 64 8.405 8.405 7.885 0.520 18135 2270 1 3 . 1 1 65 65 ASN N N 65 119.981 119.981 117.816 2.165 18135 2271 1 3 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.532 0.531 18135 2272 1 3 . 1 1 65 65 ASN C C 65 177.944 177.944 177.313 0.631 18135 2273 1 3 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.825 0.043 18135 2274 1 3 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.113 -0.857 18135 2275 1 3 . 1 1 65 65 ASN H H 65 8.812 8.812 7.715 1.097 18135 2276 1 3 . 1 1 66 66 LEU N N 66 121.533 121.533 120.224 1.309 18135 2277 1 3 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.260 -0.037 18135 2278 1 3 . 1 1 66 66 LEU C C 66 177.777 177.777 178.342 -0.565 18135 2279 1 3 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.462 0.806 18135 2280 1 3 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.260 0.347 18135 2281 1 3 . 1 1 66 66 LEU H H 66 8.177 8.177 7.827 0.350 18135 2282 1 3 . 1 1 67 67 PHE N N 67 110.842 110.842 115.086 -4.244 18135 2283 1 3 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.645 0.235 18135 2284 1 3 . 1 1 67 67 PHE C C 67 177.965 177.965 177.958 0.007 18135 2285 1 3 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.602 0.932 18135 2286 1 3 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.860 -0.244 18135 2287 1 3 . 1 1 67 67 PHE H H 67 8.160 8.160 8.531 -0.371 18135 2288 1 3 . 1 1 68 68 SER N N 68 119.131 119.131 113.962 5.169 18135 2289 1 3 . 1 1 68 68 SER HA H 68 4.580 4.580 4.405 0.175 18135 2290 1 3 . 1 1 68 68 SER C C 68 173.472 173.472 175.224 -1.752 18135 2291 1 3 . 1 1 68 68 SER CA C 68 59.191 59.191 59.028 0.163 18135 2292 1 3 . 1 1 68 68 SER CB C 68 63.123 63.123 63.352 -0.229 18135 2293 1 3 . 1 1 68 68 SER H H 68 8.016 8.016 7.896 0.120 18135 2294 1 3 . 1 1 69 69 THR N N 69 111.353 111.353 115.166 -3.813 18135 2295 1 3 . 1 1 69 69 THR HA H 69 4.345 4.345 4.405 -0.060 18135 2296 1 3 . 1 1 69 69 THR C C 69 175.661 175.661 174.538 1.123 18135 2297 1 3 . 1 1 69 69 THR CA C 69 61.411 61.411 60.525 0.886 18135 2298 1 3 . 1 1 69 69 THR CB C 69 72.209 72.209 70.523 1.686 18135 2299 1 3 . 1 1 69 69 THR H H 69 6.977 6.977 7.342 -0.365 18135 2300 1 3 . 1 1 70 70 LYS N N 70 121.120 121.120 122.983 -1.863 18135 2301 1 3 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.105 -0.016 18135 2302 1 3 . 1 1 70 70 LYS C C 70 179.259 179.259 177.530 1.729 18135 2303 1 3 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.815 -0.859 18135 2304 1 3 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.457 -0.707 18135 2305 1 3 . 1 1 70 70 LYS H H 70 9.065 9.065 8.608 0.457 18135 2306 1 3 . 1 1 71 71 ASP N N 71 116.374 116.374 120.229 -3.855 18135 2307 1 3 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.307 -0.132 18135 2308 1 3 . 1 1 71 71 ASP C C 71 178.372 178.372 177.224 1.148 18135 2309 1 3 . 1 1 71 71 ASP CA C 71 57.067 57.067 56.974 0.093 18135 2310 1 3 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.691 -0.385 18135 2311 1 3 . 1 1 71 71 ASP H H 71 7.518 7.518 7.803 -0.285 18135 2312 1 3 . 1 1 72 72 SER N N 72 117.341 117.341 114.242 3.099 18135 2313 1 3 . 1 1 72 72 SER HA H 72 3.715 3.715 3.211 0.504 18135 2314 1 3 . 1 1 72 72 SER C C 72 176.897 176.897 175.604 1.293 18135 2315 1 3 . 1 1 72 72 SER CA C 72 60.267 60.267 60.447 -0.180 18135 2316 1 3 . 1 1 72 72 SER CB C 72 62.616 62.616 63.235 -0.619 18135 2317 1 3 . 1 1 72 72 SER H H 72 8.066 8.066 7.803 0.263 18135 2318 1 3 . 1 1 73 73 SER N N 73 113.398 113.398 117.039 -3.641 18135 2319 1 3 . 1 1 73 73 SER HA H 73 4.094 4.094 4.135 -0.041 18135 2320 1 3 . 1 1 73 73 SER C C 73 174.855 174.855 175.027 -0.172 18135 2321 1 3 . 1 1 73 73 SER CA C 73 61.385 61.385 60.033 1.352 18135 2322 1 3 . 1 1 73 73 SER CB C 73 62.798 62.798 62.894 -0.096 18135 2323 1 3 . 1 1 73 73 SER H H 73 7.982 7.982 7.541 0.441 18135 2324 1 3 . 1 1 74 74 ALA N N 74 119.486 119.486 120.207 -0.721 18135 2325 1 3 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.256 -0.099 18135 2326 1 3 . 1 1 74 74 ALA C C 74 177.626 177.626 177.357 0.269 18135 2327 1 3 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.230 0.483 18135 2328 1 3 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.897 -0.150 18135 2329 1 3 . 1 1 74 74 ALA H H 74 7.095 7.095 7.405 -0.310 18135 2330 1 3 . 1 1 75 75 ALA N N 75 121.465 121.465 120.130 1.335 18135 2331 1 3 . 1 1 75 75 ALA HA H 75 3.696 3.696 4.017 -0.321 18135 2332 1 3 . 1 1 75 75 ALA C C 75 177.197 177.197 176.129 1.068 18135 2333 1 3 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.553 1.451 18135 2334 1 3 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.307 -1.047 18135 2335 1 3 . 1 1 75 75 ALA H H 75 7.159 7.159 7.107 0.052 18135 2336 1 3 . 1 1 76 76 TRP N N 76 116.791 116.791 117.465 -0.674 18135 2337 1 3 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.756 0.294 18135 2338 1 3 . 1 1 76 76 TRP C C 76 177.617 177.617 175.189 2.428 18135 2339 1 3 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.227 -1.908 18135 2340 1 3 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.978 2.098 18135 2341 1 3 . 1 1 76 76 TRP H H 76 7.080 7.080 7.096 -0.016 18135 2342 1 3 . 1 1 77 77 ASP N N 77 119.928 119.928 121.343 -1.415 18135 2343 1 3 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.551 -0.194 18135 2344 1 3 . 1 1 77 77 ASP C C 77 176.877 176.877 177.653 -0.776 18135 2345 1 3 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.114 -0.296 18135 2346 1 3 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.388 0.227 18135 2347 1 3 . 1 1 77 77 ASP H H 77 8.259 8.259 8.642 -0.383 18135 2348 1 3 . 1 1 78 78 GLU N N 78 127.277 127.277 126.383 0.894 18135 2349 1 3 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.998 -0.113 18135 2350 1 3 . 1 1 78 78 GLU C C 78 177.439 177.439 178.160 -0.721 18135 2351 1 3 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.629 -0.245 18135 2352 1 3 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.490 -0.848 18135 2353 1 3 . 1 1 78 78 GLU H H 78 8.920 8.920 8.932 -0.012 18135 2354 1 3 . 1 1 79 79 THR N N 79 115.422 115.422 117.897 -2.475 18135 2355 1 3 . 1 1 79 79 THR HA H 79 3.907 3.907 4.038 -0.131 18135 2356 1 3 . 1 1 79 79 THR C C 79 177.330 177.330 176.592 0.738 18135 2357 1 3 . 1 1 79 79 THR CA C 79 66.263 66.263 65.705 0.558 18135 2358 1 3 . 1 1 79 79 THR CB C 79 68.002 68.002 68.276 -0.274 18135 2359 1 3 . 1 1 79 79 THR H H 79 8.124 8.124 7.906 0.218 18135 2360 1 3 . 1 1 80 80 LEU N N 80 121.791 121.791 122.229 -0.438 18135 2361 1 3 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.164 -0.277 18135 2362 1 3 . 1 1 80 80 LEU C C 80 179.018 179.018 179.223 -0.205 18135 2363 1 3 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.734 -0.495 18135 2364 1 3 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.169 0.483 18135 2365 1 3 . 1 1 80 80 LEU H H 80 7.725 7.725 8.017 -0.292 18135 2366 1 3 . 1 1 81 81 LEU N N 81 119.280 119.280 120.380 -1.100 18135 2367 1 3 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.112 -0.623 18135 2368 1 3 . 1 1 81 81 LEU C C 81 177.062 177.062 178.511 -1.449 18135 2369 1 3 . 1 1 81 81 LEU CA C 81 57.709 57.709 59.048 -1.339 18135 2370 1 3 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.052 -1.104 18135 2371 1 3 . 1 1 81 81 LEU H H 81 8.344 8.344 8.583 -0.239 18135 2372 1 3 . 1 1 82 82 ASP N N 82 115.357 115.357 119.886 -4.529 18135 2373 1 3 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.377 -0.103 18135 2374 1 3 . 1 1 82 82 ASP C C 82 179.018 179.018 178.516 0.502 18135 2375 1 3 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.839 -1.024 18135 2376 1 3 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.961 -2.740 18135 2377 1 3 . 1 1 82 82 ASP H H 82 8.001 8.001 8.569 -0.568 18135 2378 1 3 . 1 1 83 83 LYS N N 83 119.603 119.603 118.306 1.297 18135 2379 1 3 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.895 0.087 18135 2380 1 3 . 1 1 83 83 LYS C C 83 178.624 178.624 179.058 -0.434 18135 2381 1 3 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.806 0.939 18135 2382 1 3 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.042 1.064 18135 2383 1 3 . 1 1 83 83 LYS H H 83 7.342 7.342 7.757 -0.415 18135 2384 1 3 . 1 1 84 84 PHE N N 84 123.933 123.933 121.970 1.963 18135 2385 1 3 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.015 0.020 18135 2386 1 3 . 1 1 84 84 PHE C C 84 177.210 177.210 176.651 0.559 18135 2387 1 3 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.964 -1.621 18135 2388 1 3 . 1 1 84 84 PHE CB C 84 39.316 39.316 39.022 0.294 18135 2389 1 3 . 1 1 84 84 PHE H H 84 8.471 8.471 8.457 0.014 18135 2390 1 3 . 1 1 85 85 TYR N N 85 118.387 118.387 117.566 0.821 18135 2391 1 3 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.822 0.246 18135 2392 1 3 . 1 1 85 85 TYR C C 85 178.104 178.104 177.281 0.823 18135 2393 1 3 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.614 -1.038 18135 2394 1 3 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.032 -0.055 18135 2395 1 3 . 1 1 85 85 TYR H H 85 9.011 9.011 9.109 -0.098 18135 2396 1 3 . 1 1 86 86 THR N N 86 114.035 114.035 116.348 -2.313 18135 2397 1 3 . 1 1 86 86 THR HA H 86 3.945 3.945 3.297 0.648 18135 2398 1 3 . 1 1 86 86 THR C C 86 176.708 176.708 176.481 0.227 18135 2399 1 3 . 1 1 86 86 THR CA C 86 66.759 66.759 66.258 0.501 18135 2400 1 3 . 1 1 86 86 THR CB C 86 68.853 68.853 67.700 1.153 18135 2401 1 3 . 1 1 86 86 THR H H 86 7.609 7.609 7.408 0.201 18135 2402 1 3 . 1 1 87 87 GLU N N 87 120.790 120.790 121.673 -0.883 18135 2403 1 3 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.957 0.090 18135 2404 1 3 . 1 1 87 87 GLU C C 87 179.606 179.606 178.900 0.706 18135 2405 1 3 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.182 -0.784 18135 2406 1 3 . 1 1 87 87 GLU CB C 87 28.286 28.286 28.967 -0.681 18135 2407 1 3 . 1 1 87 87 GLU H H 87 7.712 7.712 7.625 0.087 18135 2408 1 3 . 1 1 88 88 LEU N N 88 120.729 120.729 120.288 0.441 18135 2409 1 3 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.931 -0.203 18135 2410 1 3 . 1 1 88 88 LEU C C 88 178.695 178.695 179.112 -0.417 18135 2411 1 3 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.329 0.922 18135 2412 1 3 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.206 1.381 18135 2413 1 3 . 1 1 88 88 LEU H H 88 8.393 8.393 7.430 0.963 18135 2414 1 3 . 1 1 89 89 TYR N N 89 118.654 118.654 119.174 -0.520 18135 2415 1 3 . 1 1 89 89 TYR HA H 89 3.931 3.931 3.944 -0.013 18135 2416 1 3 . 1 1 89 89 TYR C C 89 178.438 178.438 178.640 -0.202 18135 2417 1 3 . 1 1 89 89 TYR CA C 89 61.407 61.407 60.975 0.432 18135 2418 1 3 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.301 0.566 18135 2419 1 3 . 1 1 89 89 TYR H H 89 8.637 8.637 8.238 0.399 18135 2420 1 3 . 1 1 90 90 GLN N N 90 118.263 118.263 116.449 1.814 18135 2421 1 3 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.969 0.017 18135 2422 1 3 . 1 1 90 90 GLN C C 90 178.411 178.411 178.717 -0.306 18135 2423 1 3 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.661 0.121 18135 2424 1 3 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.294 -0.147 18135 2425 1 3 . 1 1 90 90 GLN H H 90 7.796 7.796 7.801 -0.005 18135 2426 1 3 . 1 1 91 91 GLN N N 91 117.959 117.959 120.213 -2.254 18135 2427 1 3 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.047 0.035 18135 2428 1 3 . 1 1 91 91 GLN C C 91 178.705 178.705 178.488 0.217 18135 2429 1 3 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.861 -0.041 18135 2430 1 3 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.328 0.845 18135 2431 1 3 . 1 1 91 91 GLN H H 91 7.727 7.727 7.974 -0.247 18135 2432 1 3 . 1 1 92 92 LEU N N 92 119.965 119.965 118.569 1.396 18135 2433 1 3 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.968 -0.234 18135 2434 1 3 . 1 1 92 92 LEU C C 92 178.984 178.984 178.781 0.203 18135 2435 1 3 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.957 -0.465 18135 2436 1 3 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.806 0.573 18135 2437 1 3 . 1 1 92 92 LEU H H 92 8.465 8.465 8.552 -0.087 18135 2438 1 3 . 1 1 93 93 ASN N N 93 117.793 117.793 118.420 -0.627 18135 2439 1 3 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.257 0.144 18135 2440 1 3 . 1 1 93 93 ASN C C 93 178.309 178.309 177.200 1.109 18135 2441 1 3 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.243 0.160 18135 2442 1 3 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.188 0.450 18135 2443 1 3 . 1 1 93 93 ASN H H 93 8.091 8.091 8.077 0.014 18135 2444 1 3 . 1 1 94 94 ASP N N 94 121.133 121.133 120.191 0.942 18135 2445 1 3 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.407 -0.002 18135 2446 1 3 . 1 1 94 94 ASP C C 94 178.328 178.328 178.617 -0.289 18135 2447 1 3 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.011 -0.464 18135 2448 1 3 . 1 1 94 94 ASP CB C 94 38.649 38.649 41.080 -2.431 18135 2449 1 3 . 1 1 94 94 ASP H H 94 8.362 8.362 7.941 0.421 18135 2450 1 3 . 1 1 95 95 LEU N N 95 119.160 119.160 120.783 -1.623 18135 2451 1 3 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.828 0.211 18135 2452 1 3 . 1 1 95 95 LEU C C 95 178.826 178.826 178.449 0.377 18135 2453 1 3 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.340 -1.313 18135 2454 1 3 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.070 0.140 18135 2455 1 3 . 1 1 95 95 LEU H H 95 8.143 8.143 8.504 -0.361 18135 2456 1 3 . 1 1 96 96 GLU N N 96 118.813 118.813 118.763 0.050 18135 2457 1 3 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.737 0.224 18135 2458 1 3 . 1 1 96 96 GLU C C 96 177.640 177.640 178.279 -0.639 18135 2459 1 3 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.465 -1.751 18135 2460 1 3 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.463 -1.325 18135 2461 1 3 . 1 1 96 96 GLU H H 96 8.111 8.111 8.325 -0.214 18135 2462 1 3 . 1 1 97 97 ALA N N 97 120.549 120.549 121.104 -0.555 18135 2463 1 3 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.974 0.148 18135 2464 1 3 . 1 1 97 97 ALA C C 97 179.126 179.126 180.284 -1.158 18135 2465 1 3 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.760 -0.727 18135 2466 1 3 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.869 0.111 18135 2467 1 3 . 1 1 97 97 ALA H H 97 7.798 7.798 7.779 0.019 18135 2468 1 3 . 1 1 98 98 CYS N N 98 115.510 115.510 117.489 -1.979 18135 2469 1 3 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.157 0.293 18135 2470 1 3 . 1 1 98 98 CYS C C 98 175.363 175.363 176.372 -1.009 18135 2471 1 3 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.375 -5.209 18135 2472 1 3 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.135 15.744 18135 2473 1 3 . 1 1 98 98 CYS H H 98 7.597 7.597 7.899 -0.302 18135 2474 1 3 . 1 1 99 99 VAL N N 99 121.713 121.713 119.465 2.248 18135 2475 1 3 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.900 -0.106 18135 2476 1 3 . 1 1 99 99 VAL C C 99 177.357 177.357 177.993 -0.636 18135 2477 1 3 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.624 -1.041 18135 2478 1 3 . 1 1 99 99 VAL CB C 99 32.031 32.031 31.873 0.157 18135 2479 1 3 . 1 1 99 99 VAL H H 99 7.828 7.828 7.517 0.311 18135 2480 1 3 . 1 1 100 100 ILE N N 100 122.333 122.333 119.158 3.175 18135 2481 1 3 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.707 0.217 18135 2482 1 3 . 1 1 100 100 ILE C C 100 176.827 176.827 176.492 0.335 18135 2483 1 3 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.618 -1.381 18135 2484 1 3 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.656 0.622 18135 2485 1 3 . 1 1 100 100 ILE H H 100 8.067 8.067 8.317 -0.250 18135 2486 1 3 . 1 1 101 101 GLN N N 101 121.864 121.864 117.613 4.251 18135 2487 1 3 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.260 -0.034 18135 2488 1 3 . 1 1 101 101 GLN C C 101 176.438 176.438 178.066 -1.628 18135 2489 1 3 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.278 0.042 18135 2490 1 3 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.239 -0.228 18135 2491 1 3 . 1 1 101 101 GLN H H 101 8.062 8.062 7.398 0.664 18135 2492 1 3 . 1 1 102 102 GLY N N 102 109.288 109.288 109.719 -0.431 18135 2493 1 3 . 1 1 102 102 GLY C C 102 173.855 173.855 175.488 -1.633 18135 2494 1 3 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.600 -1.441 18135 2495 1 3 . 1 1 102 102 GLY H H 102 8.087 8.087 8.825 -0.738 18135 2496 1 3 . 1 1 103 103 VAL N N 103 118.932 118.932 119.267 -0.335 18135 2497 1 3 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.796 0.278 18135 2498 1 3 . 1 1 103 103 VAL C C 103 176.299 176.299 176.099 0.200 18135 2499 1 3 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.981 -1.482 18135 2500 1 3 . 1 1 103 103 VAL CB C 103 32.854 32.854 32.002 0.852 18135 2501 1 3 . 1 1 103 103 VAL H H 103 8.079 8.079 7.568 0.511 18135 2502 1 3 . 1 1 104 104 GLY N N 104 112.028 112.028 107.119 4.909 18135 2503 1 3 . 1 1 104 104 GLY C C 104 173.694 173.694 172.731 0.963 18135 2504 1 3 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.109 0.293 18135 2505 1 3 . 1 1 104 104 GLY H H 104 8.446 8.446 7.788 0.658 18135 2506 1 3 . 1 1 105 105 VAL N N 105 120.439 120.439 121.029 -0.590 18135 2507 1 3 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.432 -0.244 18135 2508 1 3 . 1 1 105 105 VAL C C 105 175.963 175.963 173.702 2.261 18135 2509 1 3 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.279 0.857 18135 2510 1 3 . 1 1 105 105 VAL CB C 105 32.814 32.814 33.488 -0.674 18135 2511 1 3 . 1 1 105 105 VAL H H 105 7.867 7.867 7.891 -0.024 18135 2512 1 3 . 1 1 106 106 THR N N 106 116.366 116.366 118.731 -2.365 18135 2513 1 3 . 1 1 106 106 THR HA H 106 4.548 4.548 4.607 -0.059 18135 2514 1 3 . 1 1 106 106 THR C C 106 173.731 173.731 174.100 -0.369 18135 2515 1 3 . 1 1 106 106 THR CA C 106 59.419 59.419 60.787 -1.368 18135 2516 1 3 . 1 1 106 106 THR CB C 106 79.536 79.536 70.785 8.751 18135 2517 1 3 . 1 1 106 106 THR H H 106 8.565 8.565 8.192 0.373 18135 2518 1 3 . 1 1 107 107 GLU N N 107 119.743 119.743 122.176 -2.433 18135 2519 1 3 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.725 -0.263 18135 2520 1 3 . 1 1 107 107 GLU C C 107 175.639 175.639 176.556 -0.917 18135 2521 1 3 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.871 0.840 18135 2522 1 3 . 1 1 107 107 GLU CB C 107 30.499 30.499 32.704 -2.205 18135 2523 1 3 . 1 1 107 107 GLU H H 107 8.410 8.410 8.635 -0.225 18135 2524 1 3 . 1 1 108 108 THR N N 108 114.402 114.402 112.253 2.149 18135 2525 1 3 . 1 1 108 108 THR HA H 108 4.448 4.448 4.722 -0.274 18135 2526 1 3 . 1 1 108 108 THR CA C 108 60.348 60.348 58.716 1.632 18135 2527 1 3 . 1 1 108 108 THR CB C 108 68.544 68.544 68.477 0.067 18135 2528 1 3 . 1 1 108 108 THR H H 108 8.155 8.155 8.343 -0.188 18135 2529 1 3 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.398 -0.160 18135 2530 1 3 . 1 1 109 109 PRO C C 109 178.666 178.666 177.739 0.927 18135 2531 1 3 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.174 1.202 18135 2532 1 3 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.965 -0.117 18135 2533 1 3 . 1 1 110 110 LEU N N 110 118.566 118.566 119.135 -0.569 18135 2534 1 3 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.075 0.041 18135 2535 1 3 . 1 1 110 110 LEU C C 110 178.293 178.293 179.357 -1.064 18135 2536 1 3 . 1 1 110 110 LEU CA C 110 56.686 56.686 58.344 -1.659 18135 2537 1 3 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.583 0.386 18135 2538 1 3 . 1 1 110 110 LEU H H 110 8.016 8.016 7.950 0.066 18135 2539 1 3 . 1 1 111 111 MET N N 111 118.982 118.982 115.876 3.106 18135 2540 1 3 . 1 1 111 111 MET HA H 111 4.210 4.210 4.226 -0.016 18135 2541 1 3 . 1 1 111 111 MET C C 111 178.720 178.720 177.794 0.926 18135 2542 1 3 . 1 1 111 111 MET CA C 111 58.144 58.144 57.435 0.709 18135 2543 1 3 . 1 1 111 111 MET CB C 111 32.374 32.374 32.115 0.259 18135 2544 1 3 . 1 1 111 111 MET H H 111 7.705 7.705 8.216 -0.511 18135 2545 1 3 . 1 1 112 112 LYS N N 112 121.377 121.377 118.990 2.387 18135 2546 1 3 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.085 0.023 18135 2547 1 3 . 1 1 112 112 LYS C C 112 178.000 178.000 178.235 -0.235 18135 2548 1 3 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.836 -2.531 18135 2549 1 3 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.199 0.168 18135 2550 1 3 . 1 1 112 112 LYS H H 112 8.257 8.257 7.739 0.518 18135 2551 1 3 . 1 1 113 113 GLU N N 113 119.104 119.104 118.777 0.327 18135 2552 1 3 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.037 0.029 18135 2553 1 3 . 1 1 113 113 GLU C C 113 178.289 178.289 178.753 -0.464 18135 2554 1 3 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.167 -0.914 18135 2555 1 3 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.078 -0.940 18135 2556 1 3 . 1 1 113 113 GLU H H 113 8.270 8.270 7.695 0.575 18135 2557 1 3 . 1 1 114 114 ASP N N 114 119.224 119.224 119.887 -0.663 18135 2558 1 3 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.561 -0.273 18135 2559 1 3 . 1 1 114 114 ASP C C 114 178.365 178.365 178.164 0.201 18135 2560 1 3 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.190 -1.081 18135 2561 1 3 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.925 -2.690 18135 2562 1 3 . 1 1 114 114 ASP H H 114 8.618 8.618 7.660 0.958 18135 2563 1 3 . 1 1 115 115 SER N N 115 118.195 118.195 116.772 1.423 18135 2564 1 3 . 1 1 115 115 SER HA H 115 4.200 4.200 4.079 0.121 18135 2565 1 3 . 1 1 115 115 SER C C 115 175.986 175.986 176.464 -0.478 18135 2566 1 3 . 1 1 115 115 SER CA C 115 61.588 61.588 62.076 -0.488 18135 2567 1 3 . 1 1 115 115 SER CB C 115 62.653 62.653 63.228 -0.575 18135 2568 1 3 . 1 1 115 115 SER H H 115 8.181 8.181 7.574 0.607 18135 2569 1 3 . 1 1 116 116 ILE N N 116 123.340 123.340 120.477 2.863 18135 2570 1 3 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.863 -0.237 18135 2571 1 3 . 1 1 116 116 ILE C C 116 178.367 178.367 178.121 0.246 18135 2572 1 3 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.870 0.947 18135 2573 1 3 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.966 0.452 18135 2574 1 3 . 1 1 116 116 ILE H H 116 7.773 7.773 8.373 -0.600 18135 2575 1 3 . 1 1 117 117 LEU N N 117 120.968 120.968 121.369 -0.401 18135 2576 1 3 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.906 -0.001 18135 2577 1 3 . 1 1 117 117 LEU C C 117 178.746 178.746 178.287 0.459 18135 2578 1 3 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.341 -0.198 18135 2579 1 3 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.582 0.004 18135 2580 1 3 . 1 1 117 117 LEU H H 117 8.406 8.406 7.355 1.051 18135 2581 1 3 . 1 1 118 118 ALA N N 118 120.150 120.150 122.144 -1.994 18135 2582 1 3 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.667 0.445 18135 2583 1 3 . 1 1 118 118 ALA C C 118 181.633 181.633 178.668 2.965 18135 2584 1 3 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.125 0.188 18135 2585 1 3 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.436 -0.326 18135 2586 1 3 . 1 1 118 118 ALA H H 118 7.894 7.894 8.229 -0.335 18135 2587 1 3 . 1 1 119 119 VAL N N 119 118.873 118.873 115.808 3.065 18135 2588 1 3 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.305 0.450 18135 2589 1 3 . 1 1 119 119 VAL C C 119 177.896 177.896 177.592 0.304 18135 2590 1 3 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.081 1.100 18135 2591 1 3 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.110 0.784 18135 2592 1 3 . 1 1 119 119 VAL H H 119 7.572 7.572 7.758 -0.186 18135 2593 1 3 . 1 1 120 120 ARG N N 120 121.436 121.436 120.076 1.360 18135 2594 1 3 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.048 -0.021 18135 2595 1 3 . 1 1 120 120 ARG C C 120 179.848 179.848 178.844 1.004 18135 2596 1 3 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.928 1.339 18135 2597 1 3 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.951 -0.256 18135 2598 1 3 . 1 1 120 120 ARG H H 120 8.629 8.629 8.098 0.531 18135 2599 1 3 . 1 1 121 121 LYS N N 121 119.589 119.589 119.656 -0.067 18135 2600 1 3 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.965 0.109 18135 2601 1 3 . 1 1 121 121 LYS C C 121 178.331 178.331 179.545 -1.214 18135 2602 1 3 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.931 0.509 18135 2603 1 3 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.352 -0.245 18135 2604 1 3 . 1 1 121 121 LYS H H 121 9.015 9.015 8.021 0.994 18135 2605 1 3 . 1 1 122 122 TYR N N 122 121.546 121.546 118.953 2.593 18135 2606 1 3 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.222 0.110 18135 2607 1 3 . 1 1 122 122 TYR C C 122 176.527 176.527 177.995 -1.468 18135 2608 1 3 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.690 1.714 18135 2609 1 3 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.196 0.529 18135 2610 1 3 . 1 1 122 122 TYR H H 122 7.473 7.473 7.748 -0.276 18135 2611 1 3 . 1 1 123 123 PHE N N 123 116.026 116.026 120.170 -4.144 18135 2612 1 3 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.971 -0.231 18135 2613 1 3 . 1 1 123 123 PHE C C 123 179.005 179.005 177.519 1.486 18135 2614 1 3 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.441 3.087 18135 2615 1 3 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.794 0.537 18135 2616 1 3 . 1 1 123 123 PHE H H 123 7.932 7.932 8.352 -0.420 18135 2617 1 3 . 1 1 124 124 GLN N N 124 123.043 123.043 118.650 4.393 18135 2618 1 3 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.391 0.788 18135 2619 1 3 . 1 1 124 124 GLN C C 124 178.772 178.772 178.209 0.563 18135 2620 1 3 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.085 0.231 18135 2621 1 3 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.169 -0.538 18135 2622 1 3 . 1 1 124 124 GLN H H 124 8.470 8.470 8.428 0.042 18135 2623 1 3 . 1 1 125 125 ARG N N 125 120.342 120.342 119.371 0.971 18135 2624 1 3 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.120 -0.042 18135 2625 1 3 . 1 1 125 125 ARG C C 125 180.340 180.340 179.431 0.909 18135 2626 1 3 . 1 1 125 125 ARG CA C 125 61.297 61.297 59.424 1.873 18135 2627 1 3 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.241 0.084 18135 2628 1 3 . 1 1 125 125 ARG H H 125 8.137 8.137 7.998 0.139 18135 2629 1 3 . 1 1 126 126 ILE N N 126 121.876 121.876 121.094 0.782 18135 2630 1 3 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.814 -0.463 18135 2631 1 3 . 1 1 126 126 ILE C C 126 176.857 176.857 177.907 -1.050 18135 2632 1 3 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.817 1.016 18135 2633 1 3 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.930 0.354 18135 2634 1 3 . 1 1 126 126 ILE H H 126 7.526 7.526 8.362 -0.836 18135 2635 1 3 . 1 1 127 127 THR N N 127 115.613 115.613 115.088 0.525 18135 2636 1 3 . 1 1 127 127 THR HA H 127 3.633 3.633 3.863 -0.230 18135 2637 1 3 . 1 1 127 127 THR C C 127 176.645 176.645 176.944 -0.299 18135 2638 1 3 . 1 1 127 127 THR CA C 127 67.294 67.294 66.384 0.910 18135 2639 1 3 . 1 1 127 127 THR CB C 127 68.871 68.871 68.769 0.102 18135 2640 1 3 . 1 1 127 127 THR H H 127 8.288 8.288 8.087 0.201 18135 2641 1 3 . 1 1 128 128 LEU N N 128 122.627 122.627 122.011 0.616 18135 2642 1 3 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.868 0.088 18135 2643 1 3 . 1 1 128 128 LEU C C 128 178.331 178.331 177.752 0.579 18135 2644 1 3 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.965 0.123 18135 2645 1 3 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.710 -0.136 18135 2646 1 3 . 1 1 128 128 LEU H H 128 8.263 8.263 8.084 0.179 18135 2647 1 3 . 1 1 129 129 TYR N N 129 120.955 120.955 120.377 0.578 18135 2648 1 3 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.066 -0.176 18135 2649 1 3 . 1 1 129 129 TYR C C 129 176.040 176.040 177.736 -1.696 18135 2650 1 3 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.257 0.236 18135 2651 1 3 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.309 0.616 18135 2652 1 3 . 1 1 129 129 TYR H H 129 7.518 7.518 8.332 -0.814 18135 2653 1 3 . 1 1 130 130 LEU N N 130 119.155 119.155 116.187 2.968 18135 2654 1 3 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.329 -0.484 18135 2655 1 3 . 1 1 130 130 LEU C C 130 177.948 177.948 178.327 -0.379 18135 2656 1 3 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.811 0.302 18135 2657 1 3 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.508 1.078 18135 2658 1 3 . 1 1 130 130 LEU H H 130 7.717 7.717 7.968 -0.251 18135 2659 1 3 . 1 1 131 131 LYS N N 131 116.832 116.832 120.090 -3.258 18135 2660 1 3 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.815 -0.407 18135 2661 1 3 . 1 1 131 131 LYS C C 131 181.265 181.265 179.723 1.542 18135 2662 1 3 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.720 0.011 18135 2663 1 3 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.000 0.672 18135 2664 1 3 . 1 1 131 131 LYS H H 131 7.493 7.493 7.902 -0.409 18135 2665 1 3 . 1 1 132 132 GLU N N 132 121.918 121.918 119.743 2.175 18135 2666 1 3 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.090 -0.246 18135 2667 1 3 . 1 1 132 132 GLU C C 132 178.377 178.377 178.082 0.295 18135 2668 1 3 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.625 0.262 18135 2669 1 3 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.610 -0.943 18135 2670 1 3 . 1 1 132 132 GLU H H 132 8.430 8.430 8.051 0.379 18135 2671 1 3 . 1 1 133 133 LYS N N 133 116.079 116.079 116.121 -0.042 18135 2672 1 3 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.259 -0.293 18135 2673 1 3 . 1 1 133 133 LYS C C 133 175.282 175.282 175.478 -0.196 18135 2674 1 3 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.827 -0.529 18135 2675 1 3 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.867 0.131 18135 2676 1 3 . 1 1 133 133 LYS H H 133 7.390 7.390 7.297 0.093 18135 2677 1 3 . 1 1 134 134 LYS N N 134 117.759 117.759 115.857 1.902 18135 2678 1 3 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.054 -0.472 18135 2679 1 3 . 1 1 134 134 LYS C C 134 176.271 176.271 175.990 0.281 18135 2680 1 3 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.829 0.479 18135 2681 1 3 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.107 -0.305 18135 2682 1 3 . 1 1 134 134 LYS H H 134 7.716 7.716 7.505 0.211 18135 2683 1 3 . 1 1 135 135 TYR N N 135 110.598 110.598 113.436 -2.838 18135 2684 1 3 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.871 -0.994 18135 2685 1 3 . 1 1 135 135 TYR C C 135 174.148 174.148 175.302 -1.154 18135 2686 1 3 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.161 0.554 18135 2687 1 3 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.253 -0.547 18135 2688 1 3 . 1 1 135 135 TYR H H 135 8.428 8.428 8.782 -0.354 18135 2689 1 3 . 1 1 136 136 SER N N 136 113.712 113.712 115.506 -1.794 18135 2690 1 3 . 1 1 136 136 SER HA H 136 4.553 4.553 4.393 0.160 18135 2691 1 3 . 1 1 136 136 SER CA C 136 57.108 57.108 58.740 -1.632 18135 2692 1 3 . 1 1 136 136 SER CB C 136 62.500 62.500 64.013 -1.513 18135 2693 1 3 . 1 1 136 136 SER H H 136 6.744 6.744 7.385 -0.641 18135 2694 1 3 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.440 -0.275 18135 2695 1 3 . 1 1 137 137 PRO C C 137 180.675 180.675 177.400 3.275 18135 2696 1 3 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.805 0.852 18135 2697 1 3 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.706 0.277 18135 2698 1 3 . 1 1 138 138 CYS N N 138 113.914 113.914 115.879 -1.965 18135 2699 1 3 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.636 0.034 18135 2700 1 3 . 1 1 138 138 CYS C C 138 176.015 176.015 176.140 -0.125 18135 2701 1 3 . 1 1 138 138 CYS CA C 138 57.095 57.095 59.657 -2.562 18135 2702 1 3 . 1 1 138 138 CYS CB C 138 36.779 36.779 25.969 10.810 18135 2703 1 3 . 1 1 138 138 CYS H H 138 8.580 8.580 8.448 0.132 18135 2704 1 3 . 1 1 139 139 ALA N N 139 125.290 125.290 124.641 0.649 18135 2705 1 3 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.177 0.272 18135 2706 1 3 . 1 1 139 139 ALA C C 139 180.149 180.149 179.218 0.931 18135 2707 1 3 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.915 -0.137 18135 2708 1 3 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.057 0.861 18135 2709 1 3 . 1 1 139 139 ALA H H 139 8.087 8.087 8.025 0.062 18135 2710 1 3 . 1 1 140 140 TRP N N 140 116.599 116.599 118.555 -1.956 18135 2711 1 3 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.311 0.291 18135 2712 1 3 . 1 1 140 140 TRP C C 140 179.137 179.137 178.600 0.537 18135 2713 1 3 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.262 -0.728 18135 2714 1 3 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.448 -0.190 18135 2715 1 3 . 1 1 140 140 TRP H H 140 8.505 8.505 7.821 0.684 18135 2716 1 3 . 1 1 141 141 GLU N N 141 121.578 121.578 119.875 1.703 18135 2717 1 3 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.282 0.941 18135 2718 1 3 . 1 1 141 141 GLU C C 141 177.886 177.886 178.983 -1.097 18135 2719 1 3 . 1 1 141 141 GLU CA C 141 57.907 57.907 60.013 -2.106 18135 2720 1 3 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.530 -0.813 18135 2721 1 3 . 1 1 141 141 GLU H H 141 8.182 8.182 8.053 0.129 18135 2722 1 3 . 1 1 142 142 VAL N N 142 121.202 121.202 119.982 1.220 18135 2723 1 3 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.723 -0.093 18135 2724 1 3 . 1 1 142 142 VAL C C 142 180.246 180.246 178.308 1.938 18135 2725 1 3 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.775 0.208 18135 2726 1 3 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.070 0.752 18135 2727 1 3 . 1 1 142 142 VAL H H 142 8.623 8.623 8.140 0.483 18135 2728 1 3 . 1 1 143 143 VAL N N 143 120.119 120.119 119.992 0.127 18135 2729 1 3 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.778 -0.481 18135 2730 1 3 . 1 1 143 143 VAL C C 143 176.407 176.407 178.660 -2.253 18135 2731 1 3 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.824 1.154 18135 2732 1 3 . 1 1 143 143 VAL CB C 143 31.655 31.655 30.999 0.656 18135 2733 1 3 . 1 1 143 143 VAL H H 143 8.323 8.323 8.732 -0.409 18135 2734 1 3 . 1 1 144 144 ARG N N 144 124.102 124.102 119.345 4.757 18135 2735 1 3 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.089 -0.392 18135 2736 1 3 . 1 1 144 144 ARG C C 144 178.127 178.127 178.510 -0.383 18135 2737 1 3 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.074 1.927 18135 2738 1 3 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.469 0.467 18135 2739 1 3 . 1 1 144 144 ARG H H 144 9.619 9.619 8.410 1.209 18135 2740 1 3 . 1 1 145 145 ALA N N 145 119.431 119.431 121.831 -2.400 18135 2741 1 3 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.060 -0.209 18135 2742 1 3 . 1 1 145 145 ALA C C 145 180.763 180.763 179.881 0.882 18135 2743 1 3 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.410 -0.035 18135 2744 1 3 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.052 0.133 18135 2745 1 3 . 1 1 145 145 ALA H H 145 8.867 8.867 8.352 0.515 18135 2746 1 3 . 1 1 146 146 GLU N N 146 121.815 121.815 119.028 2.787 18135 2747 1 3 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.221 -0.010 18135 2748 1 3 . 1 1 146 146 GLU C C 146 177.296 177.296 179.096 -1.800 18135 2749 1 3 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.239 -0.859 18135 2750 1 3 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.632 -1.498 18135 2751 1 3 . 1 1 146 146 GLU H H 146 8.136 8.136 8.004 0.132 18135 2752 1 3 . 1 1 147 147 ILE N N 147 119.542 119.542 120.393 -0.851 18135 2753 1 3 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.710 0.260 18135 2754 1 3 . 1 1 147 147 ILE C C 147 178.283 178.283 177.972 0.311 18135 2755 1 3 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.813 -3.560 18135 2756 1 3 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.572 -2.233 18135 2757 1 3 . 1 1 147 147 ILE H H 147 8.736 8.736 8.079 0.657 18135 2758 1 3 . 1 1 148 148 MET N N 148 119.501 119.501 118.856 0.645 18135 2759 1 3 . 1 1 148 148 MET HA H 148 3.801 3.801 4.192 -0.391 18135 2760 1 3 . 1 1 148 148 MET C C 148 178.210 178.210 178.603 -0.393 18135 2761 1 3 . 1 1 148 148 MET CA C 148 60.184 60.184 59.849 0.335 18135 2762 1 3 . 1 1 148 148 MET CB C 148 32.914 32.914 31.998 0.916 18135 2763 1 3 . 1 1 148 148 MET H H 148 8.440 8.440 8.329 0.111 18135 2764 1 3 . 1 1 149 149 ARG N N 149 119.734 119.734 119.548 0.186 18135 2765 1 3 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.108 -0.193 18135 2766 1 3 . 1 1 149 149 ARG C C 149 178.978 178.978 179.264 -0.286 18135 2767 1 3 . 1 1 149 149 ARG CA C 149 59.863 59.863 58.690 1.173 18135 2768 1 3 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.324 0.956 18135 2769 1 3 . 1 1 149 149 ARG H H 149 7.648 7.648 8.411 -0.763 18135 2770 1 3 . 1 1 150 150 SER N N 150 118.109 118.109 114.546 3.563 18135 2771 1 3 . 1 1 150 150 SER HA H 150 3.339 3.339 3.799 -0.460 18135 2772 1 3 . 1 1 150 150 SER C C 150 177.292 177.292 176.182 1.110 18135 2773 1 3 . 1 1 150 150 SER CA C 150 61.316 61.316 60.721 0.595 18135 2774 1 3 . 1 1 150 150 SER CB C 150 60.288 60.288 62.120 -1.832 18135 2775 1 3 . 1 1 150 150 SER H H 150 9.194 9.194 8.377 0.817 18135 2776 1 3 . 1 1 151 151 PHE N N 151 125.265 125.265 123.598 1.667 18135 2777 1 3 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.318 -0.282 18135 2778 1 3 . 1 1 151 151 PHE C C 151 178.696 178.696 177.404 1.292 18135 2779 1 3 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.617 1.803 18135 2780 1 3 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.619 0.267 18135 2781 1 3 . 1 1 151 151 PHE H H 151 9.455 9.455 8.189 1.266 18135 2782 1 3 . 1 1 152 152 SER N N 152 115.963 115.963 115.735 0.228 18135 2783 1 3 . 1 1 152 152 SER HA H 152 3.880 3.880 3.682 0.198 18135 2784 1 3 . 1 1 152 152 SER C C 152 175.858 175.858 176.710 -0.852 18135 2785 1 3 . 1 1 152 152 SER CA C 152 62.388 62.388 61.033 1.355 18135 2786 1 3 . 1 1 152 152 SER CB C 152 62.519 62.519 63.188 -0.669 18135 2787 1 3 . 1 1 152 152 SER H H 152 7.839 7.839 8.511 -0.672 18135 2788 1 3 . 1 1 153 153 LEU N N 153 121.365 121.365 122.553 -1.188 18135 2789 1 3 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.098 -0.017 18135 2790 1 3 . 1 1 153 153 LEU C C 153 179.515 179.515 179.138 0.377 18135 2791 1 3 . 1 1 153 153 LEU CA C 153 57.883 57.883 58.049 -0.166 18135 2792 1 3 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.930 0.412 18135 2793 1 3 . 1 1 153 153 LEU H H 153 7.775 7.775 8.161 -0.386 18135 2794 1 3 . 1 1 154 154 SER N N 154 113.950 113.950 113.532 0.418 18135 2795 1 3 . 1 1 154 154 SER HA H 154 3.781 3.781 4.456 -0.675 18135 2796 1 3 . 1 1 154 154 SER C C 154 174.312 174.312 176.413 -2.101 18135 2797 1 3 . 1 1 154 154 SER CA C 154 61.366 61.366 61.427 -0.061 18135 2798 1 3 . 1 1 154 154 SER CB C 154 63.242 63.242 63.396 -0.154 18135 2799 1 3 . 1 1 154 154 SER H H 154 7.874 7.874 8.447 -0.573 18135 2800 1 3 . 1 1 155 155 THR N N 155 109.346 109.346 109.865 -0.519 18135 2801 1 3 . 1 1 155 155 THR HA H 155 4.060 4.060 4.379 -0.319 18135 2802 1 3 . 1 1 155 155 THR C C 155 174.798 174.798 175.871 -1.073 18135 2803 1 3 . 1 1 155 155 THR CA C 155 62.275 62.275 64.655 -2.380 18135 2804 1 3 . 1 1 155 155 THR CB C 155 69.342 69.342 69.009 0.333 18135 2805 1 3 . 1 1 155 155 THR H H 155 7.176 7.176 7.961 -0.785 18135 2806 1 3 . 1 1 156 156 ASN N N 156 119.785 119.785 121.014 -1.229 18135 2807 1 3 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.822 -0.295 18135 2808 1 3 . 1 1 156 156 ASN C C 156 175.528 175.528 175.210 0.318 18135 2809 1 3 . 1 1 156 156 ASN CA C 156 53.937 53.937 51.951 1.986 18135 2810 1 3 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.915 0.423 18135 2811 1 3 . 1 1 156 156 ASN H H 156 7.749 7.749 7.919 -0.170 18135 2812 1 3 . 1 1 157 157 LEU N N 157 120.552 120.552 120.861 -0.309 18135 2813 1 3 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.345 -0.090 18135 2814 1 3 . 1 1 157 157 LEU C C 157 174.702 174.702 178.088 -3.386 18135 2815 1 3 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.506 -0.832 18135 2816 1 3 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.110 0.241 18135 2817 1 3 . 1 1 157 157 LEU H H 157 8.097 8.097 7.450 0.647 18135 2818 1 3 . 1 1 158 158 GLN N N 158 119.860 119.860 116.594 3.266 18135 2819 1 3 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.392 -0.212 18135 2820 1 3 . 1 1 158 158 GLN C C 158 176.434 176.434 175.855 0.579 18135 2821 1 3 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.851 1.046 18135 2822 1 3 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.926 -0.916 18135 2823 1 3 . 1 1 158 158 GLN H H 158 8.230 8.230 8.217 0.013 18135 2824 1 3 . 1 1 159 159 GLU N N 159 120.461 120.461 118.718 1.743 18135 2825 1 3 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.141 0.078 18135 2826 1 3 . 1 1 159 159 GLU C C 159 175.251 175.251 175.329 -0.078 18135 2827 1 3 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.073 -0.378 18135 2828 1 3 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.783 0.198 18135 2829 1 3 . 1 1 159 159 GLU H H 159 8.300 8.300 8.732 -0.432 18135 2830 1 3 . 1 1 160 160 SER N N 160 115.719 115.719 112.941 2.778 18135 2831 1 3 . 1 1 160 160 SER HA H 160 4.372 4.372 4.682 -0.310 18135 2832 1 3 . 1 1 160 160 SER C C 160 174.188 174.188 175.400 -1.212 18135 2833 1 3 . 1 1 160 160 SER CA C 160 58.481 58.481 58.337 0.144 18135 2834 1 3 . 1 1 160 160 SER CB C 160 63.731 63.731 63.469 0.262 18135 2835 1 3 . 1 1 160 160 SER H H 160 8.113 8.113 8.497 -0.384 18135 2836 1 3 . 1 1 161 161 LEU N N 161 123.794 123.794 121.649 2.145 18135 2837 1 3 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.175 0.105 18135 2838 1 3 . 1 1 161 161 LEU C C 161 177.293 177.293 176.663 0.630 18135 2839 1 3 . 1 1 161 161 LEU CA C 161 55.190 55.190 56.877 -1.687 18135 2840 1 3 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.394 -0.110 18135 2841 1 3 . 1 1 161 161 LEU H H 161 8.032 8.032 7.984 0.048 18135 2842 1 3 . 1 1 162 162 ARG N N 162 120.715 120.715 118.702 2.013 18135 2843 1 3 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.566 -0.397 18135 2844 1 3 . 1 1 162 162 ARG C C 162 176.288 176.288 175.439 0.849 18135 2845 1 3 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.213 1.833 18135 2846 1 3 . 1 1 162 162 ARG CB C 162 30.935 30.935 31.691 -0.756 18135 2847 1 3 . 1 1 162 162 ARG H H 162 8.094 8.094 8.196 -0.102 18135 2848 1 3 . 1 1 163 163 SER N N 163 116.670 116.670 117.069 -0.399 18135 2849 1 3 . 1 1 163 163 SER HA H 163 4.372 4.372 4.412 -0.040 18135 2850 1 3 . 1 1 163 163 SER C C 163 174.184 174.184 174.904 -0.720 18135 2851 1 3 . 1 1 163 163 SER CA C 163 58.481 58.481 58.825 -0.344 18135 2852 1 3 . 1 1 163 163 SER CB C 163 63.745 63.745 63.622 0.123 18135 2853 1 3 . 1 1 163 163 SER H H 163 8.191 8.191 8.360 -0.169 18135 2854 1 3 . 1 1 164 164 LYS N N 164 123.100 123.100 121.094 2.006 18135 2855 1 3 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.530 -0.253 18135 2856 1 3 . 1 1 164 164 LYS C C 164 175.617 175.617 176.201 -0.584 18135 2857 1 3 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.549 -0.236 18135 2858 1 3 . 1 1 164 164 LYS CB C 164 32.965 32.965 33.003 -0.038 18135 2859 1 3 . 1 1 164 164 LYS H H 164 8.251 8.251 8.484 -0.233 18135 2860 1 4 . 1 1 2 2 ASP N N 2 125.691 125.691 120.017 5.674 18135 2861 1 4 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.565 0.145 18135 2862 1 4 . 1 1 2 2 ASP C C 2 174.758 174.758 175.909 -1.151 18135 2863 1 4 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.520 -1.677 18135 2864 1 4 . 1 1 2 2 ASP CB C 2 39.321 39.321 40.701 -1.380 18135 2865 1 4 . 1 1 2 2 ASP H H 2 8.773 8.773 8.510 0.263 18135 2866 1 4 . 1 1 3 3 LEU N N 3 123.957 123.957 118.073 5.884 18135 2867 1 4 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.342 0.059 18135 2868 1 4 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.361 0.292 18135 2869 1 4 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.165 0.390 18135 2870 1 4 . 1 1 3 3 LEU H H 3 8.164 8.164 7.412 0.752 18135 2871 1 4 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.449 -0.135 18135 2872 1 4 . 1 1 4 4 PRO C C 4 176.213 176.213 176.257 -0.044 18135 2873 1 4 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.147 0.761 18135 2874 1 4 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.363 1.531 18135 2875 1 4 . 1 1 5 5 GLN N N 5 121.621 121.621 121.883 -0.262 18135 2876 1 4 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.143 0.083 18135 2877 1 4 . 1 1 5 5 GLN C C 5 176.995 176.995 176.756 0.239 18135 2878 1 4 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.329 -1.619 18135 2879 1 4 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.129 -0.178 18135 2880 1 4 . 1 1 5 5 GLN H H 5 8.767 8.767 8.720 0.047 18135 2881 1 4 . 1 1 6 6 THR N N 6 111.419 111.419 111.099 0.320 18135 2882 1 4 . 1 1 6 6 THR HA H 6 4.135 4.135 4.458 -0.323 18135 2883 1 4 . 1 1 6 6 THR C C 6 174.695 174.695 175.352 -0.657 18135 2884 1 4 . 1 1 6 6 THR CA C 6 62.661 62.661 63.764 -1.103 18135 2885 1 4 . 1 1 6 6 THR CB C 6 69.365 69.365 68.945 0.420 18135 2886 1 4 . 1 1 6 6 THR H H 6 7.865 7.865 8.573 -0.708 18135 2887 1 4 . 1 1 7 7 HIS N N 7 119.137 119.137 119.698 -0.561 18135 2888 1 4 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.648 -0.063 18135 2889 1 4 . 1 1 7 7 HIS C C 7 174.980 174.980 175.179 -0.199 18135 2890 1 4 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.044 -2.040 18135 2891 1 4 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.967 -1.804 18135 2892 1 4 . 1 1 7 7 HIS H H 7 8.567 8.567 8.553 0.014 18135 2893 1 4 . 1 1 8 8 SER N N 8 115.796 115.796 113.106 2.690 18135 2894 1 4 . 1 1 8 8 SER HA H 8 4.363 4.363 4.375 -0.012 18135 2895 1 4 . 1 1 8 8 SER C C 8 175.312 175.312 175.054 0.258 18135 2896 1 4 . 1 1 8 8 SER CA C 8 58.969 58.969 60.467 -1.498 18135 2897 1 4 . 1 1 8 8 SER CB C 8 63.439 63.439 64.468 -1.029 18135 2898 1 4 . 1 1 8 8 SER H H 8 8.180 8.180 7.930 0.250 18135 2899 1 4 . 1 1 9 9 LEU N N 9 123.844 123.844 118.529 5.315 18135 2900 1 4 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.524 -0.369 18135 2901 1 4 . 1 1 9 9 LEU C C 9 178.568 178.568 178.385 0.183 18135 2902 1 4 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.847 0.119 18135 2903 1 4 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.146 -0.350 18135 2904 1 4 . 1 1 9 9 LEU H H 9 8.404 8.404 7.587 0.817 18135 2905 1 4 . 1 1 10 10 GLY N N 10 107.582 107.582 107.793 -0.211 18135 2906 1 4 . 1 1 10 10 GLY C C 10 174.586 174.586 175.199 -0.613 18135 2907 1 4 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.374 -0.469 18135 2908 1 4 . 1 1 10 10 GLY H H 10 8.438 8.438 8.581 -0.143 18135 2909 1 4 . 1 1 11 11 SER N N 11 118.806 118.806 117.636 1.170 18135 2910 1 4 . 1 1 11 11 SER HA H 11 4.156 4.156 4.072 0.084 18135 2911 1 4 . 1 1 11 11 SER C C 11 175.749 175.749 176.251 -0.502 18135 2912 1 4 . 1 1 11 11 SER CA C 11 61.299 61.299 61.927 -0.628 18135 2913 1 4 . 1 1 11 11 SER CB C 11 62.653 62.653 62.593 0.060 18135 2914 1 4 . 1 1 11 11 SER H H 11 8.249 8.249 8.195 0.054 18135 2915 1 4 . 1 1 12 12 ARG N N 12 121.986 121.986 122.361 -0.375 18135 2916 1 4 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.134 -0.180 18135 2917 1 4 . 1 1 12 12 ARG C C 12 178.283 178.283 178.346 -0.063 18135 2918 1 4 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.372 1.458 18135 2919 1 4 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.102 -0.518 18135 2920 1 4 . 1 1 12 12 ARG H H 12 8.027 8.027 8.164 -0.137 18135 2921 1 4 . 1 1 13 13 ARG N N 13 119.432 119.432 118.897 0.535 18135 2922 1 4 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.068 -0.229 18135 2923 1 4 . 1 1 13 13 ARG C C 13 178.480 178.480 178.642 -0.162 18135 2924 1 4 . 1 1 13 13 ARG CA C 13 60.491 60.491 60.093 0.398 18135 2925 1 4 . 1 1 13 13 ARG CB C 13 30.082 30.082 30.035 0.047 18135 2926 1 4 . 1 1 13 13 ARG H H 13 8.437 8.437 7.922 0.515 18135 2927 1 4 . 1 1 14 14 THR N N 14 116.879 116.879 117.006 -0.127 18135 2928 1 4 . 1 1 14 14 THR HA H 14 3.532 3.532 4.163 -0.631 18135 2929 1 4 . 1 1 14 14 THR C C 14 175.584 175.584 176.800 -1.216 18135 2930 1 4 . 1 1 14 14 THR CA C 14 68.036 68.036 67.192 0.844 18135 2931 1 4 . 1 1 14 14 THR CB C 14 67.969 67.969 68.619 -0.650 18135 2932 1 4 . 1 1 14 14 THR H H 14 7.957 7.957 8.204 -0.247 18135 2933 1 4 . 1 1 15 15 LEU N N 15 120.252 120.252 121.860 -1.608 18135 2934 1 4 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.973 -0.027 18135 2935 1 4 . 1 1 15 15 LEU C C 15 178.652 178.652 178.946 -0.294 18135 2936 1 4 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.350 -0.262 18135 2937 1 4 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.782 -0.228 18135 2938 1 4 . 1 1 15 15 LEU H H 15 7.550 7.550 8.165 -0.615 18135 2939 1 4 . 1 1 16 16 MET N N 16 118.788 118.788 117.311 1.477 18135 2940 1 4 . 1 1 16 16 MET HA H 16 4.023 4.023 4.038 -0.015 18135 2941 1 4 . 1 1 16 16 MET C C 16 178.718 178.718 178.899 -0.181 18135 2942 1 4 . 1 1 16 16 MET CA C 16 58.513 58.513 58.133 0.381 18135 2943 1 4 . 1 1 16 16 MET CB C 16 32.150 32.150 31.371 0.779 18135 2944 1 4 . 1 1 16 16 MET H H 16 7.985 7.985 8.314 -0.329 18135 2945 1 4 . 1 1 17 17 LEU N N 17 120.644 120.644 119.617 1.027 18135 2946 1 4 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.998 -0.026 18135 2947 1 4 . 1 1 17 17 LEU C C 17 178.238 178.238 179.514 -1.276 18135 2948 1 4 . 1 1 17 17 LEU CA C 17 57.727 57.727 57.911 -0.184 18135 2949 1 4 . 1 1 17 17 LEU CB C 17 42.135 42.135 40.645 1.490 18135 2950 1 4 . 1 1 17 17 LEU H H 17 7.829 7.829 8.203 -0.374 18135 2951 1 4 . 1 1 18 18 LEU N N 18 118.280 118.280 118.968 -0.688 18135 2952 1 4 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.743 -0.237 18135 2953 1 4 . 1 1 18 18 LEU C C 18 175.739 175.739 178.750 -3.011 18135 2954 1 4 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.424 0.232 18135 2955 1 4 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.341 0.901 18135 2956 1 4 . 1 1 18 18 LEU H H 18 7.499 7.499 8.440 -0.941 18135 2957 1 4 . 1 1 19 19 ALA N N 19 121.961 121.961 120.672 1.289 18135 2958 1 4 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.139 -0.302 18135 2959 1 4 . 1 1 19 19 ALA C C 19 180.736 180.736 178.986 1.750 18135 2960 1 4 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.228 0.838 18135 2961 1 4 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.257 -1.180 18135 2962 1 4 . 1 1 19 19 ALA H H 19 7.950 7.950 7.804 0.146 18135 2963 1 4 . 1 1 20 20 GLN N N 20 118.605 118.605 116.779 1.826 18135 2964 1 4 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.143 -0.208 18135 2965 1 4 . 1 1 20 20 GLN C C 20 176.945 176.945 177.525 -0.580 18135 2966 1 4 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.676 0.339 18135 2967 1 4 . 1 1 20 20 GLN CB C 20 28.474 28.474 28.872 -0.398 18135 2968 1 4 . 1 1 20 20 GLN H H 20 7.958 7.958 8.091 -0.133 18135 2969 1 4 . 1 1 21 21 MET N N 21 116.693 116.693 117.926 -1.233 18135 2970 1 4 . 1 1 21 21 MET HA H 21 3.861 3.861 4.328 -0.467 18135 2971 1 4 . 1 1 21 21 MET C C 21 174.671 174.671 175.832 -1.161 18135 2972 1 4 . 1 1 21 21 MET CA C 21 57.111 57.111 57.097 0.014 18135 2973 1 4 . 1 1 21 21 MET CB C 21 34.073 34.073 33.174 0.899 18135 2974 1 4 . 1 1 21 21 MET H H 21 7.420 7.420 7.728 -0.308 18135 2975 1 4 . 1 1 22 22 ARG N N 22 115.451 115.451 120.988 -5.537 18135 2976 1 4 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.065 0.788 18135 2977 1 4 . 1 1 22 22 ARG C C 22 175.950 175.950 174.647 1.303 18135 2978 1 4 . 1 1 22 22 ARG CA C 22 58.452 58.452 54.969 3.483 18135 2979 1 4 . 1 1 22 22 ARG CB C 22 31.514 31.514 29.982 1.532 18135 2980 1 4 . 1 1 22 22 ARG H H 22 6.484 6.484 7.325 -0.841 18135 2981 1 4 . 1 1 23 23 LYS N N 23 128.593 128.593 126.894 1.699 18135 2982 1 4 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.487 -0.002 18135 2983 1 4 . 1 1 23 23 LYS C C 23 176.643 176.643 174.825 1.818 18135 2984 1 4 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.468 1.819 18135 2985 1 4 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.851 4.410 18135 2986 1 4 . 1 1 23 23 LYS H H 23 10.212 10.212 8.145 2.067 18135 2987 1 4 . 1 1 24 24 ILE N N 24 118.605 118.605 122.788 -4.183 18135 2988 1 4 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.399 0.085 18135 2989 1 4 . 1 1 24 24 ILE C C 24 173.878 173.878 174.742 -0.864 18135 2990 1 4 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.730 -1.133 18135 2991 1 4 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.820 -0.364 18135 2992 1 4 . 1 1 24 24 ILE H H 24 8.465 8.465 8.220 0.245 18135 2993 1 4 . 1 1 25 25 SER N N 25 113.658 113.658 118.471 -4.813 18135 2994 1 4 . 1 1 25 25 SER HA H 25 4.481 4.481 5.043 -0.562 18135 2995 1 4 . 1 1 25 25 SER C C 25 176.359 176.359 175.871 0.488 18135 2996 1 4 . 1 1 25 25 SER CA C 25 56.975 56.975 57.415 -0.440 18135 2997 1 4 . 1 1 25 25 SER CB C 25 64.759 64.759 63.864 0.895 18135 2998 1 4 . 1 1 25 25 SER H H 25 8.104 8.104 8.526 -0.422 18135 2999 1 4 . 1 1 26 26 LEU N N 26 127.566 127.566 125.397 2.169 18135 3000 1 4 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.192 -0.315 18135 3001 1 4 . 1 1 26 26 LEU C C 26 178.946 178.946 176.968 1.978 18135 3002 1 4 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.331 0.347 18135 3003 1 4 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.750 -0.031 18135 3004 1 4 . 1 1 26 26 LEU H H 26 8.802 8.802 9.063 -0.261 18135 3005 1 4 . 1 1 27 27 PHE N N 27 117.143 117.143 116.894 0.249 18135 3006 1 4 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.617 -0.379 18135 3007 1 4 . 1 1 27 27 PHE C C 27 177.067 177.067 176.723 0.344 18135 3008 1 4 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.396 1.694 18135 3009 1 4 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.459 -0.197 18135 3010 1 4 . 1 1 27 27 PHE H H 27 7.986 7.986 7.930 0.056 18135 3011 1 4 . 1 1 28 28 SER N N 28 115.200 115.200 115.930 -0.730 18135 3012 1 4 . 1 1 28 28 SER HA H 28 4.505 4.505 4.387 0.118 18135 3013 1 4 . 1 1 28 28 SER C C 28 174.533 174.533 174.654 -0.121 18135 3014 1 4 . 1 1 28 28 SER CA C 28 59.447 59.447 60.572 -1.125 18135 3015 1 4 . 1 1 28 28 SER CB C 28 63.790 63.790 63.721 0.069 18135 3016 1 4 . 1 1 28 28 SER H H 28 7.929 7.929 8.204 -0.275 18135 3017 1 4 . 1 1 29 29 CYS N N 29 119.870 119.870 118.762 1.108 18135 3018 1 4 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.691 0.391 18135 3019 1 4 . 1 1 29 29 CYS C C 29 176.475 176.475 174.330 2.145 18135 3020 1 4 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.766 -5.336 18135 3021 1 4 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.236 10.006 18135 3022 1 4 . 1 1 29 29 CYS H H 29 7.865 7.865 7.993 -0.128 18135 3023 1 4 . 1 1 30 30 LEU N N 30 122.259 122.259 124.279 -2.020 18135 3024 1 4 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.370 -0.409 18135 3025 1 4 . 1 1 30 30 LEU C C 30 179.774 179.774 177.932 1.842 18135 3026 1 4 . 1 1 30 30 LEU CA C 30 58.303 58.303 55.926 2.377 18135 3027 1 4 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.313 -0.737 18135 3028 1 4 . 1 1 30 30 LEU H H 30 7.812 7.812 8.451 -0.639 18135 3029 1 4 . 1 1 31 31 LYS N N 31 117.731 117.731 114.083 3.648 18135 3030 1 4 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.293 0.397 18135 3031 1 4 . 1 1 31 31 LYS C C 31 176.692 176.692 175.726 0.966 18135 3032 1 4 . 1 1 31 31 LYS CA C 31 54.077 54.077 56.699 -2.622 18135 3033 1 4 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.724 -0.137 18135 3034 1 4 . 1 1 31 31 LYS H H 31 8.597 8.597 8.075 0.522 18135 3035 1 4 . 1 1 32 32 ASP N N 32 117.841 117.841 119.594 -1.753 18135 3036 1 4 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.704 -0.010 18135 3037 1 4 . 1 1 32 32 ASP C C 32 175.505 175.505 175.693 -0.188 18135 3038 1 4 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.314 -0.226 18135 3039 1 4 . 1 1 32 32 ASP CB C 32 41.808 41.808 43.194 -1.385 18135 3040 1 4 . 1 1 32 32 ASP H H 32 7.808 7.808 7.981 -0.173 18135 3041 1 4 . 1 1 33 33 ARG N N 33 120.876 120.876 120.243 0.633 18135 3042 1 4 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.159 -0.118 18135 3043 1 4 . 1 1 33 33 ARG C C 33 175.286 175.286 175.670 -0.384 18135 3044 1 4 . 1 1 33 33 ARG CA C 33 58.083 58.083 55.626 2.457 18135 3045 1 4 . 1 1 33 33 ARG CB C 33 30.013 30.013 31.045 -1.032 18135 3046 1 4 . 1 1 33 33 ARG H H 33 7.378 7.378 7.352 0.026 18135 3047 1 4 . 1 1 34 34 HIS N N 34 120.555 120.555 117.500 3.055 18135 3048 1 4 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.680 -0.468 18135 3049 1 4 . 1 1 34 34 HIS C C 34 170.494 170.494 173.648 -3.154 18135 3050 1 4 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.603 -2.996 18135 3051 1 4 . 1 1 34 34 HIS CB C 34 31.488 31.488 27.875 3.613 18135 3052 1 4 . 1 1 34 34 HIS H H 34 7.974 7.974 8.737 -0.763 18135 3053 1 4 . 1 1 35 35 ASP N N 35 125.061 125.061 121.380 3.681 18135 3054 1 4 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.562 0.076 18135 3055 1 4 . 1 1 35 35 ASP C C 35 175.943 175.943 176.497 -0.554 18135 3056 1 4 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.419 -2.050 18135 3057 1 4 . 1 1 35 35 ASP CB C 35 40.362 40.362 42.137 -1.775 18135 3058 1 4 . 1 1 35 35 ASP H H 35 7.805 7.805 8.851 -1.046 18135 3059 1 4 . 1 1 36 36 PHE N N 36 122.860 122.860 120.005 2.855 18135 3060 1 4 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.202 0.123 18135 3061 1 4 . 1 1 36 36 PHE C C 36 176.643 176.643 177.213 -0.570 18135 3062 1 4 . 1 1 36 36 PHE CA C 36 59.639 59.639 59.535 0.104 18135 3063 1 4 . 1 1 36 36 PHE CB C 36 40.691 40.691 38.785 1.906 18135 3064 1 4 . 1 1 36 36 PHE H H 36 8.973 8.973 7.129 1.844 18135 3065 1 4 . 1 1 37 37 GLY N N 37 111.856 111.856 109.073 2.783 18135 3066 1 4 . 1 1 37 37 GLY C C 37 175.185 175.185 174.660 0.525 18135 3067 1 4 . 1 1 37 37 GLY CA C 37 48.143 48.143 45.421 2.722 18135 3068 1 4 . 1 1 37 37 GLY H H 37 8.727 8.727 8.169 0.558 18135 3069 1 4 . 1 1 38 38 PHE N N 38 123.178 123.178 124.402 -1.224 18135 3070 1 4 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.878 -0.964 18135 3071 1 4 . 1 1 38 38 PHE CA C 38 55.804 55.804 54.200 1.604 18135 3072 1 4 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.836 -0.179 18135 3073 1 4 . 1 1 38 38 PHE H H 38 9.169 9.169 8.335 0.834 18135 3074 1 4 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.400 0.129 18135 3075 1 4 . 1 1 39 39 PRO C C 39 174.634 174.634 176.727 -2.093 18135 3076 1 4 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.509 -0.966 18135 3077 1 4 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.441 -1.737 18135 3078 1 4 . 1 1 40 40 GLN N N 40 123.608 123.608 122.969 0.639 18135 3079 1 4 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.267 -0.648 18135 3080 1 4 . 1 1 40 40 GLN C C 40 176.958 176.958 177.767 -0.809 18135 3081 1 4 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.806 -0.733 18135 3082 1 4 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.288 1.529 18135 3083 1 4 . 1 1 40 40 GLN H H 40 7.966 7.966 8.041 -0.075 18135 3084 1 4 . 1 1 41 41 GLU N N 41 119.446 119.446 119.228 0.218 18135 3085 1 4 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.110 0.027 18135 3086 1 4 . 1 1 41 41 GLU C C 41 177.346 177.346 177.823 -0.477 18135 3087 1 4 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.108 -1.179 18135 3088 1 4 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.184 -1.351 18135 3089 1 4 . 1 1 41 41 GLU H H 41 9.044 9.044 8.652 0.392 18135 3090 1 4 . 1 1 42 42 GLU N N 42 117.196 117.196 117.512 -0.316 18135 3091 1 4 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.298 -0.235 18135 3092 1 4 . 1 1 42 42 GLU C C 42 174.886 174.886 177.869 -2.983 18135 3093 1 4 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.494 -1.110 18135 3094 1 4 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.022 -2.464 18135 3095 1 4 . 1 1 42 42 GLU H H 42 7.646 7.646 7.864 -0.218 18135 3096 1 4 . 1 1 43 43 PHE N N 43 115.527 115.527 122.133 -6.606 18135 3097 1 4 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.517 -0.031 18135 3098 1 4 . 1 1 43 43 PHE C C 43 175.615 175.615 175.897 -0.282 18135 3099 1 4 . 1 1 43 43 PHE CA C 43 57.548 57.548 59.241 -1.693 18135 3100 1 4 . 1 1 43 43 PHE CB C 43 39.893 39.893 39.873 0.020 18135 3101 1 4 . 1 1 43 43 PHE H H 43 7.601 7.601 8.437 -0.836 18135 3102 1 4 . 1 1 44 44 GLY N N 44 107.243 107.243 108.695 -1.452 18135 3103 1 4 . 1 1 44 44 GLY C C 44 174.032 174.032 174.133 -0.101 18135 3104 1 4 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.062 0.550 18135 3105 1 4 . 1 1 44 44 GLY H H 44 7.733 7.733 7.638 0.095 18135 3106 1 4 . 1 1 45 45 ASN N N 45 117.599 117.599 116.144 1.455 18135 3107 1 4 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.599 -0.048 18135 3108 1 4 . 1 1 45 45 ASN C C 45 175.894 175.894 174.092 1.802 18135 3109 1 4 . 1 1 45 45 ASN CA C 45 53.849 53.849 54.697 -0.848 18135 3110 1 4 . 1 1 45 45 ASN CB C 45 38.419 38.419 38.151 0.268 18135 3111 1 4 . 1 1 45 45 ASN H H 45 8.343 8.343 8.817 -0.474 18135 3112 1 4 . 1 1 46 46 GLN N N 46 118.916 118.916 114.542 4.374 18135 3113 1 4 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.325 -0.243 18135 3114 1 4 . 1 1 46 46 GLN C C 46 175.851 175.851 174.971 0.880 18135 3115 1 4 . 1 1 46 46 GLN CA C 46 56.646 56.646 54.511 2.135 18135 3116 1 4 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.750 0.694 18135 3117 1 4 . 1 1 46 46 GLN H H 46 8.652 8.652 8.169 0.483 18135 3118 1 4 . 1 1 47 47 PHE N N 47 119.511 119.511 116.100 3.411 18135 3119 1 4 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.596 -0.034 18135 3120 1 4 . 1 1 47 47 PHE C C 47 176.258 176.258 174.947 1.311 18135 3121 1 4 . 1 1 47 47 PHE CA C 47 57.920 57.920 57.023 0.897 18135 3122 1 4 . 1 1 47 47 PHE CB C 47 39.858 39.858 37.968 1.890 18135 3123 1 4 . 1 1 47 47 PHE H H 47 7.904 7.904 7.821 0.083 18135 3124 1 4 . 1 1 48 48 GLN N N 48 120.127 120.127 119.244 0.883 18135 3125 1 4 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.179 0.196 18135 3126 1 4 . 1 1 48 48 GLN C C 48 181.265 181.265 177.088 4.177 18135 3127 1 4 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.737 0.839 18135 3128 1 4 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.693 -0.225 18135 3129 1 4 . 1 1 48 48 GLN H H 48 8.255 8.255 7.423 0.832 18135 3130 1 4 . 1 1 49 49 LYS N N 49 121.777 121.777 121.506 0.271 18135 3131 1 4 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.354 -0.251 18135 3132 1 4 . 1 1 49 49 LYS C C 49 177.968 177.968 177.734 0.234 18135 3133 1 4 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.798 -0.650 18135 3134 1 4 . 1 1 49 49 LYS CB C 49 32.390 32.390 31.727 0.663 18135 3135 1 4 . 1 1 49 49 LYS H H 49 8.426 8.426 8.607 -0.181 18135 3136 1 4 . 1 1 50 50 ALA N N 50 120.573 120.573 119.363 1.210 18135 3137 1 4 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.338 -0.268 18135 3138 1 4 . 1 1 50 50 ALA C C 50 178.697 178.697 177.715 0.982 18135 3139 1 4 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.154 1.614 18135 3140 1 4 . 1 1 50 50 ALA CB C 50 18.874 18.874 17.851 1.023 18135 3141 1 4 . 1 1 50 50 ALA H H 50 8.578 8.578 7.914 0.664 18135 3142 1 4 . 1 1 51 51 GLU N N 51 115.015 115.015 117.082 -2.067 18135 3143 1 4 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.255 0.011 18135 3144 1 4 . 1 1 51 51 GLU C C 51 176.995 176.995 177.043 -0.048 18135 3145 1 4 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.628 -0.635 18135 3146 1 4 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.115 -1.210 18135 3147 1 4 . 1 1 51 51 GLU H H 51 7.907 7.907 8.295 -0.388 18135 3148 1 4 . 1 1 52 52 THR N N 52 111.210 111.210 114.997 -3.787 18135 3149 1 4 . 1 1 52 52 THR HA H 52 4.114 4.114 4.267 -0.153 18135 3150 1 4 . 1 1 52 52 THR C C 52 175.271 175.271 175.660 -0.389 18135 3151 1 4 . 1 1 52 52 THR CA C 52 63.611 63.611 65.163 -1.552 18135 3152 1 4 . 1 1 52 52 THR CB C 52 69.673 69.673 69.137 0.536 18135 3153 1 4 . 1 1 52 52 THR H H 52 7.863 7.863 7.331 0.532 18135 3154 1 4 . 1 1 53 53 ILE N N 53 119.113 119.113 122.271 -3.158 18135 3155 1 4 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.067 -0.203 18135 3156 1 4 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.853 1.054 18135 3157 1 4 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.274 -1.321 18135 3158 1 4 . 1 1 53 53 ILE H H 53 8.341 8.341 8.038 0.303 18135 3159 1 4 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.376 -0.090 18135 3160 1 4 . 1 1 54 54 PRO C C 54 179.655 179.655 178.869 0.786 18135 3161 1 4 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.137 -0.086 18135 3162 1 4 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.095 0.790 18135 3163 1 4 . 1 1 55 55 VAL N N 55 116.355 116.355 116.699 -0.344 18135 3164 1 4 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.871 -0.190 18135 3165 1 4 . 1 1 55 55 VAL C C 55 177.649 177.649 178.171 -0.522 18135 3166 1 4 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.325 0.512 18135 3167 1 4 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.389 1.082 18135 3168 1 4 . 1 1 55 55 VAL H H 55 7.119 7.119 7.519 -0.400 18135 3169 1 4 . 1 1 56 56 LEU N N 56 123.038 123.038 121.666 1.372 18135 3170 1 4 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.099 0.211 18135 3171 1 4 . 1 1 56 56 LEU C C 56 178.637 178.637 178.135 0.502 18135 3172 1 4 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.271 -0.185 18135 3173 1 4 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.285 1.033 18135 3174 1 4 . 1 1 56 56 LEU H H 56 8.535 8.535 8.439 0.096 18135 3175 1 4 . 1 1 57 57 HIS N N 57 117.041 117.041 118.499 -1.458 18135 3176 1 4 . 1 1 57 57 HIS HA H 57 3.786 3.786 3.995 -0.209 18135 3177 1 4 . 1 1 57 57 HIS C C 57 175.640 175.640 177.378 -1.738 18135 3178 1 4 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.697 0.834 18135 3179 1 4 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.088 -1.879 18135 3180 1 4 . 1 1 57 57 HIS H H 57 9.047 9.047 7.995 1.052 18135 3181 1 4 . 1 1 58 58 GLU N N 58 119.521 119.521 118.417 1.104 18135 3182 1 4 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.743 0.264 18135 3183 1 4 . 1 1 58 58 GLU C C 58 179.029 179.029 178.735 0.294 18135 3184 1 4 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.315 -0.348 18135 3185 1 4 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.407 -1.117 18135 3186 1 4 . 1 1 58 58 GLU H H 58 7.860 7.860 8.134 -0.274 18135 3187 1 4 . 1 1 59 59 MET N N 59 119.512 119.512 120.002 -0.490 18135 3188 1 4 . 1 1 59 59 MET HA H 59 4.074 4.074 4.293 -0.219 18135 3189 1 4 . 1 1 59 59 MET C C 59 177.031 177.031 178.661 -1.630 18135 3190 1 4 . 1 1 59 59 MET CA C 59 59.408 59.408 58.261 1.147 18135 3191 1 4 . 1 1 59 59 MET CB C 59 32.525 32.525 32.586 -0.060 18135 3192 1 4 . 1 1 59 59 MET H H 59 8.442 8.442 7.844 0.598 18135 3193 1 4 . 1 1 60 60 ILE N N 60 117.183 117.183 117.869 -0.686 18135 3194 1 4 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.506 -0.089 18135 3195 1 4 . 1 1 60 60 ILE C C 60 177.524 177.524 178.167 -0.643 18135 3196 1 4 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.752 0.574 18135 3197 1 4 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.056 -0.196 18135 3198 1 4 . 1 1 60 60 ILE H H 60 8.338 8.338 7.753 0.585 18135 3199 1 4 . 1 1 61 61 GLN N N 61 120.191 120.191 120.171 0.020 18135 3200 1 4 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.720 -0.018 18135 3201 1 4 . 1 1 61 61 GLN C C 61 178.270 178.270 177.735 0.535 18135 3202 1 4 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.216 -0.430 18135 3203 1 4 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.160 0.506 18135 3204 1 4 . 1 1 61 61 GLN H H 61 8.234 8.234 8.107 0.127 18135 3205 1 4 . 1 1 62 62 GLN N N 62 116.795 116.795 118.752 -1.957 18135 3206 1 4 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.214 0.413 18135 3207 1 4 . 1 1 62 62 GLN C C 62 179.685 179.685 178.551 1.134 18135 3208 1 4 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.246 -0.238 18135 3209 1 4 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.796 -3.454 18135 3210 1 4 . 1 1 62 62 GLN H H 62 8.421 8.421 7.860 0.561 18135 3211 1 4 . 1 1 63 63 ILE N N 63 122.797 122.797 120.150 2.647 18135 3212 1 4 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.916 -0.267 18135 3213 1 4 . 1 1 63 63 ILE C C 63 177.279 177.279 177.842 -0.563 18135 3214 1 4 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.716 2.249 18135 3215 1 4 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.812 -0.497 18135 3216 1 4 . 1 1 63 63 ILE H H 63 8.164 8.164 7.673 0.491 18135 3217 1 4 . 1 1 64 64 PHE N N 64 120.820 120.820 121.234 -0.414 18135 3218 1 4 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.451 -0.735 18135 3219 1 4 . 1 1 64 64 PHE C C 64 178.402 178.402 176.775 1.627 18135 3220 1 4 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.303 0.849 18135 3221 1 4 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.545 -0.035 18135 3222 1 4 . 1 1 64 64 PHE H H 64 8.405 8.405 7.961 0.444 18135 3223 1 4 . 1 1 65 65 ASN N N 65 119.981 119.981 118.695 1.286 18135 3224 1 4 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.805 0.258 18135 3225 1 4 . 1 1 65 65 ASN C C 65 177.944 177.944 177.422 0.522 18135 3226 1 4 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.483 -0.615 18135 3227 1 4 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.558 -1.302 18135 3228 1 4 . 1 1 65 65 ASN H H 65 8.812 8.812 8.045 0.767 18135 3229 1 4 . 1 1 66 66 LEU N N 66 121.533 121.533 120.531 1.002 18135 3230 1 4 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.157 0.067 18135 3231 1 4 . 1 1 66 66 LEU C C 66 177.777 177.777 179.579 -1.802 18135 3232 1 4 . 1 1 66 66 LEU CA C 66 58.268 58.268 58.294 -0.026 18135 3233 1 4 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.511 0.096 18135 3234 1 4 . 1 1 66 66 LEU H H 66 8.177 8.177 7.929 0.248 18135 3235 1 4 . 1 1 67 67 PHE N N 67 110.842 110.842 115.059 -4.217 18135 3236 1 4 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.526 0.354 18135 3237 1 4 . 1 1 67 67 PHE C C 67 177.965 177.965 176.761 1.204 18135 3238 1 4 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.948 0.586 18135 3239 1 4 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.971 -0.355 18135 3240 1 4 . 1 1 67 67 PHE H H 67 8.160 8.160 8.435 -0.275 18135 3241 1 4 . 1 1 68 68 SER N N 68 119.131 119.131 112.968 6.163 18135 3242 1 4 . 1 1 68 68 SER HA H 68 4.580 4.580 4.244 0.336 18135 3243 1 4 . 1 1 68 68 SER C C 68 173.472 173.472 175.092 -1.620 18135 3244 1 4 . 1 1 68 68 SER CA C 68 59.191 59.191 58.942 0.249 18135 3245 1 4 . 1 1 68 68 SER CB C 68 63.123 63.123 63.437 -0.314 18135 3246 1 4 . 1 1 68 68 SER H H 68 8.016 8.016 7.412 0.604 18135 3247 1 4 . 1 1 69 69 THR N N 69 111.353 111.353 116.202 -4.849 18135 3248 1 4 . 1 1 69 69 THR HA H 69 4.345 4.345 4.432 -0.087 18135 3249 1 4 . 1 1 69 69 THR C C 69 175.661 175.661 174.133 1.528 18135 3250 1 4 . 1 1 69 69 THR CA C 69 61.411 61.411 60.808 0.603 18135 3251 1 4 . 1 1 69 69 THR CB C 69 72.209 72.209 70.480 1.729 18135 3252 1 4 . 1 1 69 69 THR H H 69 6.977 6.977 7.353 -0.376 18135 3253 1 4 . 1 1 70 70 LYS N N 70 121.120 121.120 123.203 -2.083 18135 3254 1 4 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.099 -0.010 18135 3255 1 4 . 1 1 70 70 LYS C C 70 179.259 179.259 177.418 1.841 18135 3256 1 4 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.903 -0.947 18135 3257 1 4 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.413 -0.663 18135 3258 1 4 . 1 1 70 70 LYS H H 70 9.065 9.065 8.609 0.456 18135 3259 1 4 . 1 1 71 71 ASP N N 71 116.374 116.374 120.031 -3.657 18135 3260 1 4 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.274 -0.099 18135 3261 1 4 . 1 1 71 71 ASP C C 71 178.372 178.372 177.109 1.263 18135 3262 1 4 . 1 1 71 71 ASP CA C 71 57.067 57.067 56.888 0.179 18135 3263 1 4 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.323 -0.017 18135 3264 1 4 . 1 1 71 71 ASP H H 71 7.518 7.518 7.888 -0.370 18135 3265 1 4 . 1 1 72 72 SER N N 72 117.341 117.341 114.267 3.074 18135 3266 1 4 . 1 1 72 72 SER HA H 72 3.715 3.715 3.462 0.253 18135 3267 1 4 . 1 1 72 72 SER C C 72 176.897 176.897 175.774 1.123 18135 3268 1 4 . 1 1 72 72 SER CA C 72 60.267 60.267 60.519 -0.252 18135 3269 1 4 . 1 1 72 72 SER CB C 72 62.616 62.616 63.537 -0.921 18135 3270 1 4 . 1 1 72 72 SER H H 72 8.066 8.066 7.610 0.456 18135 3271 1 4 . 1 1 73 73 SER N N 73 113.398 113.398 118.441 -5.043 18135 3272 1 4 . 1 1 73 73 SER HA H 73 4.094 4.094 4.165 -0.071 18135 3273 1 4 . 1 1 73 73 SER C C 73 174.855 174.855 175.482 -0.627 18135 3274 1 4 . 1 1 73 73 SER CA C 73 61.385 61.385 60.861 0.524 18135 3275 1 4 . 1 1 73 73 SER CB C 73 62.798 62.798 62.944 -0.146 18135 3276 1 4 . 1 1 73 73 SER H H 73 7.982 7.982 7.476 0.506 18135 3277 1 4 . 1 1 74 74 ALA N N 74 119.486 119.486 119.744 -0.258 18135 3278 1 4 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.313 -0.156 18135 3279 1 4 . 1 1 74 74 ALA C C 74 177.626 177.626 177.222 0.404 18135 3280 1 4 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.596 0.117 18135 3281 1 4 . 1 1 74 74 ALA CB C 74 18.747 18.747 19.018 -0.271 18135 3282 1 4 . 1 1 74 74 ALA H H 74 7.095 7.095 7.963 -0.868 18135 3283 1 4 . 1 1 75 75 ALA N N 75 121.465 121.465 121.277 0.188 18135 3284 1 4 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.855 -0.159 18135 3285 1 4 . 1 1 75 75 ALA C C 75 177.197 177.197 176.335 0.862 18135 3286 1 4 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.324 0.680 18135 3287 1 4 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.904 -0.644 18135 3288 1 4 . 1 1 75 75 ALA H H 75 7.159 7.159 7.378 -0.219 18135 3289 1 4 . 1 1 76 76 TRP N N 76 116.791 116.791 116.872 -0.081 18135 3290 1 4 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.703 0.347 18135 3291 1 4 . 1 1 76 76 TRP C C 76 177.617 177.617 174.841 2.776 18135 3292 1 4 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.036 -1.717 18135 3293 1 4 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.031 2.045 18135 3294 1 4 . 1 1 76 76 TRP H H 76 7.080 7.080 7.197 -0.117 18135 3295 1 4 . 1 1 77 77 ASP N N 77 119.928 119.928 120.802 -0.874 18135 3296 1 4 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.533 -0.176 18135 3297 1 4 . 1 1 77 77 ASP C C 77 176.877 176.877 177.786 -0.909 18135 3298 1 4 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.507 -0.689 18135 3299 1 4 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.554 1.060 18135 3300 1 4 . 1 1 77 77 ASP H H 77 8.259 8.259 9.002 -0.743 18135 3301 1 4 . 1 1 78 78 GLU N N 78 127.277 127.277 125.948 1.329 18135 3302 1 4 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.964 -0.079 18135 3303 1 4 . 1 1 78 78 GLU C C 78 177.439 177.439 178.058 -0.619 18135 3304 1 4 . 1 1 78 78 GLU CA C 78 59.384 59.384 60.173 -0.789 18135 3305 1 4 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.110 -0.468 18135 3306 1 4 . 1 1 78 78 GLU H H 78 8.920 8.920 8.884 0.036 18135 3307 1 4 . 1 1 79 79 THR N N 79 115.422 115.422 117.402 -1.980 18135 3308 1 4 . 1 1 79 79 THR HA H 79 3.907 3.907 4.116 -0.209 18135 3309 1 4 . 1 1 79 79 THR C C 79 177.330 177.330 176.374 0.956 18135 3310 1 4 . 1 1 79 79 THR CA C 79 66.263 66.263 65.079 1.184 18135 3311 1 4 . 1 1 79 79 THR CB C 79 68.002 68.002 68.084 -0.082 18135 3312 1 4 . 1 1 79 79 THR H H 79 8.124 8.124 8.100 0.024 18135 3313 1 4 . 1 1 80 80 LEU N N 80 121.791 121.791 121.816 -0.025 18135 3314 1 4 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.113 -0.226 18135 3315 1 4 . 1 1 80 80 LEU C C 80 179.018 179.018 178.488 0.530 18135 3316 1 4 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.728 -0.489 18135 3317 1 4 . 1 1 80 80 LEU CB C 80 41.652 41.652 40.992 0.660 18135 3318 1 4 . 1 1 80 80 LEU H H 80 7.725 7.725 8.082 -0.357 18135 3319 1 4 . 1 1 81 81 LEU N N 81 119.280 119.280 120.424 -1.144 18135 3320 1 4 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.234 -0.745 18135 3321 1 4 . 1 1 81 81 LEU C C 81 177.062 177.062 178.716 -1.654 18135 3322 1 4 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.767 -1.058 18135 3323 1 4 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.211 -1.263 18135 3324 1 4 . 1 1 81 81 LEU H H 81 8.344 8.344 8.785 -0.441 18135 3325 1 4 . 1 1 82 82 ASP N N 82 115.357 115.357 120.076 -4.719 18135 3326 1 4 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.387 -0.113 18135 3327 1 4 . 1 1 82 82 ASP C C 82 179.018 179.018 178.484 0.534 18135 3328 1 4 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.781 -0.966 18135 3329 1 4 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.855 -2.634 18135 3330 1 4 . 1 1 82 82 ASP H H 82 8.001 8.001 8.500 -0.499 18135 3331 1 4 . 1 1 83 83 LYS N N 83 119.603 119.603 118.784 0.819 18135 3332 1 4 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.878 0.104 18135 3333 1 4 . 1 1 83 83 LYS C C 83 178.624 178.624 178.924 -0.300 18135 3334 1 4 . 1 1 83 83 LYS CA C 83 59.745 59.745 59.041 0.704 18135 3335 1 4 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.255 0.851 18135 3336 1 4 . 1 1 83 83 LYS H H 83 7.342 7.342 7.736 -0.394 18135 3337 1 4 . 1 1 84 84 PHE N N 84 123.933 123.933 121.579 2.354 18135 3338 1 4 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.026 0.009 18135 3339 1 4 . 1 1 84 84 PHE C C 84 177.210 177.210 177.047 0.163 18135 3340 1 4 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.798 -1.455 18135 3341 1 4 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.902 0.414 18135 3342 1 4 . 1 1 84 84 PHE H H 84 8.471 8.471 8.434 0.037 18135 3343 1 4 . 1 1 85 85 TYR N N 85 118.387 118.387 117.482 0.905 18135 3344 1 4 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.697 0.371 18135 3345 1 4 . 1 1 85 85 TYR C C 85 178.104 178.104 177.413 0.691 18135 3346 1 4 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.772 -1.195 18135 3347 1 4 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.164 -0.187 18135 3348 1 4 . 1 1 85 85 TYR H H 85 9.011 9.011 8.864 0.147 18135 3349 1 4 . 1 1 86 86 THR N N 86 114.035 114.035 116.480 -2.445 18135 3350 1 4 . 1 1 86 86 THR HA H 86 3.945 3.945 3.190 0.755 18135 3351 1 4 . 1 1 86 86 THR C C 86 176.708 176.708 176.467 0.241 18135 3352 1 4 . 1 1 86 86 THR CA C 86 66.759 66.759 66.901 -0.142 18135 3353 1 4 . 1 1 86 86 THR CB C 86 68.853 68.853 68.060 0.793 18135 3354 1 4 . 1 1 86 86 THR H H 86 7.609 7.609 7.481 0.128 18135 3355 1 4 . 1 1 87 87 GLU N N 87 120.790 120.790 121.400 -0.610 18135 3356 1 4 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.921 0.126 18135 3357 1 4 . 1 1 87 87 GLU C C 87 179.606 179.606 178.855 0.751 18135 3358 1 4 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.422 -1.024 18135 3359 1 4 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.230 -0.944 18135 3360 1 4 . 1 1 87 87 GLU H H 87 7.712 7.712 7.606 0.106 18135 3361 1 4 . 1 1 88 88 LEU N N 88 120.729 120.729 119.901 0.828 18135 3362 1 4 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.908 -0.180 18135 3363 1 4 . 1 1 88 88 LEU C C 88 178.695 178.695 179.296 -0.601 18135 3364 1 4 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.274 0.977 18135 3365 1 4 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.008 1.579 18135 3366 1 4 . 1 1 88 88 LEU H H 88 8.393 8.393 7.450 0.943 18135 3367 1 4 . 1 1 89 89 TYR N N 89 118.654 118.654 118.746 -0.092 18135 3368 1 4 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.082 -0.151 18135 3369 1 4 . 1 1 89 89 TYR C C 89 178.438 178.438 178.597 -0.159 18135 3370 1 4 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.283 0.124 18135 3371 1 4 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.419 0.448 18135 3372 1 4 . 1 1 89 89 TYR H H 89 8.637 8.637 8.407 0.230 18135 3373 1 4 . 1 1 90 90 GLN N N 90 118.263 118.263 116.466 1.797 18135 3374 1 4 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.997 -0.011 18135 3375 1 4 . 1 1 90 90 GLN C C 90 178.411 178.411 178.834 -0.423 18135 3376 1 4 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.644 0.138 18135 3377 1 4 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.291 -0.144 18135 3378 1 4 . 1 1 90 90 GLN H H 90 7.796 7.796 7.876 -0.080 18135 3379 1 4 . 1 1 91 91 GLN N N 91 117.959 117.959 120.306 -2.347 18135 3380 1 4 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.084 -0.002 18135 3381 1 4 . 1 1 91 91 GLN C C 91 178.705 178.705 178.548 0.157 18135 3382 1 4 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.818 0.002 18135 3383 1 4 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.406 0.767 18135 3384 1 4 . 1 1 91 91 GLN H H 91 7.727 7.727 8.124 -0.397 18135 3385 1 4 . 1 1 92 92 LEU N N 92 119.965 119.965 118.450 1.515 18135 3386 1 4 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.986 -0.252 18135 3387 1 4 . 1 1 92 92 LEU C C 92 178.984 178.984 178.703 0.281 18135 3388 1 4 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.955 -0.463 18135 3389 1 4 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.865 0.514 18135 3390 1 4 . 1 1 92 92 LEU H H 92 8.465 8.465 8.448 0.017 18135 3391 1 4 . 1 1 93 93 ASN N N 93 117.793 117.793 118.313 -0.520 18135 3392 1 4 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.259 0.142 18135 3393 1 4 . 1 1 93 93 ASN C C 93 178.309 178.309 177.103 1.206 18135 3394 1 4 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.269 0.134 18135 3395 1 4 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.236 0.402 18135 3396 1 4 . 1 1 93 93 ASN H H 93 8.091 8.091 8.094 -0.003 18135 3397 1 4 . 1 1 94 94 ASP N N 94 121.133 121.133 120.393 0.740 18135 3398 1 4 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.387 0.018 18135 3399 1 4 . 1 1 94 94 ASP C C 94 178.328 178.328 178.582 -0.254 18135 3400 1 4 . 1 1 94 94 ASP CA C 94 56.547 56.547 56.624 -0.077 18135 3401 1 4 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.921 -2.272 18135 3402 1 4 . 1 1 94 94 ASP H H 94 8.362 8.362 7.944 0.418 18135 3403 1 4 . 1 1 95 95 LEU N N 95 119.160 119.160 121.096 -1.936 18135 3404 1 4 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.833 0.206 18135 3405 1 4 . 1 1 95 95 LEU C C 95 178.826 178.826 178.526 0.300 18135 3406 1 4 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.111 -1.084 18135 3407 1 4 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.054 0.156 18135 3408 1 4 . 1 1 95 95 LEU H H 95 8.143 8.143 8.468 -0.325 18135 3409 1 4 . 1 1 96 96 GLU N N 96 118.813 118.813 118.853 -0.040 18135 3410 1 4 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.712 0.249 18135 3411 1 4 . 1 1 96 96 GLU C C 96 177.640 177.640 178.289 -0.649 18135 3412 1 4 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.468 -1.754 18135 3413 1 4 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.429 -1.291 18135 3414 1 4 . 1 1 96 96 GLU H H 96 8.111 8.111 8.314 -0.203 18135 3415 1 4 . 1 1 97 97 ALA N N 97 120.549 120.549 120.903 -0.354 18135 3416 1 4 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.986 0.136 18135 3417 1 4 . 1 1 97 97 ALA C C 97 179.126 179.126 180.225 -1.099 18135 3418 1 4 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.694 -0.661 18135 3419 1 4 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.921 0.059 18135 3420 1 4 . 1 1 97 97 ALA H H 97 7.798 7.798 7.785 0.013 18135 3421 1 4 . 1 1 98 98 CYS N N 98 115.510 115.510 117.315 -1.805 18135 3422 1 4 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.184 0.266 18135 3423 1 4 . 1 1 98 98 CYS C C 98 175.363 175.363 176.119 -0.756 18135 3424 1 4 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.127 -4.961 18135 3425 1 4 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.117 15.762 18135 3426 1 4 . 1 1 98 98 CYS H H 98 7.597 7.597 7.767 -0.170 18135 3427 1 4 . 1 1 99 99 VAL N N 99 121.713 121.713 118.896 2.817 18135 3428 1 4 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.811 -0.017 18135 3429 1 4 . 1 1 99 99 VAL C C 99 177.357 177.357 177.803 -0.446 18135 3430 1 4 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.475 -0.892 18135 3431 1 4 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.325 -0.295 18135 3432 1 4 . 1 1 99 99 VAL H H 99 7.828 7.828 7.599 0.229 18135 3433 1 4 . 1 1 100 100 ILE N N 100 122.333 122.333 118.202 4.131 18135 3434 1 4 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.697 0.227 18135 3435 1 4 . 1 1 100 100 ILE C C 100 176.827 176.827 176.574 0.253 18135 3436 1 4 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.566 -1.328 18135 3437 1 4 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.613 0.665 18135 3438 1 4 . 1 1 100 100 ILE H H 100 8.067 8.067 8.202 -0.135 18135 3439 1 4 . 1 1 101 101 GLN N N 101 121.864 121.864 117.408 4.456 18135 3440 1 4 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.187 0.039 18135 3441 1 4 . 1 1 101 101 GLN C C 101 176.438 176.438 178.079 -1.641 18135 3442 1 4 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.635 -0.315 18135 3443 1 4 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.149 -0.138 18135 3444 1 4 . 1 1 101 101 GLN H H 101 8.062 8.062 7.412 0.650 18135 3445 1 4 . 1 1 102 102 GLY N N 102 109.288 109.288 108.545 0.743 18135 3446 1 4 . 1 1 102 102 GLY C C 102 173.855 173.855 175.437 -1.582 18135 3447 1 4 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.063 -0.904 18135 3448 1 4 . 1 1 102 102 GLY H H 102 8.087 8.087 8.803 -0.716 18135 3449 1 4 . 1 1 103 103 VAL N N 103 118.932 118.932 118.775 0.157 18135 3450 1 4 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.795 0.279 18135 3451 1 4 . 1 1 103 103 VAL C C 103 176.299 176.299 175.784 0.515 18135 3452 1 4 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.562 -1.062 18135 3453 1 4 . 1 1 103 103 VAL CB C 103 32.854 32.854 32.018 0.836 18135 3454 1 4 . 1 1 103 103 VAL H H 103 8.079 8.079 7.667 0.412 18135 3455 1 4 . 1 1 104 104 GLY N N 104 112.028 112.028 107.314 4.714 18135 3456 1 4 . 1 1 104 104 GLY C C 104 173.694 173.694 173.252 0.442 18135 3457 1 4 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.212 0.190 18135 3458 1 4 . 1 1 104 104 GLY H H 104 8.446 8.446 7.655 0.791 18135 3459 1 4 . 1 1 105 105 VAL N N 105 120.439 120.439 121.289 -0.850 18135 3460 1 4 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.393 -0.205 18135 3461 1 4 . 1 1 105 105 VAL C C 105 175.963 175.963 174.711 1.252 18135 3462 1 4 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.858 1.278 18135 3463 1 4 . 1 1 105 105 VAL CB C 105 32.814 32.814 35.167 -2.353 18135 3464 1 4 . 1 1 105 105 VAL H H 105 7.867 7.867 7.990 -0.123 18135 3465 1 4 . 1 1 106 106 THR N N 106 116.366 116.366 115.068 1.298 18135 3466 1 4 . 1 1 106 106 THR HA H 106 4.548 4.548 4.573 -0.025 18135 3467 1 4 . 1 1 106 106 THR C C 106 173.731 173.731 173.920 -0.189 18135 3468 1 4 . 1 1 106 106 THR CA C 106 59.419 59.419 59.850 -0.431 18135 3469 1 4 . 1 1 106 106 THR CB C 106 79.536 79.536 70.778 8.758 18135 3470 1 4 . 1 1 106 106 THR H H 106 8.565 8.565 8.107 0.458 18135 3471 1 4 . 1 1 107 107 GLU N N 107 119.743 119.743 118.662 1.081 18135 3472 1 4 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.566 -0.104 18135 3473 1 4 . 1 1 107 107 GLU C C 107 175.639 175.639 176.224 -0.585 18135 3474 1 4 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.998 0.713 18135 3475 1 4 . 1 1 107 107 GLU CB C 107 30.499 30.499 30.502 -0.003 18135 3476 1 4 . 1 1 107 107 GLU H H 107 8.410 8.410 8.374 0.036 18135 3477 1 4 . 1 1 108 108 THR N N 108 114.402 114.402 109.884 4.518 18135 3478 1 4 . 1 1 108 108 THR HA H 108 4.448 4.448 4.760 -0.312 18135 3479 1 4 . 1 1 108 108 THR CA C 108 60.348 60.348 58.690 1.658 18135 3480 1 4 . 1 1 108 108 THR CB C 108 68.544 68.544 69.757 -1.212 18135 3481 1 4 . 1 1 108 108 THR H H 108 8.155 8.155 8.118 0.037 18135 3482 1 4 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.451 -0.213 18135 3483 1 4 . 1 1 109 109 PRO C C 109 178.666 178.666 177.655 1.011 18135 3484 1 4 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.237 1.139 18135 3485 1 4 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.865 -0.017 18135 3486 1 4 . 1 1 110 110 LEU N N 110 118.566 118.566 118.552 0.014 18135 3487 1 4 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.176 -0.060 18135 3488 1 4 . 1 1 110 110 LEU C C 110 178.293 178.293 179.158 -0.865 18135 3489 1 4 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.889 -1.204 18135 3490 1 4 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.090 0.879 18135 3491 1 4 . 1 1 110 110 LEU H H 110 8.016 8.016 7.983 0.033 18135 3492 1 4 . 1 1 111 111 MET N N 111 118.982 118.982 115.847 3.135 18135 3493 1 4 . 1 1 111 111 MET HA H 111 4.210 4.210 4.322 -0.113 18135 3494 1 4 . 1 1 111 111 MET C C 111 178.720 178.720 177.783 0.937 18135 3495 1 4 . 1 1 111 111 MET CA C 111 58.144 58.144 56.655 1.489 18135 3496 1 4 . 1 1 111 111 MET CB C 111 32.374 32.374 32.414 -0.040 18135 3497 1 4 . 1 1 111 111 MET H H 111 7.705 7.705 8.025 -0.320 18135 3498 1 4 . 1 1 112 112 LYS N N 112 121.377 121.377 119.705 1.672 18135 3499 1 4 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.038 0.070 18135 3500 1 4 . 1 1 112 112 LYS C C 112 178.000 178.000 178.246 -0.246 18135 3501 1 4 . 1 1 112 112 LYS CA C 112 56.305 56.305 59.013 -2.708 18135 3502 1 4 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.185 0.181 18135 3503 1 4 . 1 1 112 112 LYS H H 112 8.257 8.257 7.605 0.652 18135 3504 1 4 . 1 1 113 113 GLU N N 113 119.104 119.104 118.766 0.338 18135 3505 1 4 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.015 0.051 18135 3506 1 4 . 1 1 113 113 GLU C C 113 178.289 178.289 178.590 -0.301 18135 3507 1 4 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.272 -1.019 18135 3508 1 4 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.405 -1.267 18135 3509 1 4 . 1 1 113 113 GLU H H 113 8.270 8.270 7.846 0.424 18135 3510 1 4 . 1 1 114 114 ASP N N 114 119.224 119.224 118.627 0.597 18135 3511 1 4 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.600 -0.312 18135 3512 1 4 . 1 1 114 114 ASP C C 114 178.365 178.365 178.029 0.336 18135 3513 1 4 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.452 -1.344 18135 3514 1 4 . 1 1 114 114 ASP CB C 114 38.235 38.235 41.228 -2.993 18135 3515 1 4 . 1 1 114 114 ASP H H 114 8.618 8.618 7.557 1.061 18135 3516 1 4 . 1 1 115 115 SER N N 115 118.195 118.195 116.724 1.471 18135 3517 1 4 . 1 1 115 115 SER HA H 115 4.200 4.200 4.148 0.052 18135 3518 1 4 . 1 1 115 115 SER C C 115 175.986 175.986 176.599 -0.613 18135 3519 1 4 . 1 1 115 115 SER CA C 115 61.588 61.588 62.089 -0.501 18135 3520 1 4 . 1 1 115 115 SER CB C 115 62.653 62.653 63.098 -0.445 18135 3521 1 4 . 1 1 115 115 SER H H 115 8.181 8.181 7.507 0.674 18135 3522 1 4 . 1 1 116 116 ILE N N 116 123.340 123.340 121.729 1.611 18135 3523 1 4 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.911 -0.285 18135 3524 1 4 . 1 1 116 116 ILE C C 116 178.367 178.367 178.526 -0.159 18135 3525 1 4 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.953 0.864 18135 3526 1 4 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.575 0.843 18135 3527 1 4 . 1 1 116 116 ILE H H 116 7.773 7.773 8.407 -0.634 18135 3528 1 4 . 1 1 117 117 LEU N N 117 120.968 120.968 121.267 -0.299 18135 3529 1 4 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.952 -0.047 18135 3530 1 4 . 1 1 117 117 LEU C C 117 178.746 178.746 178.454 0.292 18135 3531 1 4 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.480 -0.337 18135 3532 1 4 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.635 -0.049 18135 3533 1 4 . 1 1 117 117 LEU H H 117 8.406 8.406 7.499 0.907 18135 3534 1 4 . 1 1 118 118 ALA N N 118 120.150 120.150 121.907 -1.757 18135 3535 1 4 . 1 1 118 118 ALA HA H 118 4.112 4.112 4.039 0.073 18135 3536 1 4 . 1 1 118 118 ALA C C 118 181.633 181.633 179.596 2.037 18135 3537 1 4 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.497 -0.184 18135 3538 1 4 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.533 -0.423 18135 3539 1 4 . 1 1 118 118 ALA H H 118 7.894 7.894 8.304 -0.410 18135 3540 1 4 . 1 1 119 119 VAL N N 119 118.873 118.873 115.637 3.236 18135 3541 1 4 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.486 0.269 18135 3542 1 4 . 1 1 119 119 VAL C C 119 177.896 177.896 178.102 -0.206 18135 3543 1 4 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.979 1.202 18135 3544 1 4 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.898 0.995 18135 3545 1 4 . 1 1 119 119 VAL H H 119 7.572 7.572 8.072 -0.500 18135 3546 1 4 . 1 1 120 120 ARG N N 120 121.436 121.436 121.159 0.277 18135 3547 1 4 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.132 -0.105 18135 3548 1 4 . 1 1 120 120 ARG C C 120 179.848 179.848 178.768 1.080 18135 3549 1 4 . 1 1 120 120 ARG CA C 120 61.267 61.267 60.123 1.144 18135 3550 1 4 . 1 1 120 120 ARG CB C 120 29.695 29.695 30.079 -0.384 18135 3551 1 4 . 1 1 120 120 ARG H H 120 8.629 8.629 8.661 -0.032 18135 3552 1 4 . 1 1 121 121 LYS N N 121 119.589 119.589 119.839 -0.250 18135 3553 1 4 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.016 0.058 18135 3554 1 4 . 1 1 121 121 LYS C C 121 178.331 178.331 179.183 -0.852 18135 3555 1 4 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.513 0.927 18135 3556 1 4 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.200 -0.093 18135 3557 1 4 . 1 1 121 121 LYS H H 121 9.015 9.015 8.304 0.711 18135 3558 1 4 . 1 1 122 122 TYR N N 122 121.546 121.546 120.150 1.396 18135 3559 1 4 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.105 0.227 18135 3560 1 4 . 1 1 122 122 TYR C C 122 176.527 176.527 177.740 -1.213 18135 3561 1 4 . 1 1 122 122 TYR CA C 122 60.404 60.404 61.595 -1.191 18135 3562 1 4 . 1 1 122 122 TYR CB C 122 37.725 37.725 38.461 -0.736 18135 3563 1 4 . 1 1 122 122 TYR H H 122 7.473 7.473 8.239 -0.766 18135 3564 1 4 . 1 1 123 123 PHE N N 123 116.026 116.026 119.336 -3.310 18135 3565 1 4 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.909 -0.169 18135 3566 1 4 . 1 1 123 123 PHE C C 123 179.005 179.005 177.608 1.397 18135 3567 1 4 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.720 2.808 18135 3568 1 4 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.781 0.550 18135 3569 1 4 . 1 1 123 123 PHE H H 123 7.932 7.932 8.672 -0.740 18135 3570 1 4 . 1 1 124 124 GLN N N 124 123.043 123.043 118.063 4.980 18135 3571 1 4 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.348 0.831 18135 3572 1 4 . 1 1 124 124 GLN C C 124 178.772 178.772 178.548 0.224 18135 3573 1 4 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.058 0.258 18135 3574 1 4 . 1 1 124 124 GLN CB C 124 27.631 27.631 27.982 -0.351 18135 3575 1 4 . 1 1 124 124 GLN H H 124 8.470 8.470 8.589 -0.119 18135 3576 1 4 . 1 1 125 125 ARG N N 125 120.342 120.342 119.766 0.576 18135 3577 1 4 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.108 -0.030 18135 3578 1 4 . 1 1 125 125 ARG C C 125 180.340 180.340 179.198 1.142 18135 3579 1 4 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.850 2.447 18135 3580 1 4 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.869 0.456 18135 3581 1 4 . 1 1 125 125 ARG H H 125 8.137 8.137 7.900 0.237 18135 3582 1 4 . 1 1 126 126 ILE N N 126 121.876 121.876 120.353 1.523 18135 3583 1 4 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.218 0.133 18135 3584 1 4 . 1 1 126 126 ILE C C 126 176.857 176.857 177.524 -0.667 18135 3585 1 4 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.858 0.974 18135 3586 1 4 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.653 0.631 18135 3587 1 4 . 1 1 126 126 ILE H H 126 7.526 7.526 8.223 -0.697 18135 3588 1 4 . 1 1 127 127 THR N N 127 115.613 115.613 115.075 0.538 18135 3589 1 4 . 1 1 127 127 THR HA H 127 3.633 3.633 3.783 -0.150 18135 3590 1 4 . 1 1 127 127 THR C C 127 176.645 176.645 177.084 -0.439 18135 3591 1 4 . 1 1 127 127 THR CA C 127 67.294 67.294 66.516 0.777 18135 3592 1 4 . 1 1 127 127 THR CB C 127 68.871 68.871 68.904 -0.033 18135 3593 1 4 . 1 1 127 127 THR H H 127 8.288 8.288 8.114 0.174 18135 3594 1 4 . 1 1 128 128 LEU N N 128 122.627 122.627 122.114 0.513 18135 3595 1 4 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.935 0.021 18135 3596 1 4 . 1 1 128 128 LEU C C 128 178.331 178.331 177.556 0.775 18135 3597 1 4 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.907 0.181 18135 3598 1 4 . 1 1 128 128 LEU CB C 128 41.574 41.574 40.885 0.689 18135 3599 1 4 . 1 1 128 128 LEU H H 128 8.263 8.263 8.243 0.020 18135 3600 1 4 . 1 1 129 129 TYR N N 129 120.955 120.955 120.687 0.268 18135 3601 1 4 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.011 -0.121 18135 3602 1 4 . 1 1 129 129 TYR C C 129 176.040 176.040 177.484 -1.444 18135 3603 1 4 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.950 -0.457 18135 3604 1 4 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.224 0.701 18135 3605 1 4 . 1 1 129 129 TYR H H 129 7.518 7.518 8.236 -0.718 18135 3606 1 4 . 1 1 130 130 LEU N N 130 119.155 119.155 116.361 2.794 18135 3607 1 4 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.283 -0.438 18135 3608 1 4 . 1 1 130 130 LEU C C 130 177.948 177.948 178.347 -0.399 18135 3609 1 4 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.882 0.231 18135 3610 1 4 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.498 1.089 18135 3611 1 4 . 1 1 130 130 LEU H H 130 7.717 7.717 7.901 -0.184 18135 3612 1 4 . 1 1 131 131 LYS N N 131 116.832 116.832 120.058 -3.226 18135 3613 1 4 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.768 -0.360 18135 3614 1 4 . 1 1 131 131 LYS C C 131 181.265 181.265 179.713 1.552 18135 3615 1 4 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.630 0.101 18135 3616 1 4 . 1 1 131 131 LYS CB C 131 32.672 32.672 31.999 0.673 18135 3617 1 4 . 1 1 131 131 LYS H H 131 7.493 7.493 7.835 -0.342 18135 3618 1 4 . 1 1 132 132 GLU N N 132 121.918 121.918 119.665 2.253 18135 3619 1 4 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.064 -0.220 18135 3620 1 4 . 1 1 132 132 GLU C C 132 178.377 178.377 178.160 0.217 18135 3621 1 4 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.730 0.157 18135 3622 1 4 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.372 -0.705 18135 3623 1 4 . 1 1 132 132 GLU H H 132 8.430 8.430 8.157 0.273 18135 3624 1 4 . 1 1 133 133 LYS N N 133 116.079 116.079 116.150 -0.071 18135 3625 1 4 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.242 -0.276 18135 3626 1 4 . 1 1 133 133 LYS C C 133 175.282 175.282 175.712 -0.430 18135 3627 1 4 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.755 -0.457 18135 3628 1 4 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.900 0.098 18135 3629 1 4 . 1 1 133 133 LYS H H 133 7.390 7.390 7.293 0.097 18135 3630 1 4 . 1 1 134 134 LYS N N 134 117.759 117.759 115.801 1.958 18135 3631 1 4 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.103 -0.521 18135 3632 1 4 . 1 1 134 134 LYS C C 134 176.271 176.271 175.994 0.277 18135 3633 1 4 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.841 0.467 18135 3634 1 4 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.076 -0.274 18135 3635 1 4 . 1 1 134 134 LYS H H 134 7.716 7.716 7.770 -0.054 18135 3636 1 4 . 1 1 135 135 TYR N N 135 110.598 110.598 113.641 -3.043 18135 3637 1 4 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.864 -0.987 18135 3638 1 4 . 1 1 135 135 TYR C C 135 174.148 174.148 175.134 -0.986 18135 3639 1 4 . 1 1 135 135 TYR CA C 135 59.715 59.715 58.995 0.720 18135 3640 1 4 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.079 -0.373 18135 3641 1 4 . 1 1 135 135 TYR H H 135 8.428 8.428 8.734 -0.306 18135 3642 1 4 . 1 1 136 136 SER N N 136 113.712 113.712 115.667 -1.955 18135 3643 1 4 . 1 1 136 136 SER HA H 136 4.553 4.553 4.364 0.189 18135 3644 1 4 . 1 1 136 136 SER CA C 136 57.108 57.108 58.705 -1.597 18135 3645 1 4 . 1 1 136 136 SER CB C 136 62.500 62.500 63.966 -1.466 18135 3646 1 4 . 1 1 136 136 SER H H 136 6.744 6.744 7.333 -0.589 18135 3647 1 4 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.440 -0.275 18135 3648 1 4 . 1 1 137 137 PRO C C 137 180.675 180.675 177.223 3.452 18135 3649 1 4 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.807 0.850 18135 3650 1 4 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.956 0.027 18135 3651 1 4 . 1 1 138 138 CYS N N 138 113.914 113.914 115.465 -1.551 18135 3652 1 4 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.527 0.143 18135 3653 1 4 . 1 1 138 138 CYS C C 138 176.015 176.015 176.281 -0.266 18135 3654 1 4 . 1 1 138 138 CYS CA C 138 57.095 57.095 61.203 -4.108 18135 3655 1 4 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.375 10.404 18135 3656 1 4 . 1 1 138 138 CYS H H 138 8.580 8.580 8.524 0.056 18135 3657 1 4 . 1 1 139 139 ALA N N 139 125.290 125.290 124.017 1.273 18135 3658 1 4 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.144 0.305 18135 3659 1 4 . 1 1 139 139 ALA C C 139 180.149 180.149 179.303 0.846 18135 3660 1 4 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.932 -0.154 18135 3661 1 4 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.158 0.760 18135 3662 1 4 . 1 1 139 139 ALA H H 139 8.087 8.087 8.052 0.035 18135 3663 1 4 . 1 1 140 140 TRP N N 140 116.599 116.599 118.433 -1.834 18135 3664 1 4 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.301 0.301 18135 3665 1 4 . 1 1 140 140 TRP C C 140 179.137 179.137 178.743 0.394 18135 3666 1 4 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.428 -0.894 18135 3667 1 4 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.324 -0.066 18135 3668 1 4 . 1 1 140 140 TRP H H 140 8.505 8.505 7.808 0.697 18135 3669 1 4 . 1 1 141 141 GLU N N 141 121.578 121.578 118.499 3.079 18135 3670 1 4 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.182 1.041 18135 3671 1 4 . 1 1 141 141 GLU C C 141 177.886 177.886 179.083 -1.197 18135 3672 1 4 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.159 -1.252 18135 3673 1 4 . 1 1 141 141 GLU CB C 141 28.717 28.717 28.658 0.059 18135 3674 1 4 . 1 1 141 141 GLU H H 141 8.182 8.182 8.155 0.027 18135 3675 1 4 . 1 1 142 142 VAL N N 142 121.202 121.202 120.529 0.673 18135 3676 1 4 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.563 0.067 18135 3677 1 4 . 1 1 142 142 VAL C C 142 180.246 180.246 178.407 1.839 18135 3678 1 4 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.951 0.032 18135 3679 1 4 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.531 0.291 18135 3680 1 4 . 1 1 142 142 VAL H H 142 8.623 8.623 8.021 0.602 18135 3681 1 4 . 1 1 143 143 VAL N N 143 120.119 120.119 119.562 0.557 18135 3682 1 4 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.773 -0.476 18135 3683 1 4 . 1 1 143 143 VAL C C 143 176.407 176.407 178.301 -1.894 18135 3684 1 4 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.522 1.456 18135 3685 1 4 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.220 0.435 18135 3686 1 4 . 1 1 143 143 VAL H H 143 8.323 8.323 8.203 0.120 18135 3687 1 4 . 1 1 144 144 ARG N N 144 124.102 124.102 119.604 4.498 18135 3688 1 4 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.000 -0.303 18135 3689 1 4 . 1 1 144 144 ARG C C 144 178.127 178.127 178.675 -0.548 18135 3690 1 4 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.127 1.874 18135 3691 1 4 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.745 0.191 18135 3692 1 4 . 1 1 144 144 ARG H H 144 9.619 9.619 8.475 1.144 18135 3693 1 4 . 1 1 145 145 ALA N N 145 119.431 119.431 122.006 -2.575 18135 3694 1 4 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.018 -0.167 18135 3695 1 4 . 1 1 145 145 ALA C C 145 180.763 180.763 179.982 0.781 18135 3696 1 4 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.418 -0.043 18135 3697 1 4 . 1 1 145 145 ALA CB C 145 18.185 18.185 17.882 0.303 18135 3698 1 4 . 1 1 145 145 ALA H H 145 8.867 8.867 8.744 0.123 18135 3699 1 4 . 1 1 146 146 GLU N N 146 121.815 121.815 117.822 3.993 18135 3700 1 4 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.141 0.070 18135 3701 1 4 . 1 1 146 146 GLU C C 146 177.296 177.296 179.344 -2.048 18135 3702 1 4 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.407 -1.028 18135 3703 1 4 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.492 -1.358 18135 3704 1 4 . 1 1 146 146 GLU H H 146 8.136 8.136 7.905 0.231 18135 3705 1 4 . 1 1 147 147 ILE N N 147 119.542 119.542 121.267 -1.725 18135 3706 1 4 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.948 0.022 18135 3707 1 4 . 1 1 147 147 ILE C C 147 178.283 178.283 178.085 0.198 18135 3708 1 4 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.290 -3.037 18135 3709 1 4 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.502 -2.163 18135 3710 1 4 . 1 1 147 147 ILE H H 147 8.736 8.736 8.234 0.502 18135 3711 1 4 . 1 1 148 148 MET N N 148 119.501 119.501 118.919 0.582 18135 3712 1 4 . 1 1 148 148 MET HA H 148 3.801 3.801 4.236 -0.435 18135 3713 1 4 . 1 1 148 148 MET C C 148 178.210 178.210 178.769 -0.559 18135 3714 1 4 . 1 1 148 148 MET CA C 148 60.184 60.184 59.792 0.392 18135 3715 1 4 . 1 1 148 148 MET CB C 148 32.914 32.914 32.065 0.849 18135 3716 1 4 . 1 1 148 148 MET H H 148 8.440 8.440 8.499 -0.060 18135 3717 1 4 . 1 1 149 149 ARG N N 149 119.734 119.734 119.973 -0.239 18135 3718 1 4 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.137 -0.222 18135 3719 1 4 . 1 1 149 149 ARG C C 149 178.978 178.978 179.186 -0.208 18135 3720 1 4 . 1 1 149 149 ARG CA C 149 59.863 59.863 58.844 1.019 18135 3721 1 4 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.448 0.832 18135 3722 1 4 . 1 1 149 149 ARG H H 149 7.648 7.648 8.338 -0.690 18135 3723 1 4 . 1 1 150 150 SER N N 150 118.109 118.109 115.719 2.390 18135 3724 1 4 . 1 1 150 150 SER HA H 150 3.339 3.339 4.503 -1.164 18135 3725 1 4 . 1 1 150 150 SER C C 150 177.292 177.292 176.364 0.928 18135 3726 1 4 . 1 1 150 150 SER CA C 150 61.316 61.316 62.114 -0.798 18135 3727 1 4 . 1 1 150 150 SER CB C 150 60.288 60.288 62.895 -2.607 18135 3728 1 4 . 1 1 150 150 SER H H 150 9.194 9.194 8.428 0.766 18135 3729 1 4 . 1 1 151 151 PHE N N 151 125.265 125.265 123.275 1.990 18135 3730 1 4 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.406 -0.370 18135 3731 1 4 . 1 1 151 151 PHE C C 151 178.696 178.696 177.844 0.852 18135 3732 1 4 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.624 1.796 18135 3733 1 4 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.719 0.167 18135 3734 1 4 . 1 1 151 151 PHE H H 151 9.455 9.455 8.454 1.001 18135 3735 1 4 . 1 1 152 152 SER N N 152 115.963 115.963 116.086 -0.123 18135 3736 1 4 . 1 1 152 152 SER HA H 152 3.880 3.880 3.921 -0.041 18135 3737 1 4 . 1 1 152 152 SER C C 152 175.858 175.858 176.735 -0.877 18135 3738 1 4 . 1 1 152 152 SER CA C 152 62.388 62.388 61.119 1.269 18135 3739 1 4 . 1 1 152 152 SER CB C 152 62.519 62.519 63.370 -0.851 18135 3740 1 4 . 1 1 152 152 SER H H 152 7.839 7.839 8.345 -0.506 18135 3741 1 4 . 1 1 153 153 LEU N N 153 121.365 121.365 122.807 -1.442 18135 3742 1 4 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.106 -0.025 18135 3743 1 4 . 1 1 153 153 LEU C C 153 179.515 179.515 177.598 1.917 18135 3744 1 4 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.853 0.030 18135 3745 1 4 . 1 1 153 153 LEU CB C 153 42.342 42.342 42.357 -0.015 18135 3746 1 4 . 1 1 153 153 LEU H H 153 7.775 7.775 8.006 -0.231 18135 3747 1 4 . 1 1 154 154 SER N N 154 113.950 113.950 111.972 1.978 18135 3748 1 4 . 1 1 154 154 SER HA H 154 3.781 3.781 4.420 -0.639 18135 3749 1 4 . 1 1 154 154 SER C C 154 174.312 174.312 176.532 -2.220 18135 3750 1 4 . 1 1 154 154 SER CA C 154 61.366 61.366 61.026 0.340 18135 3751 1 4 . 1 1 154 154 SER CB C 154 63.242 63.242 63.499 -0.257 18135 3752 1 4 . 1 1 154 154 SER H H 154 7.874 7.874 8.444 -0.570 18135 3753 1 4 . 1 1 155 155 THR N N 155 109.346 109.346 112.525 -3.179 18135 3754 1 4 . 1 1 155 155 THR HA H 155 4.060 4.060 4.357 -0.297 18135 3755 1 4 . 1 1 155 155 THR C C 155 174.798 174.798 176.483 -1.685 18135 3756 1 4 . 1 1 155 155 THR CA C 155 62.275 62.275 64.569 -2.294 18135 3757 1 4 . 1 1 155 155 THR CB C 155 69.342 69.342 69.021 0.321 18135 3758 1 4 . 1 1 155 155 THR H H 155 7.176 7.176 7.797 -0.621 18135 3759 1 4 . 1 1 156 156 ASN N N 156 119.785 119.785 120.661 -0.876 18135 3760 1 4 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.709 -0.182 18135 3761 1 4 . 1 1 156 156 ASN C C 156 175.528 175.528 175.394 0.134 18135 3762 1 4 . 1 1 156 156 ASN CA C 156 53.937 53.937 53.106 0.831 18135 3763 1 4 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.953 0.385 18135 3764 1 4 . 1 1 156 156 ASN H H 156 7.749 7.749 8.028 -0.279 18135 3765 1 4 . 1 1 157 157 LEU N N 157 120.552 120.552 122.298 -1.746 18135 3766 1 4 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.488 -0.233 18135 3767 1 4 . 1 1 157 157 LEU C C 157 174.702 174.702 178.168 -3.466 18135 3768 1 4 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.328 -0.654 18135 3769 1 4 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.369 -0.018 18135 3770 1 4 . 1 1 157 157 LEU H H 157 8.097 8.097 8.232 -0.135 18135 3771 1 4 . 1 1 158 158 GLN N N 158 119.860 119.860 117.977 1.883 18135 3772 1 4 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.224 -0.044 18135 3773 1 4 . 1 1 158 158 GLN C C 158 176.434 176.434 176.104 0.330 18135 3774 1 4 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.462 1.435 18135 3775 1 4 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.329 -0.319 18135 3776 1 4 . 1 1 158 158 GLN H H 158 8.230 8.230 8.031 0.199 18135 3777 1 4 . 1 1 159 159 GLU N N 159 120.461 120.461 117.235 3.226 18135 3778 1 4 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.952 0.267 18135 3779 1 4 . 1 1 159 159 GLU C C 159 175.251 175.251 175.529 -0.278 18135 3780 1 4 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.573 -0.878 18135 3781 1 4 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.454 0.527 18135 3782 1 4 . 1 1 159 159 GLU H H 159 8.300 8.300 8.608 -0.308 18135 3783 1 4 . 1 1 160 160 SER N N 160 115.719 115.719 112.473 3.246 18135 3784 1 4 . 1 1 160 160 SER HA H 160 4.372 4.372 4.512 -0.140 18135 3785 1 4 . 1 1 160 160 SER C C 160 174.188 174.188 173.202 0.986 18135 3786 1 4 . 1 1 160 160 SER CA C 160 58.481 58.481 58.467 0.014 18135 3787 1 4 . 1 1 160 160 SER CB C 160 63.731 63.731 63.671 0.060 18135 3788 1 4 . 1 1 160 160 SER H H 160 8.113 8.113 8.238 -0.125 18135 3789 1 4 . 1 1 161 161 LEU N N 161 123.794 123.794 123.079 0.715 18135 3790 1 4 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.393 -0.113 18135 3791 1 4 . 1 1 161 161 LEU C C 161 177.293 177.293 176.083 1.210 18135 3792 1 4 . 1 1 161 161 LEU CA C 161 55.190 55.190 54.636 0.554 18135 3793 1 4 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.245 0.040 18135 3794 1 4 . 1 1 161 161 LEU H H 161 8.032 8.032 7.803 0.229 18135 3795 1 4 . 1 1 162 162 ARG N N 162 120.715 120.715 123.046 -2.331 18135 3796 1 4 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.618 -0.449 18135 3797 1 4 . 1 1 162 162 ARG C C 162 176.288 176.288 174.750 1.538 18135 3798 1 4 . 1 1 162 162 ARG CA C 162 57.046 57.046 54.554 2.492 18135 3799 1 4 . 1 1 162 162 ARG CB C 162 30.935 30.935 34.269 -3.334 18135 3800 1 4 . 1 1 162 162 ARG H H 162 8.094 8.094 8.527 -0.433 18135 3801 1 4 . 1 1 163 163 SER N N 163 116.670 116.670 118.261 -1.591 18135 3802 1 4 . 1 1 163 163 SER HA H 163 4.372 4.372 4.368 0.004 18135 3803 1 4 . 1 1 163 163 SER C C 163 174.184 174.184 175.089 -0.905 18135 3804 1 4 . 1 1 163 163 SER CA C 163 58.481 58.481 59.164 -0.683 18135 3805 1 4 . 1 1 163 163 SER CB C 163 63.745 63.745 63.277 0.468 18135 3806 1 4 . 1 1 163 163 SER H H 163 8.191 8.191 8.740 -0.549 18135 3807 1 4 . 1 1 164 164 LYS N N 164 123.100 123.100 124.653 -1.553 18135 3808 1 4 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.405 -0.128 18135 3809 1 4 . 1 1 164 164 LYS C C 164 175.617 175.617 176.415 -0.798 18135 3810 1 4 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.489 -0.176 18135 3811 1 4 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.859 0.106 18135 3812 1 4 . 1 1 164 164 LYS H H 164 8.251 8.251 8.460 -0.209 18135 3813 1 5 . 1 1 2 2 ASP N N 2 125.691 125.691 120.027 5.664 18135 3814 1 5 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.514 0.196 18135 3815 1 5 . 1 1 2 2 ASP C C 2 174.758 174.758 176.003 -1.245 18135 3816 1 5 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.950 -2.107 18135 3817 1 5 . 1 1 2 2 ASP CB C 2 39.321 39.321 40.653 -1.332 18135 3818 1 5 . 1 1 2 2 ASP H H 2 8.773 8.773 8.526 0.247 18135 3819 1 5 . 1 1 3 3 LEU N N 3 123.957 123.957 118.104 5.853 18135 3820 1 5 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.329 0.072 18135 3821 1 5 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.223 0.430 18135 3822 1 5 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.135 0.421 18135 3823 1 5 . 1 1 3 3 LEU H H 3 8.164 8.164 7.418 0.746 18135 3824 1 5 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.495 -0.181 18135 3825 1 5 . 1 1 4 4 PRO C C 4 176.213 176.213 176.297 -0.084 18135 3826 1 5 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.199 0.709 18135 3827 1 5 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.440 1.454 18135 3828 1 5 . 1 1 5 5 GLN N N 5 121.621 121.621 122.447 -0.826 18135 3829 1 5 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.148 0.078 18135 3830 1 5 . 1 1 5 5 GLN C C 5 176.995 176.995 176.666 0.329 18135 3831 1 5 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.159 -1.449 18135 3832 1 5 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.226 -0.275 18135 3833 1 5 . 1 1 5 5 GLN H H 5 8.767 8.767 8.507 0.260 18135 3834 1 5 . 1 1 6 6 THR N N 6 111.419 111.419 111.073 0.346 18135 3835 1 5 . 1 1 6 6 THR HA H 6 4.135 4.135 4.404 -0.269 18135 3836 1 5 . 1 1 6 6 THR C C 6 174.695 174.695 175.463 -0.768 18135 3837 1 5 . 1 1 6 6 THR CA C 6 62.661 62.661 63.535 -0.874 18135 3838 1 5 . 1 1 6 6 THR CB C 6 69.365 69.365 68.488 0.877 18135 3839 1 5 . 1 1 6 6 THR H H 6 7.865 7.865 8.525 -0.660 18135 3840 1 5 . 1 1 7 7 HIS N N 7 119.137 119.137 119.709 -0.572 18135 3841 1 5 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.672 -0.087 18135 3842 1 5 . 1 1 7 7 HIS C C 7 174.980 174.980 175.398 -0.418 18135 3843 1 5 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.350 -2.346 18135 3844 1 5 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.808 -1.645 18135 3845 1 5 . 1 1 7 7 HIS H H 7 8.567 8.567 8.180 0.387 18135 3846 1 5 . 1 1 8 8 SER N N 8 115.796 115.796 115.422 0.374 18135 3847 1 5 . 1 1 8 8 SER HA H 8 4.363 4.363 4.434 -0.071 18135 3848 1 5 . 1 1 8 8 SER C C 8 175.312 175.312 175.620 -0.308 18135 3849 1 5 . 1 1 8 8 SER CA C 8 58.969 58.969 60.339 -1.370 18135 3850 1 5 . 1 1 8 8 SER CB C 8 63.439 63.439 63.438 0.001 18135 3851 1 5 . 1 1 8 8 SER H H 8 8.180 8.180 8.038 0.142 18135 3852 1 5 . 1 1 9 9 LEU N N 9 123.844 123.844 117.295 6.549 18135 3853 1 5 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.806 -0.651 18135 3854 1 5 . 1 1 9 9 LEU C C 9 178.568 178.568 178.501 0.067 18135 3855 1 5 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.529 0.437 18135 3856 1 5 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.370 -0.574 18135 3857 1 5 . 1 1 9 9 LEU H H 9 8.404 8.404 7.614 0.790 18135 3858 1 5 . 1 1 10 10 GLY N N 10 107.582 107.582 107.359 0.223 18135 3859 1 5 . 1 1 10 10 GLY C C 10 174.586 174.586 175.482 -0.896 18135 3860 1 5 . 1 1 10 10 GLY CA C 10 46.905 46.905 46.876 0.029 18135 3861 1 5 . 1 1 10 10 GLY H H 10 8.438 8.438 8.631 -0.193 18135 3862 1 5 . 1 1 11 11 SER N N 11 118.806 118.806 117.304 1.502 18135 3863 1 5 . 1 1 11 11 SER HA H 11 4.156 4.156 4.190 -0.034 18135 3864 1 5 . 1 1 11 11 SER C C 11 175.749 175.749 176.464 -0.715 18135 3865 1 5 . 1 1 11 11 SER CA C 11 61.299 61.299 62.039 -0.740 18135 3866 1 5 . 1 1 11 11 SER CB C 11 62.653 62.653 63.160 -0.507 18135 3867 1 5 . 1 1 11 11 SER H H 11 8.249 8.249 8.381 -0.132 18135 3868 1 5 . 1 1 12 12 ARG N N 12 121.986 121.986 121.598 0.388 18135 3869 1 5 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.048 -0.094 18135 3870 1 5 . 1 1 12 12 ARG C C 12 178.283 178.283 178.301 -0.018 18135 3871 1 5 . 1 1 12 12 ARG CA C 12 59.830 59.830 59.235 0.595 18135 3872 1 5 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.075 -0.491 18135 3873 1 5 . 1 1 12 12 ARG H H 12 8.027 8.027 7.799 0.228 18135 3874 1 5 . 1 1 13 13 ARG N N 13 119.432 119.432 118.555 0.877 18135 3875 1 5 . 1 1 13 13 ARG HA H 13 3.839 3.839 3.979 -0.140 18135 3876 1 5 . 1 1 13 13 ARG C C 13 178.480 178.480 178.854 -0.374 18135 3877 1 5 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.745 0.746 18135 3878 1 5 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.836 0.246 18135 3879 1 5 . 1 1 13 13 ARG H H 13 8.437 8.437 7.774 0.663 18135 3880 1 5 . 1 1 14 14 THR N N 14 116.879 116.879 117.162 -0.283 18135 3881 1 5 . 1 1 14 14 THR HA H 14 3.532 3.532 4.013 -0.481 18135 3882 1 5 . 1 1 14 14 THR C C 14 175.584 175.584 176.918 -1.334 18135 3883 1 5 . 1 1 14 14 THR CA C 14 68.036 68.036 66.690 1.346 18135 3884 1 5 . 1 1 14 14 THR CB C 14 67.969 67.969 68.678 -0.709 18135 3885 1 5 . 1 1 14 14 THR H H 14 7.957 7.957 8.310 -0.353 18135 3886 1 5 . 1 1 15 15 LEU N N 15 120.252 120.252 122.100 -1.848 18135 3887 1 5 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.942 0.004 18135 3888 1 5 . 1 1 15 15 LEU C C 15 178.652 178.652 179.106 -0.454 18135 3889 1 5 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.261 -0.173 18135 3890 1 5 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.822 -0.268 18135 3891 1 5 . 1 1 15 15 LEU H H 15 7.550 7.550 8.124 -0.574 18135 3892 1 5 . 1 1 16 16 MET N N 16 118.788 118.788 117.139 1.649 18135 3893 1 5 . 1 1 16 16 MET HA H 16 4.023 4.023 3.998 0.025 18135 3894 1 5 . 1 1 16 16 MET C C 16 178.718 178.718 178.860 -0.142 18135 3895 1 5 . 1 1 16 16 MET CA C 16 58.513 58.513 58.600 -0.087 18135 3896 1 5 . 1 1 16 16 MET CB C 16 32.150 32.150 31.549 0.601 18135 3897 1 5 . 1 1 16 16 MET H H 16 7.985 7.985 8.464 -0.479 18135 3898 1 5 . 1 1 17 17 LEU N N 17 120.644 120.644 119.778 0.866 18135 3899 1 5 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.987 -0.015 18135 3900 1 5 . 1 1 17 17 LEU C C 17 178.238 178.238 179.293 -1.055 18135 3901 1 5 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.562 -0.835 18135 3902 1 5 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.224 0.911 18135 3903 1 5 . 1 1 17 17 LEU H H 17 7.829 7.829 8.540 -0.711 18135 3904 1 5 . 1 1 18 18 LEU N N 18 118.280 118.280 118.819 -0.539 18135 3905 1 5 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.834 -0.328 18135 3906 1 5 . 1 1 18 18 LEU C C 18 175.739 175.739 178.564 -2.825 18135 3907 1 5 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.379 0.277 18135 3908 1 5 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.461 0.781 18135 3909 1 5 . 1 1 18 18 LEU H H 18 7.499 7.499 8.354 -0.855 18135 3910 1 5 . 1 1 19 19 ALA N N 19 121.961 121.961 120.566 1.395 18135 3911 1 5 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.143 -0.306 18135 3912 1 5 . 1 1 19 19 ALA C C 19 180.736 180.736 178.157 2.579 18135 3913 1 5 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.084 0.982 18135 3914 1 5 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.326 -1.249 18135 3915 1 5 . 1 1 19 19 ALA H H 19 7.950 7.950 7.751 0.199 18135 3916 1 5 . 1 1 20 20 GLN N N 20 118.605 118.605 116.020 2.585 18135 3917 1 5 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.206 -0.271 18135 3918 1 5 . 1 1 20 20 GLN C C 20 176.945 176.945 177.336 -0.391 18135 3919 1 5 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.483 0.532 18135 3920 1 5 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.376 -0.902 18135 3921 1 5 . 1 1 20 20 GLN H H 20 7.958 7.958 8.156 -0.198 18135 3922 1 5 . 1 1 21 21 MET N N 21 116.693 116.693 115.948 0.745 18135 3923 1 5 . 1 1 21 21 MET HA H 21 3.861 3.861 4.589 -0.728 18135 3924 1 5 . 1 1 21 21 MET C C 21 174.671 174.671 175.364 -0.693 18135 3925 1 5 . 1 1 21 21 MET CA C 21 57.111 57.111 57.044 0.067 18135 3926 1 5 . 1 1 21 21 MET CB C 21 34.073 34.073 34.261 -0.188 18135 3927 1 5 . 1 1 21 21 MET H H 21 7.420 7.420 7.601 -0.181 18135 3928 1 5 . 1 1 22 22 ARG N N 22 115.451 115.451 121.046 -5.595 18135 3929 1 5 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.656 0.197 18135 3930 1 5 . 1 1 22 22 ARG C C 22 175.950 175.950 174.713 1.237 18135 3931 1 5 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.432 3.020 18135 3932 1 5 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.451 1.063 18135 3933 1 5 . 1 1 22 22 ARG H H 22 6.484 6.484 7.234 -0.750 18135 3934 1 5 . 1 1 23 23 LYS N N 23 128.593 128.593 127.351 1.242 18135 3935 1 5 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.615 -0.130 18135 3936 1 5 . 1 1 23 23 LYS C C 23 176.643 176.643 175.545 1.098 18135 3937 1 5 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.949 1.338 18135 3938 1 5 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.369 3.892 18135 3939 1 5 . 1 1 23 23 LYS H H 23 10.212 10.212 8.767 1.445 18135 3940 1 5 . 1 1 24 24 ILE N N 24 118.605 118.605 121.381 -2.776 18135 3941 1 5 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.418 0.067 18135 3942 1 5 . 1 1 24 24 ILE C C 24 173.878 173.878 174.497 -0.619 18135 3943 1 5 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.695 -1.098 18135 3944 1 5 . 1 1 24 24 ILE CB C 24 41.456 41.456 40.939 0.517 18135 3945 1 5 . 1 1 24 24 ILE H H 24 8.465 8.465 8.394 0.071 18135 3946 1 5 . 1 1 25 25 SER N N 25 113.658 113.658 118.253 -4.595 18135 3947 1 5 . 1 1 25 25 SER HA H 25 4.481 4.481 4.941 -0.460 18135 3948 1 5 . 1 1 25 25 SER C C 25 176.359 176.359 175.868 0.491 18135 3949 1 5 . 1 1 25 25 SER CA C 25 56.975 56.975 57.226 -0.251 18135 3950 1 5 . 1 1 25 25 SER CB C 25 64.759 64.759 63.646 1.113 18135 3951 1 5 . 1 1 25 25 SER H H 25 8.104 8.104 8.542 -0.438 18135 3952 1 5 . 1 1 26 26 LEU N N 26 127.566 127.566 124.568 2.998 18135 3953 1 5 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.232 -0.355 18135 3954 1 5 . 1 1 26 26 LEU C C 26 178.946 178.946 177.052 1.894 18135 3955 1 5 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.130 0.548 18135 3956 1 5 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.758 -0.039 18135 3957 1 5 . 1 1 26 26 LEU H H 26 8.802 8.802 8.928 -0.126 18135 3958 1 5 . 1 1 27 27 PHE N N 27 117.143 117.143 116.628 0.515 18135 3959 1 5 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.651 -0.413 18135 3960 1 5 . 1 1 27 27 PHE C C 27 177.067 177.067 176.832 0.235 18135 3961 1 5 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.495 1.595 18135 3962 1 5 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.417 -0.155 18135 3963 1 5 . 1 1 27 27 PHE H H 27 7.986 7.986 7.918 0.068 18135 3964 1 5 . 1 1 28 28 SER N N 28 115.200 115.200 116.605 -1.405 18135 3965 1 5 . 1 1 28 28 SER HA H 28 4.505 4.505 4.383 0.122 18135 3966 1 5 . 1 1 28 28 SER C C 28 174.533 174.533 174.842 -0.309 18135 3967 1 5 . 1 1 28 28 SER CA C 28 59.447 59.447 60.663 -1.216 18135 3968 1 5 . 1 1 28 28 SER CB C 28 63.790 63.790 63.567 0.223 18135 3969 1 5 . 1 1 28 28 SER H H 28 7.929 7.929 8.128 -0.199 18135 3970 1 5 . 1 1 29 29 CYS N N 29 119.870 119.870 120.374 -0.504 18135 3971 1 5 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.715 0.367 18135 3972 1 5 . 1 1 29 29 CYS C C 29 176.475 176.475 174.482 1.993 18135 3973 1 5 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.292 -4.862 18135 3974 1 5 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.423 9.819 18135 3975 1 5 . 1 1 29 29 CYS H H 29 7.865 7.865 7.817 0.048 18135 3976 1 5 . 1 1 30 30 LEU N N 30 122.259 122.259 123.720 -1.461 18135 3977 1 5 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.377 -0.416 18135 3978 1 5 . 1 1 30 30 LEU C C 30 179.774 179.774 177.454 2.320 18135 3979 1 5 . 1 1 30 30 LEU CA C 30 58.303 58.303 55.014 3.289 18135 3980 1 5 . 1 1 30 30 LEU CB C 30 41.576 41.576 41.775 -0.199 18135 3981 1 5 . 1 1 30 30 LEU H H 30 7.812 7.812 8.580 -0.768 18135 3982 1 5 . 1 1 31 31 LYS N N 31 117.731 117.731 116.396 1.335 18135 3983 1 5 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.339 0.351 18135 3984 1 5 . 1 1 31 31 LYS C C 31 176.692 176.692 175.640 1.052 18135 3985 1 5 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.070 -2.993 18135 3986 1 5 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.618 -1.031 18135 3987 1 5 . 1 1 31 31 LYS H H 31 8.597 8.597 8.098 0.499 18135 3988 1 5 . 1 1 32 32 ASP N N 32 117.841 117.841 117.392 0.449 18135 3989 1 5 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.673 0.021 18135 3990 1 5 . 1 1 32 32 ASP C C 32 175.505 175.505 176.486 -0.981 18135 3991 1 5 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.551 -0.463 18135 3992 1 5 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.053 -0.245 18135 3993 1 5 . 1 1 32 32 ASP H H 32 7.808 7.808 7.442 0.366 18135 3994 1 5 . 1 1 33 33 ARG N N 33 120.876 120.876 119.397 1.479 18135 3995 1 5 . 1 1 33 33 ARG HA H 33 4.041 4.041 3.847 0.194 18135 3996 1 5 . 1 1 33 33 ARG C C 33 175.286 175.286 175.554 -0.268 18135 3997 1 5 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.604 -0.521 18135 3998 1 5 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.084 -0.071 18135 3999 1 5 . 1 1 33 33 ARG H H 33 7.378 7.378 7.574 -0.196 18135 4000 1 5 . 1 1 34 34 HIS N N 34 120.555 120.555 115.919 4.636 18135 4001 1 5 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.658 -0.446 18135 4002 1 5 . 1 1 34 34 HIS C C 34 170.494 170.494 173.696 -3.202 18135 4003 1 5 . 1 1 34 34 HIS CA C 34 54.607 54.607 55.409 -0.802 18135 4004 1 5 . 1 1 34 34 HIS CB C 34 31.488 31.488 32.766 -1.278 18135 4005 1 5 . 1 1 34 34 HIS H H 34 7.974 7.974 7.719 0.255 18135 4006 1 5 . 1 1 35 35 ASP N N 35 125.061 125.061 122.551 2.510 18135 4007 1 5 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.428 0.210 18135 4008 1 5 . 1 1 35 35 ASP C C 35 175.943 175.943 176.605 -0.662 18135 4009 1 5 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.630 -2.261 18135 4010 1 5 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.088 -0.726 18135 4011 1 5 . 1 1 35 35 ASP H H 35 7.805 7.805 8.585 -0.780 18135 4012 1 5 . 1 1 36 36 PHE N N 36 122.860 122.860 120.579 2.281 18135 4013 1 5 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.318 0.007 18135 4014 1 5 . 1 1 36 36 PHE C C 36 176.643 176.643 177.392 -0.749 18135 4015 1 5 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.940 0.699 18135 4016 1 5 . 1 1 36 36 PHE CB C 36 40.691 40.691 38.719 1.972 18135 4017 1 5 . 1 1 36 36 PHE H H 36 8.973 8.973 7.483 1.490 18135 4018 1 5 . 1 1 37 37 GLY N N 37 111.856 111.856 109.823 2.033 18135 4019 1 5 . 1 1 37 37 GLY C C 37 175.185 175.185 174.249 0.936 18135 4020 1 5 . 1 1 37 37 GLY CA C 37 48.143 48.143 45.114 3.029 18135 4021 1 5 . 1 1 37 37 GLY H H 37 8.727 8.727 8.635 0.092 18135 4022 1 5 . 1 1 38 38 PHE N N 38 123.178 123.178 122.035 1.143 18135 4023 1 5 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.591 -0.677 18135 4024 1 5 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.817 1.987 18135 4025 1 5 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.063 0.594 18135 4026 1 5 . 1 1 38 38 PHE H H 38 9.169 9.169 7.715 1.454 18135 4027 1 5 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.398 0.131 18135 4028 1 5 . 1 1 39 39 PRO C C 39 174.634 174.634 177.063 -2.429 18135 4029 1 5 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.664 -1.121 18135 4030 1 5 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.027 -1.323 18135 4031 1 5 . 1 1 40 40 GLN N N 40 123.608 123.608 121.684 1.924 18135 4032 1 5 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.140 -0.521 18135 4033 1 5 . 1 1 40 40 GLN C C 40 176.958 176.958 177.464 -0.506 18135 4034 1 5 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.171 -1.098 18135 4035 1 5 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.592 1.225 18135 4036 1 5 . 1 1 40 40 GLN H H 40 7.966 7.966 7.983 -0.017 18135 4037 1 5 . 1 1 41 41 GLU N N 41 119.446 119.446 120.696 -1.250 18135 4038 1 5 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.085 0.052 18135 4039 1 5 . 1 1 41 41 GLU C C 41 177.346 177.346 177.983 -0.637 18135 4040 1 5 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.876 -0.947 18135 4041 1 5 . 1 1 41 41 GLU CB C 41 27.833 27.833 28.974 -1.141 18135 4042 1 5 . 1 1 41 41 GLU H H 41 9.044 9.044 8.574 0.470 18135 4043 1 5 . 1 1 42 42 GLU N N 42 117.196 117.196 116.892 0.304 18135 4044 1 5 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.312 -0.249 18135 4045 1 5 . 1 1 42 42 GLU C C 42 174.886 174.886 178.030 -3.144 18135 4046 1 5 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.775 -1.391 18135 4047 1 5 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.782 -2.224 18135 4048 1 5 . 1 1 42 42 GLU H H 42 7.646 7.646 7.810 -0.164 18135 4049 1 5 . 1 1 43 43 PHE N N 43 115.527 115.527 122.837 -7.310 18135 4050 1 5 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.565 -0.079 18135 4051 1 5 . 1 1 43 43 PHE C C 43 175.615 175.615 176.037 -0.422 18135 4052 1 5 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.614 -1.066 18135 4053 1 5 . 1 1 43 43 PHE CB C 43 39.893 39.893 39.875 0.018 18135 4054 1 5 . 1 1 43 43 PHE H H 43 7.601 7.601 8.622 -1.021 18135 4055 1 5 . 1 1 44 44 GLY N N 44 107.243 107.243 108.753 -1.510 18135 4056 1 5 . 1 1 44 44 GLY C C 44 174.032 174.032 174.180 -0.148 18135 4057 1 5 . 1 1 44 44 GLY CA C 44 45.612 45.612 46.013 -0.401 18135 4058 1 5 . 1 1 44 44 GLY H H 44 7.733 7.733 7.847 -0.114 18135 4059 1 5 . 1 1 45 45 ASN N N 45 117.599 117.599 121.360 -3.761 18135 4060 1 5 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.734 -0.183 18135 4061 1 5 . 1 1 45 45 ASN C C 45 175.894 175.894 175.042 0.852 18135 4062 1 5 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.855 0.994 18135 4063 1 5 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.918 -1.499 18135 4064 1 5 . 1 1 45 45 ASN H H 45 8.343 8.343 7.648 0.695 18135 4065 1 5 . 1 1 46 46 GLN N N 46 118.916 118.916 119.194 -0.278 18135 4066 1 5 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.371 -0.289 18135 4067 1 5 . 1 1 46 46 GLN C C 46 175.851 175.851 176.800 -0.949 18135 4068 1 5 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.532 1.114 18135 4069 1 5 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.128 0.316 18135 4070 1 5 . 1 1 46 46 GLN H H 46 8.652 8.652 8.685 -0.033 18135 4071 1 5 . 1 1 47 47 PHE N N 47 119.511 119.511 119.317 0.194 18135 4072 1 5 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.453 0.109 18135 4073 1 5 . 1 1 47 47 PHE C C 47 176.258 176.258 175.752 0.506 18135 4074 1 5 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.683 -0.763 18135 4075 1 5 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.569 0.289 18135 4076 1 5 . 1 1 47 47 PHE H H 47 7.904 7.904 7.947 -0.043 18135 4077 1 5 . 1 1 48 48 GLN N N 48 120.127 120.127 118.052 2.075 18135 4078 1 5 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.448 -0.073 18135 4079 1 5 . 1 1 48 48 GLN C C 48 181.265 181.265 175.479 5.786 18135 4080 1 5 . 1 1 48 48 GLN CA C 48 55.576 55.576 55.088 0.488 18135 4081 1 5 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.047 -0.578 18135 4082 1 5 . 1 1 48 48 GLN H H 48 8.255 8.255 7.591 0.664 18135 4083 1 5 . 1 1 49 49 LYS N N 49 121.777 121.777 124.306 -2.529 18135 4084 1 5 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.347 -0.244 18135 4085 1 5 . 1 1 49 49 LYS C C 49 177.968 177.968 178.238 -0.270 18135 4086 1 5 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.984 -0.835 18135 4087 1 5 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.313 0.077 18135 4088 1 5 . 1 1 49 49 LYS H H 49 8.426 8.426 8.643 -0.217 18135 4089 1 5 . 1 1 50 50 ALA N N 50 120.573 120.573 119.709 0.864 18135 4090 1 5 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.162 -0.092 18135 4091 1 5 . 1 1 50 50 ALA C C 50 178.697 178.697 177.576 1.121 18135 4092 1 5 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.930 0.838 18135 4093 1 5 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.016 0.858 18135 4094 1 5 . 1 1 50 50 ALA H H 50 8.578 8.578 8.203 0.375 18135 4095 1 5 . 1 1 51 51 GLU N N 51 115.015 115.015 113.652 1.363 18135 4096 1 5 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.273 -0.007 18135 4097 1 5 . 1 1 51 51 GLU C C 51 176.995 176.995 176.876 0.119 18135 4098 1 5 . 1 1 51 51 GLU CA C 51 56.993 56.993 56.977 0.016 18135 4099 1 5 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.165 -1.260 18135 4100 1 5 . 1 1 51 51 GLU H H 51 7.907 7.907 8.228 -0.321 18135 4101 1 5 . 1 1 52 52 THR N N 52 111.210 111.210 116.161 -4.951 18135 4102 1 5 . 1 1 52 52 THR HA H 52 4.114 4.114 4.293 -0.179 18135 4103 1 5 . 1 1 52 52 THR C C 52 175.271 175.271 175.577 -0.306 18135 4104 1 5 . 1 1 52 52 THR CA C 52 63.611 63.611 64.304 -0.693 18135 4105 1 5 . 1 1 52 52 THR CB C 52 69.673 69.673 68.801 0.872 18135 4106 1 5 . 1 1 52 52 THR H H 52 7.863 7.863 7.522 0.341 18135 4107 1 5 . 1 1 53 53 ILE N N 53 119.113 119.113 122.006 -2.893 18135 4108 1 5 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.125 -0.261 18135 4109 1 5 . 1 1 53 53 ILE CA C 53 66.907 66.907 66.138 0.769 18135 4110 1 5 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.225 -1.272 18135 4111 1 5 . 1 1 53 53 ILE H H 53 8.341 8.341 7.793 0.548 18135 4112 1 5 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.362 -0.076 18135 4113 1 5 . 1 1 54 54 PRO C C 54 179.655 179.655 178.860 0.795 18135 4114 1 5 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.319 -0.268 18135 4115 1 5 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.152 0.733 18135 4116 1 5 . 1 1 55 55 VAL N N 55 116.355 116.355 116.419 -0.064 18135 4117 1 5 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.808 -0.127 18135 4118 1 5 . 1 1 55 55 VAL C C 55 177.649 177.649 178.138 -0.489 18135 4119 1 5 . 1 1 55 55 VAL CA C 55 65.837 65.837 66.298 -0.461 18135 4120 1 5 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.386 0.085 18135 4121 1 5 . 1 1 55 55 VAL H H 55 7.119 7.119 7.345 -0.226 18135 4122 1 5 . 1 1 56 56 LEU N N 56 123.038 123.038 121.185 1.853 18135 4123 1 5 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.055 0.255 18135 4124 1 5 . 1 1 56 56 LEU C C 56 178.637 178.637 177.769 0.868 18135 4125 1 5 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.279 -0.193 18135 4126 1 5 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.399 0.919 18135 4127 1 5 . 1 1 56 56 LEU H H 56 8.535 8.535 8.385 0.150 18135 4128 1 5 . 1 1 57 57 HIS N N 57 117.041 117.041 118.531 -1.490 18135 4129 1 5 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.010 -0.224 18135 4130 1 5 . 1 1 57 57 HIS C C 57 175.640 175.640 177.339 -1.699 18135 4131 1 5 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.702 0.829 18135 4132 1 5 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.131 -1.922 18135 4133 1 5 . 1 1 57 57 HIS H H 57 9.047 9.047 8.030 1.017 18135 4134 1 5 . 1 1 58 58 GLU N N 58 119.521 119.521 118.476 1.045 18135 4135 1 5 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.766 0.241 18135 4136 1 5 . 1 1 58 58 GLU C C 58 179.029 179.029 178.669 0.360 18135 4137 1 5 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.230 -0.263 18135 4138 1 5 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.269 -0.979 18135 4139 1 5 . 1 1 58 58 GLU H H 58 7.860 7.860 8.128 -0.268 18135 4140 1 5 . 1 1 59 59 MET N N 59 119.512 119.512 120.218 -0.706 18135 4141 1 5 . 1 1 59 59 MET HA H 59 4.074 4.074 4.194 -0.120 18135 4142 1 5 . 1 1 59 59 MET C C 59 177.031 177.031 178.835 -1.804 18135 4143 1 5 . 1 1 59 59 MET CA C 59 59.408 59.408 59.514 -0.106 18135 4144 1 5 . 1 1 59 59 MET CB C 59 32.525 32.525 32.858 -0.333 18135 4145 1 5 . 1 1 59 59 MET H H 59 8.442 8.442 7.991 0.451 18135 4146 1 5 . 1 1 60 60 ILE N N 60 117.183 117.183 118.070 -0.887 18135 4147 1 5 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.479 -0.062 18135 4148 1 5 . 1 1 60 60 ILE C C 60 177.524 177.524 178.115 -0.591 18135 4149 1 5 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.998 0.328 18135 4150 1 5 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.257 -0.397 18135 4151 1 5 . 1 1 60 60 ILE H H 60 8.338 8.338 7.737 0.601 18135 4152 1 5 . 1 1 61 61 GLN N N 61 120.191 120.191 119.755 0.436 18135 4153 1 5 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.937 -0.235 18135 4154 1 5 . 1 1 61 61 GLN C C 61 178.270 178.270 177.819 0.451 18135 4155 1 5 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.465 -0.679 18135 4156 1 5 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.259 0.407 18135 4157 1 5 . 1 1 61 61 GLN H H 61 8.234 8.234 8.204 0.030 18135 4158 1 5 . 1 1 62 62 GLN N N 62 116.795 116.795 118.956 -2.161 18135 4159 1 5 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.451 0.176 18135 4160 1 5 . 1 1 62 62 GLN C C 62 179.685 179.685 178.349 1.336 18135 4161 1 5 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.462 -0.453 18135 4162 1 5 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.739 -3.397 18135 4163 1 5 . 1 1 62 62 GLN H H 62 8.421 8.421 8.195 0.226 18135 4164 1 5 . 1 1 63 63 ILE N N 63 122.797 122.797 120.089 2.708 18135 4165 1 5 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.866 -0.217 18135 4166 1 5 . 1 1 63 63 ILE C C 63 177.279 177.279 177.891 -0.612 18135 4167 1 5 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.767 2.198 18135 4168 1 5 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.810 -0.495 18135 4169 1 5 . 1 1 63 63 ILE H H 63 8.164 8.164 7.566 0.598 18135 4170 1 5 . 1 1 64 64 PHE N N 64 120.820 120.820 121.166 -0.346 18135 4171 1 5 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.491 -0.775 18135 4172 1 5 . 1 1 64 64 PHE C C 64 178.402 178.402 176.863 1.539 18135 4173 1 5 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.113 1.039 18135 4174 1 5 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.565 -0.055 18135 4175 1 5 . 1 1 64 64 PHE H H 64 8.405 8.405 7.898 0.507 18135 4176 1 5 . 1 1 65 65 ASN N N 65 119.981 119.981 117.878 2.103 18135 4177 1 5 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.497 0.566 18135 4178 1 5 . 1 1 65 65 ASN C C 65 177.944 177.944 177.394 0.550 18135 4179 1 5 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.928 -0.060 18135 4180 1 5 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.188 -0.932 18135 4181 1 5 . 1 1 65 65 ASN H H 65 8.812 8.812 7.621 1.191 18135 4182 1 5 . 1 1 66 66 LEU N N 66 121.533 121.533 119.769 1.764 18135 4183 1 5 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.178 0.045 18135 4184 1 5 . 1 1 66 66 LEU C C 66 177.777 177.777 179.504 -1.727 18135 4185 1 5 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.954 0.314 18135 4186 1 5 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.532 0.075 18135 4187 1 5 . 1 1 66 66 LEU H H 66 8.177 8.177 7.798 0.379 18135 4188 1 5 . 1 1 67 67 PHE N N 67 110.842 110.842 114.813 -3.971 18135 4189 1 5 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.622 0.258 18135 4190 1 5 . 1 1 67 67 PHE C C 67 177.965 177.965 176.869 1.096 18135 4191 1 5 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.411 1.123 18135 4192 1 5 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.915 -0.299 18135 4193 1 5 . 1 1 67 67 PHE H H 67 8.160 8.160 8.646 -0.486 18135 4194 1 5 . 1 1 68 68 SER N N 68 119.131 119.131 113.220 5.911 18135 4195 1 5 . 1 1 68 68 SER HA H 68 4.580 4.580 4.449 0.131 18135 4196 1 5 . 1 1 68 68 SER C C 68 173.472 173.472 174.901 -1.429 18135 4197 1 5 . 1 1 68 68 SER CA C 68 59.191 59.191 59.243 -0.052 18135 4198 1 5 . 1 1 68 68 SER CB C 68 63.123 63.123 64.112 -0.989 18135 4199 1 5 . 1 1 68 68 SER H H 68 8.016 8.016 7.799 0.217 18135 4200 1 5 . 1 1 69 69 THR N N 69 111.353 111.353 115.164 -3.811 18135 4201 1 5 . 1 1 69 69 THR HA H 69 4.345 4.345 4.441 -0.096 18135 4202 1 5 . 1 1 69 69 THR C C 69 175.661 175.661 174.685 0.976 18135 4203 1 5 . 1 1 69 69 THR CA C 69 61.411 61.411 60.333 1.078 18135 4204 1 5 . 1 1 69 69 THR CB C 69 72.209 72.209 70.541 1.668 18135 4205 1 5 . 1 1 69 69 THR H H 69 6.977 6.977 7.393 -0.416 18135 4206 1 5 . 1 1 70 70 LYS N N 70 121.120 121.120 122.652 -1.532 18135 4207 1 5 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.124 -0.035 18135 4208 1 5 . 1 1 70 70 LYS C C 70 179.259 179.259 177.366 1.893 18135 4209 1 5 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.806 -0.850 18135 4210 1 5 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.451 -0.701 18135 4211 1 5 . 1 1 70 70 LYS H H 70 9.065 9.065 8.570 0.495 18135 4212 1 5 . 1 1 71 71 ASP N N 71 116.374 116.374 120.017 -3.643 18135 4213 1 5 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.304 -0.129 18135 4214 1 5 . 1 1 71 71 ASP C C 71 178.372 178.372 177.721 0.651 18135 4215 1 5 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.078 -0.011 18135 4216 1 5 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.292 0.014 18135 4217 1 5 . 1 1 71 71 ASP H H 71 7.518 7.518 7.822 -0.304 18135 4218 1 5 . 1 1 72 72 SER N N 72 117.341 117.341 114.600 2.741 18135 4219 1 5 . 1 1 72 72 SER HA H 72 3.715 3.715 3.169 0.546 18135 4220 1 5 . 1 1 72 72 SER C C 72 176.897 176.897 175.543 1.354 18135 4221 1 5 . 1 1 72 72 SER CA C 72 60.267 60.267 60.516 -0.249 18135 4222 1 5 . 1 1 72 72 SER CB C 72 62.616 62.616 62.944 -0.328 18135 4223 1 5 . 1 1 72 72 SER H H 72 8.066 8.066 8.105 -0.039 18135 4224 1 5 . 1 1 73 73 SER N N 73 113.398 113.398 117.002 -3.604 18135 4225 1 5 . 1 1 73 73 SER HA H 73 4.094 4.094 4.107 -0.013 18135 4226 1 5 . 1 1 73 73 SER C C 73 174.855 174.855 174.953 -0.098 18135 4227 1 5 . 1 1 73 73 SER CA C 73 61.385 61.385 60.144 1.241 18135 4228 1 5 . 1 1 73 73 SER CB C 73 62.798 62.798 62.806 -0.008 18135 4229 1 5 . 1 1 73 73 SER H H 73 7.982 7.982 7.646 0.336 18135 4230 1 5 . 1 1 74 74 ALA N N 74 119.486 119.486 120.205 -0.719 18135 4231 1 5 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.215 -0.058 18135 4232 1 5 . 1 1 74 74 ALA C C 74 177.626 177.626 177.167 0.459 18135 4233 1 5 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.074 0.639 18135 4234 1 5 . 1 1 74 74 ALA CB C 74 18.747 18.747 19.011 -0.264 18135 4235 1 5 . 1 1 74 74 ALA H H 74 7.095 7.095 7.336 -0.241 18135 4236 1 5 . 1 1 75 75 ALA N N 75 121.465 121.465 120.430 1.035 18135 4237 1 5 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.919 -0.223 18135 4238 1 5 . 1 1 75 75 ALA C C 75 177.197 177.197 175.766 1.431 18135 4239 1 5 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.653 1.351 18135 4240 1 5 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.080 -0.820 18135 4241 1 5 . 1 1 75 75 ALA H H 75 7.159 7.159 7.302 -0.143 18135 4242 1 5 . 1 1 76 76 TRP N N 76 116.791 116.791 116.538 0.253 18135 4243 1 5 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.716 0.334 18135 4244 1 5 . 1 1 76 76 TRP C C 76 177.617 177.617 174.919 2.698 18135 4245 1 5 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.189 -1.870 18135 4246 1 5 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.154 1.922 18135 4247 1 5 . 1 1 76 76 TRP H H 76 7.080 7.080 7.177 -0.097 18135 4248 1 5 . 1 1 77 77 ASP N N 77 119.928 119.928 121.103 -1.175 18135 4249 1 5 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.576 -0.219 18135 4250 1 5 . 1 1 77 77 ASP C C 77 176.877 176.877 177.659 -0.782 18135 4251 1 5 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.477 -0.659 18135 4252 1 5 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.789 0.826 18135 4253 1 5 . 1 1 77 77 ASP H H 77 8.259 8.259 8.692 -0.433 18135 4254 1 5 . 1 1 78 78 GLU N N 78 127.277 127.277 126.337 0.940 18135 4255 1 5 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.953 -0.068 18135 4256 1 5 . 1 1 78 78 GLU C C 78 177.439 177.439 178.350 -0.911 18135 4257 1 5 . 1 1 78 78 GLU CA C 78 59.384 59.384 60.279 -0.895 18135 4258 1 5 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.054 -0.412 18135 4259 1 5 . 1 1 78 78 GLU H H 78 8.920 8.920 8.925 -0.005 18135 4260 1 5 . 1 1 79 79 THR N N 79 115.422 115.422 116.645 -1.223 18135 4261 1 5 . 1 1 79 79 THR HA H 79 3.907 3.907 4.030 -0.123 18135 4262 1 5 . 1 1 79 79 THR C C 79 177.330 177.330 176.476 0.854 18135 4263 1 5 . 1 1 79 79 THR CA C 79 66.263 66.263 65.776 0.487 18135 4264 1 5 . 1 1 79 79 THR CB C 79 68.002 68.002 68.403 -0.401 18135 4265 1 5 . 1 1 79 79 THR H H 79 8.124 8.124 8.095 0.029 18135 4266 1 5 . 1 1 80 80 LEU N N 80 121.791 121.791 122.130 -0.339 18135 4267 1 5 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.161 -0.274 18135 4268 1 5 . 1 1 80 80 LEU C C 80 179.018 179.018 178.906 0.112 18135 4269 1 5 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.698 -0.459 18135 4270 1 5 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.196 0.457 18135 4271 1 5 . 1 1 80 80 LEU H H 80 7.725 7.725 8.043 -0.318 18135 4272 1 5 . 1 1 81 81 LEU N N 81 119.280 119.280 120.578 -1.298 18135 4273 1 5 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.232 -0.743 18135 4274 1 5 . 1 1 81 81 LEU C C 81 177.062 177.062 178.860 -1.798 18135 4275 1 5 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.748 -1.039 18135 4276 1 5 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.039 -1.091 18135 4277 1 5 . 1 1 81 81 LEU H H 81 8.344 8.344 8.709 -0.365 18135 4278 1 5 . 1 1 82 82 ASP N N 82 115.357 115.357 119.841 -4.484 18135 4279 1 5 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.440 -0.166 18135 4280 1 5 . 1 1 82 82 ASP C C 82 179.018 179.018 178.491 0.527 18135 4281 1 5 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.491 -0.676 18135 4282 1 5 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.772 -2.551 18135 4283 1 5 . 1 1 82 82 ASP H H 82 8.001 8.001 8.593 -0.592 18135 4284 1 5 . 1 1 83 83 LYS N N 83 119.603 119.603 118.977 0.626 18135 4285 1 5 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.877 0.105 18135 4286 1 5 . 1 1 83 83 LYS C C 83 178.624 178.624 178.879 -0.255 18135 4287 1 5 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.870 0.875 18135 4288 1 5 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.053 1.054 18135 4289 1 5 . 1 1 83 83 LYS H H 83 7.342 7.342 7.692 -0.350 18135 4290 1 5 . 1 1 84 84 PHE N N 84 123.933 123.933 121.969 1.964 18135 4291 1 5 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.052 -0.017 18135 4292 1 5 . 1 1 84 84 PHE C C 84 177.210 177.210 176.962 0.248 18135 4293 1 5 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.831 -1.488 18135 4294 1 5 . 1 1 84 84 PHE CB C 84 39.316 39.316 39.065 0.252 18135 4295 1 5 . 1 1 84 84 PHE H H 84 8.471 8.471 8.451 0.020 18135 4296 1 5 . 1 1 85 85 TYR N N 85 118.387 118.387 117.891 0.496 18135 4297 1 5 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.811 0.257 18135 4298 1 5 . 1 1 85 85 TYR C C 85 178.104 178.104 177.306 0.798 18135 4299 1 5 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.835 -1.258 18135 4300 1 5 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.011 -0.034 18135 4301 1 5 . 1 1 85 85 TYR H H 85 9.011 9.011 9.024 -0.013 18135 4302 1 5 . 1 1 86 86 THR N N 86 114.035 114.035 116.917 -2.882 18135 4303 1 5 . 1 1 86 86 THR HA H 86 3.945 3.945 3.187 0.758 18135 4304 1 5 . 1 1 86 86 THR C C 86 176.708 176.708 176.363 0.345 18135 4305 1 5 . 1 1 86 86 THR CA C 86 66.759 66.759 66.834 -0.075 18135 4306 1 5 . 1 1 86 86 THR CB C 86 68.853 68.853 68.053 0.799 18135 4307 1 5 . 1 1 86 86 THR H H 86 7.609 7.609 7.312 0.297 18135 4308 1 5 . 1 1 87 87 GLU N N 87 120.790 120.790 121.720 -0.930 18135 4309 1 5 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.911 0.136 18135 4310 1 5 . 1 1 87 87 GLU C C 87 179.606 179.606 178.866 0.740 18135 4311 1 5 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.762 -1.364 18135 4312 1 5 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.194 -0.908 18135 4313 1 5 . 1 1 87 87 GLU H H 87 7.712 7.712 7.545 0.167 18135 4314 1 5 . 1 1 88 88 LEU N N 88 120.729 120.729 120.216 0.513 18135 4315 1 5 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.922 -0.194 18135 4316 1 5 . 1 1 88 88 LEU C C 88 178.695 178.695 179.115 -0.420 18135 4317 1 5 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.375 0.876 18135 4318 1 5 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.174 1.413 18135 4319 1 5 . 1 1 88 88 LEU H H 88 8.393 8.393 7.436 0.957 18135 4320 1 5 . 1 1 89 89 TYR N N 89 118.654 118.654 119.128 -0.474 18135 4321 1 5 . 1 1 89 89 TYR HA H 89 3.931 3.931 3.941 -0.010 18135 4322 1 5 . 1 1 89 89 TYR C C 89 178.438 178.438 178.647 -0.209 18135 4323 1 5 . 1 1 89 89 TYR CA C 89 61.407 61.407 60.963 0.444 18135 4324 1 5 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.298 0.569 18135 4325 1 5 . 1 1 89 89 TYR H H 89 8.637 8.637 8.206 0.431 18135 4326 1 5 . 1 1 90 90 GLN N N 90 118.263 118.263 116.436 1.827 18135 4327 1 5 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.972 0.014 18135 4328 1 5 . 1 1 90 90 GLN C C 90 178.411 178.411 178.716 -0.305 18135 4329 1 5 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.641 0.141 18135 4330 1 5 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.304 -0.157 18135 4331 1 5 . 1 1 90 90 GLN H H 90 7.796 7.796 7.791 0.005 18135 4332 1 5 . 1 1 91 91 GLN N N 91 117.959 117.959 120.208 -2.249 18135 4333 1 5 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.056 0.026 18135 4334 1 5 . 1 1 91 91 GLN C C 91 178.705 178.705 178.538 0.167 18135 4335 1 5 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.814 0.006 18135 4336 1 5 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.343 0.830 18135 4337 1 5 . 1 1 91 91 GLN H H 91 7.727 7.727 8.030 -0.303 18135 4338 1 5 . 1 1 92 92 LEU N N 92 119.965 119.965 118.710 1.255 18135 4339 1 5 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.956 -0.222 18135 4340 1 5 . 1 1 92 92 LEU C C 92 178.984 178.984 178.776 0.208 18135 4341 1 5 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.990 -0.498 18135 4342 1 5 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.798 0.581 18135 4343 1 5 . 1 1 92 92 LEU H H 92 8.465 8.465 8.580 -0.115 18135 4344 1 5 . 1 1 93 93 ASN N N 93 117.793 117.793 118.320 -0.527 18135 4345 1 5 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.269 0.132 18135 4346 1 5 . 1 1 93 93 ASN C C 93 178.309 178.309 177.142 1.167 18135 4347 1 5 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.246 0.157 18135 4348 1 5 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.204 0.434 18135 4349 1 5 . 1 1 93 93 ASN H H 93 8.091 8.091 7.979 0.112 18135 4350 1 5 . 1 1 94 94 ASP N N 94 121.133 121.133 120.800 0.333 18135 4351 1 5 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.360 0.045 18135 4352 1 5 . 1 1 94 94 ASP C C 94 178.328 178.328 178.674 -0.346 18135 4353 1 5 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.480 -0.933 18135 4354 1 5 . 1 1 94 94 ASP CB C 94 38.649 38.649 41.069 -2.421 18135 4355 1 5 . 1 1 94 94 ASP H H 94 8.362 8.362 7.960 0.402 18135 4356 1 5 . 1 1 95 95 LEU N N 95 119.160 119.160 121.150 -1.990 18135 4357 1 5 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.831 0.208 18135 4358 1 5 . 1 1 95 95 LEU C C 95 178.826 178.826 178.430 0.396 18135 4359 1 5 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.112 -1.085 18135 4360 1 5 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.074 0.136 18135 4361 1 5 . 1 1 95 95 LEU H H 95 8.143 8.143 8.576 -0.433 18135 4362 1 5 . 1 1 96 96 GLU N N 96 118.813 118.813 118.775 0.038 18135 4363 1 5 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.730 0.231 18135 4364 1 5 . 1 1 96 96 GLU C C 96 177.640 177.640 178.282 -0.642 18135 4365 1 5 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.483 -1.769 18135 4366 1 5 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.430 -1.292 18135 4367 1 5 . 1 1 96 96 GLU H H 96 8.111 8.111 8.305 -0.194 18135 4368 1 5 . 1 1 97 97 ALA N N 97 120.549 120.549 121.015 -0.466 18135 4369 1 5 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.981 0.141 18135 4370 1 5 . 1 1 97 97 ALA C C 97 179.126 179.126 180.275 -1.149 18135 4371 1 5 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.727 -0.694 18135 4372 1 5 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.869 0.111 18135 4373 1 5 . 1 1 97 97 ALA H H 97 7.798 7.798 7.770 0.028 18135 4374 1 5 . 1 1 98 98 CYS N N 98 115.510 115.510 117.222 -1.712 18135 4375 1 5 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.155 0.295 18135 4376 1 5 . 1 1 98 98 CYS C C 98 175.363 175.363 175.894 -0.531 18135 4377 1 5 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.325 -5.159 18135 4378 1 5 . 1 1 98 98 CYS CB C 98 41.879 41.879 25.982 15.897 18135 4379 1 5 . 1 1 98 98 CYS H H 98 7.597 7.597 7.828 -0.231 18135 4380 1 5 . 1 1 99 99 VAL N N 99 121.713 121.713 118.426 3.287 18135 4381 1 5 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.827 -0.033 18135 4382 1 5 . 1 1 99 99 VAL C C 99 177.357 177.357 177.721 -0.364 18135 4383 1 5 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.326 -0.743 18135 4384 1 5 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.293 -0.262 18135 4385 1 5 . 1 1 99 99 VAL H H 99 7.828 7.828 7.421 0.407 18135 4386 1 5 . 1 1 100 100 ILE N N 100 122.333 122.333 117.921 4.412 18135 4387 1 5 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.708 0.216 18135 4388 1 5 . 1 1 100 100 ILE C C 100 176.827 176.827 176.696 0.131 18135 4389 1 5 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.565 -1.327 18135 4390 1 5 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.703 0.575 18135 4391 1 5 . 1 1 100 100 ILE H H 100 8.067 8.067 8.177 -0.110 18135 4392 1 5 . 1 1 101 101 GLN N N 101 121.864 121.864 117.295 4.569 18135 4393 1 5 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.218 0.008 18135 4394 1 5 . 1 1 101 101 GLN C C 101 176.438 176.438 178.010 -1.572 18135 4395 1 5 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.579 -0.259 18135 4396 1 5 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.110 -0.099 18135 4397 1 5 . 1 1 101 101 GLN H H 101 8.062 8.062 7.419 0.643 18135 4398 1 5 . 1 1 102 102 GLY N N 102 109.288 109.288 107.460 1.828 18135 4399 1 5 . 1 1 102 102 GLY C C 102 173.855 173.855 175.283 -1.428 18135 4400 1 5 . 1 1 102 102 GLY CA C 102 45.159 45.159 45.555 -0.396 18135 4401 1 5 . 1 1 102 102 GLY H H 102 8.087 8.087 8.811 -0.724 18135 4402 1 5 . 1 1 103 103 VAL N N 103 118.932 118.932 119.141 -0.209 18135 4403 1 5 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.897 0.177 18135 4404 1 5 . 1 1 103 103 VAL C C 103 176.299 176.299 175.618 0.681 18135 4405 1 5 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.745 -1.246 18135 4406 1 5 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.637 1.217 18135 4407 1 5 . 1 1 103 103 VAL H H 103 8.079 8.079 7.682 0.397 18135 4408 1 5 . 1 1 104 104 GLY N N 104 112.028 112.028 107.839 4.189 18135 4409 1 5 . 1 1 104 104 GLY C C 104 173.694 173.694 173.073 0.621 18135 4410 1 5 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.036 0.366 18135 4411 1 5 . 1 1 104 104 GLY H H 104 8.446 8.446 7.473 0.973 18135 4412 1 5 . 1 1 105 105 VAL N N 105 120.439 120.439 121.888 -1.449 18135 4413 1 5 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.447 -0.259 18135 4414 1 5 . 1 1 105 105 VAL C C 105 175.963 175.963 174.365 1.598 18135 4415 1 5 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.752 1.384 18135 4416 1 5 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.453 -1.639 18135 4417 1 5 . 1 1 105 105 VAL H H 105 7.867 7.867 7.994 -0.127 18135 4418 1 5 . 1 1 106 106 THR N N 106 116.366 116.366 118.037 -1.671 18135 4419 1 5 . 1 1 106 106 THR HA H 106 4.548 4.548 4.595 -0.047 18135 4420 1 5 . 1 1 106 106 THR C C 106 173.731 173.731 173.726 0.005 18135 4421 1 5 . 1 1 106 106 THR CA C 106 59.419 59.419 60.390 -0.971 18135 4422 1 5 . 1 1 106 106 THR CB C 106 79.536 79.536 71.042 8.494 18135 4423 1 5 . 1 1 106 106 THR H H 106 8.565 8.565 8.087 0.478 18135 4424 1 5 . 1 1 107 107 GLU N N 107 119.743 119.743 118.586 1.157 18135 4425 1 5 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.633 -0.171 18135 4426 1 5 . 1 1 107 107 GLU C C 107 175.639 175.639 175.875 -0.236 18135 4427 1 5 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.775 0.936 18135 4428 1 5 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.167 -0.668 18135 4429 1 5 . 1 1 107 107 GLU H H 107 8.410 8.410 8.470 -0.060 18135 4430 1 5 . 1 1 108 108 THR N N 108 114.402 114.402 110.652 3.750 18135 4431 1 5 . 1 1 108 108 THR HA H 108 4.448 4.448 4.921 -0.473 18135 4432 1 5 . 1 1 108 108 THR CA C 108 60.348 60.348 58.205 2.143 18135 4433 1 5 . 1 1 108 108 THR CB C 108 68.544 68.544 70.081 -1.537 18135 4434 1 5 . 1 1 108 108 THR H H 108 8.155 8.155 8.539 -0.384 18135 4435 1 5 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.449 -0.211 18135 4436 1 5 . 1 1 109 109 PRO C C 109 178.666 178.666 177.108 1.558 18135 4437 1 5 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.203 1.173 18135 4438 1 5 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.869 -0.021 18135 4439 1 5 . 1 1 110 110 LEU N N 110 118.566 118.566 118.509 0.057 18135 4440 1 5 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.171 -0.055 18135 4441 1 5 . 1 1 110 110 LEU C C 110 178.293 178.293 179.250 -0.957 18135 4442 1 5 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.754 -1.068 18135 4443 1 5 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.845 0.124 18135 4444 1 5 . 1 1 110 110 LEU H H 110 8.016 8.016 7.696 0.320 18135 4445 1 5 . 1 1 111 111 MET N N 111 118.982 118.982 116.302 2.680 18135 4446 1 5 . 1 1 111 111 MET HA H 111 4.210 4.210 4.237 -0.027 18135 4447 1 5 . 1 1 111 111 MET C C 111 178.720 178.720 177.757 0.963 18135 4448 1 5 . 1 1 111 111 MET CA C 111 58.144 58.144 58.059 0.084 18135 4449 1 5 . 1 1 111 111 MET CB C 111 32.374 32.374 32.638 -0.264 18135 4450 1 5 . 1 1 111 111 MET H H 111 7.705 7.705 7.605 0.100 18135 4451 1 5 . 1 1 112 112 LYS N N 112 121.377 121.377 119.259 2.118 18135 4452 1 5 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.246 -0.138 18135 4453 1 5 . 1 1 112 112 LYS C C 112 178.000 178.000 178.559 -0.559 18135 4454 1 5 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.501 -2.196 18135 4455 1 5 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.173 0.194 18135 4456 1 5 . 1 1 112 112 LYS H H 112 8.257 8.257 7.615 0.642 18135 4457 1 5 . 1 1 113 113 GLU N N 113 119.104 119.104 118.690 0.414 18135 4458 1 5 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.074 -0.008 18135 4459 1 5 . 1 1 113 113 GLU C C 113 178.289 178.289 178.516 -0.227 18135 4460 1 5 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.127 -0.874 18135 4461 1 5 . 1 1 113 113 GLU CB C 113 28.138 28.138 28.994 -0.856 18135 4462 1 5 . 1 1 113 113 GLU H H 113 8.270 8.270 7.652 0.618 18135 4463 1 5 . 1 1 114 114 ASP N N 114 119.224 119.224 119.274 -0.050 18135 4464 1 5 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.593 -0.305 18135 4465 1 5 . 1 1 114 114 ASP C C 114 178.365 178.365 178.096 0.269 18135 4466 1 5 . 1 1 114 114 ASP CA C 114 56.108 56.108 56.711 -0.603 18135 4467 1 5 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.886 -2.651 18135 4468 1 5 . 1 1 114 114 ASP H H 114 8.618 8.618 7.625 0.993 18135 4469 1 5 . 1 1 115 115 SER N N 115 118.195 118.195 117.095 1.100 18135 4470 1 5 . 1 1 115 115 SER HA H 115 4.200 4.200 4.132 0.068 18135 4471 1 5 . 1 1 115 115 SER C C 115 175.986 175.986 177.051 -1.065 18135 4472 1 5 . 1 1 115 115 SER CA C 115 61.588 61.588 61.388 0.201 18135 4473 1 5 . 1 1 115 115 SER CB C 115 62.653 62.653 63.111 -0.458 18135 4474 1 5 . 1 1 115 115 SER H H 115 8.181 8.181 7.546 0.635 18135 4475 1 5 . 1 1 116 116 ILE N N 116 123.340 123.340 121.849 1.491 18135 4476 1 5 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.858 -0.232 18135 4477 1 5 . 1 1 116 116 ILE C C 116 178.367 178.367 178.135 0.232 18135 4478 1 5 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.462 1.355 18135 4479 1 5 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.673 0.745 18135 4480 1 5 . 1 1 116 116 ILE H H 116 7.773 7.773 8.379 -0.606 18135 4481 1 5 . 1 1 117 117 LEU N N 117 120.968 120.968 121.601 -0.633 18135 4482 1 5 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.932 -0.027 18135 4483 1 5 . 1 1 117 117 LEU C C 117 178.746 178.746 178.342 0.404 18135 4484 1 5 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.725 -0.582 18135 4485 1 5 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.609 -0.023 18135 4486 1 5 . 1 1 117 117 LEU H H 117 8.406 8.406 7.384 1.022 18135 4487 1 5 . 1 1 118 118 ALA N N 118 120.150 120.150 121.658 -1.508 18135 4488 1 5 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.957 0.155 18135 4489 1 5 . 1 1 118 118 ALA C C 118 181.633 181.633 179.737 1.896 18135 4490 1 5 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.399 -0.086 18135 4491 1 5 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.232 -0.122 18135 4492 1 5 . 1 1 118 118 ALA H H 118 7.894 7.894 8.073 -0.179 18135 4493 1 5 . 1 1 119 119 VAL N N 119 118.873 118.873 118.479 0.394 18135 4494 1 5 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.514 0.241 18135 4495 1 5 . 1 1 119 119 VAL C C 119 177.896 177.896 178.370 -0.474 18135 4496 1 5 . 1 1 119 119 VAL CA C 119 67.181 67.181 67.226 -0.045 18135 4497 1 5 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.008 0.886 18135 4498 1 5 . 1 1 119 119 VAL H H 119 7.572 7.572 8.100 -0.528 18135 4499 1 5 . 1 1 120 120 ARG N N 120 121.436 121.436 119.606 1.830 18135 4500 1 5 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.088 -0.061 18135 4501 1 5 . 1 1 120 120 ARG C C 120 179.848 179.848 178.998 0.850 18135 4502 1 5 . 1 1 120 120 ARG CA C 120 61.267 61.267 60.093 1.174 18135 4503 1 5 . 1 1 120 120 ARG CB C 120 29.695 29.695 30.001 -0.306 18135 4504 1 5 . 1 1 120 120 ARG H H 120 8.629 8.629 8.609 0.020 18135 4505 1 5 . 1 1 121 121 LYS N N 121 119.589 119.589 119.432 0.157 18135 4506 1 5 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.987 0.087 18135 4507 1 5 . 1 1 121 121 LYS C C 121 178.331 178.331 179.177 -0.846 18135 4508 1 5 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.805 0.635 18135 4509 1 5 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.453 -0.346 18135 4510 1 5 . 1 1 121 121 LYS H H 121 9.015 9.015 8.372 0.643 18135 4511 1 5 . 1 1 122 122 TYR N N 122 121.546 121.546 120.204 1.342 18135 4512 1 5 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.155 0.177 18135 4513 1 5 . 1 1 122 122 TYR C C 122 176.527 176.527 177.935 -1.408 18135 4514 1 5 . 1 1 122 122 TYR CA C 122 60.404 60.404 60.790 -0.386 18135 4515 1 5 . 1 1 122 122 TYR CB C 122 37.725 37.725 38.298 -0.573 18135 4516 1 5 . 1 1 122 122 TYR H H 122 7.473 7.473 8.222 -0.749 18135 4517 1 5 . 1 1 123 123 PHE N N 123 116.026 116.026 119.651 -3.625 18135 4518 1 5 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.832 -0.092 18135 4519 1 5 . 1 1 123 123 PHE C C 123 179.005 179.005 177.560 1.445 18135 4520 1 5 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.520 3.008 18135 4521 1 5 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.581 0.750 18135 4522 1 5 . 1 1 123 123 PHE H H 123 7.932 7.932 8.809 -0.877 18135 4523 1 5 . 1 1 124 124 GLN N N 124 123.043 123.043 118.544 4.499 18135 4524 1 5 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.371 0.808 18135 4525 1 5 . 1 1 124 124 GLN C C 124 178.772 178.772 178.568 0.204 18135 4526 1 5 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.029 0.287 18135 4527 1 5 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.171 -0.540 18135 4528 1 5 . 1 1 124 124 GLN H H 124 8.470 8.470 8.540 -0.070 18135 4529 1 5 . 1 1 125 125 ARG N N 125 120.342 120.342 119.436 0.906 18135 4530 1 5 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.161 -0.083 18135 4531 1 5 . 1 1 125 125 ARG C C 125 180.340 180.340 179.250 1.090 18135 4532 1 5 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.504 2.793 18135 4533 1 5 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.863 0.462 18135 4534 1 5 . 1 1 125 125 ARG H H 125 8.137 8.137 7.903 0.234 18135 4535 1 5 . 1 1 126 126 ILE N N 126 121.876 121.876 120.936 0.940 18135 4536 1 5 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.320 0.031 18135 4537 1 5 . 1 1 126 126 ILE C C 126 176.857 176.857 177.696 -0.839 18135 4538 1 5 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.994 0.838 18135 4539 1 5 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.608 0.676 18135 4540 1 5 . 1 1 126 126 ILE H H 126 7.526 7.526 8.230 -0.704 18135 4541 1 5 . 1 1 127 127 THR N N 127 115.613 115.613 115.228 0.385 18135 4542 1 5 . 1 1 127 127 THR HA H 127 3.633 3.633 3.864 -0.231 18135 4543 1 5 . 1 1 127 127 THR C C 127 176.645 176.645 177.101 -0.456 18135 4544 1 5 . 1 1 127 127 THR CA C 127 67.294 67.294 66.034 1.260 18135 4545 1 5 . 1 1 127 127 THR CB C 127 68.871 68.871 68.644 0.227 18135 4546 1 5 . 1 1 127 127 THR H H 127 8.288 8.288 7.962 0.326 18135 4547 1 5 . 1 1 128 128 LEU N N 128 122.627 122.627 122.026 0.601 18135 4548 1 5 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.921 0.035 18135 4549 1 5 . 1 1 128 128 LEU C C 128 178.331 178.331 177.617 0.714 18135 4550 1 5 . 1 1 128 128 LEU CA C 128 58.088 58.088 58.057 0.031 18135 4551 1 5 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.426 0.148 18135 4552 1 5 . 1 1 128 128 LEU H H 128 8.263 8.263 7.910 0.353 18135 4553 1 5 . 1 1 129 129 TYR N N 129 120.955 120.955 120.197 0.758 18135 4554 1 5 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.020 -0.130 18135 4555 1 5 . 1 1 129 129 TYR C C 129 176.040 176.040 177.235 -1.195 18135 4556 1 5 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.766 -0.273 18135 4557 1 5 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.259 0.666 18135 4558 1 5 . 1 1 129 129 TYR H H 129 7.518 7.518 8.159 -0.641 18135 4559 1 5 . 1 1 130 130 LEU N N 130 119.155 119.155 116.504 2.651 18135 4560 1 5 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.334 -0.489 18135 4561 1 5 . 1 1 130 130 LEU C C 130 177.948 177.948 178.401 -0.453 18135 4562 1 5 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.919 0.194 18135 4563 1 5 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.559 1.027 18135 4564 1 5 . 1 1 130 130 LEU H H 130 7.717 7.717 7.953 -0.236 18135 4565 1 5 . 1 1 131 131 LYS N N 131 116.832 116.832 119.999 -3.167 18135 4566 1 5 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.917 -0.509 18135 4567 1 5 . 1 1 131 131 LYS C C 131 181.265 181.265 179.770 1.495 18135 4568 1 5 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.677 0.054 18135 4569 1 5 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.042 0.630 18135 4570 1 5 . 1 1 131 131 LYS H H 131 7.493 7.493 7.881 -0.388 18135 4571 1 5 . 1 1 132 132 GLU N N 132 121.918 121.918 119.666 2.252 18135 4572 1 5 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.091 -0.247 18135 4573 1 5 . 1 1 132 132 GLU C C 132 178.377 178.377 178.117 0.260 18135 4574 1 5 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.713 0.174 18135 4575 1 5 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.423 -0.756 18135 4576 1 5 . 1 1 132 132 GLU H H 132 8.430 8.430 8.079 0.351 18135 4577 1 5 . 1 1 133 133 LYS N N 133 116.079 116.079 116.249 -0.170 18135 4578 1 5 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.251 -0.285 18135 4579 1 5 . 1 1 133 133 LYS C C 133 175.282 175.282 175.677 -0.395 18135 4580 1 5 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.813 -0.515 18135 4581 1 5 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.966 0.032 18135 4582 1 5 . 1 1 133 133 LYS H H 133 7.390 7.390 7.339 0.051 18135 4583 1 5 . 1 1 134 134 LYS N N 134 117.759 117.759 115.919 1.840 18135 4584 1 5 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.058 -0.476 18135 4585 1 5 . 1 1 134 134 LYS C C 134 176.271 176.271 175.977 0.294 18135 4586 1 5 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.774 0.534 18135 4587 1 5 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.063 -0.261 18135 4588 1 5 . 1 1 134 134 LYS H H 134 7.716 7.716 7.623 0.093 18135 4589 1 5 . 1 1 135 135 TYR N N 135 110.598 110.598 113.916 -3.318 18135 4590 1 5 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.945 -1.068 18135 4591 1 5 . 1 1 135 135 TYR C C 135 174.148 174.148 175.263 -1.115 18135 4592 1 5 . 1 1 135 135 TYR CA C 135 59.715 59.715 58.985 0.730 18135 4593 1 5 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.096 -0.390 18135 4594 1 5 . 1 1 135 135 TYR H H 135 8.428 8.428 8.775 -0.347 18135 4595 1 5 . 1 1 136 136 SER N N 136 113.712 113.712 116.081 -2.369 18135 4596 1 5 . 1 1 136 136 SER HA H 136 4.553 4.553 4.408 0.145 18135 4597 1 5 . 1 1 136 136 SER CA C 136 57.108 57.108 58.099 -0.991 18135 4598 1 5 . 1 1 136 136 SER CB C 136 62.500 62.500 64.421 -1.921 18135 4599 1 5 . 1 1 136 136 SER H H 136 6.744 6.744 7.400 -0.656 18135 4600 1 5 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.476 -0.311 18135 4601 1 5 . 1 1 137 137 PRO C C 137 180.675 180.675 177.520 3.155 18135 4602 1 5 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.567 1.090 18135 4603 1 5 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.456 0.527 18135 4604 1 5 . 1 1 138 138 CYS N N 138 113.914 113.914 117.058 -3.144 18135 4605 1 5 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.579 0.091 18135 4606 1 5 . 1 1 138 138 CYS C C 138 176.015 176.015 175.911 0.104 18135 4607 1 5 . 1 1 138 138 CYS CA C 138 57.095 57.095 59.848 -2.753 18135 4608 1 5 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.588 10.191 18135 4609 1 5 . 1 1 138 138 CYS H H 138 8.580 8.580 8.461 0.119 18135 4610 1 5 . 1 1 139 139 ALA N N 139 125.290 125.290 124.888 0.402 18135 4611 1 5 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.188 0.261 18135 4612 1 5 . 1 1 139 139 ALA C C 139 180.149 180.149 179.324 0.825 18135 4613 1 5 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.974 -0.196 18135 4614 1 5 . 1 1 139 139 ALA CB C 139 18.918 18.918 17.805 1.113 18135 4615 1 5 . 1 1 139 139 ALA H H 139 8.087 8.087 7.471 0.616 18135 4616 1 5 . 1 1 140 140 TRP N N 140 116.599 116.599 118.579 -1.980 18135 4617 1 5 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.299 0.303 18135 4618 1 5 . 1 1 140 140 TRP C C 140 179.137 179.137 178.642 0.495 18135 4619 1 5 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.531 -0.997 18135 4620 1 5 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.301 -0.043 18135 4621 1 5 . 1 1 140 140 TRP H H 140 8.505 8.505 7.746 0.759 18135 4622 1 5 . 1 1 141 141 GLU N N 141 121.578 121.578 119.091 2.487 18135 4623 1 5 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.264 0.959 18135 4624 1 5 . 1 1 141 141 GLU C C 141 177.886 177.886 178.893 -1.007 18135 4625 1 5 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.790 -1.883 18135 4626 1 5 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.184 -0.467 18135 4627 1 5 . 1 1 141 141 GLU H H 141 8.182 8.182 8.076 0.106 18135 4628 1 5 . 1 1 142 142 VAL N N 142 121.202 121.202 120.552 0.650 18135 4629 1 5 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.684 -0.054 18135 4630 1 5 . 1 1 142 142 VAL C C 142 180.246 180.246 178.501 1.745 18135 4631 1 5 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.782 0.201 18135 4632 1 5 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.464 0.358 18135 4633 1 5 . 1 1 142 142 VAL H H 142 8.623 8.623 8.141 0.482 18135 4634 1 5 . 1 1 143 143 VAL N N 143 120.119 120.119 119.368 0.751 18135 4635 1 5 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.714 -0.417 18135 4636 1 5 . 1 1 143 143 VAL C C 143 176.407 176.407 178.542 -2.135 18135 4637 1 5 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.558 1.420 18135 4638 1 5 . 1 1 143 143 VAL CB C 143 31.655 31.655 30.976 0.679 18135 4639 1 5 . 1 1 143 143 VAL H H 143 8.323 8.323 8.288 0.035 18135 4640 1 5 . 1 1 144 144 ARG N N 144 124.102 124.102 120.704 3.398 18135 4641 1 5 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.064 -0.367 18135 4642 1 5 . 1 1 144 144 ARG C C 144 178.127 178.127 178.182 -0.055 18135 4643 1 5 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.666 1.335 18135 4644 1 5 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.811 0.125 18135 4645 1 5 . 1 1 144 144 ARG H H 144 9.619 9.619 8.366 1.253 18135 4646 1 5 . 1 1 145 145 ALA N N 145 119.431 119.431 121.868 -2.437 18135 4647 1 5 . 1 1 145 145 ALA HA H 145 3.851 3.851 3.984 -0.133 18135 4648 1 5 . 1 1 145 145 ALA C C 145 180.763 180.763 179.683 1.080 18135 4649 1 5 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.396 -0.021 18135 4650 1 5 . 1 1 145 145 ALA CB C 145 18.185 18.185 17.638 0.547 18135 4651 1 5 . 1 1 145 145 ALA H H 145 8.867 8.867 8.138 0.729 18135 4652 1 5 . 1 1 146 146 GLU N N 146 121.815 121.815 119.202 2.613 18135 4653 1 5 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.260 -0.049 18135 4654 1 5 . 1 1 146 146 GLU C C 146 177.296 177.296 178.935 -1.639 18135 4655 1 5 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.314 -0.935 18135 4656 1 5 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.559 -1.425 18135 4657 1 5 . 1 1 146 146 GLU H H 146 8.136 8.136 7.990 0.146 18135 4658 1 5 . 1 1 147 147 ILE N N 147 119.542 119.542 120.701 -1.159 18135 4659 1 5 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.821 0.149 18135 4660 1 5 . 1 1 147 147 ILE C C 147 178.283 178.283 178.407 -0.124 18135 4661 1 5 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.649 -3.396 18135 4662 1 5 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.423 -2.084 18135 4663 1 5 . 1 1 147 147 ILE H H 147 8.736 8.736 8.266 0.470 18135 4664 1 5 . 1 1 148 148 MET N N 148 119.501 119.501 118.585 0.916 18135 4665 1 5 . 1 1 148 148 MET HA H 148 3.801 3.801 4.200 -0.399 18135 4666 1 5 . 1 1 148 148 MET C C 148 178.210 178.210 178.740 -0.530 18135 4667 1 5 . 1 1 148 148 MET CA C 148 60.184 60.184 59.885 0.299 18135 4668 1 5 . 1 1 148 148 MET CB C 148 32.914 32.914 32.056 0.858 18135 4669 1 5 . 1 1 148 148 MET H H 148 8.440 8.440 8.446 -0.006 18135 4670 1 5 . 1 1 149 149 ARG N N 149 119.734 119.734 119.623 0.111 18135 4671 1 5 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.124 -0.209 18135 4672 1 5 . 1 1 149 149 ARG C C 149 178.978 178.978 178.873 0.105 18135 4673 1 5 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.145 0.718 18135 4674 1 5 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.529 0.751 18135 4675 1 5 . 1 1 149 149 ARG H H 149 7.648 7.648 8.451 -0.803 18135 4676 1 5 . 1 1 150 150 SER N N 150 118.109 118.109 114.574 3.535 18135 4677 1 5 . 1 1 150 150 SER HA H 150 3.339 3.339 4.310 -0.971 18135 4678 1 5 . 1 1 150 150 SER C C 150 177.292 177.292 176.583 0.709 18135 4679 1 5 . 1 1 150 150 SER CA C 150 61.316 61.316 62.100 -0.784 18135 4680 1 5 . 1 1 150 150 SER CB C 150 60.288 60.288 63.063 -2.775 18135 4681 1 5 . 1 1 150 150 SER H H 150 9.194 9.194 8.551 0.643 18135 4682 1 5 . 1 1 151 151 PHE N N 151 125.265 125.265 123.034 2.231 18135 4683 1 5 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.409 -0.373 18135 4684 1 5 . 1 1 151 151 PHE C C 151 178.696 178.696 177.546 1.150 18135 4685 1 5 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.243 2.177 18135 4686 1 5 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.563 0.323 18135 4687 1 5 . 1 1 151 151 PHE H H 151 9.455 9.455 8.435 1.020 18135 4688 1 5 . 1 1 152 152 SER N N 152 115.963 115.963 114.962 1.001 18135 4689 1 5 . 1 1 152 152 SER HA H 152 3.880 3.880 3.713 0.167 18135 4690 1 5 . 1 1 152 152 SER C C 152 175.858 175.858 176.724 -0.866 18135 4691 1 5 . 1 1 152 152 SER CA C 152 62.388 62.388 61.510 0.878 18135 4692 1 5 . 1 1 152 152 SER CB C 152 62.519 62.519 63.204 -0.685 18135 4693 1 5 . 1 1 152 152 SER H H 152 7.839 7.839 8.455 -0.616 18135 4694 1 5 . 1 1 153 153 LEU N N 153 121.365 121.365 122.086 -0.721 18135 4695 1 5 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.221 -0.140 18135 4696 1 5 . 1 1 153 153 LEU C C 153 179.515 179.515 178.628 0.887 18135 4697 1 5 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.940 -0.057 18135 4698 1 5 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.462 0.880 18135 4699 1 5 . 1 1 153 153 LEU H H 153 7.775 7.775 8.504 -0.729 18135 4700 1 5 . 1 1 154 154 SER N N 154 113.950 113.950 113.288 0.662 18135 4701 1 5 . 1 1 154 154 SER HA H 154 3.781 3.781 4.460 -0.679 18135 4702 1 5 . 1 1 154 154 SER C C 154 174.312 174.312 176.297 -1.985 18135 4703 1 5 . 1 1 154 154 SER CA C 154 61.366 61.366 61.320 0.046 18135 4704 1 5 . 1 1 154 154 SER CB C 154 63.242 63.242 63.385 -0.142 18135 4705 1 5 . 1 1 154 154 SER H H 154 7.874 7.874 8.581 -0.707 18135 4706 1 5 . 1 1 155 155 THR N N 155 109.346 109.346 113.468 -4.122 18135 4707 1 5 . 1 1 155 155 THR HA H 155 4.060 4.060 4.189 -0.129 18135 4708 1 5 . 1 1 155 155 THR C C 155 174.798 174.798 175.173 -0.375 18135 4709 1 5 . 1 1 155 155 THR CA C 155 62.275 62.275 64.085 -1.810 18135 4710 1 5 . 1 1 155 155 THR CB C 155 69.342 69.342 69.052 0.290 18135 4711 1 5 . 1 1 155 155 THR H H 155 7.176 7.176 7.869 -0.693 18135 4712 1 5 . 1 1 156 156 ASN N N 156 119.785 119.785 121.478 -1.693 18135 4713 1 5 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.782 -0.255 18135 4714 1 5 . 1 1 156 156 ASN C C 156 175.528 175.528 175.288 0.240 18135 4715 1 5 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.613 1.324 18135 4716 1 5 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.884 0.454 18135 4717 1 5 . 1 1 156 156 ASN H H 156 7.749 7.749 7.973 -0.224 18135 4718 1 5 . 1 1 157 157 LEU N N 157 120.552 120.552 121.373 -0.821 18135 4719 1 5 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.540 -0.285 18135 4720 1 5 . 1 1 157 157 LEU C C 157 174.702 174.702 178.156 -3.454 18135 4721 1 5 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.279 -0.605 18135 4722 1 5 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.168 0.183 18135 4723 1 5 . 1 1 157 157 LEU H H 157 8.097 8.097 7.701 0.396 18135 4724 1 5 . 1 1 158 158 GLN N N 158 119.860 119.860 118.290 1.570 18135 4725 1 5 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.303 -0.123 18135 4726 1 5 . 1 1 158 158 GLN C C 158 176.434 176.434 175.350 1.084 18135 4727 1 5 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.690 1.207 18135 4728 1 5 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.894 -0.884 18135 4729 1 5 . 1 1 158 158 GLN H H 158 8.230 8.230 8.127 0.103 18135 4730 1 5 . 1 1 159 159 GLU N N 159 120.461 120.461 118.498 1.963 18135 4731 1 5 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.014 0.205 18135 4732 1 5 . 1 1 159 159 GLU C C 159 175.251 175.251 175.436 -0.185 18135 4733 1 5 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.278 -0.583 18135 4734 1 5 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.189 0.792 18135 4735 1 5 . 1 1 159 159 GLU H H 159 8.300 8.300 8.709 -0.409 18135 4736 1 5 . 1 1 160 160 SER N N 160 115.719 115.719 110.886 4.833 18135 4737 1 5 . 1 1 160 160 SER HA H 160 4.372 4.372 4.556 -0.184 18135 4738 1 5 . 1 1 160 160 SER C C 160 174.188 174.188 174.205 -0.017 18135 4739 1 5 . 1 1 160 160 SER CA C 160 58.481 58.481 59.085 -0.604 18135 4740 1 5 . 1 1 160 160 SER CB C 160 63.731 63.731 63.630 0.101 18135 4741 1 5 . 1 1 160 160 SER H H 160 8.113 8.113 8.433 -0.320 18135 4742 1 5 . 1 1 161 161 LEU N N 161 123.794 123.794 123.126 0.668 18135 4743 1 5 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.344 -0.064 18135 4744 1 5 . 1 1 161 161 LEU C C 161 177.293 177.293 176.888 0.405 18135 4745 1 5 . 1 1 161 161 LEU CA C 161 55.190 55.190 56.141 -0.951 18135 4746 1 5 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.361 -0.077 18135 4747 1 5 . 1 1 161 161 LEU H H 161 8.032 8.032 8.089 -0.057 18135 4748 1 5 . 1 1 162 162 ARG N N 162 120.715 120.715 117.471 3.244 18135 4749 1 5 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.703 -0.534 18135 4750 1 5 . 1 1 162 162 ARG C C 162 176.288 176.288 174.807 1.481 18135 4751 1 5 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.523 1.523 18135 4752 1 5 . 1 1 162 162 ARG CB C 162 30.935 30.935 32.806 -1.871 18135 4753 1 5 . 1 1 162 162 ARG H H 162 8.094 8.094 8.151 -0.057 18135 4754 1 5 . 1 1 163 163 SER N N 163 116.670 116.670 115.716 0.954 18135 4755 1 5 . 1 1 163 163 SER HA H 163 4.372 4.372 4.745 -0.373 18135 4756 1 5 . 1 1 163 163 SER C C 163 174.184 174.184 174.422 -0.238 18135 4757 1 5 . 1 1 163 163 SER CA C 163 58.481 58.481 57.806 0.675 18135 4758 1 5 . 1 1 163 163 SER CB C 163 63.745 63.745 64.533 -0.788 18135 4759 1 5 . 1 1 163 163 SER H H 163 8.191 8.191 8.363 -0.172 18135 4760 1 5 . 1 1 164 164 LYS N N 164 123.100 123.100 123.148 -0.048 18135 4761 1 5 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.530 -0.253 18135 4762 1 5 . 1 1 164 164 LYS C C 164 175.617 175.617 176.770 -1.153 18135 4763 1 5 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.761 -0.448 18135 4764 1 5 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.610 0.355 18135 4765 1 5 . 1 1 164 164 LYS H H 164 8.251 8.251 8.604 -0.353 18135 4766 1 6 . 1 1 2 2 ASP N N 2 125.691 125.691 120.885 4.806 18135 4767 1 6 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.487 0.223 18135 4768 1 6 . 1 1 2 2 ASP C C 2 174.758 174.758 176.188 -1.430 18135 4769 1 6 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.781 -1.938 18135 4770 1 6 . 1 1 2 2 ASP CB C 2 39.321 39.321 40.907 -1.586 18135 4771 1 6 . 1 1 2 2 ASP H H 2 8.773 8.773 8.465 0.308 18135 4772 1 6 . 1 1 3 3 LEU N N 3 123.957 123.957 115.757 8.200 18135 4773 1 6 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.305 0.096 18135 4774 1 6 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.275 1.378 18135 4775 1 6 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.528 0.027 18135 4776 1 6 . 1 1 3 3 LEU H H 3 8.164 8.164 7.283 0.881 18135 4777 1 6 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.415 -0.101 18135 4778 1 6 . 1 1 4 4 PRO C C 4 176.213 176.213 176.587 -0.374 18135 4779 1 6 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.130 0.778 18135 4780 1 6 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.388 1.506 18135 4781 1 6 . 1 1 5 5 GLN N N 5 121.621 121.621 121.847 -0.226 18135 4782 1 6 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.187 0.039 18135 4783 1 6 . 1 1 5 5 GLN C C 5 176.995 176.995 176.612 0.383 18135 4784 1 6 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.268 -1.558 18135 4785 1 6 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.543 -0.592 18135 4786 1 6 . 1 1 5 5 GLN H H 5 8.767 8.767 8.717 0.050 18135 4787 1 6 . 1 1 6 6 THR N N 6 111.419 111.419 111.204 0.215 18135 4788 1 6 . 1 1 6 6 THR HA H 6 4.135 4.135 4.488 -0.353 18135 4789 1 6 . 1 1 6 6 THR C C 6 174.695 174.695 175.818 -1.123 18135 4790 1 6 . 1 1 6 6 THR CA C 6 62.661 62.661 62.713 -0.052 18135 4791 1 6 . 1 1 6 6 THR CB C 6 69.365 69.365 68.885 0.480 18135 4792 1 6 . 1 1 6 6 THR H H 6 7.865 7.865 8.545 -0.680 18135 4793 1 6 . 1 1 7 7 HIS N N 7 119.137 119.137 119.755 -0.618 18135 4794 1 6 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.565 0.020 18135 4795 1 6 . 1 1 7 7 HIS C C 7 174.980 174.980 175.054 -0.074 18135 4796 1 6 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.565 -2.561 18135 4797 1 6 . 1 1 7 7 HIS CB C 7 28.163 28.163 30.007 -1.844 18135 4798 1 6 . 1 1 7 7 HIS H H 7 8.567 8.567 8.514 0.053 18135 4799 1 6 . 1 1 8 8 SER N N 8 115.796 115.796 113.256 2.540 18135 4800 1 6 . 1 1 8 8 SER HA H 8 4.363 4.363 4.434 -0.071 18135 4801 1 6 . 1 1 8 8 SER C C 8 175.312 175.312 176.337 -1.025 18135 4802 1 6 . 1 1 8 8 SER CA C 8 58.969 58.969 60.467 -1.498 18135 4803 1 6 . 1 1 8 8 SER CB C 8 63.439 63.439 63.584 -0.145 18135 4804 1 6 . 1 1 8 8 SER H H 8 8.180 8.180 7.867 0.313 18135 4805 1 6 . 1 1 9 9 LEU N N 9 123.844 123.844 118.090 5.754 18135 4806 1 6 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.751 -0.596 18135 4807 1 6 . 1 1 9 9 LEU C C 9 178.568 178.568 178.405 0.163 18135 4808 1 6 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.637 0.329 18135 4809 1 6 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.433 -0.637 18135 4810 1 6 . 1 1 9 9 LEU H H 9 8.404 8.404 7.773 0.631 18135 4811 1 6 . 1 1 10 10 GLY N N 10 107.582 107.582 107.825 -0.243 18135 4812 1 6 . 1 1 10 10 GLY C C 10 174.586 174.586 175.729 -1.143 18135 4813 1 6 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.208 -0.303 18135 4814 1 6 . 1 1 10 10 GLY H H 10 8.438 8.438 8.602 -0.164 18135 4815 1 6 . 1 1 11 11 SER N N 11 118.806 118.806 116.866 1.940 18135 4816 1 6 . 1 1 11 11 SER HA H 11 4.156 4.156 4.090 0.066 18135 4817 1 6 . 1 1 11 11 SER C C 11 175.749 175.749 176.791 -1.042 18135 4818 1 6 . 1 1 11 11 SER CA C 11 61.299 61.299 61.583 -0.284 18135 4819 1 6 . 1 1 11 11 SER CB C 11 62.653 62.653 63.059 -0.405 18135 4820 1 6 . 1 1 11 11 SER H H 11 8.249 8.249 8.337 -0.088 18135 4821 1 6 . 1 1 12 12 ARG N N 12 121.986 121.986 121.582 0.404 18135 4822 1 6 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.096 -0.142 18135 4823 1 6 . 1 1 12 12 ARG C C 12 178.283 178.283 178.560 -0.277 18135 4824 1 6 . 1 1 12 12 ARG CA C 12 59.830 59.830 59.218 0.612 18135 4825 1 6 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.206 -0.622 18135 4826 1 6 . 1 1 12 12 ARG H H 12 8.027 8.027 8.155 -0.128 18135 4827 1 6 . 1 1 13 13 ARG N N 13 119.432 119.432 119.353 0.079 18135 4828 1 6 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.106 -0.267 18135 4829 1 6 . 1 1 13 13 ARG C C 13 178.480 178.480 178.730 -0.250 18135 4830 1 6 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.113 1.378 18135 4831 1 6 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.407 0.675 18135 4832 1 6 . 1 1 13 13 ARG H H 13 8.437 8.437 8.051 0.386 18135 4833 1 6 . 1 1 14 14 THR N N 14 116.879 116.879 116.539 0.340 18135 4834 1 6 . 1 1 14 14 THR HA H 14 3.532 3.532 4.179 -0.647 18135 4835 1 6 . 1 1 14 14 THR C C 14 175.584 175.584 177.196 -1.612 18135 4836 1 6 . 1 1 14 14 THR CA C 14 68.036 68.036 66.475 1.562 18135 4837 1 6 . 1 1 14 14 THR CB C 14 67.969 67.969 68.500 -0.531 18135 4838 1 6 . 1 1 14 14 THR H H 14 7.957 7.957 8.192 -0.235 18135 4839 1 6 . 1 1 15 15 LEU N N 15 120.252 120.252 122.733 -2.481 18135 4840 1 6 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.014 -0.068 18135 4841 1 6 . 1 1 15 15 LEU C C 15 178.652 178.652 179.115 -0.463 18135 4842 1 6 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.333 -0.245 18135 4843 1 6 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.891 -0.337 18135 4844 1 6 . 1 1 15 15 LEU H H 15 7.550 7.550 8.176 -0.626 18135 4845 1 6 . 1 1 16 16 MET N N 16 118.788 118.788 117.023 1.765 18135 4846 1 6 . 1 1 16 16 MET HA H 16 4.023 4.023 4.042 -0.019 18135 4847 1 6 . 1 1 16 16 MET C C 16 178.718 178.718 178.850 -0.132 18135 4848 1 6 . 1 1 16 16 MET CA C 16 58.513 58.513 58.079 0.434 18135 4849 1 6 . 1 1 16 16 MET CB C 16 32.150 32.150 31.447 0.703 18135 4850 1 6 . 1 1 16 16 MET H H 16 7.985 7.985 8.428 -0.443 18135 4851 1 6 . 1 1 17 17 LEU N N 17 120.644 120.644 119.763 0.881 18135 4852 1 6 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.946 0.026 18135 4853 1 6 . 1 1 17 17 LEU C C 17 178.238 178.238 179.228 -0.990 18135 4854 1 6 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.026 -0.299 18135 4855 1 6 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.644 0.491 18135 4856 1 6 . 1 1 17 17 LEU H H 17 7.829 7.829 8.220 -0.391 18135 4857 1 6 . 1 1 18 18 LEU N N 18 118.280 118.280 118.650 -0.370 18135 4858 1 6 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.791 -0.285 18135 4859 1 6 . 1 1 18 18 LEU C C 18 175.739 175.739 178.320 -2.581 18135 4860 1 6 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.198 0.458 18135 4861 1 6 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.517 0.725 18135 4862 1 6 . 1 1 18 18 LEU H H 18 7.499 7.499 8.299 -0.800 18135 4863 1 6 . 1 1 19 19 ALA N N 19 121.961 121.961 120.900 1.061 18135 4864 1 6 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.163 -0.326 18135 4865 1 6 . 1 1 19 19 ALA C C 19 180.736 180.736 178.231 2.505 18135 4866 1 6 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.111 0.956 18135 4867 1 6 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.259 -1.182 18135 4868 1 6 . 1 1 19 19 ALA H H 19 7.950 7.950 7.727 0.223 18135 4869 1 6 . 1 1 20 20 GLN N N 20 118.605 118.605 115.948 2.657 18135 4870 1 6 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.180 -0.245 18135 4871 1 6 . 1 1 20 20 GLN C C 20 176.945 176.945 177.649 -0.704 18135 4872 1 6 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.712 0.303 18135 4873 1 6 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.512 -1.038 18135 4874 1 6 . 1 1 20 20 GLN H H 20 7.958 7.958 8.097 -0.139 18135 4875 1 6 . 1 1 21 21 MET N N 21 116.693 116.693 115.981 0.712 18135 4876 1 6 . 1 1 21 21 MET HA H 21 3.861 3.861 4.431 -0.570 18135 4877 1 6 . 1 1 21 21 MET C C 21 174.671 174.671 175.871 -1.200 18135 4878 1 6 . 1 1 21 21 MET CA C 21 57.111 57.111 57.270 -0.159 18135 4879 1 6 . 1 1 21 21 MET CB C 21 34.073 34.073 33.358 0.715 18135 4880 1 6 . 1 1 21 21 MET H H 21 7.420 7.420 7.836 -0.416 18135 4881 1 6 . 1 1 22 22 ARG N N 22 115.451 115.451 121.869 -6.418 18135 4882 1 6 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.438 0.415 18135 4883 1 6 . 1 1 22 22 ARG C C 22 175.950 175.950 174.596 1.354 18135 4884 1 6 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.431 3.021 18135 4885 1 6 . 1 1 22 22 ARG CB C 22 31.514 31.514 29.775 1.739 18135 4886 1 6 . 1 1 22 22 ARG H H 22 6.484 6.484 7.268 -0.784 18135 4887 1 6 . 1 1 23 23 LYS N N 23 128.593 128.593 127.627 0.966 18135 4888 1 6 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.551 -0.066 18135 4889 1 6 . 1 1 23 23 LYS C C 23 176.643 176.643 175.708 0.935 18135 4890 1 6 . 1 1 23 23 LYS CA C 23 57.287 57.287 56.106 1.181 18135 4891 1 6 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.053 4.208 18135 4892 1 6 . 1 1 23 23 LYS H H 23 10.212 10.212 8.526 1.686 18135 4893 1 6 . 1 1 24 24 ILE N N 24 118.605 118.605 122.207 -3.602 18135 4894 1 6 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.462 0.022 18135 4895 1 6 . 1 1 24 24 ILE C C 24 173.878 173.878 174.807 -0.929 18135 4896 1 6 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.619 -1.022 18135 4897 1 6 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.810 -0.354 18135 4898 1 6 . 1 1 24 24 ILE H H 24 8.465 8.465 8.305 0.161 18135 4899 1 6 . 1 1 25 25 SER N N 25 113.658 113.658 117.652 -3.994 18135 4900 1 6 . 1 1 25 25 SER HA H 25 4.481 4.481 4.904 -0.423 18135 4901 1 6 . 1 1 25 25 SER C C 25 176.359 176.359 175.567 0.792 18135 4902 1 6 . 1 1 25 25 SER CA C 25 56.975 56.975 56.765 0.210 18135 4903 1 6 . 1 1 25 25 SER CB C 25 64.759 64.759 63.928 0.832 18135 4904 1 6 . 1 1 25 25 SER H H 25 8.104 8.104 8.693 -0.589 18135 4905 1 6 . 1 1 26 26 LEU N N 26 127.566 127.566 126.946 0.620 18135 4906 1 6 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.250 -0.373 18135 4907 1 6 . 1 1 26 26 LEU C C 26 178.946 178.946 178.286 0.660 18135 4908 1 6 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.770 -0.092 18135 4909 1 6 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.288 -0.569 18135 4910 1 6 . 1 1 26 26 LEU H H 26 8.802 8.802 9.105 -0.303 18135 4911 1 6 . 1 1 27 27 PHE N N 27 117.143 117.143 116.041 1.102 18135 4912 1 6 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.555 -0.317 18135 4913 1 6 . 1 1 27 27 PHE C C 27 177.067 177.067 176.719 0.348 18135 4914 1 6 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.303 1.787 18135 4915 1 6 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.434 -0.171 18135 4916 1 6 . 1 1 27 27 PHE H H 27 7.986 7.986 8.063 -0.077 18135 4917 1 6 . 1 1 28 28 SER N N 28 115.200 115.200 116.331 -1.131 18135 4918 1 6 . 1 1 28 28 SER HA H 28 4.505 4.505 4.399 0.106 18135 4919 1 6 . 1 1 28 28 SER C C 28 174.533 174.533 174.772 -0.239 18135 4920 1 6 . 1 1 28 28 SER CA C 28 59.447 59.447 60.375 -0.928 18135 4921 1 6 . 1 1 28 28 SER CB C 28 63.790 63.790 63.456 0.334 18135 4922 1 6 . 1 1 28 28 SER H H 28 7.929 7.929 8.006 -0.077 18135 4923 1 6 . 1 1 29 29 CYS N N 29 119.870 119.870 120.039 -0.169 18135 4924 1 6 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.674 0.408 18135 4925 1 6 . 1 1 29 29 CYS C C 29 176.475 176.475 174.387 2.088 18135 4926 1 6 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.371 -4.941 18135 4927 1 6 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.715 9.527 18135 4928 1 6 . 1 1 29 29 CYS H H 29 7.865 7.865 8.314 -0.449 18135 4929 1 6 . 1 1 30 30 LEU N N 30 122.259 122.259 123.074 -0.815 18135 4930 1 6 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.309 -0.348 18135 4931 1 6 . 1 1 30 30 LEU C C 30 179.774 179.774 178.161 1.613 18135 4932 1 6 . 1 1 30 30 LEU CA C 30 58.303 58.303 55.866 2.437 18135 4933 1 6 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.023 -0.447 18135 4934 1 6 . 1 1 30 30 LEU H H 30 7.812 7.812 8.474 -0.662 18135 4935 1 6 . 1 1 31 31 LYS N N 31 117.731 117.731 113.345 4.386 18135 4936 1 6 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.216 0.474 18135 4937 1 6 . 1 1 31 31 LYS C C 31 176.692 176.692 175.799 0.893 18135 4938 1 6 . 1 1 31 31 LYS CA C 31 54.077 54.077 56.511 -2.434 18135 4939 1 6 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.437 0.150 18135 4940 1 6 . 1 1 31 31 LYS H H 31 8.597 8.597 8.160 0.437 18135 4941 1 6 . 1 1 32 32 ASP N N 32 117.841 117.841 119.479 -1.638 18135 4942 1 6 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.714 -0.020 18135 4943 1 6 . 1 1 32 32 ASP C C 32 175.505 175.505 176.244 -0.739 18135 4944 1 6 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.003 0.085 18135 4945 1 6 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.419 -0.611 18135 4946 1 6 . 1 1 32 32 ASP H H 32 7.808 7.808 7.850 -0.042 18135 4947 1 6 . 1 1 33 33 ARG N N 33 120.876 120.876 120.382 0.494 18135 4948 1 6 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.174 -0.133 18135 4949 1 6 . 1 1 33 33 ARG C C 33 175.286 175.286 175.542 -0.256 18135 4950 1 6 . 1 1 33 33 ARG CA C 33 58.083 58.083 56.389 1.694 18135 4951 1 6 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.882 -0.869 18135 4952 1 6 . 1 1 33 33 ARG H H 33 7.378 7.378 7.273 0.105 18135 4953 1 6 . 1 1 34 34 HIS N N 34 120.555 120.555 116.926 3.629 18135 4954 1 6 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.363 -0.151 18135 4955 1 6 . 1 1 34 34 HIS C C 34 170.494 170.494 173.472 -2.978 18135 4956 1 6 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.636 -3.029 18135 4957 1 6 . 1 1 34 34 HIS CB C 34 31.488 31.488 27.615 3.873 18135 4958 1 6 . 1 1 34 34 HIS H H 34 7.974 7.974 8.788 -0.814 18135 4959 1 6 . 1 1 35 35 ASP N N 35 125.061 125.061 122.144 2.917 18135 4960 1 6 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.445 0.193 18135 4961 1 6 . 1 1 35 35 ASP C C 35 175.943 175.943 176.315 -0.372 18135 4962 1 6 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.288 -1.919 18135 4963 1 6 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.926 -1.564 18135 4964 1 6 . 1 1 35 35 ASP H H 35 7.805 7.805 8.111 -0.306 18135 4965 1 6 . 1 1 36 36 PHE N N 36 122.860 122.860 120.060 2.800 18135 4966 1 6 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.371 -0.046 18135 4967 1 6 . 1 1 36 36 PHE C C 36 176.643 176.643 177.045 -0.402 18135 4968 1 6 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.521 1.118 18135 4969 1 6 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.404 1.287 18135 4970 1 6 . 1 1 36 36 PHE H H 36 8.973 8.973 7.046 1.927 18135 4971 1 6 . 1 1 37 37 GLY N N 37 111.856 111.856 108.912 2.944 18135 4972 1 6 . 1 1 37 37 GLY C C 37 175.185 175.185 174.025 1.160 18135 4973 1 6 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.707 3.436 18135 4974 1 6 . 1 1 37 37 GLY H H 37 8.727 8.727 7.933 0.794 18135 4975 1 6 . 1 1 38 38 PHE N N 38 123.178 123.178 118.311 4.867 18135 4976 1 6 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.530 -0.616 18135 4977 1 6 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.269 2.535 18135 4978 1 6 . 1 1 38 38 PHE CB C 38 38.657 38.657 37.823 0.834 18135 4979 1 6 . 1 1 38 38 PHE H H 38 9.169 9.169 7.255 1.915 18135 4980 1 6 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.440 0.089 18135 4981 1 6 . 1 1 39 39 PRO C C 39 174.634 174.634 177.218 -2.584 18135 4982 1 6 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.611 -1.068 18135 4983 1 6 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.628 -1.925 18135 4984 1 6 . 1 1 40 40 GLN N N 40 123.608 123.608 122.897 0.711 18135 4985 1 6 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.275 -0.656 18135 4986 1 6 . 1 1 40 40 GLN C C 40 176.958 176.958 177.537 -0.579 18135 4987 1 6 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.914 -0.841 18135 4988 1 6 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.866 0.952 18135 4989 1 6 . 1 1 40 40 GLN H H 40 7.966 7.966 8.341 -0.375 18135 4990 1 6 . 1 1 41 41 GLU N N 41 119.446 119.446 120.519 -1.073 18135 4991 1 6 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.166 -0.029 18135 4992 1 6 . 1 1 41 41 GLU C C 41 177.346 177.346 177.724 -0.378 18135 4993 1 6 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.021 -1.092 18135 4994 1 6 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.357 -1.524 18135 4995 1 6 . 1 1 41 41 GLU H H 41 9.044 9.044 8.659 0.385 18135 4996 1 6 . 1 1 42 42 GLU N N 42 117.196 117.196 117.298 -0.102 18135 4997 1 6 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.344 -0.281 18135 4998 1 6 . 1 1 42 42 GLU C C 42 174.886 174.886 177.851 -2.965 18135 4999 1 6 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.892 -1.508 18135 5000 1 6 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.870 -2.312 18135 5001 1 6 . 1 1 42 42 GLU H H 42 7.646 7.646 7.877 -0.231 18135 5002 1 6 . 1 1 43 43 PHE N N 43 115.527 115.527 122.916 -7.389 18135 5003 1 6 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.682 -0.196 18135 5004 1 6 . 1 1 43 43 PHE C C 43 175.615 175.615 176.047 -0.432 18135 5005 1 6 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.864 -1.316 18135 5006 1 6 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.322 -0.429 18135 5007 1 6 . 1 1 43 43 PHE H H 43 7.601 7.601 8.635 -1.034 18135 5008 1 6 . 1 1 44 44 GLY N N 44 107.243 107.243 108.438 -1.195 18135 5009 1 6 . 1 1 44 44 GLY C C 44 174.032 174.032 173.850 0.182 18135 5010 1 6 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.591 0.021 18135 5011 1 6 . 1 1 44 44 GLY H H 44 7.733 7.733 7.781 -0.048 18135 5012 1 6 . 1 1 45 45 ASN N N 45 117.599 117.599 121.724 -4.125 18135 5013 1 6 . 1 1 45 45 ASN HA H 45 4.551 4.551 5.007 -0.456 18135 5014 1 6 . 1 1 45 45 ASN C C 45 175.894 175.894 174.842 1.052 18135 5015 1 6 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.423 1.426 18135 5016 1 6 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.785 -1.366 18135 5017 1 6 . 1 1 45 45 ASN H H 45 8.343 8.343 7.608 0.735 18135 5018 1 6 . 1 1 46 46 GLN N N 46 118.916 118.916 119.268 -0.352 18135 5019 1 6 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.418 -0.336 18135 5020 1 6 . 1 1 46 46 GLN C C 46 175.851 175.851 176.301 -0.450 18135 5021 1 6 . 1 1 46 46 GLN CA C 46 56.646 56.646 54.961 1.685 18135 5022 1 6 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.645 -0.201 18135 5023 1 6 . 1 1 46 46 GLN H H 46 8.652 8.652 8.731 -0.079 18135 5024 1 6 . 1 1 47 47 PHE N N 47 119.511 119.511 116.834 2.677 18135 5025 1 6 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.681 -0.119 18135 5026 1 6 . 1 1 47 47 PHE C C 47 176.258 176.258 175.264 0.994 18135 5027 1 6 . 1 1 47 47 PHE CA C 47 57.920 57.920 57.156 0.764 18135 5028 1 6 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.019 0.839 18135 5029 1 6 . 1 1 47 47 PHE H H 47 7.904 7.904 7.802 0.102 18135 5030 1 6 . 1 1 48 48 GLN N N 48 120.127 120.127 119.474 0.653 18135 5031 1 6 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.355 0.020 18135 5032 1 6 . 1 1 48 48 GLN C C 48 181.265 181.265 175.180 6.085 18135 5033 1 6 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.380 1.196 18135 5034 1 6 . 1 1 48 48 GLN CB C 48 29.468 29.468 31.312 -1.844 18135 5035 1 6 . 1 1 48 48 GLN H H 48 8.255 8.255 7.486 0.769 18135 5036 1 6 . 1 1 49 49 LYS N N 49 121.777 121.777 121.513 0.264 18135 5037 1 6 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.057 0.046 18135 5038 1 6 . 1 1 49 49 LYS C C 49 177.968 177.968 177.118 0.850 18135 5039 1 6 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.231 -0.082 18135 5040 1 6 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.357 0.033 18135 5041 1 6 . 1 1 49 49 LYS H H 49 8.426 8.426 8.581 -0.155 18135 5042 1 6 . 1 1 50 50 ALA N N 50 120.573 120.573 121.168 -0.595 18135 5043 1 6 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.314 -0.244 18135 5044 1 6 . 1 1 50 50 ALA C C 50 178.697 178.697 177.113 1.584 18135 5045 1 6 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.226 1.542 18135 5046 1 6 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.499 0.375 18135 5047 1 6 . 1 1 50 50 ALA H H 50 8.578 8.578 8.071 0.507 18135 5048 1 6 . 1 1 51 51 GLU N N 51 115.015 115.015 115.697 -0.682 18135 5049 1 6 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.199 0.067 18135 5050 1 6 . 1 1 51 51 GLU C C 51 176.995 176.995 176.557 0.438 18135 5051 1 6 . 1 1 51 51 GLU CA C 51 56.993 56.993 56.984 0.009 18135 5052 1 6 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.342 -0.437 18135 5053 1 6 . 1 1 51 51 GLU H H 51 7.907 7.907 8.463 -0.556 18135 5054 1 6 . 1 1 52 52 THR N N 52 111.210 111.210 114.502 -3.292 18135 5055 1 6 . 1 1 52 52 THR HA H 52 4.114 4.114 4.255 -0.141 18135 5056 1 6 . 1 1 52 52 THR C C 52 175.271 175.271 175.713 -0.442 18135 5057 1 6 . 1 1 52 52 THR CA C 52 63.611 63.611 64.835 -1.224 18135 5058 1 6 . 1 1 52 52 THR CB C 52 69.673 69.673 68.774 0.899 18135 5059 1 6 . 1 1 52 52 THR H H 52 7.863 7.863 7.450 0.413 18135 5060 1 6 . 1 1 53 53 ILE N N 53 119.113 119.113 122.360 -3.247 18135 5061 1 6 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.020 -0.156 18135 5062 1 6 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.821 1.086 18135 5063 1 6 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.294 -1.341 18135 5064 1 6 . 1 1 53 53 ILE H H 53 8.341 8.341 8.135 0.206 18135 5065 1 6 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.378 -0.092 18135 5066 1 6 . 1 1 54 54 PRO C C 54 179.655 179.655 178.908 0.747 18135 5067 1 6 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.159 -0.108 18135 5068 1 6 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.420 0.465 18135 5069 1 6 . 1 1 55 55 VAL N N 55 116.355 116.355 116.676 -0.321 18135 5070 1 6 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.861 -0.180 18135 5071 1 6 . 1 1 55 55 VAL C C 55 177.649 177.649 178.198 -0.549 18135 5072 1 6 . 1 1 55 55 VAL CA C 55 65.837 65.837 66.167 -0.330 18135 5073 1 6 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.101 0.370 18135 5074 1 6 . 1 1 55 55 VAL H H 55 7.119 7.119 7.436 -0.317 18135 5075 1 6 . 1 1 56 56 LEU N N 56 123.038 123.038 120.888 2.150 18135 5076 1 6 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.080 0.230 18135 5077 1 6 . 1 1 56 56 LEU C C 56 178.637 178.637 178.075 0.562 18135 5078 1 6 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.394 -0.308 18135 5079 1 6 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.238 1.080 18135 5080 1 6 . 1 1 56 56 LEU H H 56 8.535 8.535 8.457 0.078 18135 5081 1 6 . 1 1 57 57 HIS N N 57 117.041 117.041 118.495 -1.454 18135 5082 1 6 . 1 1 57 57 HIS HA H 57 3.786 3.786 3.993 -0.207 18135 5083 1 6 . 1 1 57 57 HIS C C 57 175.640 175.640 177.371 -1.731 18135 5084 1 6 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.702 0.829 18135 5085 1 6 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.091 -1.882 18135 5086 1 6 . 1 1 57 57 HIS H H 57 9.047 9.047 8.104 0.943 18135 5087 1 6 . 1 1 58 58 GLU N N 58 119.521 119.521 118.693 0.828 18135 5088 1 6 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.768 0.239 18135 5089 1 6 . 1 1 58 58 GLU C C 58 179.029 179.029 178.960 0.069 18135 5090 1 6 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.467 -0.500 18135 5091 1 6 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.419 -1.129 18135 5092 1 6 . 1 1 58 58 GLU H H 58 7.860 7.860 8.186 -0.326 18135 5093 1 6 . 1 1 59 59 MET N N 59 119.512 119.512 119.013 0.499 18135 5094 1 6 . 1 1 59 59 MET HA H 59 4.074 4.074 4.248 -0.174 18135 5095 1 6 . 1 1 59 59 MET C C 59 177.031 177.031 179.128 -2.097 18135 5096 1 6 . 1 1 59 59 MET CA C 59 59.408 59.408 59.867 -0.459 18135 5097 1 6 . 1 1 59 59 MET CB C 59 32.525 32.525 32.850 -0.325 18135 5098 1 6 . 1 1 59 59 MET H H 59 8.442 8.442 8.028 0.414 18135 5099 1 6 . 1 1 60 60 ILE N N 60 117.183 117.183 117.963 -0.780 18135 5100 1 6 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.504 -0.087 18135 5101 1 6 . 1 1 60 60 ILE C C 60 177.524 177.524 178.185 -0.661 18135 5102 1 6 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.948 0.378 18135 5103 1 6 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.157 -0.298 18135 5104 1 6 . 1 1 60 60 ILE H H 60 8.338 8.338 7.758 0.580 18135 5105 1 6 . 1 1 61 61 GLN N N 61 120.191 120.191 119.700 0.491 18135 5106 1 6 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.721 -0.019 18135 5107 1 6 . 1 1 61 61 GLN C C 61 178.270 178.270 177.739 0.531 18135 5108 1 6 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.285 -0.499 18135 5109 1 6 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.151 0.515 18135 5110 1 6 . 1 1 61 61 GLN H H 61 8.234 8.234 8.117 0.117 18135 5111 1 6 . 1 1 62 62 GLN N N 62 116.795 116.795 119.010 -2.215 18135 5112 1 6 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.216 0.411 18135 5113 1 6 . 1 1 62 62 GLN C C 62 179.685 179.685 178.359 1.326 18135 5114 1 6 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.452 -0.444 18135 5115 1 6 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.953 -3.611 18135 5116 1 6 . 1 1 62 62 GLN H H 62 8.421 8.421 8.208 0.213 18135 5117 1 6 . 1 1 63 63 ILE N N 63 122.797 122.797 119.948 2.849 18135 5118 1 6 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.942 -0.293 18135 5119 1 6 . 1 1 63 63 ILE C C 63 177.279 177.279 177.873 -0.594 18135 5120 1 6 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.561 2.404 18135 5121 1 6 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.823 -0.508 18135 5122 1 6 . 1 1 63 63 ILE H H 63 8.164 8.164 7.637 0.527 18135 5123 1 6 . 1 1 64 64 PHE N N 64 120.820 120.820 121.448 -0.628 18135 5124 1 6 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.425 -0.709 18135 5125 1 6 . 1 1 64 64 PHE C C 64 178.402 178.402 176.744 1.658 18135 5126 1 6 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.457 0.695 18135 5127 1 6 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.640 -0.130 18135 5128 1 6 . 1 1 64 64 PHE H H 64 8.405 8.405 7.867 0.538 18135 5129 1 6 . 1 1 65 65 ASN N N 65 119.981 119.981 118.492 1.489 18135 5130 1 6 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.812 0.251 18135 5131 1 6 . 1 1 65 65 ASN C C 65 177.944 177.944 177.471 0.473 18135 5132 1 6 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.233 -0.366 18135 5133 1 6 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.551 -1.295 18135 5134 1 6 . 1 1 65 65 ASN H H 65 8.812 8.812 8.097 0.715 18135 5135 1 6 . 1 1 66 66 LEU N N 66 121.533 121.533 120.385 1.148 18135 5136 1 6 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.296 -0.073 18135 5137 1 6 . 1 1 66 66 LEU C C 66 177.777 177.777 178.111 -0.334 18135 5138 1 6 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.507 0.761 18135 5139 1 6 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.074 0.533 18135 5140 1 6 . 1 1 66 66 LEU H H 66 8.177 8.177 7.918 0.259 18135 5141 1 6 . 1 1 67 67 PHE N N 67 110.842 110.842 112.802 -1.960 18135 5142 1 6 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.622 0.258 18135 5143 1 6 . 1 1 67 67 PHE C C 67 177.965 177.965 176.301 1.664 18135 5144 1 6 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.524 1.010 18135 5145 1 6 . 1 1 67 67 PHE CB C 67 38.616 38.616 39.537 -0.921 18135 5146 1 6 . 1 1 67 67 PHE H H 67 8.160 8.160 8.150 0.010 18135 5147 1 6 . 1 1 68 68 SER N N 68 119.131 119.131 113.311 5.820 18135 5148 1 6 . 1 1 68 68 SER HA H 68 4.580 4.580 4.278 0.302 18135 5149 1 6 . 1 1 68 68 SER C C 68 173.472 173.472 174.753 -1.281 18135 5150 1 6 . 1 1 68 68 SER CA C 68 59.191 59.191 59.069 0.122 18135 5151 1 6 . 1 1 68 68 SER CB C 68 63.123 63.123 63.629 -0.506 18135 5152 1 6 . 1 1 68 68 SER H H 68 8.016 8.016 7.443 0.573 18135 5153 1 6 . 1 1 69 69 THR N N 69 111.353 111.353 114.646 -3.293 18135 5154 1 6 . 1 1 69 69 THR HA H 69 4.345 4.345 4.411 -0.066 18135 5155 1 6 . 1 1 69 69 THR C C 69 175.661 175.661 174.625 1.036 18135 5156 1 6 . 1 1 69 69 THR CA C 69 61.411 61.411 60.406 1.005 18135 5157 1 6 . 1 1 69 69 THR CB C 69 72.209 72.209 70.550 1.659 18135 5158 1 6 . 1 1 69 69 THR H H 69 6.977 6.977 7.282 -0.305 18135 5159 1 6 . 1 1 70 70 LYS N N 70 121.120 121.120 122.979 -1.859 18135 5160 1 6 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.111 -0.022 18135 5161 1 6 . 1 1 70 70 LYS C C 70 179.259 179.259 177.436 1.823 18135 5162 1 6 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.716 -0.760 18135 5163 1 6 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.187 -0.437 18135 5164 1 6 . 1 1 70 70 LYS H H 70 9.065 9.065 8.601 0.464 18135 5165 1 6 . 1 1 71 71 ASP N N 71 116.374 116.374 120.261 -3.887 18135 5166 1 6 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.284 -0.109 18135 5167 1 6 . 1 1 71 71 ASP C C 71 178.372 178.372 177.469 0.903 18135 5168 1 6 . 1 1 71 71 ASP CA C 71 57.067 57.067 56.977 0.090 18135 5169 1 6 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.439 -0.133 18135 5170 1 6 . 1 1 71 71 ASP H H 71 7.518 7.518 7.682 -0.164 18135 5171 1 6 . 1 1 72 72 SER N N 72 117.341 117.341 113.922 3.419 18135 5172 1 6 . 1 1 72 72 SER HA H 72 3.715 3.715 3.202 0.513 18135 5173 1 6 . 1 1 72 72 SER C C 72 176.897 176.897 175.241 1.656 18135 5174 1 6 . 1 1 72 72 SER CA C 72 60.267 60.267 61.037 -0.770 18135 5175 1 6 . 1 1 72 72 SER CB C 72 62.616 62.616 63.056 -0.440 18135 5176 1 6 . 1 1 72 72 SER H H 72 8.066 8.066 7.901 0.165 18135 5177 1 6 . 1 1 73 73 SER N N 73 113.398 113.398 115.975 -2.577 18135 5178 1 6 . 1 1 73 73 SER HA H 73 4.094 4.094 4.117 -0.024 18135 5179 1 6 . 1 1 73 73 SER C C 73 174.855 174.855 175.052 -0.197 18135 5180 1 6 . 1 1 73 73 SER CA C 73 61.385 61.385 60.145 1.240 18135 5181 1 6 . 1 1 73 73 SER CB C 73 62.798 62.798 62.971 -0.173 18135 5182 1 6 . 1 1 73 73 SER H H 73 7.982 7.982 7.583 0.399 18135 5183 1 6 . 1 1 74 74 ALA N N 74 119.486 119.486 119.952 -0.466 18135 5184 1 6 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.250 -0.093 18135 5185 1 6 . 1 1 74 74 ALA C C 74 177.626 177.626 177.008 0.618 18135 5186 1 6 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.285 0.428 18135 5187 1 6 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.906 -0.159 18135 5188 1 6 . 1 1 74 74 ALA H H 74 7.095 7.095 7.401 -0.306 18135 5189 1 6 . 1 1 75 75 ALA N N 75 121.465 121.465 121.187 0.278 18135 5190 1 6 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.985 -0.289 18135 5191 1 6 . 1 1 75 75 ALA C C 75 177.197 177.197 176.212 0.985 18135 5192 1 6 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.813 1.191 18135 5193 1 6 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.107 -0.847 18135 5194 1 6 . 1 1 75 75 ALA H H 75 7.159 7.159 7.406 -0.247 18135 5195 1 6 . 1 1 76 76 TRP N N 76 116.791 116.791 116.759 0.032 18135 5196 1 6 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.740 0.310 18135 5197 1 6 . 1 1 76 76 TRP C C 76 177.617 177.617 174.963 2.654 18135 5198 1 6 . 1 1 76 76 TRP CA C 76 53.319 53.319 54.818 -1.499 18135 5199 1 6 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.009 2.067 18135 5200 1 6 . 1 1 76 76 TRP H H 76 7.080 7.080 7.087 -0.007 18135 5201 1 6 . 1 1 77 77 ASP N N 77 119.928 119.928 121.639 -1.711 18135 5202 1 6 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.606 -0.249 18135 5203 1 6 . 1 1 77 77 ASP C C 77 176.877 176.877 177.705 -0.828 18135 5204 1 6 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.291 -0.473 18135 5205 1 6 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.984 0.631 18135 5206 1 6 . 1 1 77 77 ASP H H 77 8.259 8.259 8.764 -0.505 18135 5207 1 6 . 1 1 78 78 GLU N N 78 127.277 127.277 125.732 1.545 18135 5208 1 6 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.982 -0.097 18135 5209 1 6 . 1 1 78 78 GLU C C 78 177.439 177.439 177.941 -0.502 18135 5210 1 6 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.922 -0.538 18135 5211 1 6 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.376 -0.734 18135 5212 1 6 . 1 1 78 78 GLU H H 78 8.920 8.920 8.853 0.067 18135 5213 1 6 . 1 1 79 79 THR N N 79 115.422 115.422 118.002 -2.580 18135 5214 1 6 . 1 1 79 79 THR HA H 79 3.907 3.907 4.069 -0.162 18135 5215 1 6 . 1 1 79 79 THR C C 79 177.330 177.330 176.692 0.638 18135 5216 1 6 . 1 1 79 79 THR CA C 79 66.263 66.263 65.580 0.683 18135 5217 1 6 . 1 1 79 79 THR CB C 79 68.002 68.002 68.124 -0.122 18135 5218 1 6 . 1 1 79 79 THR H H 79 8.124 8.124 8.261 -0.137 18135 5219 1 6 . 1 1 80 80 LEU N N 80 121.791 121.791 122.568 -0.777 18135 5220 1 6 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.144 -0.257 18135 5221 1 6 . 1 1 80 80 LEU C C 80 179.018 179.018 178.679 0.339 18135 5222 1 6 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.374 -0.135 18135 5223 1 6 . 1 1 80 80 LEU CB C 80 41.652 41.652 40.849 0.803 18135 5224 1 6 . 1 1 80 80 LEU H H 80 7.725 7.725 8.090 -0.365 18135 5225 1 6 . 1 1 81 81 LEU N N 81 119.280 119.280 120.520 -1.240 18135 5226 1 6 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.224 -0.736 18135 5227 1 6 . 1 1 81 81 LEU C C 81 177.062 177.062 178.818 -1.756 18135 5228 1 6 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.628 -0.919 18135 5229 1 6 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.056 -1.108 18135 5230 1 6 . 1 1 81 81 LEU H H 81 8.344 8.344 8.849 -0.505 18135 5231 1 6 . 1 1 82 82 ASP N N 82 115.357 115.357 119.690 -4.333 18135 5232 1 6 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.398 -0.124 18135 5233 1 6 . 1 1 82 82 ASP C C 82 179.018 179.018 178.479 0.539 18135 5234 1 6 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.606 -0.791 18135 5235 1 6 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.876 -2.655 18135 5236 1 6 . 1 1 82 82 ASP H H 82 8.001 8.001 8.515 -0.514 18135 5237 1 6 . 1 1 83 83 LYS N N 83 119.603 119.603 118.841 0.762 18135 5238 1 6 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.886 0.096 18135 5239 1 6 . 1 1 83 83 LYS C C 83 178.624 178.624 178.898 -0.274 18135 5240 1 6 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.978 0.767 18135 5241 1 6 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.268 0.838 18135 5242 1 6 . 1 1 83 83 LYS H H 83 7.342 7.342 7.663 -0.321 18135 5243 1 6 . 1 1 84 84 PHE N N 84 123.933 123.933 121.716 2.217 18135 5244 1 6 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.028 0.007 18135 5245 1 6 . 1 1 84 84 PHE C C 84 177.210 177.210 177.052 0.158 18135 5246 1 6 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.841 -1.498 18135 5247 1 6 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.889 0.428 18135 5248 1 6 . 1 1 84 84 PHE H H 84 8.471 8.471 8.491 -0.020 18135 5249 1 6 . 1 1 85 85 TYR N N 85 118.387 118.387 117.419 0.968 18135 5250 1 6 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.705 0.363 18135 5251 1 6 . 1 1 85 85 TYR C C 85 178.104 178.104 177.494 0.610 18135 5252 1 6 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.557 -0.980 18135 5253 1 6 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.163 -0.186 18135 5254 1 6 . 1 1 85 85 TYR H H 85 9.011 9.011 8.987 0.024 18135 5255 1 6 . 1 1 86 86 THR N N 86 114.035 114.035 116.382 -2.347 18135 5256 1 6 . 1 1 86 86 THR HA H 86 3.945 3.945 3.229 0.716 18135 5257 1 6 . 1 1 86 86 THR C C 86 176.708 176.708 176.292 0.416 18135 5258 1 6 . 1 1 86 86 THR CA C 86 66.759 66.759 66.982 -0.223 18135 5259 1 6 . 1 1 86 86 THR CB C 86 68.853 68.853 67.823 1.030 18135 5260 1 6 . 1 1 86 86 THR H H 86 7.609 7.609 7.417 0.192 18135 5261 1 6 . 1 1 87 87 GLU N N 87 120.790 120.790 121.480 -0.690 18135 5262 1 6 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.887 0.160 18135 5263 1 6 . 1 1 87 87 GLU C C 87 179.606 179.606 178.916 0.690 18135 5264 1 6 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.666 -1.268 18135 5265 1 6 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.422 -1.136 18135 5266 1 6 . 1 1 87 87 GLU H H 87 7.712 7.712 7.671 0.041 18135 5267 1 6 . 1 1 88 88 LEU N N 88 120.729 120.729 119.752 0.977 18135 5268 1 6 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.884 -0.156 18135 5269 1 6 . 1 1 88 88 LEU C C 88 178.695 178.695 179.304 -0.609 18135 5270 1 6 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.360 0.891 18135 5271 1 6 . 1 1 88 88 LEU CB C 88 41.587 41.587 39.970 1.617 18135 5272 1 6 . 1 1 88 88 LEU H H 88 8.393 8.393 7.436 0.957 18135 5273 1 6 . 1 1 89 89 TYR N N 89 118.654 118.654 118.435 0.219 18135 5274 1 6 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.059 -0.128 18135 5275 1 6 . 1 1 89 89 TYR C C 89 178.438 178.438 178.555 -0.117 18135 5276 1 6 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.318 0.089 18135 5277 1 6 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.420 0.447 18135 5278 1 6 . 1 1 89 89 TYR H H 89 8.637 8.637 8.317 0.320 18135 5279 1 6 . 1 1 90 90 GLN N N 90 118.263 118.263 116.573 1.690 18135 5280 1 6 . 1 1 90 90 GLN HA H 90 3.986 3.986 4.006 -0.020 18135 5281 1 6 . 1 1 90 90 GLN C C 90 178.411 178.411 178.753 -0.342 18135 5282 1 6 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.780 0.002 18135 5283 1 6 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.399 -0.252 18135 5284 1 6 . 1 1 90 90 GLN H H 90 7.796 7.796 7.758 0.038 18135 5285 1 6 . 1 1 91 91 GLN N N 91 117.959 117.959 119.774 -1.815 18135 5286 1 6 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.076 0.006 18135 5287 1 6 . 1 1 91 91 GLN C C 91 178.705 178.705 178.631 0.074 18135 5288 1 6 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.389 0.431 18135 5289 1 6 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.289 0.884 18135 5290 1 6 . 1 1 91 91 GLN H H 91 7.727 7.727 8.338 -0.611 18135 5291 1 6 . 1 1 92 92 LEU N N 92 119.965 119.965 118.054 1.911 18135 5292 1 6 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.971 -0.237 18135 5293 1 6 . 1 1 92 92 LEU C C 92 178.984 178.984 178.701 0.283 18135 5294 1 6 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.865 -0.373 18135 5295 1 6 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.695 0.684 18135 5296 1 6 . 1 1 92 92 LEU H H 92 8.465 8.465 8.481 -0.016 18135 5297 1 6 . 1 1 93 93 ASN N N 93 117.793 117.793 118.385 -0.592 18135 5298 1 6 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.253 0.148 18135 5299 1 6 . 1 1 93 93 ASN C C 93 178.309 178.309 177.144 1.165 18135 5300 1 6 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.252 0.151 18135 5301 1 6 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.214 0.424 18135 5302 1 6 . 1 1 93 93 ASN H H 93 8.091 8.091 8.024 0.067 18135 5303 1 6 . 1 1 94 94 ASP N N 94 121.133 121.133 120.784 0.349 18135 5304 1 6 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.380 0.025 18135 5305 1 6 . 1 1 94 94 ASP C C 94 178.328 178.328 178.658 -0.330 18135 5306 1 6 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.479 -0.932 18135 5307 1 6 . 1 1 94 94 ASP CB C 94 38.649 38.649 41.036 -2.387 18135 5308 1 6 . 1 1 94 94 ASP H H 94 8.362 8.362 7.984 0.378 18135 5309 1 6 . 1 1 95 95 LEU N N 95 119.160 119.160 121.027 -1.867 18135 5310 1 6 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.840 0.199 18135 5311 1 6 . 1 1 95 95 LEU C C 95 178.826 178.826 178.447 0.379 18135 5312 1 6 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.091 -1.064 18135 5313 1 6 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.090 0.120 18135 5314 1 6 . 1 1 95 95 LEU H H 95 8.143 8.143 8.566 -0.423 18135 5315 1 6 . 1 1 96 96 GLU N N 96 118.813 118.813 118.890 -0.077 18135 5316 1 6 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.767 0.194 18135 5317 1 6 . 1 1 96 96 GLU C C 96 177.640 177.640 178.187 -0.547 18135 5318 1 6 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.354 -1.640 18135 5319 1 6 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.509 -1.371 18135 5320 1 6 . 1 1 96 96 GLU H H 96 8.111 8.111 8.333 -0.222 18135 5321 1 6 . 1 1 97 97 ALA N N 97 120.549 120.549 121.198 -0.649 18135 5322 1 6 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.967 0.155 18135 5323 1 6 . 1 1 97 97 ALA C C 97 179.126 179.126 180.177 -1.051 18135 5324 1 6 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.724 -0.691 18135 5325 1 6 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.878 0.102 18135 5326 1 6 . 1 1 97 97 ALA H H 97 7.798 7.798 7.793 0.005 18135 5327 1 6 . 1 1 98 98 CYS N N 98 115.510 115.510 117.566 -2.056 18135 5328 1 6 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.117 0.333 18135 5329 1 6 . 1 1 98 98 CYS C C 98 175.363 175.363 176.330 -0.967 18135 5330 1 6 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.163 -4.997 18135 5331 1 6 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.437 15.442 18135 5332 1 6 . 1 1 98 98 CYS H H 98 7.597 7.597 7.926 -0.329 18135 5333 1 6 . 1 1 99 99 VAL N N 99 121.713 121.713 119.608 2.105 18135 5334 1 6 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.892 -0.098 18135 5335 1 6 . 1 1 99 99 VAL C C 99 177.357 177.357 177.970 -0.613 18135 5336 1 6 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.430 -0.847 18135 5337 1 6 . 1 1 99 99 VAL CB C 99 32.031 32.031 31.880 0.151 18135 5338 1 6 . 1 1 99 99 VAL H H 99 7.828 7.828 7.404 0.424 18135 5339 1 6 . 1 1 100 100 ILE N N 100 122.333 122.333 119.173 3.160 18135 5340 1 6 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.677 0.247 18135 5341 1 6 . 1 1 100 100 ILE C C 100 176.827 176.827 176.432 0.395 18135 5342 1 6 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.603 -1.365 18135 5343 1 6 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.665 0.613 18135 5344 1 6 . 1 1 100 100 ILE H H 100 8.067 8.067 8.277 -0.210 18135 5345 1 6 . 1 1 101 101 GLN N N 101 121.864 121.864 117.592 4.272 18135 5346 1 6 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.191 0.035 18135 5347 1 6 . 1 1 101 101 GLN C C 101 176.438 176.438 178.093 -1.655 18135 5348 1 6 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.578 -0.258 18135 5349 1 6 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.106 -0.095 18135 5350 1 6 . 1 1 101 101 GLN H H 101 8.062 8.062 7.406 0.656 18135 5351 1 6 . 1 1 102 102 GLY N N 102 109.288 109.288 110.198 -0.910 18135 5352 1 6 . 1 1 102 102 GLY C C 102 173.855 173.855 175.493 -1.638 18135 5353 1 6 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.256 -1.097 18135 5354 1 6 . 1 1 102 102 GLY H H 102 8.087 8.087 8.825 -0.738 18135 5355 1 6 . 1 1 103 103 VAL N N 103 118.932 118.932 118.975 -0.043 18135 5356 1 6 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.791 0.283 18135 5357 1 6 . 1 1 103 103 VAL C C 103 176.299 176.299 175.885 0.414 18135 5358 1 6 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.529 -1.030 18135 5359 1 6 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.973 0.881 18135 5360 1 6 . 1 1 103 103 VAL H H 103 8.079 8.079 7.673 0.406 18135 5361 1 6 . 1 1 104 104 GLY N N 104 112.028 112.028 107.929 4.099 18135 5362 1 6 . 1 1 104 104 GLY C C 104 173.694 173.694 172.739 0.955 18135 5363 1 6 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.055 0.347 18135 5364 1 6 . 1 1 104 104 GLY H H 104 8.446 8.446 7.799 0.647 18135 5365 1 6 . 1 1 105 105 VAL N N 105 120.439 120.439 120.497 -0.058 18135 5366 1 6 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.399 -0.211 18135 5367 1 6 . 1 1 105 105 VAL C C 105 175.963 175.963 173.963 2.000 18135 5368 1 6 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.641 1.495 18135 5369 1 6 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.326 -1.512 18135 5370 1 6 . 1 1 105 105 VAL H H 105 7.867 7.867 7.906 -0.039 18135 5371 1 6 . 1 1 106 106 THR N N 106 116.366 116.366 118.773 -2.407 18135 5372 1 6 . 1 1 106 106 THR HA H 106 4.548 4.548 4.609 -0.061 18135 5373 1 6 . 1 1 106 106 THR C C 106 173.731 173.731 173.743 -0.012 18135 5374 1 6 . 1 1 106 106 THR CA C 106 59.419 59.419 60.795 -1.376 18135 5375 1 6 . 1 1 106 106 THR CB C 106 79.536 79.536 70.808 8.728 18135 5376 1 6 . 1 1 106 106 THR H H 106 8.565 8.565 8.049 0.516 18135 5377 1 6 . 1 1 107 107 GLU N N 107 119.743 119.743 121.712 -1.969 18135 5378 1 6 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.758 -0.296 18135 5379 1 6 . 1 1 107 107 GLU C C 107 175.639 175.639 176.459 -0.820 18135 5380 1 6 . 1 1 107 107 GLU CA C 107 55.711 55.711 55.055 0.656 18135 5381 1 6 . 1 1 107 107 GLU CB C 107 30.499 30.499 32.783 -2.284 18135 5382 1 6 . 1 1 107 107 GLU H H 107 8.410 8.410 8.608 -0.198 18135 5383 1 6 . 1 1 108 108 THR N N 108 114.402 114.402 112.416 1.986 18135 5384 1 6 . 1 1 108 108 THR HA H 108 4.448 4.448 4.739 -0.291 18135 5385 1 6 . 1 1 108 108 THR CA C 108 60.348 60.348 58.770 1.578 18135 5386 1 6 . 1 1 108 108 THR CB C 108 68.544 68.544 68.508 0.036 18135 5387 1 6 . 1 1 108 108 THR H H 108 8.155 8.155 8.313 -0.158 18135 5388 1 6 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.380 -0.142 18135 5389 1 6 . 1 1 109 109 PRO C C 109 178.666 178.666 177.932 0.734 18135 5390 1 6 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.095 1.281 18135 5391 1 6 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.982 -0.134 18135 5392 1 6 . 1 1 110 110 LEU N N 110 118.566 118.566 118.242 0.324 18135 5393 1 6 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.101 0.015 18135 5394 1 6 . 1 1 110 110 LEU C C 110 178.293 178.293 179.663 -1.370 18135 5395 1 6 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.936 -1.250 18135 5396 1 6 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.610 0.359 18135 5397 1 6 . 1 1 110 110 LEU H H 110 8.016 8.016 7.852 0.164 18135 5398 1 6 . 1 1 111 111 MET N N 111 118.982 118.982 115.875 3.107 18135 5399 1 6 . 1 1 111 111 MET HA H 111 4.210 4.210 4.314 -0.104 18135 5400 1 6 . 1 1 111 111 MET C C 111 178.720 178.720 177.703 1.017 18135 5401 1 6 . 1 1 111 111 MET CA C 111 58.144 58.144 56.795 1.349 18135 5402 1 6 . 1 1 111 111 MET CB C 111 32.374 32.374 32.106 0.268 18135 5403 1 6 . 1 1 111 111 MET H H 111 7.705 7.705 7.956 -0.251 18135 5404 1 6 . 1 1 112 112 LYS N N 112 121.377 121.377 120.212 1.165 18135 5405 1 6 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.093 0.015 18135 5406 1 6 . 1 1 112 112 LYS C C 112 178.000 178.000 178.468 -0.468 18135 5407 1 6 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.961 -2.656 18135 5408 1 6 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.088 0.279 18135 5409 1 6 . 1 1 112 112 LYS H H 112 8.257 8.257 7.651 0.606 18135 5410 1 6 . 1 1 113 113 GLU N N 113 119.104 119.104 119.050 0.054 18135 5411 1 6 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.993 0.073 18135 5412 1 6 . 1 1 113 113 GLU C C 113 178.289 178.289 178.653 -0.364 18135 5413 1 6 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.439 -1.186 18135 5414 1 6 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.362 -1.224 18135 5415 1 6 . 1 1 113 113 GLU H H 113 8.270 8.270 7.875 0.395 18135 5416 1 6 . 1 1 114 114 ASP N N 114 119.224 119.224 119.441 -0.217 18135 5417 1 6 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.554 -0.266 18135 5418 1 6 . 1 1 114 114 ASP C C 114 178.365 178.365 178.183 0.182 18135 5419 1 6 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.106 -0.998 18135 5420 1 6 . 1 1 114 114 ASP CB C 114 38.235 38.235 41.109 -2.874 18135 5421 1 6 . 1 1 114 114 ASP H H 114 8.618 8.618 7.631 0.987 18135 5422 1 6 . 1 1 115 115 SER N N 115 118.195 118.195 117.226 0.969 18135 5423 1 6 . 1 1 115 115 SER HA H 115 4.200 4.200 4.120 0.080 18135 5424 1 6 . 1 1 115 115 SER C C 115 175.986 175.986 176.643 -0.657 18135 5425 1 6 . 1 1 115 115 SER CA C 115 61.588 61.588 61.728 -0.140 18135 5426 1 6 . 1 1 115 115 SER CB C 115 62.653 62.653 63.234 -0.581 18135 5427 1 6 . 1 1 115 115 SER H H 115 8.181 8.181 7.553 0.628 18135 5428 1 6 . 1 1 116 116 ILE N N 116 123.340 123.340 120.287 3.053 18135 5429 1 6 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.854 -0.228 18135 5430 1 6 . 1 1 116 116 ILE C C 116 178.367 178.367 177.737 0.630 18135 5431 1 6 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.748 1.069 18135 5432 1 6 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.901 0.517 18135 5433 1 6 . 1 1 116 116 ILE H H 116 7.773 7.773 8.306 -0.533 18135 5434 1 6 . 1 1 117 117 LEU N N 117 120.968 120.968 121.382 -0.414 18135 5435 1 6 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.889 0.017 18135 5436 1 6 . 1 1 117 117 LEU C C 117 178.746 178.746 178.302 0.444 18135 5437 1 6 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.338 -0.195 18135 5438 1 6 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.548 0.038 18135 5439 1 6 . 1 1 117 117 LEU H H 117 8.406 8.406 7.406 1.000 18135 5440 1 6 . 1 1 118 118 ALA N N 118 120.150 120.150 121.963 -1.813 18135 5441 1 6 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.654 0.458 18135 5442 1 6 . 1 1 118 118 ALA C C 118 181.633 181.633 178.593 3.040 18135 5443 1 6 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.112 0.201 18135 5444 1 6 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.352 -0.242 18135 5445 1 6 . 1 1 118 118 ALA H H 118 7.894 7.894 8.276 -0.382 18135 5446 1 6 . 1 1 119 119 VAL N N 119 118.873 118.873 116.247 2.626 18135 5447 1 6 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.427 0.328 18135 5448 1 6 . 1 1 119 119 VAL C C 119 177.896 177.896 177.671 0.225 18135 5449 1 6 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.165 2.016 18135 5450 1 6 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.098 1.796 18135 5451 1 6 . 1 1 119 119 VAL H H 119 7.572 7.572 7.776 -0.204 18135 5452 1 6 . 1 1 120 120 ARG N N 120 121.436 121.436 120.157 1.279 18135 5453 1 6 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.102 -0.075 18135 5454 1 6 . 1 1 120 120 ARG C C 120 179.848 179.848 178.755 1.093 18135 5455 1 6 . 1 1 120 120 ARG CA C 120 61.267 61.267 58.884 2.383 18135 5456 1 6 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.376 0.319 18135 5457 1 6 . 1 1 120 120 ARG H H 120 8.629 8.629 8.406 0.223 18135 5458 1 6 . 1 1 121 121 LYS N N 121 119.589 119.589 120.485 -0.896 18135 5459 1 6 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.999 0.075 18135 5460 1 6 . 1 1 121 121 LYS C C 121 178.331 178.331 179.330 -0.999 18135 5461 1 6 . 1 1 121 121 LYS CA C 121 60.440 60.440 58.937 1.503 18135 5462 1 6 . 1 1 121 121 LYS CB C 121 32.107 32.107 31.840 0.267 18135 5463 1 6 . 1 1 121 121 LYS H H 121 9.015 9.015 8.094 0.921 18135 5464 1 6 . 1 1 122 122 TYR N N 122 121.546 121.546 118.503 3.043 18135 5465 1 6 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.133 0.199 18135 5466 1 6 . 1 1 122 122 TYR C C 122 176.527 176.527 177.808 -1.281 18135 5467 1 6 . 1 1 122 122 TYR CA C 122 60.404 60.404 59.019 1.385 18135 5468 1 6 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.213 0.512 18135 5469 1 6 . 1 1 122 122 TYR H H 122 7.473 7.473 7.670 -0.197 18135 5470 1 6 . 1 1 123 123 PHE N N 123 116.026 116.026 120.065 -4.039 18135 5471 1 6 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.973 -0.233 18135 5472 1 6 . 1 1 123 123 PHE C C 123 179.005 179.005 177.595 1.410 18135 5473 1 6 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.625 2.903 18135 5474 1 6 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.872 0.459 18135 5475 1 6 . 1 1 123 123 PHE H H 123 7.932 7.932 8.286 -0.354 18135 5476 1 6 . 1 1 124 124 GLN N N 124 123.043 123.043 117.935 5.108 18135 5477 1 6 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.436 0.743 18135 5478 1 6 . 1 1 124 124 GLN C C 124 178.772 178.772 178.752 0.020 18135 5479 1 6 . 1 1 124 124 GLN CA C 124 59.316 59.316 58.995 0.322 18135 5480 1 6 . 1 1 124 124 GLN CB C 124 27.631 27.631 27.960 -0.329 18135 5481 1 6 . 1 1 124 124 GLN H H 124 8.470 8.470 8.547 -0.077 18135 5482 1 6 . 1 1 125 125 ARG N N 125 120.342 120.342 118.940 1.402 18135 5483 1 6 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.158 -0.080 18135 5484 1 6 . 1 1 125 125 ARG C C 125 180.340 180.340 179.195 1.145 18135 5485 1 6 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.618 2.679 18135 5486 1 6 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.114 0.211 18135 5487 1 6 . 1 1 125 125 ARG H H 125 8.137 8.137 8.005 0.132 18135 5488 1 6 . 1 1 126 126 ILE N N 126 121.876 121.876 121.184 0.692 18135 5489 1 6 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.706 -0.355 18135 5490 1 6 . 1 1 126 126 ILE C C 126 176.857 176.857 177.976 -1.119 18135 5491 1 6 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.948 0.884 18135 5492 1 6 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.770 0.514 18135 5493 1 6 . 1 1 126 126 ILE H H 126 7.526 7.526 8.444 -0.918 18135 5494 1 6 . 1 1 127 127 THR N N 127 115.613 115.613 114.954 0.659 18135 5495 1 6 . 1 1 127 127 THR HA H 127 3.633 3.633 3.871 -0.238 18135 5496 1 6 . 1 1 127 127 THR C C 127 176.645 176.645 176.816 -0.171 18135 5497 1 6 . 1 1 127 127 THR CA C 127 67.294 67.294 66.437 0.857 18135 5498 1 6 . 1 1 127 127 THR CB C 127 68.871 68.871 68.881 -0.010 18135 5499 1 6 . 1 1 127 127 THR H H 127 8.288 8.288 8.161 0.127 18135 5500 1 6 . 1 1 128 128 LEU N N 128 122.627 122.627 122.433 0.194 18135 5501 1 6 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.947 0.009 18135 5502 1 6 . 1 1 128 128 LEU C C 128 178.331 178.331 177.680 0.651 18135 5503 1 6 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.901 0.187 18135 5504 1 6 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.274 0.300 18135 5505 1 6 . 1 1 128 128 LEU H H 128 8.263 8.263 8.108 0.155 18135 5506 1 6 . 1 1 129 129 TYR N N 129 120.955 120.955 120.358 0.597 18135 5507 1 6 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.296 -0.406 18135 5508 1 6 . 1 1 129 129 TYR C C 129 176.040 176.040 177.597 -1.557 18135 5509 1 6 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.300 0.193 18135 5510 1 6 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.203 0.722 18135 5511 1 6 . 1 1 129 129 TYR H H 129 7.518 7.518 8.351 -0.833 18135 5512 1 6 . 1 1 130 130 LEU N N 130 119.155 119.155 116.388 2.767 18135 5513 1 6 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.299 -0.454 18135 5514 1 6 . 1 1 130 130 LEU C C 130 177.948 177.948 178.364 -0.416 18135 5515 1 6 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.949 0.164 18135 5516 1 6 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.515 1.071 18135 5517 1 6 . 1 1 130 130 LEU H H 130 7.717 7.717 7.989 -0.272 18135 5518 1 6 . 1 1 131 131 LYS N N 131 116.832 116.832 119.967 -3.135 18135 5519 1 6 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.731 -0.323 18135 5520 1 6 . 1 1 131 131 LYS C C 131 181.265 181.265 179.680 1.585 18135 5521 1 6 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.649 0.082 18135 5522 1 6 . 1 1 131 131 LYS CB C 131 32.672 32.672 31.994 0.678 18135 5523 1 6 . 1 1 131 131 LYS H H 131 7.493 7.493 7.873 -0.380 18135 5524 1 6 . 1 1 132 132 GLU N N 132 121.918 121.918 119.837 2.081 18135 5525 1 6 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.077 -0.233 18135 5526 1 6 . 1 1 132 132 GLU C C 132 178.377 178.377 178.126 0.251 18135 5527 1 6 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.698 0.189 18135 5528 1 6 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.562 -0.895 18135 5529 1 6 . 1 1 132 132 GLU H H 132 8.430 8.430 8.009 0.421 18135 5530 1 6 . 1 1 133 133 LYS N N 133 116.079 116.079 115.902 0.177 18135 5531 1 6 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.277 -0.311 18135 5532 1 6 . 1 1 133 133 LYS C C 133 175.282 175.282 175.466 -0.184 18135 5533 1 6 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.787 -0.489 18135 5534 1 6 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.853 0.145 18135 5535 1 6 . 1 1 133 133 LYS H H 133 7.390 7.390 7.300 0.090 18135 5536 1 6 . 1 1 134 134 LYS N N 134 117.759 117.759 115.910 1.849 18135 5537 1 6 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.054 -0.472 18135 5538 1 6 . 1 1 134 134 LYS C C 134 176.271 176.271 175.976 0.295 18135 5539 1 6 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.828 0.480 18135 5540 1 6 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.073 -0.271 18135 5541 1 6 . 1 1 134 134 LYS H H 134 7.716 7.716 7.577 0.139 18135 5542 1 6 . 1 1 135 135 TYR N N 135 110.598 110.598 113.703 -3.105 18135 5543 1 6 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.892 -1.015 18135 5544 1 6 . 1 1 135 135 TYR C C 135 174.148 174.148 175.198 -1.050 18135 5545 1 6 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.051 0.664 18135 5546 1 6 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.091 -0.385 18135 5547 1 6 . 1 1 135 135 TYR H H 135 8.428 8.428 8.750 -0.322 18135 5548 1 6 . 1 1 136 136 SER N N 136 113.712 113.712 115.457 -1.745 18135 5549 1 6 . 1 1 136 136 SER HA H 136 4.553 4.553 4.373 0.180 18135 5550 1 6 . 1 1 136 136 SER CA C 136 57.108 57.108 58.841 -1.733 18135 5551 1 6 . 1 1 136 136 SER CB C 136 62.500 62.500 64.057 -1.557 18135 5552 1 6 . 1 1 136 136 SER H H 136 6.744 6.744 7.358 -0.614 18135 5553 1 6 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.431 -0.266 18135 5554 1 6 . 1 1 137 137 PRO C C 137 180.675 180.675 177.270 3.405 18135 5555 1 6 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.711 0.946 18135 5556 1 6 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.850 0.133 18135 5557 1 6 . 1 1 138 138 CYS N N 138 113.914 113.914 115.474 -1.560 18135 5558 1 6 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.663 0.007 18135 5559 1 6 . 1 1 138 138 CYS C C 138 176.015 176.015 176.472 -0.457 18135 5560 1 6 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.633 -3.538 18135 5561 1 6 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.320 10.459 18135 5562 1 6 . 1 1 138 138 CYS H H 138 8.580 8.580 8.475 0.105 18135 5563 1 6 . 1 1 139 139 ALA N N 139 125.290 125.290 123.999 1.291 18135 5564 1 6 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.168 0.281 18135 5565 1 6 . 1 1 139 139 ALA C C 139 180.149 180.149 179.292 0.857 18135 5566 1 6 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.937 -0.159 18135 5567 1 6 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.193 0.725 18135 5568 1 6 . 1 1 139 139 ALA H H 139 8.087 8.087 8.051 0.036 18135 5569 1 6 . 1 1 140 140 TRP N N 140 116.599 116.599 118.533 -1.934 18135 5570 1 6 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.314 0.288 18135 5571 1 6 . 1 1 140 140 TRP C C 140 179.137 179.137 178.582 0.555 18135 5572 1 6 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.290 -0.756 18135 5573 1 6 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.424 -0.166 18135 5574 1 6 . 1 1 140 140 TRP H H 140 8.505 8.505 7.799 0.706 18135 5575 1 6 . 1 1 141 141 GLU N N 141 121.578 121.578 119.675 1.903 18135 5576 1 6 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.236 0.987 18135 5577 1 6 . 1 1 141 141 GLU C C 141 177.886 177.886 178.848 -0.962 18135 5578 1 6 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.911 -2.004 18135 5579 1 6 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.464 -0.747 18135 5580 1 6 . 1 1 141 141 GLU H H 141 8.182 8.182 8.040 0.142 18135 5581 1 6 . 1 1 142 142 VAL N N 142 121.202 121.202 120.063 1.139 18135 5582 1 6 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.580 0.050 18135 5583 1 6 . 1 1 142 142 VAL C C 142 180.246 180.246 178.397 1.849 18135 5584 1 6 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.865 0.118 18135 5585 1 6 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.861 -0.039 18135 5586 1 6 . 1 1 142 142 VAL H H 142 8.623 8.623 8.031 0.592 18135 5587 1 6 . 1 1 143 143 VAL N N 143 120.119 120.119 119.515 0.604 18135 5588 1 6 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.795 -0.498 18135 5589 1 6 . 1 1 143 143 VAL C C 143 176.407 176.407 178.426 -2.019 18135 5590 1 6 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.864 1.114 18135 5591 1 6 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.538 0.117 18135 5592 1 6 . 1 1 143 143 VAL H H 143 8.323 8.323 8.394 -0.071 18135 5593 1 6 . 1 1 144 144 ARG N N 144 124.102 124.102 119.323 4.779 18135 5594 1 6 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.104 -0.407 18135 5595 1 6 . 1 1 144 144 ARG C C 144 178.127 178.127 178.427 -0.300 18135 5596 1 6 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.429 1.572 18135 5597 1 6 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.629 0.307 18135 5598 1 6 . 1 1 144 144 ARG H H 144 9.619 9.619 8.309 1.310 18135 5599 1 6 . 1 1 145 145 ALA N N 145 119.431 119.431 122.142 -2.711 18135 5600 1 6 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.063 -0.212 18135 5601 1 6 . 1 1 145 145 ALA C C 145 180.763 180.763 180.114 0.649 18135 5602 1 6 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.433 -0.058 18135 5603 1 6 . 1 1 145 145 ALA CB C 145 18.185 18.185 17.980 0.204 18135 5604 1 6 . 1 1 145 145 ALA H H 145 8.867 8.867 8.314 0.553 18135 5605 1 6 . 1 1 146 146 GLU N N 146 121.815 121.815 118.140 3.675 18135 5606 1 6 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.207 0.004 18135 5607 1 6 . 1 1 146 146 GLU C C 146 177.296 177.296 179.325 -2.029 18135 5608 1 6 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.403 -1.024 18135 5609 1 6 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.522 -1.388 18135 5610 1 6 . 1 1 146 146 GLU H H 146 8.136 8.136 8.086 0.050 18135 5611 1 6 . 1 1 147 147 ILE N N 147 119.542 119.542 121.453 -1.911 18135 5612 1 6 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.862 0.108 18135 5613 1 6 . 1 1 147 147 ILE C C 147 178.283 178.283 178.496 -0.213 18135 5614 1 6 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.285 -3.032 18135 5615 1 6 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.484 -2.145 18135 5616 1 6 . 1 1 147 147 ILE H H 147 8.736 8.736 8.298 0.438 18135 5617 1 6 . 1 1 148 148 MET N N 148 119.501 119.501 118.338 1.163 18135 5618 1 6 . 1 1 148 148 MET HA H 148 3.801 3.801 4.144 -0.343 18135 5619 1 6 . 1 1 148 148 MET C C 148 178.210 178.210 178.688 -0.478 18135 5620 1 6 . 1 1 148 148 MET CA C 148 60.184 60.184 59.945 0.239 18135 5621 1 6 . 1 1 148 148 MET CB C 148 32.914 32.914 31.971 0.943 18135 5622 1 6 . 1 1 148 148 MET H H 148 8.440 8.440 8.560 -0.120 18135 5623 1 6 . 1 1 149 149 ARG N N 149 119.734 119.734 119.539 0.195 18135 5624 1 6 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.105 -0.190 18135 5625 1 6 . 1 1 149 149 ARG C C 149 178.978 178.978 179.052 -0.074 18135 5626 1 6 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.174 0.689 18135 5627 1 6 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.673 0.607 18135 5628 1 6 . 1 1 149 149 ARG H H 149 7.648 7.648 8.442 -0.794 18135 5629 1 6 . 1 1 150 150 SER N N 150 118.109 118.109 115.036 3.073 18135 5630 1 6 . 1 1 150 150 SER HA H 150 3.339 3.339 3.660 -0.321 18135 5631 1 6 . 1 1 150 150 SER C C 150 177.292 177.292 176.309 0.983 18135 5632 1 6 . 1 1 150 150 SER CA C 150 61.316 61.316 61.552 -0.236 18135 5633 1 6 . 1 1 150 150 SER CB C 150 60.288 60.288 62.427 -2.139 18135 5634 1 6 . 1 1 150 150 SER H H 150 9.194 9.194 8.286 0.908 18135 5635 1 6 . 1 1 151 151 PHE N N 151 125.265 125.265 125.242 0.023 18135 5636 1 6 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.423 -0.387 18135 5637 1 6 . 1 1 151 151 PHE C C 151 178.696 178.696 177.742 0.954 18135 5638 1 6 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.598 1.822 18135 5639 1 6 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.597 0.289 18135 5640 1 6 . 1 1 151 151 PHE H H 151 9.455 9.455 8.512 0.943 18135 5641 1 6 . 1 1 152 152 SER N N 152 115.963 115.963 116.473 -0.510 18135 5642 1 6 . 1 1 152 152 SER HA H 152 3.880 3.880 3.806 0.074 18135 5643 1 6 . 1 1 152 152 SER C C 152 175.858 175.858 176.967 -1.109 18135 5644 1 6 . 1 1 152 152 SER CA C 152 62.388 62.388 61.539 0.848 18135 5645 1 6 . 1 1 152 152 SER CB C 152 62.519 62.519 63.074 -0.555 18135 5646 1 6 . 1 1 152 152 SER H H 152 7.839 7.839 8.513 -0.674 18135 5647 1 6 . 1 1 153 153 LEU N N 153 121.365 121.365 122.150 -0.785 18135 5648 1 6 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.196 -0.115 18135 5649 1 6 . 1 1 153 153 LEU C C 153 179.515 179.515 178.922 0.593 18135 5650 1 6 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.725 0.158 18135 5651 1 6 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.319 1.022 18135 5652 1 6 . 1 1 153 153 LEU H H 153 7.775 7.775 8.390 -0.616 18135 5653 1 6 . 1 1 154 154 SER N N 154 113.950 113.950 113.821 0.129 18135 5654 1 6 . 1 1 154 154 SER HA H 154 3.781 3.781 4.433 -0.652 18135 5655 1 6 . 1 1 154 154 SER C C 154 174.312 174.312 176.428 -2.116 18135 5656 1 6 . 1 1 154 154 SER CA C 154 61.366 61.366 61.223 0.143 18135 5657 1 6 . 1 1 154 154 SER CB C 154 63.242 63.242 63.443 -0.201 18135 5658 1 6 . 1 1 154 154 SER H H 154 7.874 7.874 8.553 -0.679 18135 5659 1 6 . 1 1 155 155 THR N N 155 109.346 109.346 111.767 -2.421 18135 5660 1 6 . 1 1 155 155 THR HA H 155 4.060 4.060 4.471 -0.411 18135 5661 1 6 . 1 1 155 155 THR C C 155 174.798 174.798 175.921 -1.123 18135 5662 1 6 . 1 1 155 155 THR CA C 155 62.275 62.275 63.998 -1.723 18135 5663 1 6 . 1 1 155 155 THR CB C 155 69.342 69.342 68.931 0.411 18135 5664 1 6 . 1 1 155 155 THR H H 155 7.176 7.176 7.923 -0.747 18135 5665 1 6 . 1 1 156 156 ASN N N 156 119.785 119.785 122.090 -2.305 18135 5666 1 6 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.842 -0.315 18135 5667 1 6 . 1 1 156 156 ASN C C 156 175.528 175.528 174.841 0.687 18135 5668 1 6 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.774 1.163 18135 5669 1 6 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.333 1.005 18135 5670 1 6 . 1 1 156 156 ASN H H 156 7.749 7.749 7.972 -0.223 18135 5671 1 6 . 1 1 157 157 LEU N N 157 120.552 120.552 121.329 -0.777 18135 5672 1 6 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.513 -0.258 18135 5673 1 6 . 1 1 157 157 LEU C C 157 174.702 174.702 178.232 -3.530 18135 5674 1 6 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.494 -0.820 18135 5675 1 6 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.183 0.168 18135 5676 1 6 . 1 1 157 157 LEU H H 157 8.097 8.097 7.726 0.371 18135 5677 1 6 . 1 1 158 158 GLN N N 158 119.860 119.860 118.071 1.789 18135 5678 1 6 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.253 -0.073 18135 5679 1 6 . 1 1 158 158 GLN C C 158 176.434 176.434 175.889 0.545 18135 5680 1 6 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.488 1.409 18135 5681 1 6 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.279 -0.269 18135 5682 1 6 . 1 1 158 158 GLN H H 158 8.230 8.230 8.027 0.203 18135 5683 1 6 . 1 1 159 159 GLU N N 159 120.461 120.461 117.499 2.962 18135 5684 1 6 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.978 0.241 18135 5685 1 6 . 1 1 159 159 GLU C C 159 175.251 175.251 175.447 -0.196 18135 5686 1 6 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.379 -0.684 18135 5687 1 6 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.956 0.025 18135 5688 1 6 . 1 1 159 159 GLU H H 159 8.300 8.300 8.808 -0.508 18135 5689 1 6 . 1 1 160 160 SER N N 160 115.719 115.719 111.999 3.720 18135 5690 1 6 . 1 1 160 160 SER HA H 160 4.372 4.372 4.533 -0.161 18135 5691 1 6 . 1 1 160 160 SER C C 160 174.188 174.188 174.252 -0.064 18135 5692 1 6 . 1 1 160 160 SER CA C 160 58.481 58.481 57.772 0.709 18135 5693 1 6 . 1 1 160 160 SER CB C 160 63.731 63.731 63.095 0.636 18135 5694 1 6 . 1 1 160 160 SER H H 160 8.113 8.113 8.216 -0.103 18135 5695 1 6 . 1 1 161 161 LEU N N 161 123.794 123.794 121.148 2.646 18135 5696 1 6 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.338 -0.058 18135 5697 1 6 . 1 1 161 161 LEU C C 161 177.293 177.293 177.033 0.260 18135 5698 1 6 . 1 1 161 161 LEU CA C 161 55.190 55.190 54.831 0.359 18135 5699 1 6 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.566 -0.282 18135 5700 1 6 . 1 1 161 161 LEU H H 161 8.032 8.032 7.622 0.410 18135 5701 1 6 . 1 1 162 162 ARG N N 162 120.715 120.715 118.329 2.386 18135 5702 1 6 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.031 0.138 18135 5703 1 6 . 1 1 162 162 ARG C C 162 176.288 176.288 175.102 1.186 18135 5704 1 6 . 1 1 162 162 ARG CA C 162 57.046 57.046 57.004 0.042 18135 5705 1 6 . 1 1 162 162 ARG CB C 162 30.935 30.935 28.822 2.113 18135 5706 1 6 . 1 1 162 162 ARG H H 162 8.094 8.094 8.657 -0.563 18135 5707 1 6 . 1 1 163 163 SER N N 163 116.670 116.670 112.706 3.964 18135 5708 1 6 . 1 1 163 163 SER HA H 163 4.372 4.372 4.635 -0.263 18135 5709 1 6 . 1 1 163 163 SER C C 163 174.184 174.184 173.983 0.201 18135 5710 1 6 . 1 1 163 163 SER CA C 163 58.481 58.481 56.599 1.882 18135 5711 1 6 . 1 1 163 163 SER CB C 163 63.745 63.745 65.761 -2.017 18135 5712 1 6 . 1 1 163 163 SER H H 163 8.191 8.191 7.903 0.288 18135 5713 1 6 . 1 1 164 164 LYS N N 164 123.100 123.100 119.986 3.114 18135 5714 1 6 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.579 -0.302 18135 5715 1 6 . 1 1 164 164 LYS C C 164 175.617 175.617 176.646 -1.029 18135 5716 1 6 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.266 0.047 18135 5717 1 6 . 1 1 164 164 LYS CB C 164 32.965 32.965 31.396 1.569 18135 5718 1 6 . 1 1 164 164 LYS H H 164 8.251 8.251 8.421 -0.170 18135 5719 1 7 . 1 1 2 2 ASP N N 2 125.691 125.691 120.631 5.060 18135 5720 1 7 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.497 0.213 18135 5721 1 7 . 1 1 2 2 ASP C C 2 174.758 174.758 176.040 -1.282 18135 5722 1 7 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.495 -1.652 18135 5723 1 7 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.178 -1.857 18135 5724 1 7 . 1 1 2 2 ASP H H 2 8.773 8.773 8.329 0.444 18135 5725 1 7 . 1 1 3 3 LEU N N 3 123.957 123.957 115.910 8.047 18135 5726 1 7 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.279 0.122 18135 5727 1 7 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.416 1.237 18135 5728 1 7 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.750 -0.195 18135 5729 1 7 . 1 1 3 3 LEU H H 3 8.164 8.164 7.304 0.860 18135 5730 1 7 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.559 -0.245 18135 5731 1 7 . 1 1 4 4 PRO C C 4 176.213 176.213 177.087 -0.874 18135 5732 1 7 . 1 1 4 4 PRO CA C 4 63.908 63.908 62.935 0.973 18135 5733 1 7 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.235 1.659 18135 5734 1 7 . 1 1 5 5 GLN N N 5 121.621 121.621 120.844 0.777 18135 5735 1 7 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.191 0.035 18135 5736 1 7 . 1 1 5 5 GLN C C 5 176.995 176.995 177.064 -0.069 18135 5737 1 7 . 1 1 5 5 GLN CA C 5 57.710 57.710 58.647 -0.937 18135 5738 1 7 . 1 1 5 5 GLN CB C 5 28.951 28.951 28.805 0.146 18135 5739 1 7 . 1 1 5 5 GLN H H 5 8.767 8.767 8.768 -0.001 18135 5740 1 7 . 1 1 6 6 THR N N 6 111.419 111.419 111.106 0.313 18135 5741 1 7 . 1 1 6 6 THR HA H 6 4.135 4.135 4.442 -0.307 18135 5742 1 7 . 1 1 6 6 THR C C 6 174.695 174.695 174.610 0.085 18135 5743 1 7 . 1 1 6 6 THR CA C 6 62.661 62.661 62.791 -0.130 18135 5744 1 7 . 1 1 6 6 THR CB C 6 69.365 69.365 69.094 0.271 18135 5745 1 7 . 1 1 6 6 THR H H 6 7.865 7.865 8.411 -0.546 18135 5746 1 7 . 1 1 7 7 HIS N N 7 119.137 119.137 118.565 0.572 18135 5747 1 7 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.723 -0.138 18135 5748 1 7 . 1 1 7 7 HIS C C 7 174.980 174.980 175.065 -0.085 18135 5749 1 7 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.394 -2.389 18135 5750 1 7 . 1 1 7 7 HIS CB C 7 28.163 28.163 30.106 -1.943 18135 5751 1 7 . 1 1 7 7 HIS H H 7 8.567 8.567 8.160 0.407 18135 5752 1 7 . 1 1 8 8 SER N N 8 115.796 115.796 113.809 1.987 18135 5753 1 7 . 1 1 8 8 SER HA H 8 4.363 4.363 4.395 -0.032 18135 5754 1 7 . 1 1 8 8 SER C C 8 175.312 175.312 176.363 -1.051 18135 5755 1 7 . 1 1 8 8 SER CA C 8 58.969 58.969 61.022 -2.053 18135 5756 1 7 . 1 1 8 8 SER CB C 8 63.439 63.439 63.526 -0.087 18135 5757 1 7 . 1 1 8 8 SER H H 8 8.180 8.180 7.790 0.390 18135 5758 1 7 . 1 1 9 9 LEU N N 9 123.844 123.844 118.777 5.067 18135 5759 1 7 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.730 -0.575 18135 5760 1 7 . 1 1 9 9 LEU C C 9 178.568 178.568 178.386 0.182 18135 5761 1 7 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.694 0.272 18135 5762 1 7 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.369 -0.573 18135 5763 1 7 . 1 1 9 9 LEU H H 9 8.404 8.404 7.707 0.697 18135 5764 1 7 . 1 1 10 10 GLY N N 10 107.582 107.582 107.646 -0.064 18135 5765 1 7 . 1 1 10 10 GLY C C 10 174.586 174.586 176.388 -1.802 18135 5766 1 7 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.269 -0.364 18135 5767 1 7 . 1 1 10 10 GLY H H 10 8.438 8.438 8.243 0.195 18135 5768 1 7 . 1 1 11 11 SER N N 11 118.806 118.806 116.995 1.811 18135 5769 1 7 . 1 1 11 11 SER HA H 11 4.156 4.156 4.181 -0.025 18135 5770 1 7 . 1 1 11 11 SER C C 11 175.749 175.749 176.587 -0.838 18135 5771 1 7 . 1 1 11 11 SER CA C 11 61.299 61.299 61.960 -0.661 18135 5772 1 7 . 1 1 11 11 SER CB C 11 62.653 62.653 63.191 -0.538 18135 5773 1 7 . 1 1 11 11 SER H H 11 8.249 8.249 8.134 0.115 18135 5774 1 7 . 1 1 12 12 ARG N N 12 121.986 121.986 120.749 1.237 18135 5775 1 7 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.133 -0.179 18135 5776 1 7 . 1 1 12 12 ARG C C 12 178.283 178.283 178.873 -0.590 18135 5777 1 7 . 1 1 12 12 ARG CA C 12 59.830 59.830 59.306 0.524 18135 5778 1 7 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.163 -0.579 18135 5779 1 7 . 1 1 12 12 ARG H H 12 8.027 8.027 8.159 -0.132 18135 5780 1 7 . 1 1 13 13 ARG N N 13 119.432 119.432 119.670 -0.238 18135 5781 1 7 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.181 -0.342 18135 5782 1 7 . 1 1 13 13 ARG C C 13 178.480 178.480 178.108 0.372 18135 5783 1 7 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.313 1.178 18135 5784 1 7 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.759 0.323 18135 5785 1 7 . 1 1 13 13 ARG H H 13 8.437 8.437 8.196 0.241 18135 5786 1 7 . 1 1 14 14 THR N N 14 116.879 116.879 117.854 -0.975 18135 5787 1 7 . 1 1 14 14 THR HA H 14 3.532 3.532 4.178 -0.646 18135 5788 1 7 . 1 1 14 14 THR C C 14 175.584 175.584 176.724 -1.140 18135 5789 1 7 . 1 1 14 14 THR CA C 14 68.036 68.036 67.867 0.169 18135 5790 1 7 . 1 1 14 14 THR CB C 14 67.969 67.969 68.643 -0.674 18135 5791 1 7 . 1 1 14 14 THR H H 14 7.957 7.957 8.020 -0.063 18135 5792 1 7 . 1 1 15 15 LEU N N 15 120.252 120.252 121.764 -1.512 18135 5793 1 7 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.016 -0.070 18135 5794 1 7 . 1 1 15 15 LEU C C 15 178.652 178.652 178.728 -0.076 18135 5795 1 7 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.264 -0.175 18135 5796 1 7 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.729 -0.175 18135 5797 1 7 . 1 1 15 15 LEU H H 15 7.550 7.550 8.344 -0.794 18135 5798 1 7 . 1 1 16 16 MET N N 16 118.788 118.788 117.478 1.310 18135 5799 1 7 . 1 1 16 16 MET HA H 16 4.023 4.023 3.954 0.069 18135 5800 1 7 . 1 1 16 16 MET C C 16 178.718 178.718 178.684 0.034 18135 5801 1 7 . 1 1 16 16 MET CA C 16 58.513 58.513 59.199 -0.686 18135 5802 1 7 . 1 1 16 16 MET CB C 16 32.150 32.150 32.367 -0.217 18135 5803 1 7 . 1 1 16 16 MET H H 16 7.985 7.985 7.798 0.187 18135 5804 1 7 . 1 1 17 17 LEU N N 17 120.644 120.644 119.371 1.273 18135 5805 1 7 . 1 1 17 17 LEU HA H 17 3.972 3.972 4.009 -0.037 18135 5806 1 7 . 1 1 17 17 LEU C C 17 178.238 178.238 179.420 -1.182 18135 5807 1 7 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.056 -0.329 18135 5808 1 7 . 1 1 17 17 LEU CB C 17 42.135 42.135 40.830 1.305 18135 5809 1 7 . 1 1 17 17 LEU H H 17 7.829 7.829 8.144 -0.315 18135 5810 1 7 . 1 1 18 18 LEU N N 18 118.280 118.280 118.861 -0.581 18135 5811 1 7 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.700 -0.194 18135 5812 1 7 . 1 1 18 18 LEU C C 18 175.739 175.739 178.639 -2.900 18135 5813 1 7 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.419 0.237 18135 5814 1 7 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.285 0.957 18135 5815 1 7 . 1 1 18 18 LEU H H 18 7.499 7.499 8.384 -0.885 18135 5816 1 7 . 1 1 19 19 ALA N N 19 121.961 121.961 120.695 1.266 18135 5817 1 7 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.174 -0.337 18135 5818 1 7 . 1 1 19 19 ALA C C 19 180.736 180.736 178.170 2.566 18135 5819 1 7 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.055 1.011 18135 5820 1 7 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.344 -1.267 18135 5821 1 7 . 1 1 19 19 ALA H H 19 7.950 7.950 7.742 0.208 18135 5822 1 7 . 1 1 20 20 GLN N N 20 118.605 118.605 116.184 2.421 18135 5823 1 7 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.201 -0.266 18135 5824 1 7 . 1 1 20 20 GLN C C 20 176.945 176.945 177.441 -0.496 18135 5825 1 7 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.432 0.583 18135 5826 1 7 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.305 -0.831 18135 5827 1 7 . 1 1 20 20 GLN H H 20 7.958 7.958 7.960 -0.002 18135 5828 1 7 . 1 1 21 21 MET N N 21 116.693 116.693 115.897 0.796 18135 5829 1 7 . 1 1 21 21 MET HA H 21 3.861 3.861 4.548 -0.687 18135 5830 1 7 . 1 1 21 21 MET C C 21 174.671 174.671 175.505 -0.834 18135 5831 1 7 . 1 1 21 21 MET CA C 21 57.111 57.111 56.759 0.352 18135 5832 1 7 . 1 1 21 21 MET CB C 21 34.073 34.073 34.056 0.017 18135 5833 1 7 . 1 1 21 21 MET H H 21 7.420 7.420 7.793 -0.373 18135 5834 1 7 . 1 1 22 22 ARG N N 22 115.451 115.451 122.112 -6.661 18135 5835 1 7 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.396 0.457 18135 5836 1 7 . 1 1 22 22 ARG C C 22 175.950 175.950 174.776 1.174 18135 5837 1 7 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.270 3.183 18135 5838 1 7 . 1 1 22 22 ARG CB C 22 31.514 31.514 29.672 1.842 18135 5839 1 7 . 1 1 22 22 ARG H H 22 6.484 6.484 7.265 -0.781 18135 5840 1 7 . 1 1 23 23 LYS N N 23 128.593 128.593 127.226 1.367 18135 5841 1 7 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.531 -0.046 18135 5842 1 7 . 1 1 23 23 LYS C C 23 176.643 176.643 175.005 1.638 18135 5843 1 7 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.682 1.605 18135 5844 1 7 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.807 4.454 18135 5845 1 7 . 1 1 23 23 LYS H H 23 10.212 10.212 8.431 1.781 18135 5846 1 7 . 1 1 24 24 ILE N N 24 118.605 118.605 122.313 -3.708 18135 5847 1 7 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.433 0.051 18135 5848 1 7 . 1 1 24 24 ILE C C 24 173.878 173.878 174.486 -0.608 18135 5849 1 7 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.742 -1.145 18135 5850 1 7 . 1 1 24 24 ILE CB C 24 41.456 41.456 40.830 0.626 18135 5851 1 7 . 1 1 24 24 ILE H H 24 8.465 8.465 8.260 0.205 18135 5852 1 7 . 1 1 25 25 SER N N 25 113.658 113.658 117.919 -4.261 18135 5853 1 7 . 1 1 25 25 SER HA H 25 4.481 4.481 4.870 -0.389 18135 5854 1 7 . 1 1 25 25 SER C C 25 176.359 176.359 175.621 0.738 18135 5855 1 7 . 1 1 25 25 SER CA C 25 56.975 56.975 57.694 -0.719 18135 5856 1 7 . 1 1 25 25 SER CB C 25 64.759 64.759 63.977 0.782 18135 5857 1 7 . 1 1 25 25 SER H H 25 8.104 8.104 8.630 -0.526 18135 5858 1 7 . 1 1 26 26 LEU N N 26 127.566 127.566 126.424 1.142 18135 5859 1 7 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.273 -0.396 18135 5860 1 7 . 1 1 26 26 LEU C C 26 178.946 178.946 177.856 1.090 18135 5861 1 7 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.647 0.031 18135 5862 1 7 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.337 -0.618 18135 5863 1 7 . 1 1 26 26 LEU H H 26 8.802 8.802 9.089 -0.287 18135 5864 1 7 . 1 1 27 27 PHE N N 27 117.143 117.143 115.620 1.523 18135 5865 1 7 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.520 -0.282 18135 5866 1 7 . 1 1 27 27 PHE C C 27 177.067 177.067 176.995 0.072 18135 5867 1 7 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.377 1.713 18135 5868 1 7 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.466 -0.204 18135 5869 1 7 . 1 1 27 27 PHE H H 27 7.986 7.986 8.053 -0.067 18135 5870 1 7 . 1 1 28 28 SER N N 28 115.200 115.200 115.888 -0.688 18135 5871 1 7 . 1 1 28 28 SER HA H 28 4.505 4.505 4.406 0.099 18135 5872 1 7 . 1 1 28 28 SER C C 28 174.533 174.533 174.388 0.145 18135 5873 1 7 . 1 1 28 28 SER CA C 28 59.447 59.447 60.585 -1.138 18135 5874 1 7 . 1 1 28 28 SER CB C 28 63.790 63.790 63.539 0.251 18135 5875 1 7 . 1 1 28 28 SER H H 28 7.929 7.929 8.110 -0.181 18135 5876 1 7 . 1 1 29 29 CYS N N 29 119.870 119.870 118.421 1.449 18135 5877 1 7 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.624 0.458 18135 5878 1 7 . 1 1 29 29 CYS C C 29 176.475 176.475 173.977 2.498 18135 5879 1 7 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.955 -5.525 18135 5880 1 7 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.186 10.056 18135 5881 1 7 . 1 1 29 29 CYS H H 29 7.865 7.865 7.752 0.113 18135 5882 1 7 . 1 1 30 30 LEU N N 30 122.259 122.259 123.382 -1.123 18135 5883 1 7 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.335 -0.374 18135 5884 1 7 . 1 1 30 30 LEU C C 30 179.774 179.774 178.445 1.329 18135 5885 1 7 . 1 1 30 30 LEU CA C 30 58.303 58.303 55.946 2.357 18135 5886 1 7 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.140 -0.564 18135 5887 1 7 . 1 1 30 30 LEU H H 30 7.812 7.812 8.458 -0.646 18135 5888 1 7 . 1 1 31 31 LYS N N 31 117.731 117.731 117.132 0.599 18135 5889 1 7 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.228 0.462 18135 5890 1 7 . 1 1 31 31 LYS C C 31 176.692 176.692 175.893 0.799 18135 5891 1 7 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.131 -3.054 18135 5892 1 7 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.756 -0.169 18135 5893 1 7 . 1 1 31 31 LYS H H 31 8.597 8.597 8.087 0.510 18135 5894 1 7 . 1 1 32 32 ASP N N 32 117.841 117.841 118.260 -0.419 18135 5895 1 7 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.756 -0.062 18135 5896 1 7 . 1 1 32 32 ASP C C 32 175.505 175.505 175.348 0.157 18135 5897 1 7 . 1 1 32 32 ASP CA C 32 54.088 54.088 53.769 0.319 18135 5898 1 7 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.285 -0.477 18135 5899 1 7 . 1 1 32 32 ASP H H 32 7.808 7.808 8.009 -0.201 18135 5900 1 7 . 1 1 33 33 ARG N N 33 120.876 120.876 119.402 1.474 18135 5901 1 7 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.113 -0.072 18135 5902 1 7 . 1 1 33 33 ARG C C 33 175.286 175.286 175.536 -0.250 18135 5903 1 7 . 1 1 33 33 ARG CA C 33 58.083 58.083 55.685 2.398 18135 5904 1 7 . 1 1 33 33 ARG CB C 33 30.013 30.013 31.345 -1.332 18135 5905 1 7 . 1 1 33 33 ARG H H 33 7.378 7.378 7.276 0.102 18135 5906 1 7 . 1 1 34 34 HIS N N 34 120.555 120.555 117.364 3.191 18135 5907 1 7 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.268 -0.056 18135 5908 1 7 . 1 1 34 34 HIS C C 34 170.494 170.494 173.352 -2.858 18135 5909 1 7 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.772 -3.165 18135 5910 1 7 . 1 1 34 34 HIS CB C 34 31.488 31.488 28.986 2.502 18135 5911 1 7 . 1 1 34 34 HIS H H 34 7.974 7.974 8.869 -0.895 18135 5912 1 7 . 1 1 35 35 ASP N N 35 125.061 125.061 121.677 3.384 18135 5913 1 7 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.438 0.200 18135 5914 1 7 . 1 1 35 35 ASP C C 35 175.943 175.943 176.423 -0.480 18135 5915 1 7 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.760 -2.391 18135 5916 1 7 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.815 -1.453 18135 5917 1 7 . 1 1 35 35 ASP H H 35 7.805 7.805 8.011 -0.206 18135 5918 1 7 . 1 1 36 36 PHE N N 36 122.860 122.860 119.703 3.157 18135 5919 1 7 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.327 -0.003 18135 5920 1 7 . 1 1 36 36 PHE C C 36 176.643 176.643 177.182 -0.539 18135 5921 1 7 . 1 1 36 36 PHE CA C 36 59.639 59.639 59.226 0.413 18135 5922 1 7 . 1 1 36 36 PHE CB C 36 40.691 40.691 38.875 1.816 18135 5923 1 7 . 1 1 36 36 PHE H H 36 8.973 8.973 6.953 2.020 18135 5924 1 7 . 1 1 37 37 GLY N N 37 111.856 111.856 109.226 2.630 18135 5925 1 7 . 1 1 37 37 GLY C C 37 175.185 175.185 174.082 1.103 18135 5926 1 7 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.855 3.288 18135 5927 1 7 . 1 1 37 37 GLY H H 37 8.727 8.727 8.554 0.173 18135 5928 1 7 . 1 1 38 38 PHE N N 38 123.178 123.178 121.115 2.063 18135 5929 1 7 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.634 -0.720 18135 5930 1 7 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.770 2.034 18135 5931 1 7 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.309 0.348 18135 5932 1 7 . 1 1 38 38 PHE H H 38 9.169 9.169 7.870 1.299 18135 5933 1 7 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.372 0.157 18135 5934 1 7 . 1 1 39 39 PRO C C 39 174.634 174.634 177.247 -2.613 18135 5935 1 7 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.463 -0.920 18135 5936 1 7 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.269 -1.565 18135 5937 1 7 . 1 1 40 40 GLN N N 40 123.608 123.608 122.783 0.825 18135 5938 1 7 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.250 -0.631 18135 5939 1 7 . 1 1 40 40 GLN C C 40 176.958 176.958 177.761 -0.803 18135 5940 1 7 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.297 -1.224 18135 5941 1 7 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.392 1.425 18135 5942 1 7 . 1 1 40 40 GLN H H 40 7.966 7.966 8.308 -0.342 18135 5943 1 7 . 1 1 41 41 GLU N N 41 119.446 119.446 120.834 -1.388 18135 5944 1 7 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.096 0.041 18135 5945 1 7 . 1 1 41 41 GLU C C 41 177.346 177.346 177.850 -0.504 18135 5946 1 7 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.054 -1.125 18135 5947 1 7 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.242 -1.409 18135 5948 1 7 . 1 1 41 41 GLU H H 41 9.044 9.044 8.668 0.376 18135 5949 1 7 . 1 1 42 42 GLU N N 42 117.196 117.196 117.095 0.101 18135 5950 1 7 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.271 -0.208 18135 5951 1 7 . 1 1 42 42 GLU C C 42 174.886 174.886 177.712 -2.826 18135 5952 1 7 . 1 1 42 42 GLU CA C 42 56.384 56.384 56.946 -0.562 18135 5953 1 7 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.053 -2.495 18135 5954 1 7 . 1 1 42 42 GLU H H 42 7.646 7.646 7.901 -0.255 18135 5955 1 7 . 1 1 43 43 PHE N N 43 115.527 115.527 120.836 -5.309 18135 5956 1 7 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.432 0.054 18135 5957 1 7 . 1 1 43 43 PHE C C 43 175.615 175.615 175.617 -0.002 18135 5958 1 7 . 1 1 43 43 PHE CA C 43 57.548 57.548 59.381 -1.833 18135 5959 1 7 . 1 1 43 43 PHE CB C 43 39.893 39.893 39.877 0.016 18135 5960 1 7 . 1 1 43 43 PHE H H 43 7.601 7.601 8.308 -0.707 18135 5961 1 7 . 1 1 44 44 GLY N N 44 107.243 107.243 107.386 -0.143 18135 5962 1 7 . 1 1 44 44 GLY C C 44 174.032 174.032 173.369 0.663 18135 5963 1 7 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.131 0.481 18135 5964 1 7 . 1 1 44 44 GLY H H 44 7.733 7.733 7.785 -0.052 18135 5965 1 7 . 1 1 45 45 ASN N N 45 117.599 117.599 113.754 3.845 18135 5966 1 7 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.372 0.179 18135 5967 1 7 . 1 1 45 45 ASN C C 45 175.894 175.894 175.424 0.470 18135 5968 1 7 . 1 1 45 45 ASN CA C 45 53.849 53.849 53.696 0.153 18135 5969 1 7 . 1 1 45 45 ASN CB C 45 38.419 38.419 37.228 1.190 18135 5970 1 7 . 1 1 45 45 ASN H H 45 8.343 8.343 8.531 -0.188 18135 5971 1 7 . 1 1 46 46 GLN N N 46 118.916 118.916 117.087 1.829 18135 5972 1 7 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.475 -0.393 18135 5973 1 7 . 1 1 46 46 GLN C C 46 175.851 175.851 176.482 -0.631 18135 5974 1 7 . 1 1 46 46 GLN CA C 46 56.646 56.646 54.963 1.683 18135 5975 1 7 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.011 0.433 18135 5976 1 7 . 1 1 46 46 GLN H H 46 8.652 8.652 8.736 -0.084 18135 5977 1 7 . 1 1 47 47 PHE N N 47 119.511 119.511 121.125 -1.614 18135 5978 1 7 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.376 0.186 18135 5979 1 7 . 1 1 47 47 PHE C C 47 176.258 176.258 174.995 1.263 18135 5980 1 7 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.302 -0.382 18135 5981 1 7 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.292 0.566 18135 5982 1 7 . 1 1 47 47 PHE H H 47 7.904 7.904 7.995 -0.091 18135 5983 1 7 . 1 1 48 48 GLN N N 48 120.127 120.127 117.525 2.602 18135 5984 1 7 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.504 -0.129 18135 5985 1 7 . 1 1 48 48 GLN C C 48 181.265 181.265 175.903 5.362 18135 5986 1 7 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.091 1.485 18135 5987 1 7 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.826 -0.358 18135 5988 1 7 . 1 1 48 48 GLN H H 48 8.255 8.255 7.768 0.487 18135 5989 1 7 . 1 1 49 49 LYS N N 49 121.777 121.777 121.921 -0.144 18135 5990 1 7 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.255 -0.152 18135 5991 1 7 . 1 1 49 49 LYS C C 49 177.968 177.968 177.674 0.294 18135 5992 1 7 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.784 -0.635 18135 5993 1 7 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.200 0.189 18135 5994 1 7 . 1 1 49 49 LYS H H 49 8.426 8.426 8.650 -0.224 18135 5995 1 7 . 1 1 50 50 ALA N N 50 120.573 120.573 118.943 1.630 18135 5996 1 7 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.262 -0.192 18135 5997 1 7 . 1 1 50 50 ALA C C 50 178.697 178.697 177.519 1.178 18135 5998 1 7 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.306 1.462 18135 5999 1 7 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.741 0.133 18135 6000 1 7 . 1 1 50 50 ALA H H 50 8.578 8.578 7.798 0.779 18135 6001 1 7 . 1 1 51 51 GLU N N 51 115.015 115.015 115.321 -0.306 18135 6002 1 7 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.249 0.017 18135 6003 1 7 . 1 1 51 51 GLU C C 51 176.995 176.995 177.206 -0.211 18135 6004 1 7 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.785 -0.792 18135 6005 1 7 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.406 -1.501 18135 6006 1 7 . 1 1 51 51 GLU H H 51 7.907 7.907 8.167 -0.260 18135 6007 1 7 . 1 1 52 52 THR N N 52 111.210 111.210 115.725 -4.515 18135 6008 1 7 . 1 1 52 52 THR HA H 52 4.114 4.114 4.315 -0.201 18135 6009 1 7 . 1 1 52 52 THR C C 52 175.271 175.271 175.616 -0.345 18135 6010 1 7 . 1 1 52 52 THR CA C 52 63.611 63.611 64.270 -0.659 18135 6011 1 7 . 1 1 52 52 THR CB C 52 69.673 69.673 68.771 0.902 18135 6012 1 7 . 1 1 52 52 THR H H 52 7.863 7.863 7.513 0.350 18135 6013 1 7 . 1 1 53 53 ILE N N 53 119.113 119.113 122.263 -3.150 18135 6014 1 7 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.149 -0.285 18135 6015 1 7 . 1 1 53 53 ILE CA C 53 66.907 66.907 66.034 0.873 18135 6016 1 7 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.370 -1.417 18135 6017 1 7 . 1 1 53 53 ILE H H 53 8.341 8.341 7.889 0.452 18135 6018 1 7 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.385 -0.099 18135 6019 1 7 . 1 1 54 54 PRO C C 54 179.655 179.655 178.932 0.723 18135 6020 1 7 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.026 0.025 18135 6021 1 7 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.355 0.530 18135 6022 1 7 . 1 1 55 55 VAL N N 55 116.355 116.355 116.595 -0.240 18135 6023 1 7 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.835 -0.154 18135 6024 1 7 . 1 1 55 55 VAL C C 55 177.649 177.649 177.985 -0.336 18135 6025 1 7 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.029 0.807 18135 6026 1 7 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.009 1.462 18135 6027 1 7 . 1 1 55 55 VAL H H 55 7.119 7.119 7.599 -0.480 18135 6028 1 7 . 1 1 56 56 LEU N N 56 123.038 123.038 121.274 1.764 18135 6029 1 7 . 1 1 56 56 LEU HA H 56 4.310 4.310 3.961 0.349 18135 6030 1 7 . 1 1 56 56 LEU C C 56 178.637 178.637 178.138 0.499 18135 6031 1 7 . 1 1 56 56 LEU CA C 56 58.086 58.086 59.042 -0.956 18135 6032 1 7 . 1 1 56 56 LEU CB C 56 42.318 42.318 42.005 0.313 18135 6033 1 7 . 1 1 56 56 LEU H H 56 8.535 8.535 8.503 0.032 18135 6034 1 7 . 1 1 57 57 HIS N N 57 117.041 117.041 118.016 -0.975 18135 6035 1 7 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.005 -0.219 18135 6036 1 7 . 1 1 57 57 HIS C C 57 175.640 175.640 177.650 -2.010 18135 6037 1 7 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.829 0.702 18135 6038 1 7 . 1 1 57 57 HIS CB C 57 28.209 28.209 29.939 -1.730 18135 6039 1 7 . 1 1 57 57 HIS H H 57 9.047 9.047 7.970 1.077 18135 6040 1 7 . 1 1 58 58 GLU N N 58 119.521 119.521 118.715 0.806 18135 6041 1 7 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.806 0.201 18135 6042 1 7 . 1 1 58 58 GLU C C 58 179.029 179.029 178.960 0.069 18135 6043 1 7 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.566 -0.599 18135 6044 1 7 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.462 -1.172 18135 6045 1 7 . 1 1 58 58 GLU H H 58 7.860 7.860 8.267 -0.407 18135 6046 1 7 . 1 1 59 59 MET N N 59 119.512 119.512 119.214 0.298 18135 6047 1 7 . 1 1 59 59 MET HA H 59 4.074 4.074 4.250 -0.176 18135 6048 1 7 . 1 1 59 59 MET C C 59 177.031 177.031 179.081 -2.050 18135 6049 1 7 . 1 1 59 59 MET CA C 59 59.408 59.408 59.813 -0.405 18135 6050 1 7 . 1 1 59 59 MET CB C 59 32.525 32.525 32.953 -0.427 18135 6051 1 7 . 1 1 59 59 MET H H 59 8.442 8.442 7.929 0.513 18135 6052 1 7 . 1 1 60 60 ILE N N 60 117.183 117.183 118.347 -1.164 18135 6053 1 7 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.473 -0.056 18135 6054 1 7 . 1 1 60 60 ILE C C 60 177.524 177.524 178.119 -0.595 18135 6055 1 7 . 1 1 60 60 ILE CA C 60 65.326 65.326 65.040 0.286 18135 6056 1 7 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.230 -0.370 18135 6057 1 7 . 1 1 60 60 ILE H H 60 8.338 8.338 7.759 0.579 18135 6058 1 7 . 1 1 61 61 GLN N N 61 120.191 120.191 119.423 0.768 18135 6059 1 7 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.685 0.017 18135 6060 1 7 . 1 1 61 61 GLN C C 61 178.270 178.270 177.786 0.484 18135 6061 1 7 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.220 -0.434 18135 6062 1 7 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.094 0.572 18135 6063 1 7 . 1 1 61 61 GLN H H 61 8.234 8.234 8.231 0.003 18135 6064 1 7 . 1 1 62 62 GLN N N 62 116.795 116.795 118.857 -2.062 18135 6065 1 7 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.428 0.199 18135 6066 1 7 . 1 1 62 62 GLN C C 62 179.685 179.685 178.402 1.283 18135 6067 1 7 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.432 -0.424 18135 6068 1 7 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.817 -3.475 18135 6069 1 7 . 1 1 62 62 GLN H H 62 8.421 8.421 7.990 0.431 18135 6070 1 7 . 1 1 63 63 ILE N N 63 122.797 122.797 119.904 2.893 18135 6071 1 7 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.915 -0.266 18135 6072 1 7 . 1 1 63 63 ILE C C 63 177.279 177.279 177.896 -0.617 18135 6073 1 7 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.759 2.206 18135 6074 1 7 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.894 -0.579 18135 6075 1 7 . 1 1 63 63 ILE H H 63 8.164 8.164 7.571 0.593 18135 6076 1 7 . 1 1 64 64 PHE N N 64 120.820 120.820 121.418 -0.598 18135 6077 1 7 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.483 -0.767 18135 6078 1 7 . 1 1 64 64 PHE C C 64 178.402 178.402 176.689 1.713 18135 6079 1 7 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.455 0.697 18135 6080 1 7 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.748 -0.238 18135 6081 1 7 . 1 1 64 64 PHE H H 64 8.405 8.405 8.052 0.353 18135 6082 1 7 . 1 1 65 65 ASN N N 65 119.981 119.981 118.562 1.419 18135 6083 1 7 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.773 0.290 18135 6084 1 7 . 1 1 65 65 ASN C C 65 177.944 177.944 177.432 0.512 18135 6085 1 7 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.931 -0.063 18135 6086 1 7 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.312 -1.056 18135 6087 1 7 . 1 1 65 65 ASN H H 65 8.812 8.812 8.117 0.695 18135 6088 1 7 . 1 1 66 66 LEU N N 66 121.533 121.533 120.371 1.162 18135 6089 1 7 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.163 0.060 18135 6090 1 7 . 1 1 66 66 LEU C C 66 177.777 177.777 177.930 -0.153 18135 6091 1 7 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.580 0.688 18135 6092 1 7 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.501 0.106 18135 6093 1 7 . 1 1 66 66 LEU H H 66 8.177 8.177 7.830 0.347 18135 6094 1 7 . 1 1 67 67 PHE N N 67 110.842 110.842 113.734 -2.892 18135 6095 1 7 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.563 0.317 18135 6096 1 7 . 1 1 67 67 PHE C C 67 177.965 177.965 176.576 1.389 18135 6097 1 7 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.849 0.685 18135 6098 1 7 . 1 1 67 67 PHE CB C 67 38.616 38.616 39.121 -0.505 18135 6099 1 7 . 1 1 67 67 PHE H H 67 8.160 8.160 8.373 -0.213 18135 6100 1 7 . 1 1 68 68 SER N N 68 119.131 119.131 113.811 5.320 18135 6101 1 7 . 1 1 68 68 SER HA H 68 4.580 4.580 4.266 0.314 18135 6102 1 7 . 1 1 68 68 SER C C 68 173.472 173.472 174.582 -1.110 18135 6103 1 7 . 1 1 68 68 SER CA C 68 59.191 59.191 59.280 -0.089 18135 6104 1 7 . 1 1 68 68 SER CB C 68 63.123 63.123 63.583 -0.460 18135 6105 1 7 . 1 1 68 68 SER H H 68 8.016 8.016 7.728 0.288 18135 6106 1 7 . 1 1 69 69 THR N N 69 111.353 111.353 115.846 -4.493 18135 6107 1 7 . 1 1 69 69 THR HA H 69 4.345 4.345 4.448 -0.103 18135 6108 1 7 . 1 1 69 69 THR C C 69 175.661 175.661 174.375 1.286 18135 6109 1 7 . 1 1 69 69 THR CA C 69 61.411 61.411 60.934 0.477 18135 6110 1 7 . 1 1 69 69 THR CB C 69 72.209 72.209 70.265 1.944 18135 6111 1 7 . 1 1 69 69 THR H H 69 6.977 6.977 7.251 -0.274 18135 6112 1 7 . 1 1 70 70 LYS N N 70 121.120 121.120 122.755 -1.635 18135 6113 1 7 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.126 -0.037 18135 6114 1 7 . 1 1 70 70 LYS C C 70 179.259 179.259 177.523 1.736 18135 6115 1 7 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.765 -0.809 18135 6116 1 7 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.251 -0.501 18135 6117 1 7 . 1 1 70 70 LYS H H 70 9.065 9.065 8.589 0.476 18135 6118 1 7 . 1 1 71 71 ASP N N 71 116.374 116.374 120.068 -3.694 18135 6119 1 7 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.227 -0.052 18135 6120 1 7 . 1 1 71 71 ASP C C 71 178.372 178.372 177.366 1.006 18135 6121 1 7 . 1 1 71 71 ASP CA C 71 57.067 57.067 56.934 0.133 18135 6122 1 7 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.275 0.031 18135 6123 1 7 . 1 1 71 71 ASP H H 71 7.518 7.518 7.627 -0.109 18135 6124 1 7 . 1 1 72 72 SER N N 72 117.341 117.341 113.814 3.527 18135 6125 1 7 . 1 1 72 72 SER HA H 72 3.715 3.715 3.237 0.478 18135 6126 1 7 . 1 1 72 72 SER C C 72 176.897 176.897 176.554 0.343 18135 6127 1 7 . 1 1 72 72 SER CA C 72 60.267 60.267 60.946 -0.679 18135 6128 1 7 . 1 1 72 72 SER CB C 72 62.616 62.616 63.006 -0.390 18135 6129 1 7 . 1 1 72 72 SER H H 72 8.066 8.066 8.379 -0.313 18135 6130 1 7 . 1 1 73 73 SER N N 73 113.398 113.398 117.160 -3.762 18135 6131 1 7 . 1 1 73 73 SER HA H 73 4.094 4.094 4.159 -0.065 18135 6132 1 7 . 1 1 73 73 SER C C 73 174.855 174.855 175.187 -0.332 18135 6133 1 7 . 1 1 73 73 SER CA C 73 61.385 61.385 60.701 0.684 18135 6134 1 7 . 1 1 73 73 SER CB C 73 62.798 62.798 62.891 -0.093 18135 6135 1 7 . 1 1 73 73 SER H H 73 7.982 7.982 7.683 0.299 18135 6136 1 7 . 1 1 74 74 ALA N N 74 119.486 119.486 120.256 -0.770 18135 6137 1 7 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.286 -0.129 18135 6138 1 7 . 1 1 74 74 ALA C C 74 177.626 177.626 177.132 0.494 18135 6139 1 7 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.480 0.233 18135 6140 1 7 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.858 -0.111 18135 6141 1 7 . 1 1 74 74 ALA H H 74 7.095 7.095 7.653 -0.558 18135 6142 1 7 . 1 1 75 75 ALA N N 75 121.465 121.465 121.884 -0.419 18135 6143 1 7 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.793 -0.097 18135 6144 1 7 . 1 1 75 75 ALA C C 75 177.197 177.197 176.096 1.101 18135 6145 1 7 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.993 1.011 18135 6146 1 7 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.185 -0.925 18135 6147 1 7 . 1 1 75 75 ALA H H 75 7.159 7.159 7.545 -0.386 18135 6148 1 7 . 1 1 76 76 TRP N N 76 116.791 116.791 116.433 0.358 18135 6149 1 7 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.724 0.326 18135 6150 1 7 . 1 1 76 76 TRP C C 76 177.617 177.617 174.870 2.747 18135 6151 1 7 . 1 1 76 76 TRP CA C 76 53.319 53.319 54.933 -1.614 18135 6152 1 7 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.003 2.072 18135 6153 1 7 . 1 1 76 76 TRP H H 76 7.080 7.080 7.119 -0.039 18135 6154 1 7 . 1 1 77 77 ASP N N 77 119.928 119.928 121.092 -1.164 18135 6155 1 7 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.537 -0.180 18135 6156 1 7 . 1 1 77 77 ASP C C 77 176.877 176.877 177.780 -0.903 18135 6157 1 7 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.449 -0.631 18135 6158 1 7 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.716 0.899 18135 6159 1 7 . 1 1 77 77 ASP H H 77 8.259 8.259 8.782 -0.523 18135 6160 1 7 . 1 1 78 78 GLU N N 78 127.277 127.277 125.964 1.313 18135 6161 1 7 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.966 -0.081 18135 6162 1 7 . 1 1 78 78 GLU C C 78 177.439 177.439 178.339 -0.900 18135 6163 1 7 . 1 1 78 78 GLU CA C 78 59.384 59.384 60.306 -0.922 18135 6164 1 7 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.072 -0.430 18135 6165 1 7 . 1 1 78 78 GLU H H 78 8.920 8.920 8.889 0.031 18135 6166 1 7 . 1 1 79 79 THR N N 79 115.422 115.422 117.096 -1.674 18135 6167 1 7 . 1 1 79 79 THR HA H 79 3.907 3.907 4.092 -0.185 18135 6168 1 7 . 1 1 79 79 THR C C 79 177.330 177.330 176.433 0.897 18135 6169 1 7 . 1 1 79 79 THR CA C 79 66.263 66.263 65.690 0.573 18135 6170 1 7 . 1 1 79 79 THR CB C 79 68.002 68.002 68.324 -0.322 18135 6171 1 7 . 1 1 79 79 THR H H 79 8.124 8.124 8.048 0.076 18135 6172 1 7 . 1 1 80 80 LEU N N 80 121.791 121.791 121.674 0.117 18135 6173 1 7 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.158 -0.271 18135 6174 1 7 . 1 1 80 80 LEU C C 80 179.018 179.018 178.817 0.201 18135 6175 1 7 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.675 -0.436 18135 6176 1 7 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.208 0.444 18135 6177 1 7 . 1 1 80 80 LEU H H 80 7.725 7.725 8.020 -0.295 18135 6178 1 7 . 1 1 81 81 LEU N N 81 119.280 119.280 120.764 -1.484 18135 6179 1 7 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.259 -0.770 18135 6180 1 7 . 1 1 81 81 LEU C C 81 177.062 177.062 178.921 -1.859 18135 6181 1 7 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.781 -1.072 18135 6182 1 7 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.105 -1.157 18135 6183 1 7 . 1 1 81 81 LEU H H 81 8.344 8.344 8.831 -0.487 18135 6184 1 7 . 1 1 82 82 ASP N N 82 115.357 115.357 119.720 -4.363 18135 6185 1 7 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.421 -0.147 18135 6186 1 7 . 1 1 82 82 ASP C C 82 179.018 179.018 178.520 0.498 18135 6187 1 7 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.567 -0.752 18135 6188 1 7 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.864 -2.643 18135 6189 1 7 . 1 1 82 82 ASP H H 82 8.001 8.001 8.603 -0.602 18135 6190 1 7 . 1 1 83 83 LYS N N 83 119.603 119.603 118.771 0.832 18135 6191 1 7 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.896 0.086 18135 6192 1 7 . 1 1 83 83 LYS C C 83 178.624 178.624 178.896 -0.272 18135 6193 1 7 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.827 0.918 18135 6194 1 7 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.216 0.890 18135 6195 1 7 . 1 1 83 83 LYS H H 83 7.342 7.342 7.678 -0.336 18135 6196 1 7 . 1 1 84 84 PHE N N 84 123.933 123.933 121.665 2.268 18135 6197 1 7 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.022 0.013 18135 6198 1 7 . 1 1 84 84 PHE C C 84 177.210 177.210 177.071 0.139 18135 6199 1 7 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.802 -1.459 18135 6200 1 7 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.856 0.460 18135 6201 1 7 . 1 1 84 84 PHE H H 84 8.471 8.471 8.499 -0.028 18135 6202 1 7 . 1 1 85 85 TYR N N 85 118.387 118.387 117.351 1.036 18135 6203 1 7 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.642 0.426 18135 6204 1 7 . 1 1 85 85 TYR C C 85 178.104 178.104 177.476 0.628 18135 6205 1 7 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.525 -0.948 18135 6206 1 7 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.142 -0.164 18135 6207 1 7 . 1 1 85 85 TYR H H 85 9.011 9.011 8.950 0.061 18135 6208 1 7 . 1 1 86 86 THR N N 86 114.035 114.035 116.378 -2.343 18135 6209 1 7 . 1 1 86 86 THR HA H 86 3.945 3.945 3.222 0.723 18135 6210 1 7 . 1 1 86 86 THR C C 86 176.708 176.708 175.908 0.800 18135 6211 1 7 . 1 1 86 86 THR CA C 86 66.759 66.759 67.171 -0.412 18135 6212 1 7 . 1 1 86 86 THR CB C 86 68.853 68.853 67.947 0.906 18135 6213 1 7 . 1 1 86 86 THR H H 86 7.609 7.609 7.262 0.347 18135 6214 1 7 . 1 1 87 87 GLU N N 87 120.790 120.790 122.415 -1.625 18135 6215 1 7 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.891 0.156 18135 6216 1 7 . 1 1 87 87 GLU C C 87 179.606 179.606 178.556 1.050 18135 6217 1 7 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.575 -1.177 18135 6218 1 7 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.239 -0.953 18135 6219 1 7 . 1 1 87 87 GLU H H 87 7.712 7.712 7.689 0.023 18135 6220 1 7 . 1 1 88 88 LEU N N 88 120.729 120.729 119.345 1.384 18135 6221 1 7 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.896 -0.168 18135 6222 1 7 . 1 1 88 88 LEU C C 88 178.695 178.695 179.508 -0.813 18135 6223 1 7 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.037 1.214 18135 6224 1 7 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.025 1.562 18135 6225 1 7 . 1 1 88 88 LEU H H 88 8.393 8.393 7.410 0.983 18135 6226 1 7 . 1 1 89 89 TYR N N 89 118.654 118.654 119.353 -0.699 18135 6227 1 7 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.048 -0.117 18135 6228 1 7 . 1 1 89 89 TYR C C 89 178.438 178.438 178.593 -0.155 18135 6229 1 7 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.176 0.231 18135 6230 1 7 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.442 0.425 18135 6231 1 7 . 1 1 89 89 TYR H H 89 8.637 8.637 8.130 0.507 18135 6232 1 7 . 1 1 90 90 GLN N N 90 118.263 118.263 116.693 1.570 18135 6233 1 7 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.906 0.080 18135 6234 1 7 . 1 1 90 90 GLN C C 90 178.411 178.411 178.684 -0.273 18135 6235 1 7 . 1 1 90 90 GLN CA C 90 58.782 58.782 59.248 -0.466 18135 6236 1 7 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.339 -0.192 18135 6237 1 7 . 1 1 90 90 GLN H H 90 7.796 7.796 7.826 -0.030 18135 6238 1 7 . 1 1 91 91 GLN N N 91 117.959 117.959 119.086 -1.127 18135 6239 1 7 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.029 0.053 18135 6240 1 7 . 1 1 91 91 GLN C C 91 178.705 178.705 178.622 0.083 18135 6241 1 7 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.710 0.110 18135 6242 1 7 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.312 0.861 18135 6243 1 7 . 1 1 91 91 GLN H H 91 7.727 7.727 8.556 -0.829 18135 6244 1 7 . 1 1 92 92 LEU N N 92 119.965 119.965 118.180 1.785 18135 6245 1 7 . 1 1 92 92 LEU HA H 92 3.734 3.734 4.016 -0.282 18135 6246 1 7 . 1 1 92 92 LEU C C 92 178.984 178.984 178.664 0.320 18135 6247 1 7 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.630 -0.138 18135 6248 1 7 . 1 1 92 92 LEU CB C 92 41.379 41.379 41.050 0.329 18135 6249 1 7 . 1 1 92 92 LEU H H 92 8.465 8.465 8.497 -0.032 18135 6250 1 7 . 1 1 93 93 ASN N N 93 117.793 117.793 118.830 -1.037 18135 6251 1 7 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.348 0.053 18135 6252 1 7 . 1 1 93 93 ASN C C 93 178.309 178.309 177.104 1.205 18135 6253 1 7 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.108 0.295 18135 6254 1 7 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.425 0.213 18135 6255 1 7 . 1 1 93 93 ASN H H 93 8.091 8.091 7.976 0.115 18135 6256 1 7 . 1 1 94 94 ASP N N 94 121.133 121.133 120.949 0.184 18135 6257 1 7 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.298 0.107 18135 6258 1 7 . 1 1 94 94 ASP C C 94 178.328 178.328 178.688 -0.360 18135 6259 1 7 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.915 -1.368 18135 6260 1 7 . 1 1 94 94 ASP CB C 94 38.649 38.649 41.067 -2.418 18135 6261 1 7 . 1 1 94 94 ASP H H 94 8.362 8.362 8.371 -0.009 18135 6262 1 7 . 1 1 95 95 LEU N N 95 119.160 119.160 120.947 -1.787 18135 6263 1 7 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.903 0.136 18135 6264 1 7 . 1 1 95 95 LEU C C 95 178.826 178.826 178.277 0.549 18135 6265 1 7 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.075 -1.048 18135 6266 1 7 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.069 0.141 18135 6267 1 7 . 1 1 95 95 LEU H H 95 8.143 8.143 8.488 -0.345 18135 6268 1 7 . 1 1 96 96 GLU N N 96 118.813 118.813 119.105 -0.292 18135 6269 1 7 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.645 0.316 18135 6270 1 7 . 1 1 96 96 GLU C C 96 177.640 177.640 178.231 -0.591 18135 6271 1 7 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.364 -1.650 18135 6272 1 7 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.377 -1.239 18135 6273 1 7 . 1 1 96 96 GLU H H 96 8.111 8.111 7.785 0.326 18135 6274 1 7 . 1 1 97 97 ALA N N 97 120.549 120.549 120.857 -0.308 18135 6275 1 7 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.979 0.143 18135 6276 1 7 . 1 1 97 97 ALA C C 97 179.126 179.126 180.333 -1.207 18135 6277 1 7 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.717 -0.684 18135 6278 1 7 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.885 0.095 18135 6279 1 7 . 1 1 97 97 ALA H H 97 7.798 7.798 7.831 -0.033 18135 6280 1 7 . 1 1 98 98 CYS N N 98 115.510 115.510 117.507 -1.997 18135 6281 1 7 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.141 0.309 18135 6282 1 7 . 1 1 98 98 CYS C C 98 175.363 175.363 176.371 -1.008 18135 6283 1 7 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.442 -5.276 18135 6284 1 7 . 1 1 98 98 CYS CB C 98 41.879 41.879 25.989 15.890 18135 6285 1 7 . 1 1 98 98 CYS H H 98 7.597 7.597 7.832 -0.235 18135 6286 1 7 . 1 1 99 99 VAL N N 99 121.713 121.713 119.531 2.182 18135 6287 1 7 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.887 -0.093 18135 6288 1 7 . 1 1 99 99 VAL C C 99 177.357 177.357 177.621 -0.264 18135 6289 1 7 . 1 1 99 99 VAL CA C 99 64.583 64.583 64.989 -0.406 18135 6290 1 7 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.201 -0.170 18135 6291 1 7 . 1 1 99 99 VAL H H 99 7.828 7.828 7.575 0.253 18135 6292 1 7 . 1 1 100 100 ILE N N 100 122.333 122.333 118.224 4.109 18135 6293 1 7 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.703 0.221 18135 6294 1 7 . 1 1 100 100 ILE C C 100 176.827 176.827 176.636 0.191 18135 6295 1 7 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.671 -1.433 18135 6296 1 7 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.612 0.666 18135 6297 1 7 . 1 1 100 100 ILE H H 100 8.067 8.067 8.119 -0.052 18135 6298 1 7 . 1 1 101 101 GLN N N 101 121.864 121.864 117.594 4.270 18135 6299 1 7 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.212 0.014 18135 6300 1 7 . 1 1 101 101 GLN C C 101 176.438 176.438 178.069 -1.631 18135 6301 1 7 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.498 -0.178 18135 6302 1 7 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.172 -0.161 18135 6303 1 7 . 1 1 101 101 GLN H H 101 8.062 8.062 7.400 0.662 18135 6304 1 7 . 1 1 102 102 GLY N N 102 109.288 109.288 109.949 -0.661 18135 6305 1 7 . 1 1 102 102 GLY C C 102 173.855 173.855 175.394 -1.539 18135 6306 1 7 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.228 -1.069 18135 6307 1 7 . 1 1 102 102 GLY H H 102 8.087 8.087 8.855 -0.768 18135 6308 1 7 . 1 1 103 103 VAL N N 103 118.932 118.932 119.733 -0.801 18135 6309 1 7 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.838 0.236 18135 6310 1 7 . 1 1 103 103 VAL C C 103 176.299 176.299 176.008 0.291 18135 6311 1 7 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.975 -1.476 18135 6312 1 7 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.601 1.253 18135 6313 1 7 . 1 1 103 103 VAL H H 103 8.079 8.079 7.643 0.436 18135 6314 1 7 . 1 1 104 104 GLY N N 104 112.028 112.028 107.611 4.417 18135 6315 1 7 . 1 1 104 104 GLY C C 104 173.694 173.694 173.306 0.388 18135 6316 1 7 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.191 0.211 18135 6317 1 7 . 1 1 104 104 GLY H H 104 8.446 8.446 7.760 0.686 18135 6318 1 7 . 1 1 105 105 VAL N N 105 120.439 120.439 121.008 -0.569 18135 6319 1 7 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.371 -0.183 18135 6320 1 7 . 1 1 105 105 VAL C C 105 175.963 175.963 174.538 1.425 18135 6321 1 7 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.121 1.015 18135 6322 1 7 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.924 -2.110 18135 6323 1 7 . 1 1 105 105 VAL H H 105 7.867 7.867 8.001 -0.134 18135 6324 1 7 . 1 1 106 106 THR N N 106 116.366 116.366 113.662 2.704 18135 6325 1 7 . 1 1 106 106 THR HA H 106 4.548 4.548 4.558 -0.010 18135 6326 1 7 . 1 1 106 106 THR C C 106 173.731 173.731 173.443 0.288 18135 6327 1 7 . 1 1 106 106 THR CA C 106 59.419 59.419 60.739 -1.320 18135 6328 1 7 . 1 1 106 106 THR CB C 106 79.536 79.536 71.089 8.447 18135 6329 1 7 . 1 1 106 106 THR H H 106 8.565 8.565 7.990 0.575 18135 6330 1 7 . 1 1 107 107 GLU N N 107 119.743 119.743 121.581 -1.838 18135 6331 1 7 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.771 -0.309 18135 6332 1 7 . 1 1 107 107 GLU C C 107 175.639 175.639 176.593 -0.954 18135 6333 1 7 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.804 0.907 18135 6334 1 7 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.773 -1.274 18135 6335 1 7 . 1 1 107 107 GLU H H 107 8.410 8.410 8.558 -0.148 18135 6336 1 7 . 1 1 108 108 THR N N 108 114.402 114.402 112.810 1.592 18135 6337 1 7 . 1 1 108 108 THR HA H 108 4.448 4.448 4.640 -0.192 18135 6338 1 7 . 1 1 108 108 THR CA C 108 60.348 60.348 59.035 1.313 18135 6339 1 7 . 1 1 108 108 THR CB C 108 68.544 68.544 68.090 0.454 18135 6340 1 7 . 1 1 108 108 THR H H 108 8.155 8.155 8.123 0.032 18135 6341 1 7 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.512 -0.274 18135 6342 1 7 . 1 1 109 109 PRO C C 109 178.666 178.666 178.126 0.540 18135 6343 1 7 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.401 0.975 18135 6344 1 7 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.825 0.023 18135 6345 1 7 . 1 1 110 110 LEU N N 110 118.566 118.566 117.913 0.653 18135 6346 1 7 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.107 0.009 18135 6347 1 7 . 1 1 110 110 LEU C C 110 178.293 178.293 179.084 -0.791 18135 6348 1 7 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.673 -0.987 18135 6349 1 7 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.301 0.668 18135 6350 1 7 . 1 1 110 110 LEU H H 110 8.016 8.016 7.866 0.150 18135 6351 1 7 . 1 1 111 111 MET N N 111 118.982 118.982 115.354 3.628 18135 6352 1 7 . 1 1 111 111 MET HA H 111 4.210 4.210 4.368 -0.158 18135 6353 1 7 . 1 1 111 111 MET C C 111 178.720 178.720 177.680 1.040 18135 6354 1 7 . 1 1 111 111 MET CA C 111 58.144 58.144 56.632 1.512 18135 6355 1 7 . 1 1 111 111 MET CB C 111 32.374 32.374 32.295 0.079 18135 6356 1 7 . 1 1 111 111 MET H H 111 7.705 7.705 7.949 -0.244 18135 6357 1 7 . 1 1 112 112 LYS N N 112 121.377 121.377 120.967 0.410 18135 6358 1 7 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.247 -0.139 18135 6359 1 7 . 1 1 112 112 LYS C C 112 178.000 178.000 178.664 -0.664 18135 6360 1 7 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.551 -2.247 18135 6361 1 7 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.115 0.252 18135 6362 1 7 . 1 1 112 112 LYS H H 112 8.257 8.257 7.514 0.743 18135 6363 1 7 . 1 1 113 113 GLU N N 113 119.104 119.104 118.939 0.165 18135 6364 1 7 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.997 0.069 18135 6365 1 7 . 1 1 113 113 GLU C C 113 178.289 178.289 178.954 -0.665 18135 6366 1 7 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.433 -1.180 18135 6367 1 7 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.377 -1.239 18135 6368 1 7 . 1 1 113 113 GLU H H 113 8.270 8.270 7.878 0.392 18135 6369 1 7 . 1 1 114 114 ASP N N 114 119.224 119.224 118.689 0.535 18135 6370 1 7 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.573 -0.285 18135 6371 1 7 . 1 1 114 114 ASP C C 114 178.365 178.365 178.356 0.009 18135 6372 1 7 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.553 -1.445 18135 6373 1 7 . 1 1 114 114 ASP CB C 114 38.235 38.235 41.426 -3.191 18135 6374 1 7 . 1 1 114 114 ASP H H 114 8.618 8.618 7.540 1.078 18135 6375 1 7 . 1 1 115 115 SER N N 115 118.195 118.195 116.732 1.463 18135 6376 1 7 . 1 1 115 115 SER HA H 115 4.200 4.200 4.102 0.098 18135 6377 1 7 . 1 1 115 115 SER C C 115 175.986 175.986 176.742 -0.756 18135 6378 1 7 . 1 1 115 115 SER CA C 115 61.588 61.588 62.096 -0.508 18135 6379 1 7 . 1 1 115 115 SER CB C 115 62.653 62.653 62.884 -0.231 18135 6380 1 7 . 1 1 115 115 SER H H 115 8.181 8.181 7.560 0.621 18135 6381 1 7 . 1 1 116 116 ILE N N 116 123.340 123.340 122.087 1.253 18135 6382 1 7 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.900 -0.274 18135 6383 1 7 . 1 1 116 116 ILE C C 116 178.367 178.367 178.373 -0.006 18135 6384 1 7 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.521 1.296 18135 6385 1 7 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.589 0.829 18135 6386 1 7 . 1 1 116 116 ILE H H 116 7.773 7.773 8.475 -0.702 18135 6387 1 7 . 1 1 117 117 LEU N N 117 120.968 120.968 121.263 -0.295 18135 6388 1 7 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.971 -0.066 18135 6389 1 7 . 1 1 117 117 LEU C C 117 178.746 178.746 178.467 0.279 18135 6390 1 7 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.444 -0.301 18135 6391 1 7 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.589 -0.003 18135 6392 1 7 . 1 1 117 117 LEU H H 117 8.406 8.406 7.497 0.909 18135 6393 1 7 . 1 1 118 118 ALA N N 118 120.150 120.150 122.107 -1.957 18135 6394 1 7 . 1 1 118 118 ALA HA H 118 4.112 4.112 4.073 0.039 18135 6395 1 7 . 1 1 118 118 ALA C C 118 181.633 181.633 179.526 2.107 18135 6396 1 7 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.402 -0.089 18135 6397 1 7 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.523 -0.413 18135 6398 1 7 . 1 1 118 118 ALA H H 118 7.894 7.894 8.230 -0.336 18135 6399 1 7 . 1 1 119 119 VAL N N 119 118.873 118.873 116.593 2.280 18135 6400 1 7 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.722 0.033 18135 6401 1 7 . 1 1 119 119 VAL C C 119 177.896 177.896 178.046 -0.150 18135 6402 1 7 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.612 1.569 18135 6403 1 7 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.177 1.717 18135 6404 1 7 . 1 1 119 119 VAL H H 119 7.572 7.572 8.107 -0.535 18135 6405 1 7 . 1 1 120 120 ARG N N 120 121.436 121.436 120.433 1.003 18135 6406 1 7 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.207 -0.180 18135 6407 1 7 . 1 1 120 120 ARG C C 120 179.848 179.848 178.951 0.897 18135 6408 1 7 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.398 1.869 18135 6409 1 7 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.587 0.108 18135 6410 1 7 . 1 1 120 120 ARG H H 120 8.629 8.629 8.666 -0.037 18135 6411 1 7 . 1 1 121 121 LYS N N 121 119.589 119.589 120.226 -0.637 18135 6412 1 7 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.032 0.042 18135 6413 1 7 . 1 1 121 121 LYS C C 121 178.331 178.331 179.126 -0.795 18135 6414 1 7 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.867 0.573 18135 6415 1 7 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.476 -0.369 18135 6416 1 7 . 1 1 121 121 LYS H H 121 9.015 9.015 8.278 0.737 18135 6417 1 7 . 1 1 122 122 TYR N N 122 121.546 121.546 120.363 1.183 18135 6418 1 7 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.119 0.213 18135 6419 1 7 . 1 1 122 122 TYR C C 122 176.527 176.527 177.851 -1.324 18135 6420 1 7 . 1 1 122 122 TYR CA C 122 60.404 60.404 61.550 -1.146 18135 6421 1 7 . 1 1 122 122 TYR CB C 122 37.725 37.725 38.432 -0.707 18135 6422 1 7 . 1 1 122 122 TYR H H 122 7.473 7.473 8.430 -0.957 18135 6423 1 7 . 1 1 123 123 PHE N N 123 116.026 116.026 119.332 -3.306 18135 6424 1 7 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.888 -0.148 18135 6425 1 7 . 1 1 123 123 PHE C C 123 179.005 179.005 177.489 1.516 18135 6426 1 7 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.624 2.904 18135 6427 1 7 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.678 0.653 18135 6428 1 7 . 1 1 123 123 PHE H H 123 7.932 7.932 8.626 -0.694 18135 6429 1 7 . 1 1 124 124 GLN N N 124 123.043 123.043 119.053 3.990 18135 6430 1 7 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.358 0.821 18135 6431 1 7 . 1 1 124 124 GLN C C 124 178.772 178.772 178.130 0.642 18135 6432 1 7 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.035 0.281 18135 6433 1 7 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.219 -0.588 18135 6434 1 7 . 1 1 124 124 GLN H H 124 8.470 8.470 8.461 0.009 18135 6435 1 7 . 1 1 125 125 ARG N N 125 120.342 120.342 119.568 0.774 18135 6436 1 7 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.134 -0.056 18135 6437 1 7 . 1 1 125 125 ARG C C 125 180.340 180.340 179.116 1.224 18135 6438 1 7 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.601 2.696 18135 6439 1 7 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.764 0.561 18135 6440 1 7 . 1 1 125 125 ARG H H 125 8.137 8.137 7.916 0.221 18135 6441 1 7 . 1 1 126 126 ILE N N 126 121.876 121.876 120.605 1.271 18135 6442 1 7 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.110 0.241 18135 6443 1 7 . 1 1 126 126 ILE C C 126 176.857 176.857 177.513 -0.656 18135 6444 1 7 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.869 0.963 18135 6445 1 7 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.654 0.630 18135 6446 1 7 . 1 1 126 126 ILE H H 126 7.526 7.526 8.175 -0.649 18135 6447 1 7 . 1 1 127 127 THR N N 127 115.613 115.613 115.156 0.457 18135 6448 1 7 . 1 1 127 127 THR HA H 127 3.633 3.633 3.813 -0.180 18135 6449 1 7 . 1 1 127 127 THR C C 127 176.645 176.645 177.003 -0.358 18135 6450 1 7 . 1 1 127 127 THR CA C 127 67.294 67.294 66.613 0.681 18135 6451 1 7 . 1 1 127 127 THR CB C 127 68.871 68.871 68.883 -0.012 18135 6452 1 7 . 1 1 127 127 THR H H 127 8.288 8.288 8.084 0.204 18135 6453 1 7 . 1 1 128 128 LEU N N 128 122.627 122.627 122.292 0.335 18135 6454 1 7 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.936 0.020 18135 6455 1 7 . 1 1 128 128 LEU C C 128 178.331 178.331 177.846 0.485 18135 6456 1 7 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.776 0.312 18135 6457 1 7 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.249 0.325 18135 6458 1 7 . 1 1 128 128 LEU H H 128 8.263 8.263 7.829 0.434 18135 6459 1 7 . 1 1 129 129 TYR N N 129 120.955 120.955 120.523 0.432 18135 6460 1 7 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.367 -0.477 18135 6461 1 7 . 1 1 129 129 TYR C C 129 176.040 176.040 177.709 -1.669 18135 6462 1 7 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.310 0.183 18135 6463 1 7 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.287 0.638 18135 6464 1 7 . 1 1 129 129 TYR H H 129 7.518 7.518 8.216 -0.698 18135 6465 1 7 . 1 1 130 130 LEU N N 130 119.155 119.155 116.559 2.596 18135 6466 1 7 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.336 -0.491 18135 6467 1 7 . 1 1 130 130 LEU C C 130 177.948 177.948 178.405 -0.457 18135 6468 1 7 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.922 0.191 18135 6469 1 7 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.556 1.030 18135 6470 1 7 . 1 1 130 130 LEU H H 130 7.717 7.717 7.973 -0.256 18135 6471 1 7 . 1 1 131 131 LYS N N 131 116.832 116.832 120.028 -3.196 18135 6472 1 7 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.862 -0.454 18135 6473 1 7 . 1 1 131 131 LYS C C 131 181.265 181.265 179.714 1.551 18135 6474 1 7 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.744 -0.013 18135 6475 1 7 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.026 0.646 18135 6476 1 7 . 1 1 131 131 LYS H H 131 7.493 7.493 8.002 -0.509 18135 6477 1 7 . 1 1 132 132 GLU N N 132 121.918 121.918 119.808 2.110 18135 6478 1 7 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.050 -0.206 18135 6479 1 7 . 1 1 132 132 GLU C C 132 178.377 178.377 178.424 -0.047 18135 6480 1 7 . 1 1 132 132 GLU CA C 132 58.887 58.887 59.072 -0.185 18135 6481 1 7 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.557 -0.890 18135 6482 1 7 . 1 1 132 132 GLU H H 132 8.430 8.430 8.087 0.343 18135 6483 1 7 . 1 1 133 133 LYS N N 133 116.079 116.079 116.632 -0.553 18135 6484 1 7 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.219 -0.253 18135 6485 1 7 . 1 1 133 133 LYS C C 133 175.282 175.282 176.028 -0.746 18135 6486 1 7 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.632 -0.334 18135 6487 1 7 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.767 0.231 18135 6488 1 7 . 1 1 133 133 LYS H H 133 7.390 7.390 7.348 0.042 18135 6489 1 7 . 1 1 134 134 LYS N N 134 117.759 117.759 115.953 1.806 18135 6490 1 7 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.060 -0.478 18135 6491 1 7 . 1 1 134 134 LYS C C 134 176.271 176.271 175.985 0.286 18135 6492 1 7 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.823 0.485 18135 6493 1 7 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.081 -0.279 18135 6494 1 7 . 1 1 134 134 LYS H H 134 7.716 7.716 7.617 0.099 18135 6495 1 7 . 1 1 135 135 TYR N N 135 110.598 110.598 113.749 -3.151 18135 6496 1 7 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.948 -1.071 18135 6497 1 7 . 1 1 135 135 TYR C C 135 174.148 174.148 175.218 -1.070 18135 6498 1 7 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.059 0.656 18135 6499 1 7 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.053 -0.347 18135 6500 1 7 . 1 1 135 135 TYR H H 135 8.428 8.428 8.810 -0.382 18135 6501 1 7 . 1 1 136 136 SER N N 136 113.712 113.712 115.446 -1.734 18135 6502 1 7 . 1 1 136 136 SER HA H 136 4.553 4.553 4.381 0.172 18135 6503 1 7 . 1 1 136 136 SER CA C 136 57.108 57.108 58.815 -1.707 18135 6504 1 7 . 1 1 136 136 SER CB C 136 62.500 62.500 64.055 -1.555 18135 6505 1 7 . 1 1 136 136 SER H H 136 6.744 6.744 7.380 -0.636 18135 6506 1 7 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.408 -0.243 18135 6507 1 7 . 1 1 137 137 PRO C C 137 180.675 180.675 177.315 3.360 18135 6508 1 7 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.730 0.927 18135 6509 1 7 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.822 0.161 18135 6510 1 7 . 1 1 138 138 CYS N N 138 113.914 113.914 115.775 -1.861 18135 6511 1 7 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.436 0.234 18135 6512 1 7 . 1 1 138 138 CYS C C 138 176.015 176.015 176.191 -0.176 18135 6513 1 7 . 1 1 138 138 CYS CA C 138 57.095 57.095 61.672 -4.577 18135 6514 1 7 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.411 10.368 18135 6515 1 7 . 1 1 138 138 CYS H H 138 8.580 8.580 8.549 0.031 18135 6516 1 7 . 1 1 139 139 ALA N N 139 125.290 125.290 123.963 1.327 18135 6517 1 7 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.208 0.241 18135 6518 1 7 . 1 1 139 139 ALA C C 139 180.149 180.149 179.317 0.832 18135 6519 1 7 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.941 -0.163 18135 6520 1 7 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.208 0.710 18135 6521 1 7 . 1 1 139 139 ALA H H 139 8.087 8.087 8.054 0.033 18135 6522 1 7 . 1 1 140 140 TRP N N 140 116.599 116.599 118.795 -2.196 18135 6523 1 7 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.289 0.313 18135 6524 1 7 . 1 1 140 140 TRP C C 140 179.137 179.137 178.494 0.643 18135 6525 1 7 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.421 -0.887 18135 6526 1 7 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.349 -0.091 18135 6527 1 7 . 1 1 140 140 TRP H H 140 8.505 8.505 7.877 0.628 18135 6528 1 7 . 1 1 141 141 GLU N N 141 121.578 121.578 119.158 2.420 18135 6529 1 7 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.287 0.936 18135 6530 1 7 . 1 1 141 141 GLU C C 141 177.886 177.886 178.898 -1.012 18135 6531 1 7 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.559 -1.652 18135 6532 1 7 . 1 1 141 141 GLU CB C 141 28.717 28.717 28.923 -0.206 18135 6533 1 7 . 1 1 141 141 GLU H H 141 8.182 8.182 8.201 -0.019 18135 6534 1 7 . 1 1 142 142 VAL N N 142 121.202 121.202 119.930 1.272 18135 6535 1 7 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.749 -0.119 18135 6536 1 7 . 1 1 142 142 VAL C C 142 180.246 180.246 178.485 1.761 18135 6537 1 7 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.901 0.082 18135 6538 1 7 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.160 0.662 18135 6539 1 7 . 1 1 142 142 VAL H H 142 8.623 8.623 8.113 0.510 18135 6540 1 7 . 1 1 143 143 VAL N N 143 120.119 120.119 119.341 0.778 18135 6541 1 7 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.755 -0.458 18135 6542 1 7 . 1 1 143 143 VAL C C 143 176.407 176.407 178.771 -2.364 18135 6543 1 7 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.577 1.401 18135 6544 1 7 . 1 1 143 143 VAL CB C 143 31.655 31.655 30.883 0.772 18135 6545 1 7 . 1 1 143 143 VAL H H 143 8.323 8.323 8.428 -0.105 18135 6546 1 7 . 1 1 144 144 ARG N N 144 124.102 124.102 119.621 4.481 18135 6547 1 7 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.108 -0.411 18135 6548 1 7 . 1 1 144 144 ARG C C 144 178.127 178.127 178.476 -0.349 18135 6549 1 7 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.600 1.401 18135 6550 1 7 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.721 0.215 18135 6551 1 7 . 1 1 144 144 ARG H H 144 9.619 9.619 8.524 1.095 18135 6552 1 7 . 1 1 145 145 ALA N N 145 119.431 119.431 121.966 -2.535 18135 6553 1 7 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.091 -0.240 18135 6554 1 7 . 1 1 145 145 ALA C C 145 180.763 180.763 180.126 0.637 18135 6555 1 7 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.415 -0.040 18135 6556 1 7 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.103 0.082 18135 6557 1 7 . 1 1 145 145 ALA H H 145 8.867 8.867 8.469 0.398 18135 6558 1 7 . 1 1 146 146 GLU N N 146 121.815 121.815 118.522 3.293 18135 6559 1 7 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.220 -0.009 18135 6560 1 7 . 1 1 146 146 GLU C C 146 177.296 177.296 179.432 -2.136 18135 6561 1 7 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.969 -1.590 18135 6562 1 7 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.651 -1.517 18135 6563 1 7 . 1 1 146 146 GLU H H 146 8.136 8.136 8.014 0.122 18135 6564 1 7 . 1 1 147 147 ILE N N 147 119.542 119.542 121.234 -1.692 18135 6565 1 7 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.877 0.093 18135 6566 1 7 . 1 1 147 147 ILE C C 147 178.283 178.283 177.869 0.414 18135 6567 1 7 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.999 -3.746 18135 6568 1 7 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.726 -2.387 18135 6569 1 7 . 1 1 147 147 ILE H H 147 8.736 8.736 8.277 0.459 18135 6570 1 7 . 1 1 148 148 MET N N 148 119.501 119.501 118.774 0.727 18135 6571 1 7 . 1 1 148 148 MET HA H 148 3.801 3.801 4.233 -0.432 18135 6572 1 7 . 1 1 148 148 MET C C 148 178.210 178.210 178.757 -0.547 18135 6573 1 7 . 1 1 148 148 MET CA C 148 60.184 60.184 59.783 0.401 18135 6574 1 7 . 1 1 148 148 MET CB C 148 32.914 32.914 32.030 0.884 18135 6575 1 7 . 1 1 148 148 MET H H 148 8.440 8.440 8.582 -0.142 18135 6576 1 7 . 1 1 149 149 ARG N N 149 119.734 119.734 119.976 -0.242 18135 6577 1 7 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.125 -0.210 18135 6578 1 7 . 1 1 149 149 ARG C C 149 178.978 178.978 178.969 0.009 18135 6579 1 7 . 1 1 149 149 ARG CA C 149 59.863 59.863 58.942 0.921 18135 6580 1 7 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.492 0.788 18135 6581 1 7 . 1 1 149 149 ARG H H 149 7.648 7.648 8.423 -0.775 18135 6582 1 7 . 1 1 150 150 SER N N 150 118.109 118.109 116.242 1.867 18135 6583 1 7 . 1 1 150 150 SER HA H 150 3.339 3.339 3.686 -0.347 18135 6584 1 7 . 1 1 150 150 SER C C 150 177.292 177.292 176.509 0.783 18135 6585 1 7 . 1 1 150 150 SER CA C 150 61.316 61.316 61.725 -0.409 18135 6586 1 7 . 1 1 150 150 SER CB C 150 60.288 60.288 62.559 -2.271 18135 6587 1 7 . 1 1 150 150 SER H H 150 9.194 9.194 8.312 0.882 18135 6588 1 7 . 1 1 151 151 PHE N N 151 125.265 125.265 123.775 1.490 18135 6589 1 7 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.306 -0.270 18135 6590 1 7 . 1 1 151 151 PHE C C 151 178.696 178.696 177.465 1.231 18135 6591 1 7 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.425 1.995 18135 6592 1 7 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.584 0.302 18135 6593 1 7 . 1 1 151 151 PHE H H 151 9.455 9.455 8.347 1.108 18135 6594 1 7 . 1 1 152 152 SER N N 152 115.963 115.963 115.180 0.783 18135 6595 1 7 . 1 1 152 152 SER HA H 152 3.880 3.880 3.650 0.230 18135 6596 1 7 . 1 1 152 152 SER C C 152 175.858 175.858 176.640 -0.782 18135 6597 1 7 . 1 1 152 152 SER CA C 152 62.388 62.388 61.245 1.143 18135 6598 1 7 . 1 1 152 152 SER CB C 152 62.519 62.519 63.184 -0.666 18135 6599 1 7 . 1 1 152 152 SER H H 152 7.839 7.839 8.224 -0.385 18135 6600 1 7 . 1 1 153 153 LEU N N 153 121.365 121.365 122.453 -1.088 18135 6601 1 7 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.123 -0.042 18135 6602 1 7 . 1 1 153 153 LEU C C 153 179.515 179.515 177.893 1.622 18135 6603 1 7 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.783 0.100 18135 6604 1 7 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.461 0.881 18135 6605 1 7 . 1 1 153 153 LEU H H 153 7.775 7.775 8.226 -0.451 18135 6606 1 7 . 1 1 154 154 SER N N 154 113.950 113.950 112.365 1.585 18135 6607 1 7 . 1 1 154 154 SER HA H 154 3.781 3.781 4.411 -0.630 18135 6608 1 7 . 1 1 154 154 SER C C 154 174.312 174.312 176.886 -2.574 18135 6609 1 7 . 1 1 154 154 SER CA C 154 61.366 61.366 61.232 0.134 18135 6610 1 7 . 1 1 154 154 SER CB C 154 63.242 63.242 63.626 -0.384 18135 6611 1 7 . 1 1 154 154 SER H H 154 7.874 7.874 8.387 -0.513 18135 6612 1 7 . 1 1 155 155 THR N N 155 109.346 109.346 114.522 -5.176 18135 6613 1 7 . 1 1 155 155 THR HA H 155 4.060 4.060 4.407 -0.347 18135 6614 1 7 . 1 1 155 155 THR C C 155 174.798 174.798 175.589 -0.791 18135 6615 1 7 . 1 1 155 155 THR CA C 155 62.275 62.275 64.171 -1.897 18135 6616 1 7 . 1 1 155 155 THR CB C 155 69.342 69.342 69.168 0.173 18135 6617 1 7 . 1 1 155 155 THR H H 155 7.176 7.176 7.842 -0.666 18135 6618 1 7 . 1 1 156 156 ASN N N 156 119.785 119.785 120.270 -0.485 18135 6619 1 7 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.815 -0.288 18135 6620 1 7 . 1 1 156 156 ASN C C 156 175.528 175.528 174.920 0.608 18135 6621 1 7 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.340 1.597 18135 6622 1 7 . 1 1 156 156 ASN CB C 156 38.338 38.338 38.120 0.218 18135 6623 1 7 . 1 1 156 156 ASN H H 156 7.749 7.749 7.926 -0.177 18135 6624 1 7 . 1 1 157 157 LEU N N 157 120.552 120.552 121.149 -0.597 18135 6625 1 7 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.492 -0.237 18135 6626 1 7 . 1 1 157 157 LEU C C 157 174.702 174.702 178.362 -3.660 18135 6627 1 7 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.837 -1.163 18135 6628 1 7 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.222 0.129 18135 6629 1 7 . 1 1 157 157 LEU H H 157 8.097 8.097 7.675 0.422 18135 6630 1 7 . 1 1 158 158 GLN N N 158 119.860 119.860 116.705 3.155 18135 6631 1 7 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.306 -0.126 18135 6632 1 7 . 1 1 158 158 GLN C C 158 176.434 176.434 175.351 1.083 18135 6633 1 7 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.918 0.979 18135 6634 1 7 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.464 -0.454 18135 6635 1 7 . 1 1 158 158 GLN H H 158 8.230 8.230 8.131 0.099 18135 6636 1 7 . 1 1 159 159 GLU N N 159 120.461 120.461 115.743 4.718 18135 6637 1 7 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.999 0.220 18135 6638 1 7 . 1 1 159 159 GLU C C 159 175.251 175.251 175.833 -0.582 18135 6639 1 7 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.627 -0.932 18135 6640 1 7 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.790 0.191 18135 6641 1 7 . 1 1 159 159 GLU H H 159 8.300 8.300 8.629 -0.329 18135 6642 1 7 . 1 1 160 160 SER N N 160 115.719 115.719 113.460 2.259 18135 6643 1 7 . 1 1 160 160 SER HA H 160 4.372 4.372 4.503 -0.131 18135 6644 1 7 . 1 1 160 160 SER C C 160 174.188 174.188 175.350 -1.162 18135 6645 1 7 . 1 1 160 160 SER CA C 160 58.481 58.481 57.521 0.960 18135 6646 1 7 . 1 1 160 160 SER CB C 160 63.731 63.731 63.322 0.409 18135 6647 1 7 . 1 1 160 160 SER H H 160 8.113 8.113 8.209 -0.096 18135 6648 1 7 . 1 1 161 161 LEU N N 161 123.794 123.794 122.352 1.442 18135 6649 1 7 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.197 0.083 18135 6650 1 7 . 1 1 161 161 LEU C C 161 177.293 177.293 176.724 0.569 18135 6651 1 7 . 1 1 161 161 LEU CA C 161 55.190 55.190 55.961 -0.771 18135 6652 1 7 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.245 0.039 18135 6653 1 7 . 1 1 161 161 LEU H H 161 8.032 8.032 7.879 0.153 18135 6654 1 7 . 1 1 162 162 ARG N N 162 120.715 120.715 119.453 1.262 18135 6655 1 7 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.567 -0.398 18135 6656 1 7 . 1 1 162 162 ARG C C 162 176.288 176.288 175.337 0.951 18135 6657 1 7 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.729 1.317 18135 6658 1 7 . 1 1 162 162 ARG CB C 162 30.935 30.935 29.657 1.278 18135 6659 1 7 . 1 1 162 162 ARG H H 162 8.094 8.094 8.243 -0.149 18135 6660 1 7 . 1 1 163 163 SER N N 163 116.670 116.670 117.988 -1.318 18135 6661 1 7 . 1 1 163 163 SER HA H 163 4.372 4.372 4.646 -0.274 18135 6662 1 7 . 1 1 163 163 SER C C 163 174.184 174.184 174.473 -0.289 18135 6663 1 7 . 1 1 163 163 SER CA C 163 58.481 58.481 58.176 0.305 18135 6664 1 7 . 1 1 163 163 SER CB C 163 63.745 63.745 65.261 -1.516 18135 6665 1 7 . 1 1 163 163 SER H H 163 8.191 8.191 8.421 -0.230 18135 6666 1 7 . 1 1 164 164 LYS N N 164 123.100 123.100 124.046 -0.946 18135 6667 1 7 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.500 -0.223 18135 6668 1 7 . 1 1 164 164 LYS C C 164 175.617 175.617 176.108 -0.491 18135 6669 1 7 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.462 -0.149 18135 6670 1 7 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.255 0.710 18135 6671 1 7 . 1 1 164 164 LYS H H 164 8.251 8.251 8.622 -0.371 18135 6672 1 8 . 1 1 2 2 ASP N N 2 125.691 125.691 119.898 5.793 18135 6673 1 8 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.583 0.127 18135 6674 1 8 . 1 1 2 2 ASP C C 2 174.758 174.758 176.060 -1.302 18135 6675 1 8 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.244 -1.401 18135 6676 1 8 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.136 -1.815 18135 6677 1 8 . 1 1 2 2 ASP H H 2 8.773 8.773 8.422 0.351 18135 6678 1 8 . 1 1 3 3 LEU N N 3 123.957 123.957 118.363 5.594 18135 6679 1 8 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.314 0.087 18135 6680 1 8 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.117 0.536 18135 6681 1 8 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.373 0.182 18135 6682 1 8 . 1 1 3 3 LEU H H 3 8.164 8.164 7.353 0.811 18135 6683 1 8 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.421 -0.107 18135 6684 1 8 . 1 1 4 4 PRO C C 4 176.213 176.213 176.298 -0.085 18135 6685 1 8 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.198 0.710 18135 6686 1 8 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.206 1.688 18135 6687 1 8 . 1 1 5 5 GLN N N 5 121.621 121.621 121.797 -0.176 18135 6688 1 8 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.156 0.070 18135 6689 1 8 . 1 1 5 5 GLN C C 5 176.995 176.995 176.778 0.217 18135 6690 1 8 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.156 -1.446 18135 6691 1 8 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.263 -0.312 18135 6692 1 8 . 1 1 5 5 GLN H H 5 8.767 8.767 8.608 0.159 18135 6693 1 8 . 1 1 6 6 THR N N 6 111.419 111.419 111.169 0.250 18135 6694 1 8 . 1 1 6 6 THR HA H 6 4.135 4.135 4.444 -0.309 18135 6695 1 8 . 1 1 6 6 THR C C 6 174.695 174.695 175.129 -0.434 18135 6696 1 8 . 1 1 6 6 THR CA C 6 62.661 62.661 63.348 -0.687 18135 6697 1 8 . 1 1 6 6 THR CB C 6 69.365 69.365 68.722 0.643 18135 6698 1 8 . 1 1 6 6 THR H H 6 7.865 7.865 8.598 -0.733 18135 6699 1 8 . 1 1 7 7 HIS N N 7 119.137 119.137 119.877 -0.740 18135 6700 1 8 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.595 -0.010 18135 6701 1 8 . 1 1 7 7 HIS C C 7 174.980 174.980 175.075 -0.095 18135 6702 1 8 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.590 -2.586 18135 6703 1 8 . 1 1 7 7 HIS CB C 7 28.163 28.163 30.012 -1.849 18135 6704 1 8 . 1 1 7 7 HIS H H 7 8.567 8.567 8.468 0.099 18135 6705 1 8 . 1 1 8 8 SER N N 8 115.796 115.796 113.142 2.654 18135 6706 1 8 . 1 1 8 8 SER HA H 8 4.363 4.363 4.416 -0.053 18135 6707 1 8 . 1 1 8 8 SER C C 8 175.312 175.312 175.877 -0.565 18135 6708 1 8 . 1 1 8 8 SER CA C 8 58.969 58.969 60.348 -1.379 18135 6709 1 8 . 1 1 8 8 SER CB C 8 63.439 63.439 63.493 -0.054 18135 6710 1 8 . 1 1 8 8 SER H H 8 8.180 8.180 7.866 0.314 18135 6711 1 8 . 1 1 9 9 LEU N N 9 123.844 123.844 117.918 5.926 18135 6712 1 8 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.819 -0.664 18135 6713 1 8 . 1 1 9 9 LEU C C 9 178.568 178.568 178.576 -0.008 18135 6714 1 8 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.523 0.443 18135 6715 1 8 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.429 -0.633 18135 6716 1 8 . 1 1 9 9 LEU H H 9 8.404 8.404 7.593 0.811 18135 6717 1 8 . 1 1 10 10 GLY N N 10 107.582 107.582 107.589 -0.007 18135 6718 1 8 . 1 1 10 10 GLY C C 10 174.586 174.586 175.696 -1.110 18135 6719 1 8 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.102 -0.197 18135 6720 1 8 . 1 1 10 10 GLY H H 10 8.438 8.438 8.522 -0.084 18135 6721 1 8 . 1 1 11 11 SER N N 11 118.806 118.806 116.204 2.602 18135 6722 1 8 . 1 1 11 11 SER HA H 11 4.156 4.156 4.111 0.045 18135 6723 1 8 . 1 1 11 11 SER C C 11 175.749 175.749 176.766 -1.017 18135 6724 1 8 . 1 1 11 11 SER CA C 11 61.299 61.299 61.474 -0.175 18135 6725 1 8 . 1 1 11 11 SER CB C 11 62.653 62.653 63.041 -0.388 18135 6726 1 8 . 1 1 11 11 SER H H 11 8.249 8.249 8.287 -0.038 18135 6727 1 8 . 1 1 12 12 ARG N N 12 121.986 121.986 121.241 0.745 18135 6728 1 8 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.147 -0.193 18135 6729 1 8 . 1 1 12 12 ARG C C 12 178.283 178.283 178.601 -0.318 18135 6730 1 8 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.468 1.362 18135 6731 1 8 . 1 1 12 12 ARG CB C 12 29.584 29.584 29.443 0.141 18135 6732 1 8 . 1 1 12 12 ARG H H 12 8.027 8.027 8.070 -0.043 18135 6733 1 8 . 1 1 13 13 ARG N N 13 119.432 119.432 120.084 -0.652 18135 6734 1 8 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.049 -0.210 18135 6735 1 8 . 1 1 13 13 ARG C C 13 178.480 178.480 178.347 0.133 18135 6736 1 8 . 1 1 13 13 ARG CA C 13 60.491 60.491 60.078 0.413 18135 6737 1 8 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.926 0.156 18135 6738 1 8 . 1 1 13 13 ARG H H 13 8.437 8.437 7.833 0.604 18135 6739 1 8 . 1 1 14 14 THR N N 14 116.879 116.879 116.703 0.176 18135 6740 1 8 . 1 1 14 14 THR HA H 14 3.532 3.532 4.131 -0.599 18135 6741 1 8 . 1 1 14 14 THR C C 14 175.584 175.584 176.979 -1.395 18135 6742 1 8 . 1 1 14 14 THR CA C 14 68.036 68.036 67.262 0.774 18135 6743 1 8 . 1 1 14 14 THR CB C 14 67.969 67.969 68.725 -0.756 18135 6744 1 8 . 1 1 14 14 THR H H 14 7.957 7.957 8.232 -0.275 18135 6745 1 8 . 1 1 15 15 LEU N N 15 120.252 120.252 122.197 -1.945 18135 6746 1 8 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.944 0.002 18135 6747 1 8 . 1 1 15 15 LEU C C 15 178.652 178.652 178.733 -0.081 18135 6748 1 8 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.311 -0.223 18135 6749 1 8 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.833 -0.279 18135 6750 1 8 . 1 1 15 15 LEU H H 15 7.550 7.550 8.097 -0.547 18135 6751 1 8 . 1 1 16 16 MET N N 16 118.788 118.788 117.497 1.291 18135 6752 1 8 . 1 1 16 16 MET HA H 16 4.023 4.023 3.944 0.079 18135 6753 1 8 . 1 1 16 16 MET C C 16 178.718 178.718 178.614 0.104 18135 6754 1 8 . 1 1 16 16 MET CA C 16 58.513 58.513 59.314 -0.801 18135 6755 1 8 . 1 1 16 16 MET CB C 16 32.150 32.150 32.267 -0.117 18135 6756 1 8 . 1 1 16 16 MET H H 16 7.985 7.985 8.312 -0.327 18135 6757 1 8 . 1 1 17 17 LEU N N 17 120.644 120.644 119.503 1.141 18135 6758 1 8 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.972 0.000 18135 6759 1 8 . 1 1 17 17 LEU C C 17 178.238 178.238 179.173 -0.935 18135 6760 1 8 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.422 -0.695 18135 6761 1 8 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.114 1.022 18135 6762 1 8 . 1 1 17 17 LEU H H 17 7.829 7.829 8.085 -0.256 18135 6763 1 8 . 1 1 18 18 LEU N N 18 118.280 118.280 118.776 -0.496 18135 6764 1 8 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.743 -0.237 18135 6765 1 8 . 1 1 18 18 LEU C C 18 175.739 175.739 178.561 -2.822 18135 6766 1 8 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.362 0.294 18135 6767 1 8 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.358 0.884 18135 6768 1 8 . 1 1 18 18 LEU H H 18 7.499 7.499 8.318 -0.819 18135 6769 1 8 . 1 1 19 19 ALA N N 19 121.961 121.961 120.785 1.176 18135 6770 1 8 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.144 -0.307 18135 6771 1 8 . 1 1 19 19 ALA C C 19 180.736 180.736 179.001 1.735 18135 6772 1 8 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.247 0.819 18135 6773 1 8 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.252 -1.175 18135 6774 1 8 . 1 1 19 19 ALA H H 19 7.950 7.950 7.830 0.120 18135 6775 1 8 . 1 1 20 20 GLN N N 20 118.605 118.605 116.072 2.533 18135 6776 1 8 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.176 -0.241 18135 6777 1 8 . 1 1 20 20 GLN C C 20 176.945 176.945 177.145 -0.200 18135 6778 1 8 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.593 0.422 18135 6779 1 8 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.067 -0.593 18135 6780 1 8 . 1 1 20 20 GLN H H 20 7.958 7.958 8.170 -0.212 18135 6781 1 8 . 1 1 21 21 MET N N 21 116.693 116.693 116.913 -0.220 18135 6782 1 8 . 1 1 21 21 MET HA H 21 3.861 3.861 4.424 -0.563 18135 6783 1 8 . 1 1 21 21 MET C C 21 174.671 174.671 175.849 -1.178 18135 6784 1 8 . 1 1 21 21 MET CA C 21 57.111 57.111 57.057 0.054 18135 6785 1 8 . 1 1 21 21 MET CB C 21 34.073 34.073 33.744 0.329 18135 6786 1 8 . 1 1 21 21 MET H H 21 7.420 7.420 7.606 -0.186 18135 6787 1 8 . 1 1 22 22 ARG N N 22 115.451 115.451 121.532 -6.081 18135 6788 1 8 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.462 0.391 18135 6789 1 8 . 1 1 22 22 ARG C C 22 175.950 175.950 174.523 1.427 18135 6790 1 8 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.493 2.959 18135 6791 1 8 . 1 1 22 22 ARG CB C 22 31.514 31.514 29.870 1.644 18135 6792 1 8 . 1 1 22 22 ARG H H 22 6.484 6.484 7.271 -0.787 18135 6793 1 8 . 1 1 23 23 LYS N N 23 128.593 128.593 127.645 0.948 18135 6794 1 8 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.583 -0.098 18135 6795 1 8 . 1 1 23 23 LYS C C 23 176.643 176.643 175.648 0.995 18135 6796 1 8 . 1 1 23 23 LYS CA C 23 57.287 57.287 56.074 1.213 18135 6797 1 8 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.174 4.087 18135 6798 1 8 . 1 1 23 23 LYS H H 23 10.212 10.212 8.661 1.551 18135 6799 1 8 . 1 1 24 24 ILE N N 24 118.605 118.605 122.057 -3.452 18135 6800 1 8 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.445 0.039 18135 6801 1 8 . 1 1 24 24 ILE C C 24 173.878 173.878 174.719 -0.841 18135 6802 1 8 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.619 -1.022 18135 6803 1 8 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.848 -0.392 18135 6804 1 8 . 1 1 24 24 ILE H H 24 8.465 8.465 8.352 0.113 18135 6805 1 8 . 1 1 25 25 SER N N 25 113.658 113.658 118.474 -4.816 18135 6806 1 8 . 1 1 25 25 SER HA H 25 4.481 4.481 4.847 -0.366 18135 6807 1 8 . 1 1 25 25 SER C C 25 176.359 176.359 175.592 0.767 18135 6808 1 8 . 1 1 25 25 SER CA C 25 56.975 56.975 56.650 0.325 18135 6809 1 8 . 1 1 25 25 SER CB C 25 64.759 64.759 63.761 0.998 18135 6810 1 8 . 1 1 25 25 SER H H 25 8.104 8.104 8.635 -0.531 18135 6811 1 8 . 1 1 26 26 LEU N N 26 127.566 127.566 126.533 1.033 18135 6812 1 8 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.296 -0.419 18135 6813 1 8 . 1 1 26 26 LEU C C 26 178.946 178.946 178.581 0.365 18135 6814 1 8 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.024 0.654 18135 6815 1 8 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.781 -0.062 18135 6816 1 8 . 1 1 26 26 LEU H H 26 8.802 8.802 9.154 -0.352 18135 6817 1 8 . 1 1 27 27 PHE N N 27 117.143 117.143 116.151 0.992 18135 6818 1 8 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.585 -0.347 18135 6819 1 8 . 1 1 27 27 PHE C C 27 177.067 177.067 177.124 -0.057 18135 6820 1 8 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.473 1.617 18135 6821 1 8 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.327 -0.065 18135 6822 1 8 . 1 1 27 27 PHE H H 27 7.986 7.986 8.191 -0.205 18135 6823 1 8 . 1 1 28 28 SER N N 28 115.200 115.200 115.808 -0.608 18135 6824 1 8 . 1 1 28 28 SER HA H 28 4.505 4.505 4.415 0.090 18135 6825 1 8 . 1 1 28 28 SER C C 28 174.533 174.533 174.335 0.198 18135 6826 1 8 . 1 1 28 28 SER CA C 28 59.447 59.447 60.351 -0.904 18135 6827 1 8 . 1 1 28 28 SER CB C 28 63.790 63.790 63.578 0.212 18135 6828 1 8 . 1 1 28 28 SER H H 28 7.929 7.929 8.065 -0.136 18135 6829 1 8 . 1 1 29 29 CYS N N 29 119.870 119.870 119.073 0.797 18135 6830 1 8 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.630 0.452 18135 6831 1 8 . 1 1 29 29 CYS C C 29 176.475 176.475 174.129 2.346 18135 6832 1 8 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.817 -5.387 18135 6833 1 8 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.093 10.149 18135 6834 1 8 . 1 1 29 29 CYS H H 29 7.865 7.865 7.725 0.140 18135 6835 1 8 . 1 1 30 30 LEU N N 30 122.259 122.259 123.482 -1.223 18135 6836 1 8 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.302 -0.341 18135 6837 1 8 . 1 1 30 30 LEU C C 30 179.774 179.774 178.331 1.443 18135 6838 1 8 . 1 1 30 30 LEU CA C 30 58.303 58.303 55.917 2.386 18135 6839 1 8 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.059 -0.483 18135 6840 1 8 . 1 1 30 30 LEU H H 30 7.812 7.812 8.456 -0.644 18135 6841 1 8 . 1 1 31 31 LYS N N 31 117.731 117.731 117.045 0.686 18135 6842 1 8 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.240 0.450 18135 6843 1 8 . 1 1 31 31 LYS C C 31 176.692 176.692 175.881 0.811 18135 6844 1 8 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.082 -3.005 18135 6845 1 8 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.821 -0.234 18135 6846 1 8 . 1 1 31 31 LYS H H 31 8.597 8.597 8.066 0.531 18135 6847 1 8 . 1 1 32 32 ASP N N 32 117.841 117.841 117.890 -0.049 18135 6848 1 8 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.690 0.004 18135 6849 1 8 . 1 1 32 32 ASP C C 32 175.505 175.505 175.837 -0.332 18135 6850 1 8 . 1 1 32 32 ASP CA C 32 54.088 54.088 53.938 0.150 18135 6851 1 8 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.619 -0.811 18135 6852 1 8 . 1 1 32 32 ASP H H 32 7.808 7.808 8.068 -0.260 18135 6853 1 8 . 1 1 33 33 ARG N N 33 120.876 120.876 120.463 0.413 18135 6854 1 8 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.085 -0.044 18135 6855 1 8 . 1 1 33 33 ARG C C 33 175.286 175.286 175.747 -0.461 18135 6856 1 8 . 1 1 33 33 ARG CA C 33 58.083 58.083 56.399 1.684 18135 6857 1 8 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.671 -0.658 18135 6858 1 8 . 1 1 33 33 ARG H H 33 7.378 7.378 7.265 0.113 18135 6859 1 8 . 1 1 34 34 HIS N N 34 120.555 120.555 116.146 4.409 18135 6860 1 8 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.389 -0.177 18135 6861 1 8 . 1 1 34 34 HIS C C 34 170.494 170.494 173.823 -3.329 18135 6862 1 8 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.009 -2.402 18135 6863 1 8 . 1 1 34 34 HIS CB C 34 31.488 31.488 27.467 4.021 18135 6864 1 8 . 1 1 34 34 HIS H H 34 7.974 7.974 8.658 -0.684 18135 6865 1 8 . 1 1 35 35 ASP N N 35 125.061 125.061 120.424 4.637 18135 6866 1 8 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.449 0.189 18135 6867 1 8 . 1 1 35 35 ASP C C 35 175.943 175.943 177.268 -1.325 18135 6868 1 8 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.058 -1.689 18135 6869 1 8 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.478 -1.116 18135 6870 1 8 . 1 1 35 35 ASP H H 35 7.805 7.805 8.347 -0.542 18135 6871 1 8 . 1 1 36 36 PHE N N 36 122.860 122.860 120.785 2.075 18135 6872 1 8 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.259 0.066 18135 6873 1 8 . 1 1 36 36 PHE C C 36 176.643 176.643 177.259 -0.616 18135 6874 1 8 . 1 1 36 36 PHE CA C 36 59.639 59.639 59.155 0.484 18135 6875 1 8 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.166 1.525 18135 6876 1 8 . 1 1 36 36 PHE H H 36 8.973 8.973 7.389 1.584 18135 6877 1 8 . 1 1 37 37 GLY N N 37 111.856 111.856 108.178 3.678 18135 6878 1 8 . 1 1 37 37 GLY C C 37 175.185 175.185 174.274 0.911 18135 6879 1 8 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.916 3.227 18135 6880 1 8 . 1 1 37 37 GLY H H 37 8.727 8.727 7.906 0.821 18135 6881 1 8 . 1 1 38 38 PHE N N 38 123.178 123.178 122.870 0.308 18135 6882 1 8 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.883 -0.969 18135 6883 1 8 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.497 2.307 18135 6884 1 8 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.806 -0.149 18135 6885 1 8 . 1 1 38 38 PHE H H 38 9.169 9.169 7.144 2.025 18135 6886 1 8 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.486 0.043 18135 6887 1 8 . 1 1 39 39 PRO C C 39 174.634 174.634 176.871 -2.237 18135 6888 1 8 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.748 -1.205 18135 6889 1 8 . 1 1 39 39 PRO CB C 39 28.704 28.704 31.241 -2.537 18135 6890 1 8 . 1 1 40 40 GLN N N 40 123.608 123.608 123.982 -0.374 18135 6891 1 8 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.292 -0.673 18135 6892 1 8 . 1 1 40 40 GLN C C 40 176.958 176.958 177.453 -0.495 18135 6893 1 8 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.628 -0.555 18135 6894 1 8 . 1 1 40 40 GLN CB C 40 28.817 28.817 28.005 0.812 18135 6895 1 8 . 1 1 40 40 GLN H H 40 7.966 7.966 8.265 -0.299 18135 6896 1 8 . 1 1 41 41 GLU N N 41 119.446 119.446 119.641 -0.195 18135 6897 1 8 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.053 0.084 18135 6898 1 8 . 1 1 41 41 GLU C C 41 177.346 177.346 177.748 -0.402 18135 6899 1 8 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.774 -0.845 18135 6900 1 8 . 1 1 41 41 GLU CB C 41 27.833 27.833 28.559 -0.726 18135 6901 1 8 . 1 1 41 41 GLU H H 41 9.044 9.044 8.794 0.250 18135 6902 1 8 . 1 1 42 42 GLU N N 42 117.196 117.196 117.657 -0.461 18135 6903 1 8 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.267 -0.204 18135 6904 1 8 . 1 1 42 42 GLU C C 42 174.886 174.886 177.219 -2.333 18135 6905 1 8 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.436 -1.052 18135 6906 1 8 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.787 -2.228 18135 6907 1 8 . 1 1 42 42 GLU H H 42 7.646 7.646 7.900 -0.254 18135 6908 1 8 . 1 1 43 43 PHE N N 43 115.527 115.527 121.006 -5.479 18135 6909 1 8 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.750 -0.264 18135 6910 1 8 . 1 1 43 43 PHE C C 43 175.615 175.615 175.794 -0.179 18135 6911 1 8 . 1 1 43 43 PHE CA C 43 57.548 57.548 57.875 -0.327 18135 6912 1 8 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.805 -0.912 18135 6913 1 8 . 1 1 43 43 PHE H H 43 7.601 7.601 7.588 0.013 18135 6914 1 8 . 1 1 44 44 GLY N N 44 107.243 107.243 109.825 -2.582 18135 6915 1 8 . 1 1 44 44 GLY C C 44 174.032 174.032 174.130 -0.098 18135 6916 1 8 . 1 1 44 44 GLY CA C 44 45.612 45.612 46.368 -0.756 18135 6917 1 8 . 1 1 44 44 GLY H H 44 7.733 7.733 7.945 -0.212 18135 6918 1 8 . 1 1 45 45 ASN N N 45 117.599 117.599 121.508 -3.909 18135 6919 1 8 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.708 -0.157 18135 6920 1 8 . 1 1 45 45 ASN C C 45 175.894 175.894 174.059 1.835 18135 6921 1 8 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.824 1.025 18135 6922 1 8 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.912 -1.493 18135 6923 1 8 . 1 1 45 45 ASN H H 45 8.343 8.343 7.564 0.779 18135 6924 1 8 . 1 1 46 46 GLN N N 46 118.916 118.916 117.174 1.742 18135 6925 1 8 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.496 -0.414 18135 6926 1 8 . 1 1 46 46 GLN C C 46 175.851 175.851 176.467 -0.616 18135 6927 1 8 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.517 1.129 18135 6928 1 8 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.813 -0.369 18135 6929 1 8 . 1 1 46 46 GLN H H 46 8.652 8.652 7.991 0.661 18135 6930 1 8 . 1 1 47 47 PHE N N 47 119.511 119.511 119.499 0.012 18135 6931 1 8 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.466 0.096 18135 6932 1 8 . 1 1 47 47 PHE C C 47 176.258 176.258 175.458 0.800 18135 6933 1 8 . 1 1 47 47 PHE CA C 47 57.920 57.920 59.027 -1.107 18135 6934 1 8 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.604 0.254 18135 6935 1 8 . 1 1 47 47 PHE H H 47 7.904 7.904 8.089 -0.185 18135 6936 1 8 . 1 1 48 48 GLN N N 48 120.127 120.127 117.493 2.634 18135 6937 1 8 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.509 -0.134 18135 6938 1 8 . 1 1 48 48 GLN C C 48 181.265 181.265 175.274 5.991 18135 6939 1 8 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.908 0.668 18135 6940 1 8 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.606 -1.138 18135 6941 1 8 . 1 1 48 48 GLN H H 48 8.255 8.255 7.996 0.259 18135 6942 1 8 . 1 1 49 49 LYS N N 49 121.777 121.777 123.510 -1.733 18135 6943 1 8 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.489 -0.386 18135 6944 1 8 . 1 1 49 49 LYS C C 49 177.968 177.968 177.681 0.287 18135 6945 1 8 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.025 0.124 18135 6946 1 8 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.160 0.230 18135 6947 1 8 . 1 1 49 49 LYS H H 49 8.426 8.426 8.693 -0.267 18135 6948 1 8 . 1 1 50 50 ALA N N 50 120.573 120.573 121.070 -0.497 18135 6949 1 8 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.264 -0.194 18135 6950 1 8 . 1 1 50 50 ALA C C 50 178.697 178.697 177.123 1.574 18135 6951 1 8 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.706 1.062 18135 6952 1 8 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.698 0.176 18135 6953 1 8 . 1 1 50 50 ALA H H 50 8.578 8.578 7.839 0.739 18135 6954 1 8 . 1 1 51 51 GLU N N 51 115.015 115.015 114.912 0.103 18135 6955 1 8 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.293 -0.027 18135 6956 1 8 . 1 1 51 51 GLU C C 51 176.995 176.995 176.595 0.400 18135 6957 1 8 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.117 -0.124 18135 6958 1 8 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.959 -1.054 18135 6959 1 8 . 1 1 51 51 GLU H H 51 7.907 7.907 8.310 -0.403 18135 6960 1 8 . 1 1 52 52 THR N N 52 111.210 111.210 115.443 -4.233 18135 6961 1 8 . 1 1 52 52 THR HA H 52 4.114 4.114 4.355 -0.241 18135 6962 1 8 . 1 1 52 52 THR C C 52 175.271 175.271 175.816 -0.545 18135 6963 1 8 . 1 1 52 52 THR CA C 52 63.611 63.611 65.523 -1.912 18135 6964 1 8 . 1 1 52 52 THR CB C 52 69.673 69.673 69.177 0.496 18135 6965 1 8 . 1 1 52 52 THR H H 52 7.863 7.863 7.176 0.687 18135 6966 1 8 . 1 1 53 53 ILE N N 53 119.113 119.113 121.959 -2.846 18135 6967 1 8 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.023 -0.159 18135 6968 1 8 . 1 1 53 53 ILE CA C 53 66.907 66.907 66.568 0.339 18135 6969 1 8 . 1 1 53 53 ILE CB C 53 34.953 34.953 35.982 -1.029 18135 6970 1 8 . 1 1 53 53 ILE H H 53 8.341 8.341 8.125 0.216 18135 6971 1 8 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.387 -0.101 18135 6972 1 8 . 1 1 54 54 PRO C C 54 179.655 179.655 178.939 0.716 18135 6973 1 8 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.226 -0.175 18135 6974 1 8 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.439 0.447 18135 6975 1 8 . 1 1 55 55 VAL N N 55 116.355 116.355 116.632 -0.277 18135 6976 1 8 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.902 -0.221 18135 6977 1 8 . 1 1 55 55 VAL C C 55 177.649 177.649 178.288 -0.639 18135 6978 1 8 . 1 1 55 55 VAL CA C 55 65.837 65.837 66.227 -0.390 18135 6979 1 8 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.237 0.234 18135 6980 1 8 . 1 1 55 55 VAL H H 55 7.119 7.119 7.469 -0.350 18135 6981 1 8 . 1 1 56 56 LEU N N 56 123.038 123.038 121.123 1.915 18135 6982 1 8 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.063 0.247 18135 6983 1 8 . 1 1 56 56 LEU C C 56 178.637 178.637 177.937 0.700 18135 6984 1 8 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.698 -0.612 18135 6985 1 8 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.522 0.796 18135 6986 1 8 . 1 1 56 56 LEU H H 56 8.535 8.535 8.461 0.074 18135 6987 1 8 . 1 1 57 57 HIS N N 57 117.041 117.041 118.955 -1.914 18135 6988 1 8 . 1 1 57 57 HIS HA H 57 3.786 3.786 3.971 -0.185 18135 6989 1 8 . 1 1 57 57 HIS C C 57 175.640 175.640 177.436 -1.796 18135 6990 1 8 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.562 0.969 18135 6991 1 8 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.104 -1.895 18135 6992 1 8 . 1 1 57 57 HIS H H 57 9.047 9.047 8.091 0.956 18135 6993 1 8 . 1 1 58 58 GLU N N 58 119.521 119.521 118.419 1.102 18135 6994 1 8 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.847 0.160 18135 6995 1 8 . 1 1 58 58 GLU C C 58 179.029 179.029 179.049 -0.020 18135 6996 1 8 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.184 -0.217 18135 6997 1 8 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.227 -0.937 18135 6998 1 8 . 1 1 58 58 GLU H H 58 7.860 7.860 8.264 -0.404 18135 6999 1 8 . 1 1 59 59 MET N N 59 119.512 119.512 119.155 0.357 18135 7000 1 8 . 1 1 59 59 MET HA H 59 4.074 4.074 4.118 -0.044 18135 7001 1 8 . 1 1 59 59 MET C C 59 177.031 177.031 179.023 -1.992 18135 7002 1 8 . 1 1 59 59 MET CA C 59 59.408 59.408 59.550 -0.142 18135 7003 1 8 . 1 1 59 59 MET CB C 59 32.525 32.525 32.767 -0.242 18135 7004 1 8 . 1 1 59 59 MET H H 59 8.442 8.442 7.992 0.451 18135 7005 1 8 . 1 1 60 60 ILE N N 60 117.183 117.183 117.815 -0.632 18135 7006 1 8 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.533 -0.116 18135 7007 1 8 . 1 1 60 60 ILE C C 60 177.524 177.524 178.176 -0.652 18135 7008 1 8 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.796 0.530 18135 7009 1 8 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.099 -0.239 18135 7010 1 8 . 1 1 60 60 ILE H H 60 8.338 8.338 7.867 0.471 18135 7011 1 8 . 1 1 61 61 GLN N N 61 120.191 120.191 120.228 -0.037 18135 7012 1 8 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.734 -0.032 18135 7013 1 8 . 1 1 61 61 GLN C C 61 178.270 178.270 177.773 0.497 18135 7014 1 8 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.149 -0.363 18135 7015 1 8 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.170 0.496 18135 7016 1 8 . 1 1 61 61 GLN H H 61 8.234 8.234 8.129 0.105 18135 7017 1 8 . 1 1 62 62 GLN N N 62 116.795 116.795 118.705 -1.910 18135 7018 1 8 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.253 0.374 18135 7019 1 8 . 1 1 62 62 GLN C C 62 179.685 179.685 178.387 1.298 18135 7020 1 8 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.146 -0.138 18135 7021 1 8 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.500 -3.158 18135 7022 1 8 . 1 1 62 62 GLN H H 62 8.421 8.421 8.007 0.414 18135 7023 1 8 . 1 1 63 63 ILE N N 63 122.797 122.797 120.109 2.688 18135 7024 1 8 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.865 -0.216 18135 7025 1 8 . 1 1 63 63 ILE C C 63 177.279 177.279 177.865 -0.586 18135 7026 1 8 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.592 2.373 18135 7027 1 8 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.795 -0.480 18135 7028 1 8 . 1 1 63 63 ILE H H 63 8.164 8.164 7.569 0.595 18135 7029 1 8 . 1 1 64 64 PHE N N 64 120.820 120.820 121.211 -0.391 18135 7030 1 8 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.429 -0.713 18135 7031 1 8 . 1 1 64 64 PHE C C 64 178.402 178.402 176.611 1.791 18135 7032 1 8 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.168 0.984 18135 7033 1 8 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.665 -0.155 18135 7034 1 8 . 1 1 64 64 PHE H H 64 8.405 8.405 7.967 0.438 18135 7035 1 8 . 1 1 65 65 ASN N N 65 119.981 119.981 118.208 1.773 18135 7036 1 8 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.780 0.282 18135 7037 1 8 . 1 1 65 65 ASN C C 65 177.944 177.944 177.625 0.319 18135 7038 1 8 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.196 -0.328 18135 7039 1 8 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.648 -1.392 18135 7040 1 8 . 1 1 65 65 ASN H H 65 8.812 8.812 7.959 0.853 18135 7041 1 8 . 1 1 66 66 LEU N N 66 121.533 121.533 121.094 0.439 18135 7042 1 8 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.226 -0.003 18135 7043 1 8 . 1 1 66 66 LEU C C 66 177.777 177.777 179.103 -1.326 18135 7044 1 8 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.819 0.449 18135 7045 1 8 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.112 0.495 18135 7046 1 8 . 1 1 66 66 LEU H H 66 8.177 8.177 7.981 0.196 18135 7047 1 8 . 1 1 67 67 PHE N N 67 110.842 110.842 113.798 -2.956 18135 7048 1 8 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.687 0.193 18135 7049 1 8 . 1 1 67 67 PHE C C 67 177.965 177.965 176.229 1.736 18135 7050 1 8 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.655 0.879 18135 7051 1 8 . 1 1 67 67 PHE CB C 67 38.616 38.616 39.104 -0.488 18135 7052 1 8 . 1 1 67 67 PHE H H 67 8.160 8.160 8.322 -0.162 18135 7053 1 8 . 1 1 68 68 SER N N 68 119.131 119.131 113.225 5.906 18135 7054 1 8 . 1 1 68 68 SER HA H 68 4.580 4.580 4.197 0.383 18135 7055 1 8 . 1 1 68 68 SER C C 68 173.472 173.472 174.766 -1.294 18135 7056 1 8 . 1 1 68 68 SER CA C 68 59.191 59.191 59.429 -0.238 18135 7057 1 8 . 1 1 68 68 SER CB C 68 63.123 63.123 63.330 -0.207 18135 7058 1 8 . 1 1 68 68 SER H H 68 8.016 8.016 7.413 0.603 18135 7059 1 8 . 1 1 69 69 THR N N 69 111.353 111.353 116.124 -4.771 18135 7060 1 8 . 1 1 69 69 THR HA H 69 4.345 4.345 4.475 -0.130 18135 7061 1 8 . 1 1 69 69 THR C C 69 175.661 175.661 175.109 0.552 18135 7062 1 8 . 1 1 69 69 THR CA C 69 61.411 61.411 61.437 -0.026 18135 7063 1 8 . 1 1 69 69 THR CB C 69 72.209 72.209 71.296 0.913 18135 7064 1 8 . 1 1 69 69 THR H H 69 6.977 6.977 7.368 -0.391 18135 7065 1 8 . 1 1 70 70 LYS N N 70 121.120 121.120 123.343 -2.223 18135 7066 1 8 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.123 -0.034 18135 7067 1 8 . 1 1 70 70 LYS C C 70 179.259 179.259 177.479 1.780 18135 7068 1 8 . 1 1 70 70 LYS CA C 70 57.956 57.956 59.135 -1.179 18135 7069 1 8 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.406 -0.656 18135 7070 1 8 . 1 1 70 70 LYS H H 70 9.065 9.065 8.609 0.456 18135 7071 1 8 . 1 1 71 71 ASP N N 71 116.374 116.374 119.484 -3.110 18135 7072 1 8 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.254 -0.079 18135 7073 1 8 . 1 1 71 71 ASP C C 71 178.372 178.372 177.058 1.314 18135 7074 1 8 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.418 -0.351 18135 7075 1 8 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.700 -0.395 18135 7076 1 8 . 1 1 71 71 ASP H H 71 7.518 7.518 7.819 -0.301 18135 7077 1 8 . 1 1 72 72 SER N N 72 117.341 117.341 113.597 3.744 18135 7078 1 8 . 1 1 72 72 SER HA H 72 3.715 3.715 3.135 0.580 18135 7079 1 8 . 1 1 72 72 SER C C 72 176.897 176.897 175.931 0.966 18135 7080 1 8 . 1 1 72 72 SER CA C 72 60.267 60.267 60.606 -0.339 18135 7081 1 8 . 1 1 72 72 SER CB C 72 62.616 62.616 62.779 -0.163 18135 7082 1 8 . 1 1 72 72 SER H H 72 8.066 8.066 7.707 0.359 18135 7083 1 8 . 1 1 73 73 SER N N 73 113.398 113.398 117.681 -4.283 18135 7084 1 8 . 1 1 73 73 SER HA H 73 4.094 4.094 4.195 -0.101 18135 7085 1 8 . 1 1 73 73 SER C C 73 174.855 174.855 175.256 -0.401 18135 7086 1 8 . 1 1 73 73 SER CA C 73 61.385 61.385 60.602 0.783 18135 7087 1 8 . 1 1 73 73 SER CB C 73 62.798 62.798 62.708 0.090 18135 7088 1 8 . 1 1 73 73 SER H H 73 7.982 7.982 7.596 0.386 18135 7089 1 8 . 1 1 74 74 ALA N N 74 119.486 119.486 120.480 -0.994 18135 7090 1 8 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.316 -0.159 18135 7091 1 8 . 1 1 74 74 ALA C C 74 177.626 177.626 177.418 0.208 18135 7092 1 8 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.375 0.338 18135 7093 1 8 . 1 1 74 74 ALA CB C 74 18.747 18.747 19.098 -0.351 18135 7094 1 8 . 1 1 74 74 ALA H H 74 7.095 7.095 7.407 -0.312 18135 7095 1 8 . 1 1 75 75 ALA N N 75 121.465 121.465 120.187 1.278 18135 7096 1 8 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.949 -0.253 18135 7097 1 8 . 1 1 75 75 ALA C C 75 177.197 177.197 176.140 1.057 18135 7098 1 8 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.957 1.047 18135 7099 1 8 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.998 -0.738 18135 7100 1 8 . 1 1 75 75 ALA H H 75 7.159 7.159 7.078 0.081 18135 7101 1 8 . 1 1 76 76 TRP N N 76 116.791 116.791 116.307 0.484 18135 7102 1 8 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.680 0.370 18135 7103 1 8 . 1 1 76 76 TRP C C 76 177.617 177.617 174.943 2.674 18135 7104 1 8 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.191 -1.872 18135 7105 1 8 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.192 1.885 18135 7106 1 8 . 1 1 76 76 TRP H H 76 7.080 7.080 7.191 -0.111 18135 7107 1 8 . 1 1 77 77 ASP N N 77 119.928 119.928 121.184 -1.256 18135 7108 1 8 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.525 -0.168 18135 7109 1 8 . 1 1 77 77 ASP C C 77 176.877 176.877 177.803 -0.926 18135 7110 1 8 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.092 -0.274 18135 7111 1 8 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.318 0.297 18135 7112 1 8 . 1 1 77 77 ASP H H 77 8.259 8.259 8.621 -0.362 18135 7113 1 8 . 1 1 78 78 GLU N N 78 127.277 127.277 127.374 -0.097 18135 7114 1 8 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.983 -0.098 18135 7115 1 8 . 1 1 78 78 GLU C C 78 177.439 177.439 178.345 -0.906 18135 7116 1 8 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.843 -0.459 18135 7117 1 8 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.249 -0.607 18135 7118 1 8 . 1 1 78 78 GLU H H 78 8.920 8.920 8.743 0.177 18135 7119 1 8 . 1 1 79 79 THR N N 79 115.422 115.422 116.225 -0.803 18135 7120 1 8 . 1 1 79 79 THR HA H 79 3.907 3.907 4.041 -0.134 18135 7121 1 8 . 1 1 79 79 THR C C 79 177.330 177.330 176.204 1.126 18135 7122 1 8 . 1 1 79 79 THR CA C 79 66.263 66.263 65.668 0.594 18135 7123 1 8 . 1 1 79 79 THR CB C 79 68.002 68.002 68.598 -0.596 18135 7124 1 8 . 1 1 79 79 THR H H 79 8.124 8.124 8.104 0.020 18135 7125 1 8 . 1 1 80 80 LEU N N 80 121.791 121.791 122.584 -0.793 18135 7126 1 8 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.113 -0.226 18135 7127 1 8 . 1 1 80 80 LEU C C 80 179.018 179.018 178.901 0.117 18135 7128 1 8 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.587 -0.348 18135 7129 1 8 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.279 0.373 18135 7130 1 8 . 1 1 80 80 LEU H H 80 7.725 7.725 7.720 0.005 18135 7131 1 8 . 1 1 81 81 LEU N N 81 119.280 119.280 120.732 -1.452 18135 7132 1 8 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.225 -0.736 18135 7133 1 8 . 1 1 81 81 LEU C C 81 177.062 177.062 178.956 -1.894 18135 7134 1 8 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.785 -1.076 18135 7135 1 8 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.014 -1.066 18135 7136 1 8 . 1 1 81 81 LEU H H 81 8.344 8.344 8.835 -0.490 18135 7137 1 8 . 1 1 82 82 ASP N N 82 115.357 115.357 119.952 -4.595 18135 7138 1 8 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.474 -0.200 18135 7139 1 8 . 1 1 82 82 ASP C C 82 179.018 179.018 178.992 0.026 18135 7140 1 8 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.313 -0.498 18135 7141 1 8 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.326 -2.105 18135 7142 1 8 . 1 1 82 82 ASP H H 82 8.001 8.001 8.577 -0.576 18135 7143 1 8 . 1 1 83 83 LYS N N 83 119.603 119.603 118.986 0.617 18135 7144 1 8 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.864 0.118 18135 7145 1 8 . 1 1 83 83 LYS C C 83 178.624 178.624 178.659 -0.035 18135 7146 1 8 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.725 1.020 18135 7147 1 8 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.296 0.810 18135 7148 1 8 . 1 1 83 83 LYS H H 83 7.342 7.342 7.740 -0.398 18135 7149 1 8 . 1 1 84 84 PHE N N 84 123.933 123.933 121.762 2.171 18135 7150 1 8 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.013 0.022 18135 7151 1 8 . 1 1 84 84 PHE C C 84 177.210 177.210 177.053 0.157 18135 7152 1 8 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.784 -1.441 18135 7153 1 8 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.895 0.421 18135 7154 1 8 . 1 1 84 84 PHE H H 84 8.471 8.471 8.504 -0.033 18135 7155 1 8 . 1 1 85 85 TYR N N 85 118.387 118.387 117.465 0.922 18135 7156 1 8 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.718 0.350 18135 7157 1 8 . 1 1 85 85 TYR C C 85 178.104 178.104 177.376 0.728 18135 7158 1 8 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.799 -1.222 18135 7159 1 8 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.177 -0.200 18135 7160 1 8 . 1 1 85 85 TYR H H 85 9.011 9.011 8.940 0.071 18135 7161 1 8 . 1 1 86 86 THR N N 86 114.035 114.035 115.884 -1.849 18135 7162 1 8 . 1 1 86 86 THR HA H 86 3.945 3.945 3.274 0.671 18135 7163 1 8 . 1 1 86 86 THR C C 86 176.708 176.708 176.557 0.151 18135 7164 1 8 . 1 1 86 86 THR CA C 86 66.759 66.759 66.349 0.410 18135 7165 1 8 . 1 1 86 86 THR CB C 86 68.853 68.853 67.725 1.128 18135 7166 1 8 . 1 1 86 86 THR H H 86 7.609 7.609 7.309 0.300 18135 7167 1 8 . 1 1 87 87 GLU N N 87 120.790 120.790 121.037 -0.247 18135 7168 1 8 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.966 0.081 18135 7169 1 8 . 1 1 87 87 GLU C C 87 179.606 179.606 178.654 0.952 18135 7170 1 8 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.136 -0.739 18135 7171 1 8 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.040 -0.754 18135 7172 1 8 . 1 1 87 87 GLU H H 87 7.712 7.712 7.615 0.097 18135 7173 1 8 . 1 1 88 88 LEU N N 88 120.729 120.729 119.972 0.757 18135 7174 1 8 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.900 -0.172 18135 7175 1 8 . 1 1 88 88 LEU C C 88 178.695 178.695 179.542 -0.847 18135 7176 1 8 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.347 0.903 18135 7177 1 8 . 1 1 88 88 LEU CB C 88 41.587 41.587 39.971 1.616 18135 7178 1 8 . 1 1 88 88 LEU H H 88 8.393 8.393 7.475 0.918 18135 7179 1 8 . 1 1 89 89 TYR N N 89 118.654 118.654 118.930 -0.276 18135 7180 1 8 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.082 -0.151 18135 7181 1 8 . 1 1 89 89 TYR C C 89 178.438 178.438 178.588 -0.150 18135 7182 1 8 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.213 0.194 18135 7183 1 8 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.434 0.432 18135 7184 1 8 . 1 1 89 89 TYR H H 89 8.637 8.637 8.227 0.410 18135 7185 1 8 . 1 1 90 90 GLN N N 90 118.263 118.263 116.988 1.275 18135 7186 1 8 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.976 0.010 18135 7187 1 8 . 1 1 90 90 GLN C C 90 178.411 178.411 178.590 -0.179 18135 7188 1 8 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.958 -0.176 18135 7189 1 8 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.492 -0.345 18135 7190 1 8 . 1 1 90 90 GLN H H 90 7.796 7.796 7.759 0.037 18135 7191 1 8 . 1 1 91 91 GLN N N 91 117.959 117.959 119.051 -1.092 18135 7192 1 8 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.048 0.034 18135 7193 1 8 . 1 1 91 91 GLN C C 91 178.705 178.705 178.761 -0.056 18135 7194 1 8 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.562 0.258 18135 7195 1 8 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.216 0.957 18135 7196 1 8 . 1 1 91 91 GLN H H 91 7.727 7.727 8.579 -0.852 18135 7197 1 8 . 1 1 92 92 LEU N N 92 119.965 119.965 118.324 1.641 18135 7198 1 8 . 1 1 92 92 LEU HA H 92 3.734 3.734 4.020 -0.286 18135 7199 1 8 . 1 1 92 92 LEU C C 92 178.984 178.984 178.670 0.314 18135 7200 1 8 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.656 -0.163 18135 7201 1 8 . 1 1 92 92 LEU CB C 92 41.379 41.379 41.056 0.323 18135 7202 1 8 . 1 1 92 92 LEU H H 92 8.465 8.465 8.486 -0.021 18135 7203 1 8 . 1 1 93 93 ASN N N 93 117.793 117.793 118.668 -0.875 18135 7204 1 8 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.350 0.051 18135 7205 1 8 . 1 1 93 93 ASN C C 93 178.309 178.309 177.148 1.161 18135 7206 1 8 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.064 0.339 18135 7207 1 8 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.316 0.322 18135 7208 1 8 . 1 1 93 93 ASN H H 93 8.091 8.091 7.891 0.200 18135 7209 1 8 . 1 1 94 94 ASP N N 94 121.133 121.133 121.031 0.102 18135 7210 1 8 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.377 0.028 18135 7211 1 8 . 1 1 94 94 ASP C C 94 178.328 178.328 178.802 -0.474 18135 7212 1 8 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.377 -0.830 18135 7213 1 8 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.817 -2.168 18135 7214 1 8 . 1 1 94 94 ASP H H 94 8.362 8.362 8.431 -0.069 18135 7215 1 8 . 1 1 95 95 LEU N N 95 119.160 119.160 120.594 -1.434 18135 7216 1 8 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.873 0.166 18135 7217 1 8 . 1 1 95 95 LEU C C 95 178.826 178.826 178.366 0.460 18135 7218 1 8 . 1 1 95 95 LEU CA C 95 57.027 57.027 57.976 -0.949 18135 7219 1 8 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.063 0.146 18135 7220 1 8 . 1 1 95 95 LEU H H 95 8.143 8.143 8.587 -0.444 18135 7221 1 8 . 1 1 96 96 GLU N N 96 118.813 118.813 119.095 -0.282 18135 7222 1 8 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.743 0.218 18135 7223 1 8 . 1 1 96 96 GLU C C 96 177.640 177.640 178.129 -0.489 18135 7224 1 8 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.349 -1.635 18135 7225 1 8 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.402 -1.264 18135 7226 1 8 . 1 1 96 96 GLU H H 96 8.111 8.111 7.795 0.316 18135 7227 1 8 . 1 1 97 97 ALA N N 97 120.549 120.549 121.375 -0.826 18135 7228 1 8 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.967 0.155 18135 7229 1 8 . 1 1 97 97 ALA C C 97 179.126 179.126 180.278 -1.152 18135 7230 1 8 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.774 -0.741 18135 7231 1 8 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.882 0.098 18135 7232 1 8 . 1 1 97 97 ALA H H 97 7.798 7.798 7.792 0.006 18135 7233 1 8 . 1 1 98 98 CYS N N 98 115.510 115.510 116.725 -1.215 18135 7234 1 8 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.133 0.317 18135 7235 1 8 . 1 1 98 98 CYS C C 98 175.363 175.363 176.112 -0.749 18135 7236 1 8 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.638 -5.472 18135 7237 1 8 . 1 1 98 98 CYS CB C 98 41.879 41.879 25.863 16.016 18135 7238 1 8 . 1 1 98 98 CYS H H 98 7.597 7.597 7.966 -0.369 18135 7239 1 8 . 1 1 99 99 VAL N N 99 121.713 121.713 119.079 2.634 18135 7240 1 8 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.927 -0.133 18135 7241 1 8 . 1 1 99 99 VAL C C 99 177.357 177.357 177.355 0.002 18135 7242 1 8 . 1 1 99 99 VAL CA C 99 64.583 64.583 64.871 -0.288 18135 7243 1 8 . 1 1 99 99 VAL CB C 99 32.031 32.031 31.970 0.061 18135 7244 1 8 . 1 1 99 99 VAL H H 99 7.828 7.828 7.427 0.401 18135 7245 1 8 . 1 1 100 100 ILE N N 100 122.333 122.333 117.995 4.338 18135 7246 1 8 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.738 0.186 18135 7247 1 8 . 1 1 100 100 ILE C C 100 176.827 176.827 176.964 -0.137 18135 7248 1 8 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.519 -1.281 18135 7249 1 8 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.576 0.702 18135 7250 1 8 . 1 1 100 100 ILE H H 100 8.067 8.067 8.208 -0.141 18135 7251 1 8 . 1 1 101 101 GLN N N 101 121.864 121.864 117.416 4.448 18135 7252 1 8 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.287 -0.061 18135 7253 1 8 . 1 1 101 101 GLN C C 101 176.438 176.438 177.960 -1.522 18135 7254 1 8 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.244 0.076 18135 7255 1 8 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.229 -0.218 18135 7256 1 8 . 1 1 101 101 GLN H H 101 8.062 8.062 7.431 0.631 18135 7257 1 8 . 1 1 102 102 GLY N N 102 109.288 109.288 106.994 2.294 18135 7258 1 8 . 1 1 102 102 GLY C C 102 173.855 173.855 175.364 -1.509 18135 7259 1 8 . 1 1 102 102 GLY CA C 102 45.159 45.159 45.660 -0.501 18135 7260 1 8 . 1 1 102 102 GLY H H 102 8.087 8.087 8.771 -0.684 18135 7261 1 8 . 1 1 103 103 VAL N N 103 118.932 118.932 118.520 0.412 18135 7262 1 8 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.896 0.178 18135 7263 1 8 . 1 1 103 103 VAL C C 103 176.299 176.299 175.643 0.656 18135 7264 1 8 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.267 -0.768 18135 7265 1 8 . 1 1 103 103 VAL CB C 103 32.854 32.854 32.112 0.742 18135 7266 1 8 . 1 1 103 103 VAL H H 103 8.079 8.079 7.721 0.358 18135 7267 1 8 . 1 1 104 104 GLY N N 104 112.028 112.028 107.343 4.685 18135 7268 1 8 . 1 1 104 104 GLY C C 104 173.694 173.694 173.391 0.303 18135 7269 1 8 . 1 1 104 104 GLY CA C 104 45.402 45.402 44.948 0.454 18135 7270 1 8 . 1 1 104 104 GLY H H 104 8.446 8.446 7.601 0.845 18135 7271 1 8 . 1 1 105 105 VAL N N 105 120.439 120.439 121.757 -1.318 18135 7272 1 8 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.419 -0.231 18135 7273 1 8 . 1 1 105 105 VAL C C 105 175.963 175.963 174.725 1.238 18135 7274 1 8 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.500 0.636 18135 7275 1 8 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.698 -1.884 18135 7276 1 8 . 1 1 105 105 VAL H H 105 7.867 7.867 8.035 -0.168 18135 7277 1 8 . 1 1 106 106 THR N N 106 116.366 116.366 114.152 2.214 18135 7278 1 8 . 1 1 106 106 THR HA H 106 4.548 4.548 4.586 -0.038 18135 7279 1 8 . 1 1 106 106 THR C C 106 173.731 173.731 173.642 0.089 18135 7280 1 8 . 1 1 106 106 THR CA C 106 59.419 59.419 61.032 -1.613 18135 7281 1 8 . 1 1 106 106 THR CB C 106 79.536 79.536 70.880 8.656 18135 7282 1 8 . 1 1 106 106 THR H H 106 8.565 8.565 8.211 0.354 18135 7283 1 8 . 1 1 107 107 GLU N N 107 119.743 119.743 122.767 -3.024 18135 7284 1 8 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.814 -0.352 18135 7285 1 8 . 1 1 107 107 GLU C C 107 175.639 175.639 175.967 -0.328 18135 7286 1 8 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.691 1.020 18135 7287 1 8 . 1 1 107 107 GLU CB C 107 30.499 30.499 33.028 -2.529 18135 7288 1 8 . 1 1 107 107 GLU H H 107 8.410 8.410 8.423 -0.013 18135 7289 1 8 . 1 1 108 108 THR N N 108 114.402 114.402 112.645 1.757 18135 7290 1 8 . 1 1 108 108 THR HA H 108 4.448 4.448 4.815 -0.367 18135 7291 1 8 . 1 1 108 108 THR CA C 108 60.348 60.348 59.172 1.176 18135 7292 1 8 . 1 1 108 108 THR CB C 108 68.544 68.544 69.002 -0.458 18135 7293 1 8 . 1 1 108 108 THR H H 108 8.155 8.155 8.366 -0.211 18135 7294 1 8 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.414 -0.176 18135 7295 1 8 . 1 1 109 109 PRO C C 109 178.666 178.666 177.437 1.229 18135 7296 1 8 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.182 1.194 18135 7297 1 8 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.871 -0.023 18135 7298 1 8 . 1 1 110 110 LEU N N 110 118.566 118.566 118.007 0.559 18135 7299 1 8 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.080 0.036 18135 7300 1 8 . 1 1 110 110 LEU C C 110 178.293 178.293 179.290 -0.997 18135 7301 1 8 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.608 -0.922 18135 7302 1 8 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.440 0.529 18135 7303 1 8 . 1 1 110 110 LEU H H 110 8.016 8.016 7.852 0.164 18135 7304 1 8 . 1 1 111 111 MET N N 111 118.982 118.982 116.020 2.962 18135 7305 1 8 . 1 1 111 111 MET HA H 111 4.210 4.210 4.276 -0.066 18135 7306 1 8 . 1 1 111 111 MET C C 111 178.720 178.720 177.912 0.808 18135 7307 1 8 . 1 1 111 111 MET CA C 111 58.144 58.144 57.460 0.684 18135 7308 1 8 . 1 1 111 111 MET CB C 111 32.374 32.374 32.357 0.017 18135 7309 1 8 . 1 1 111 111 MET H H 111 7.705 7.705 8.146 -0.441 18135 7310 1 8 . 1 1 112 112 LYS N N 112 121.377 121.377 119.351 2.026 18135 7311 1 8 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.245 -0.137 18135 7312 1 8 . 1 1 112 112 LYS C C 112 178.000 178.000 178.654 -0.654 18135 7313 1 8 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.378 -2.073 18135 7314 1 8 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.185 0.182 18135 7315 1 8 . 1 1 112 112 LYS H H 112 8.257 8.257 7.570 0.687 18135 7316 1 8 . 1 1 113 113 GLU N N 113 119.104 119.104 118.883 0.221 18135 7317 1 8 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.054 0.012 18135 7318 1 8 . 1 1 113 113 GLU C C 113 178.289 178.289 178.936 -0.647 18135 7319 1 8 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.163 -0.910 18135 7320 1 8 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.034 -0.896 18135 7321 1 8 . 1 1 113 113 GLU H H 113 8.270 8.270 7.769 0.501 18135 7322 1 8 . 1 1 114 114 ASP N N 114 119.224 119.224 119.811 -0.587 18135 7323 1 8 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.491 -0.203 18135 7324 1 8 . 1 1 114 114 ASP C C 114 178.365 178.365 178.222 0.143 18135 7325 1 8 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.459 -1.351 18135 7326 1 8 . 1 1 114 114 ASP CB C 114 38.235 38.235 41.054 -2.819 18135 7327 1 8 . 1 1 114 114 ASP H H 114 8.618 8.618 7.623 0.995 18135 7328 1 8 . 1 1 115 115 SER N N 115 118.195 118.195 116.937 1.258 18135 7329 1 8 . 1 1 115 115 SER HA H 115 4.200 4.200 4.145 0.055 18135 7330 1 8 . 1 1 115 115 SER C C 115 175.986 175.986 176.632 -0.646 18135 7331 1 8 . 1 1 115 115 SER CA C 115 61.588 61.588 61.725 -0.137 18135 7332 1 8 . 1 1 115 115 SER CB C 115 62.653 62.653 63.035 -0.382 18135 7333 1 8 . 1 1 115 115 SER H H 115 8.181 8.181 7.494 0.687 18135 7334 1 8 . 1 1 116 116 ILE N N 116 123.340 123.340 121.713 1.627 18135 7335 1 8 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.869 -0.243 18135 7336 1 8 . 1 1 116 116 ILE C C 116 178.367 178.367 178.009 0.358 18135 7337 1 8 . 1 1 116 116 ILE CA C 116 64.817 64.817 62.805 2.012 18135 7338 1 8 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.445 0.973 18135 7339 1 8 . 1 1 116 116 ILE H H 116 7.773 7.773 8.316 -0.543 18135 7340 1 8 . 1 1 117 117 LEU N N 117 120.968 120.968 121.345 -0.377 18135 7341 1 8 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.846 0.059 18135 7342 1 8 . 1 1 117 117 LEU C C 117 178.746 178.746 178.429 0.317 18135 7343 1 8 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.374 -0.231 18135 7344 1 8 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.603 -0.017 18135 7345 1 8 . 1 1 117 117 LEU H H 117 8.406 8.406 7.503 0.903 18135 7346 1 8 . 1 1 118 118 ALA N N 118 120.150 120.150 121.701 -1.551 18135 7347 1 8 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.754 0.358 18135 7348 1 8 . 1 1 118 118 ALA C C 118 181.633 181.633 178.761 2.872 18135 7349 1 8 . 1 1 118 118 ALA CA C 118 55.313 55.313 54.974 0.339 18135 7350 1 8 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.269 -0.159 18135 7351 1 8 . 1 1 118 118 ALA H H 118 7.894 7.894 8.095 -0.201 18135 7352 1 8 . 1 1 119 119 VAL N N 119 118.873 118.873 118.778 0.095 18135 7353 1 8 . 1 1 119 119 VAL HA H 119 3.755 3.755 2.953 0.802 18135 7354 1 8 . 1 1 119 119 VAL C C 119 177.896 177.896 178.101 -0.205 18135 7355 1 8 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.419 0.762 18135 7356 1 8 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.806 1.087 18135 7357 1 8 . 1 1 119 119 VAL H H 119 7.572 7.572 7.758 -0.186 18135 7358 1 8 . 1 1 120 120 ARG N N 120 121.436 121.436 118.413 3.023 18135 7359 1 8 . 1 1 120 120 ARG HA H 120 4.027 4.027 3.887 0.140 18135 7360 1 8 . 1 1 120 120 ARG C C 120 179.848 179.848 178.607 1.241 18135 7361 1 8 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.910 1.357 18135 7362 1 8 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.838 -0.143 18135 7363 1 8 . 1 1 120 120 ARG H H 120 8.629 8.629 8.356 0.273 18135 7364 1 8 . 1 1 121 121 LYS N N 121 119.589 119.589 120.165 -0.576 18135 7365 1 8 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.042 0.032 18135 7366 1 8 . 1 1 121 121 LYS C C 121 178.331 178.331 179.230 -0.899 18135 7367 1 8 . 1 1 121 121 LYS CA C 121 60.440 60.440 58.950 1.490 18135 7368 1 8 . 1 1 121 121 LYS CB C 121 32.107 32.107 31.869 0.238 18135 7369 1 8 . 1 1 121 121 LYS H H 121 9.015 9.015 7.846 1.169 18135 7370 1 8 . 1 1 122 122 TYR N N 122 121.546 121.546 118.584 2.962 18135 7371 1 8 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.205 0.127 18135 7372 1 8 . 1 1 122 122 TYR C C 122 176.527 176.527 178.474 -1.947 18135 7373 1 8 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.846 1.558 18135 7374 1 8 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.280 0.445 18135 7375 1 8 . 1 1 122 122 TYR H H 122 7.473 7.473 7.496 -0.023 18135 7376 1 8 . 1 1 123 123 PHE N N 123 116.026 116.026 120.020 -3.994 18135 7377 1 8 . 1 1 123 123 PHE HA H 123 3.740 3.740 4.059 -0.319 18135 7378 1 8 . 1 1 123 123 PHE C C 123 179.005 179.005 177.531 1.474 18135 7379 1 8 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.104 3.424 18135 7380 1 8 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.928 0.403 18135 7381 1 8 . 1 1 123 123 PHE H H 123 7.932 7.932 8.225 -0.293 18135 7382 1 8 . 1 1 124 124 GLN N N 124 123.043 123.043 118.358 4.685 18135 7383 1 8 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.517 0.662 18135 7384 1 8 . 1 1 124 124 GLN C C 124 178.772 178.772 178.870 -0.098 18135 7385 1 8 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.049 0.267 18135 7386 1 8 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.024 -0.393 18135 7387 1 8 . 1 1 124 124 GLN H H 124 8.470 8.470 8.423 0.047 18135 7388 1 8 . 1 1 125 125 ARG N N 125 120.342 120.342 118.664 1.678 18135 7389 1 8 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.192 -0.115 18135 7390 1 8 . 1 1 125 125 ARG C C 125 180.340 180.340 179.165 1.175 18135 7391 1 8 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.624 2.673 18135 7392 1 8 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.191 0.134 18135 7393 1 8 . 1 1 125 125 ARG H H 125 8.137 8.137 8.054 0.083 18135 7394 1 8 . 1 1 126 126 ILE N N 126 121.876 121.876 121.527 0.349 18135 7395 1 8 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.819 -0.468 18135 7396 1 8 . 1 1 126 126 ILE C C 126 176.857 176.857 177.656 -0.799 18135 7397 1 8 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.633 1.199 18135 7398 1 8 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.746 0.538 18135 7399 1 8 . 1 1 126 126 ILE H H 126 7.526 7.526 8.288 -0.762 18135 7400 1 8 . 1 1 127 127 THR N N 127 115.613 115.613 115.203 0.410 18135 7401 1 8 . 1 1 127 127 THR HA H 127 3.633 3.633 3.839 -0.206 18135 7402 1 8 . 1 1 127 127 THR C C 127 176.645 176.645 177.067 -0.422 18135 7403 1 8 . 1 1 127 127 THR CA C 127 67.294 67.294 66.603 0.691 18135 7404 1 8 . 1 1 127 127 THR CB C 127 68.871 68.871 68.869 0.002 18135 7405 1 8 . 1 1 127 127 THR H H 127 8.288 8.288 8.115 0.173 18135 7406 1 8 . 1 1 128 128 LEU N N 128 122.627 122.627 122.478 0.149 18135 7407 1 8 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.957 -0.001 18135 7408 1 8 . 1 1 128 128 LEU C C 128 178.331 178.331 177.844 0.487 18135 7409 1 8 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.857 0.231 18135 7410 1 8 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.218 0.356 18135 7411 1 8 . 1 1 128 128 LEU H H 128 8.263 8.263 7.912 0.351 18135 7412 1 8 . 1 1 129 129 TYR N N 129 120.955 120.955 120.290 0.665 18135 7413 1 8 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.097 -0.207 18135 7414 1 8 . 1 1 129 129 TYR C C 129 176.040 176.040 177.543 -1.503 18135 7415 1 8 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.205 0.288 18135 7416 1 8 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.118 0.807 18135 7417 1 8 . 1 1 129 129 TYR H H 129 7.518 7.518 8.316 -0.798 18135 7418 1 8 . 1 1 130 130 LEU N N 130 119.155 119.155 116.404 2.751 18135 7419 1 8 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.304 -0.459 18135 7420 1 8 . 1 1 130 130 LEU C C 130 177.948 177.948 178.374 -0.426 18135 7421 1 8 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.869 0.244 18135 7422 1 8 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.497 1.089 18135 7423 1 8 . 1 1 130 130 LEU H H 130 7.717 7.717 7.957 -0.240 18135 7424 1 8 . 1 1 131 131 LYS N N 131 116.832 116.832 120.100 -3.268 18135 7425 1 8 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.931 -0.523 18135 7426 1 8 . 1 1 131 131 LYS C C 131 181.265 181.265 179.738 1.527 18135 7427 1 8 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.771 -0.040 18135 7428 1 8 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.043 0.629 18135 7429 1 8 . 1 1 131 131 LYS H H 131 7.493 7.493 7.922 -0.429 18135 7430 1 8 . 1 1 132 132 GLU N N 132 121.918 121.918 119.790 2.128 18135 7431 1 8 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.103 -0.259 18135 7432 1 8 . 1 1 132 132 GLU C C 132 178.377 178.377 178.139 0.238 18135 7433 1 8 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.682 0.205 18135 7434 1 8 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.597 -0.930 18135 7435 1 8 . 1 1 132 132 GLU H H 132 8.430 8.430 8.021 0.409 18135 7436 1 8 . 1 1 133 133 LYS N N 133 116.079 116.079 116.053 0.026 18135 7437 1 8 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.304 -0.338 18135 7438 1 8 . 1 1 133 133 LYS C C 133 175.282 175.282 175.248 0.034 18135 7439 1 8 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.799 -0.501 18135 7440 1 8 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.917 0.081 18135 7441 1 8 . 1 1 133 133 LYS H H 133 7.390 7.390 7.378 0.012 18135 7442 1 8 . 1 1 134 134 LYS N N 134 117.759 117.759 114.972 2.787 18135 7443 1 8 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.058 -0.476 18135 7444 1 8 . 1 1 134 134 LYS C C 134 176.271 176.271 176.184 0.087 18135 7445 1 8 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.818 0.490 18135 7446 1 8 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.290 -0.488 18135 7447 1 8 . 1 1 134 134 LYS H H 134 7.716 7.716 7.482 0.234 18135 7448 1 8 . 1 1 135 135 TYR N N 135 110.598 110.598 113.361 -2.763 18135 7449 1 8 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.947 -1.070 18135 7450 1 8 . 1 1 135 135 TYR C C 135 174.148 174.148 175.398 -1.250 18135 7451 1 8 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.125 0.590 18135 7452 1 8 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.276 -0.570 18135 7453 1 8 . 1 1 135 135 TYR H H 135 8.428 8.428 8.974 -0.546 18135 7454 1 8 . 1 1 136 136 SER N N 136 113.712 113.712 115.416 -1.704 18135 7455 1 8 . 1 1 136 136 SER HA H 136 4.553 4.553 4.376 0.177 18135 7456 1 8 . 1 1 136 136 SER CA C 136 57.108 57.108 59.310 -2.202 18135 7457 1 8 . 1 1 136 136 SER CB C 136 62.500 62.500 64.070 -1.570 18135 7458 1 8 . 1 1 136 136 SER H H 136 6.744 6.744 7.395 -0.651 18135 7459 1 8 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.369 -0.204 18135 7460 1 8 . 1 1 137 137 PRO C C 137 180.675 180.675 177.457 3.218 18135 7461 1 8 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.757 0.900 18135 7462 1 8 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.873 0.110 18135 7463 1 8 . 1 1 138 138 CYS N N 138 113.914 113.914 115.757 -1.843 18135 7464 1 8 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.669 0.001 18135 7465 1 8 . 1 1 138 138 CYS C C 138 176.015 176.015 176.531 -0.516 18135 7466 1 8 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.683 -3.588 18135 7467 1 8 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.278 10.501 18135 7468 1 8 . 1 1 138 138 CYS H H 138 8.580 8.580 8.467 0.113 18135 7469 1 8 . 1 1 139 139 ALA N N 139 125.290 125.290 123.944 1.346 18135 7470 1 8 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.102 0.347 18135 7471 1 8 . 1 1 139 139 ALA C C 139 180.149 180.149 179.340 0.809 18135 7472 1 8 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.946 -0.168 18135 7473 1 8 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.149 0.769 18135 7474 1 8 . 1 1 139 139 ALA H H 139 8.087 8.087 8.062 0.025 18135 7475 1 8 . 1 1 140 140 TRP N N 140 116.599 116.599 118.684 -2.085 18135 7476 1 8 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.255 0.347 18135 7477 1 8 . 1 1 140 140 TRP C C 140 179.137 179.137 178.373 0.764 18135 7478 1 8 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.560 -1.026 18135 7479 1 8 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.330 -0.072 18135 7480 1 8 . 1 1 140 140 TRP H H 140 8.505 8.505 7.727 0.778 18135 7481 1 8 . 1 1 141 141 GLU N N 141 121.578 121.578 119.264 2.314 18135 7482 1 8 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.246 0.977 18135 7483 1 8 . 1 1 141 141 GLU C C 141 177.886 177.886 178.978 -1.092 18135 7484 1 8 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.946 -2.039 18135 7485 1 8 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.462 -0.745 18135 7486 1 8 . 1 1 141 141 GLU H H 141 8.182 8.182 8.140 0.042 18135 7487 1 8 . 1 1 142 142 VAL N N 142 121.202 121.202 119.683 1.519 18135 7488 1 8 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.634 -0.004 18135 7489 1 8 . 1 1 142 142 VAL C C 142 180.246 180.246 178.419 1.827 18135 7490 1 8 . 1 1 142 142 VAL CA C 142 66.983 66.983 67.180 -0.197 18135 7491 1 8 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.946 -0.124 18135 7492 1 8 . 1 1 142 142 VAL H H 142 8.623 8.623 7.995 0.628 18135 7493 1 8 . 1 1 143 143 VAL N N 143 120.119 120.119 120.572 -0.453 18135 7494 1 8 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.660 -0.363 18135 7495 1 8 . 1 1 143 143 VAL C C 143 176.407 176.407 178.242 -1.835 18135 7496 1 8 . 1 1 143 143 VAL CA C 143 67.978 67.978 67.095 0.883 18135 7497 1 8 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.638 0.017 18135 7498 1 8 . 1 1 143 143 VAL H H 143 8.323 8.323 8.487 -0.164 18135 7499 1 8 . 1 1 144 144 ARG N N 144 124.102 124.102 118.569 5.533 18135 7500 1 8 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.029 -0.332 18135 7501 1 8 . 1 1 144 144 ARG C C 144 178.127 178.127 178.705 -0.578 18135 7502 1 8 . 1 1 144 144 ARG CA C 144 61.001 61.001 57.811 3.190 18135 7503 1 8 . 1 1 144 144 ARG CB C 144 29.936 29.936 28.561 1.375 18135 7504 1 8 . 1 1 144 144 ARG H H 144 9.619 9.619 8.675 0.944 18135 7505 1 8 . 1 1 145 145 ALA N N 145 119.431 119.431 122.105 -2.674 18135 7506 1 8 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.064 -0.213 18135 7507 1 8 . 1 1 145 145 ALA C C 145 180.763 180.763 180.005 0.758 18135 7508 1 8 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.327 0.048 18135 7509 1 8 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.082 0.103 18135 7510 1 8 . 1 1 145 145 ALA H H 145 8.867 8.867 8.339 0.528 18135 7511 1 8 . 1 1 146 146 GLU N N 146 121.815 121.815 119.016 2.799 18135 7512 1 8 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.263 -0.052 18135 7513 1 8 . 1 1 146 146 GLU C C 146 177.296 177.296 179.049 -1.753 18135 7514 1 8 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.200 -0.821 18135 7515 1 8 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.608 -1.474 18135 7516 1 8 . 1 1 146 146 GLU H H 146 8.136 8.136 8.003 0.133 18135 7517 1 8 . 1 1 147 147 ILE N N 147 119.542 119.542 120.797 -1.255 18135 7518 1 8 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.754 0.216 18135 7519 1 8 . 1 1 147 147 ILE C C 147 178.283 178.283 178.310 -0.027 18135 7520 1 8 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.754 -3.501 18135 7521 1 8 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.534 -2.195 18135 7522 1 8 . 1 1 147 147 ILE H H 147 8.736 8.736 8.120 0.616 18135 7523 1 8 . 1 1 148 148 MET N N 148 119.501 119.501 118.651 0.850 18135 7524 1 8 . 1 1 148 148 MET HA H 148 3.801 3.801 4.152 -0.351 18135 7525 1 8 . 1 1 148 148 MET C C 148 178.210 178.210 178.669 -0.459 18135 7526 1 8 . 1 1 148 148 MET CA C 148 60.184 60.184 60.110 0.074 18135 7527 1 8 . 1 1 148 148 MET CB C 148 32.914 32.914 31.976 0.938 18135 7528 1 8 . 1 1 148 148 MET H H 148 8.440 8.440 8.452 -0.012 18135 7529 1 8 . 1 1 149 149 ARG N N 149 119.734 119.734 120.024 -0.290 18135 7530 1 8 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.103 -0.188 18135 7531 1 8 . 1 1 149 149 ARG C C 149 178.978 178.978 179.214 -0.236 18135 7532 1 8 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.446 0.417 18135 7533 1 8 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.750 0.530 18135 7534 1 8 . 1 1 149 149 ARG H H 149 7.648 7.648 8.411 -0.763 18135 7535 1 8 . 1 1 150 150 SER N N 150 118.109 118.109 115.543 2.566 18135 7536 1 8 . 1 1 150 150 SER HA H 150 3.339 3.339 4.066 -0.727 18135 7537 1 8 . 1 1 150 150 SER C C 150 177.292 177.292 176.121 1.171 18135 7538 1 8 . 1 1 150 150 SER CA C 150 61.316 61.316 61.815 -0.499 18135 7539 1 8 . 1 1 150 150 SER CB C 150 60.288 60.288 62.273 -1.986 18135 7540 1 8 . 1 1 150 150 SER H H 150 9.194 9.194 8.283 0.911 18135 7541 1 8 . 1 1 151 151 PHE N N 151 125.265 125.265 125.257 0.008 18135 7542 1 8 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.333 -0.297 18135 7543 1 8 . 1 1 151 151 PHE C C 151 178.696 178.696 177.647 1.049 18135 7544 1 8 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.851 1.569 18135 7545 1 8 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.657 0.229 18135 7546 1 8 . 1 1 151 151 PHE H H 151 9.455 9.455 8.434 1.021 18135 7547 1 8 . 1 1 152 152 SER N N 152 115.963 115.963 116.095 -0.132 18135 7548 1 8 . 1 1 152 152 SER HA H 152 3.880 3.880 3.866 0.014 18135 7549 1 8 . 1 1 152 152 SER C C 152 175.858 175.858 176.823 -0.965 18135 7550 1 8 . 1 1 152 152 SER CA C 152 62.388 62.388 61.535 0.854 18135 7551 1 8 . 1 1 152 152 SER CB C 152 62.519 62.519 63.378 -0.859 18135 7552 1 8 . 1 1 152 152 SER H H 152 7.839 7.839 8.628 -0.789 18135 7553 1 8 . 1 1 153 153 LEU N N 153 121.365 121.365 122.903 -1.538 18135 7554 1 8 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.134 -0.053 18135 7555 1 8 . 1 1 153 153 LEU C C 153 179.515 179.515 179.250 0.265 18135 7556 1 8 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.894 -0.011 18135 7557 1 8 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.884 0.458 18135 7558 1 8 . 1 1 153 153 LEU H H 153 7.775 7.775 8.087 -0.312 18135 7559 1 8 . 1 1 154 154 SER N N 154 113.950 113.950 114.161 -0.211 18135 7560 1 8 . 1 1 154 154 SER HA H 154 3.781 3.781 4.422 -0.641 18135 7561 1 8 . 1 1 154 154 SER C C 154 174.312 174.312 176.279 -1.967 18135 7562 1 8 . 1 1 154 154 SER CA C 154 61.366 61.366 61.736 -0.370 18135 7563 1 8 . 1 1 154 154 SER CB C 154 63.242 63.242 63.473 -0.231 18135 7564 1 8 . 1 1 154 154 SER H H 154 7.874 7.874 8.560 -0.686 18135 7565 1 8 . 1 1 155 155 THR N N 155 109.346 109.346 110.996 -1.650 18135 7566 1 8 . 1 1 155 155 THR HA H 155 4.060 4.060 4.377 -0.317 18135 7567 1 8 . 1 1 155 155 THR C C 155 174.798 174.798 176.237 -1.439 18135 7568 1 8 . 1 1 155 155 THR CA C 155 62.275 62.275 64.372 -2.097 18135 7569 1 8 . 1 1 155 155 THR CB C 155 69.342 69.342 69.061 0.281 18135 7570 1 8 . 1 1 155 155 THR H H 155 7.176 7.176 7.963 -0.787 18135 7571 1 8 . 1 1 156 156 ASN N N 156 119.785 119.785 120.384 -0.599 18135 7572 1 8 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.780 -0.253 18135 7573 1 8 . 1 1 156 156 ASN C C 156 175.528 175.528 175.070 0.458 18135 7574 1 8 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.577 1.360 18135 7575 1 8 . 1 1 156 156 ASN CB C 156 38.338 38.338 38.011 0.327 18135 7576 1 8 . 1 1 156 156 ASN H H 156 7.749 7.749 7.928 -0.179 18135 7577 1 8 . 1 1 157 157 LEU N N 157 120.552 120.552 121.490 -0.938 18135 7578 1 8 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.522 -0.267 18135 7579 1 8 . 1 1 157 157 LEU C C 157 174.702 174.702 178.211 -3.509 18135 7580 1 8 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.213 -0.539 18135 7581 1 8 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.215 0.137 18135 7582 1 8 . 1 1 157 157 LEU H H 157 8.097 8.097 7.764 0.333 18135 7583 1 8 . 1 1 158 158 GLN N N 158 119.860 119.860 118.532 1.328 18135 7584 1 8 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.234 -0.054 18135 7585 1 8 . 1 1 158 158 GLN C C 158 176.434 176.434 175.806 0.628 18135 7586 1 8 . 1 1 158 158 GLN CA C 158 56.897 56.897 56.006 0.891 18135 7587 1 8 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.568 -0.558 18135 7588 1 8 . 1 1 158 158 GLN H H 158 8.230 8.230 8.182 0.047 18135 7589 1 8 . 1 1 159 159 GLU N N 159 120.461 120.461 116.445 4.016 18135 7590 1 8 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.980 0.239 18135 7591 1 8 . 1 1 159 159 GLU C C 159 175.251 175.251 175.304 -0.053 18135 7592 1 8 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.425 -0.730 18135 7593 1 8 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.658 0.323 18135 7594 1 8 . 1 1 159 159 GLU H H 159 8.300 8.300 8.742 -0.443 18135 7595 1 8 . 1 1 160 160 SER N N 160 115.719 115.719 111.559 4.160 18135 7596 1 8 . 1 1 160 160 SER HA H 160 4.372 4.372 4.620 -0.248 18135 7597 1 8 . 1 1 160 160 SER C C 160 174.188 174.188 174.425 -0.237 18135 7598 1 8 . 1 1 160 160 SER CA C 160 58.481 58.481 58.265 0.216 18135 7599 1 8 . 1 1 160 160 SER CB C 160 63.731 63.731 63.654 0.077 18135 7600 1 8 . 1 1 160 160 SER H H 160 8.113 8.113 8.395 -0.282 18135 7601 1 8 . 1 1 161 161 LEU N N 161 123.794 123.794 122.293 1.501 18135 7602 1 8 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.349 -0.069 18135 7603 1 8 . 1 1 161 161 LEU C C 161 177.293 177.293 176.914 0.379 18135 7604 1 8 . 1 1 161 161 LEU CA C 161 55.190 55.190 56.907 -1.716 18135 7605 1 8 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.321 -0.037 18135 7606 1 8 . 1 1 161 161 LEU H H 161 8.032 8.032 7.788 0.244 18135 7607 1 8 . 1 1 162 162 ARG N N 162 120.715 120.715 120.546 0.169 18135 7608 1 8 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.535 -0.366 18135 7609 1 8 . 1 1 162 162 ARG C C 162 176.288 176.288 175.644 0.644 18135 7610 1 8 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.423 1.623 18135 7611 1 8 . 1 1 162 162 ARG CB C 162 30.935 30.935 29.491 1.444 18135 7612 1 8 . 1 1 162 162 ARG H H 162 8.094 8.094 8.375 -0.281 18135 7613 1 8 . 1 1 163 163 SER N N 163 116.670 116.670 115.802 0.868 18135 7614 1 8 . 1 1 163 163 SER HA H 163 4.372 4.372 4.931 -0.559 18135 7615 1 8 . 1 1 163 163 SER C C 163 174.184 174.184 174.864 -0.680 18135 7616 1 8 . 1 1 163 163 SER CA C 163 58.481 58.481 57.825 0.656 18135 7617 1 8 . 1 1 163 163 SER CB C 163 63.745 63.745 65.045 -1.300 18135 7618 1 8 . 1 1 163 163 SER H H 163 8.191 8.191 8.163 0.028 18135 7619 1 8 . 1 1 164 164 LYS N N 164 123.100 123.100 119.618 3.482 18135 7620 1 8 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.073 0.204 18135 7621 1 8 . 1 1 164 164 LYS C C 164 175.617 175.617 176.706 -1.089 18135 7622 1 8 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.753 -1.440 18135 7623 1 8 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.250 0.715 18135 7624 1 8 . 1 1 164 164 LYS H H 164 8.251 8.251 8.433 -0.182 18135 7625 1 9 . 1 1 2 2 ASP N N 2 125.691 125.691 120.036 5.655 18135 7626 1 9 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.596 0.114 18135 7627 1 9 . 1 1 2 2 ASP C C 2 174.758 174.758 176.031 -1.273 18135 7628 1 9 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.221 -1.378 18135 7629 1 9 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.127 -1.806 18135 7630 1 9 . 1 1 2 2 ASP H H 2 8.773 8.773 8.436 0.337 18135 7631 1 9 . 1 1 3 3 LEU N N 3 123.957 123.957 117.889 6.068 18135 7632 1 9 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.296 0.105 18135 7633 1 9 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.733 0.920 18135 7634 1 9 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.520 0.035 18135 7635 1 9 . 1 1 3 3 LEU H H 3 8.164 8.164 7.381 0.783 18135 7636 1 9 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.478 -0.164 18135 7637 1 9 . 1 1 4 4 PRO C C 4 176.213 176.213 176.503 -0.290 18135 7638 1 9 . 1 1 4 4 PRO CA C 4 63.908 63.908 62.938 0.970 18135 7639 1 9 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.659 1.235 18135 7640 1 9 . 1 1 5 5 GLN N N 5 121.621 121.621 121.962 -0.341 18135 7641 1 9 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.128 0.098 18135 7642 1 9 . 1 1 5 5 GLN C C 5 176.995 176.995 176.640 0.355 18135 7643 1 9 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.352 -1.642 18135 7644 1 9 . 1 1 5 5 GLN CB C 5 28.951 28.951 28.948 0.003 18135 7645 1 9 . 1 1 5 5 GLN H H 5 8.767 8.767 8.676 0.091 18135 7646 1 9 . 1 1 6 6 THR N N 6 111.419 111.419 111.475 -0.056 18135 7647 1 9 . 1 1 6 6 THR HA H 6 4.135 4.135 4.433 -0.298 18135 7648 1 9 . 1 1 6 6 THR C C 6 174.695 174.695 175.543 -0.848 18135 7649 1 9 . 1 1 6 6 THR CA C 6 62.661 62.661 63.359 -0.699 18135 7650 1 9 . 1 1 6 6 THR CB C 6 69.365 69.365 68.453 0.912 18135 7651 1 9 . 1 1 6 6 THR H H 6 7.865 7.865 8.518 -0.653 18135 7652 1 9 . 1 1 7 7 HIS N N 7 119.137 119.137 119.861 -0.724 18135 7653 1 9 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.649 -0.064 18135 7654 1 9 . 1 1 7 7 HIS C C 7 174.980 174.980 175.422 -0.442 18135 7655 1 9 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.412 -2.408 18135 7656 1 9 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.639 -1.476 18135 7657 1 9 . 1 1 7 7 HIS H H 7 8.567 8.567 8.573 -0.006 18135 7658 1 9 . 1 1 8 8 SER N N 8 115.796 115.796 113.625 2.171 18135 7659 1 9 . 1 1 8 8 SER HA H 8 4.363 4.363 4.439 -0.076 18135 7660 1 9 . 1 1 8 8 SER C C 8 175.312 175.312 175.608 -0.296 18135 7661 1 9 . 1 1 8 8 SER CA C 8 58.969 58.969 61.061 -2.092 18135 7662 1 9 . 1 1 8 8 SER CB C 8 63.439 63.439 64.340 -0.901 18135 7663 1 9 . 1 1 8 8 SER H H 8 8.180 8.180 7.952 0.228 18135 7664 1 9 . 1 1 9 9 LEU N N 9 123.844 123.844 118.964 4.880 18135 7665 1 9 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.610 -0.455 18135 7666 1 9 . 1 1 9 9 LEU C C 9 178.568 178.568 178.289 0.279 18135 7667 1 9 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.839 0.127 18135 7668 1 9 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.276 -0.480 18135 7669 1 9 . 1 1 9 9 LEU H H 9 8.404 8.404 7.700 0.704 18135 7670 1 9 . 1 1 10 10 GLY N N 10 107.582 107.582 108.067 -0.485 18135 7671 1 9 . 1 1 10 10 GLY C C 10 174.586 174.586 175.283 -0.697 18135 7672 1 9 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.592 -0.687 18135 7673 1 9 . 1 1 10 10 GLY H H 10 8.438 8.438 8.701 -0.263 18135 7674 1 9 . 1 1 11 11 SER N N 11 118.806 118.806 117.584 1.222 18135 7675 1 9 . 1 1 11 11 SER HA H 11 4.156 4.156 4.162 -0.006 18135 7676 1 9 . 1 1 11 11 SER C C 11 175.749 175.749 176.301 -0.552 18135 7677 1 9 . 1 1 11 11 SER CA C 11 61.299 61.299 61.894 -0.595 18135 7678 1 9 . 1 1 11 11 SER CB C 11 62.653 62.653 62.437 0.216 18135 7679 1 9 . 1 1 11 11 SER H H 11 8.249 8.249 8.236 0.013 18135 7680 1 9 . 1 1 12 12 ARG N N 12 121.986 121.986 122.414 -0.428 18135 7681 1 9 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.061 -0.107 18135 7682 1 9 . 1 1 12 12 ARG C C 12 178.283 178.283 178.243 0.040 18135 7683 1 9 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.865 0.965 18135 7684 1 9 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.290 -0.706 18135 7685 1 9 . 1 1 12 12 ARG H H 12 8.027 8.027 7.936 0.091 18135 7686 1 9 . 1 1 13 13 ARG N N 13 119.432 119.432 118.728 0.704 18135 7687 1 9 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.070 -0.231 18135 7688 1 9 . 1 1 13 13 ARG C C 13 178.480 178.480 178.478 0.002 18135 7689 1 9 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.727 0.764 18135 7690 1 9 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.935 0.147 18135 7691 1 9 . 1 1 13 13 ARG H H 13 8.437 8.437 8.054 0.383 18135 7692 1 9 . 1 1 14 14 THR N N 14 116.879 116.879 117.282 -0.403 18135 7693 1 9 . 1 1 14 14 THR HA H 14 3.532 3.532 4.129 -0.597 18135 7694 1 9 . 1 1 14 14 THR C C 14 175.584 175.584 176.714 -1.130 18135 7695 1 9 . 1 1 14 14 THR CA C 14 68.036 68.036 67.573 0.463 18135 7696 1 9 . 1 1 14 14 THR CB C 14 67.969 67.969 68.762 -0.793 18135 7697 1 9 . 1 1 14 14 THR H H 14 7.957 7.957 8.205 -0.248 18135 7698 1 9 . 1 1 15 15 LEU N N 15 120.252 120.252 122.559 -2.307 18135 7699 1 9 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.981 -0.035 18135 7700 1 9 . 1 1 15 15 LEU C C 15 178.652 178.652 178.781 -0.129 18135 7701 1 9 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.384 -0.296 18135 7702 1 9 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.824 -0.270 18135 7703 1 9 . 1 1 15 15 LEU H H 15 7.550 7.550 8.102 -0.552 18135 7704 1 9 . 1 1 16 16 MET N N 16 118.788 118.788 117.875 0.913 18135 7705 1 9 . 1 1 16 16 MET HA H 16 4.023 4.023 4.024 -0.001 18135 7706 1 9 . 1 1 16 16 MET C C 16 178.718 178.718 178.487 0.231 18135 7707 1 9 . 1 1 16 16 MET CA C 16 58.513 58.513 59.531 -1.018 18135 7708 1 9 . 1 1 16 16 MET CB C 16 32.150 32.150 32.574 -0.424 18135 7709 1 9 . 1 1 16 16 MET H H 16 7.985 7.985 8.367 -0.382 18135 7710 1 9 . 1 1 17 17 LEU N N 17 120.644 120.644 120.115 0.529 18135 7711 1 9 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.922 0.050 18135 7712 1 9 . 1 1 17 17 LEU C C 17 178.238 178.238 179.343 -1.105 18135 7713 1 9 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.196 -0.469 18135 7714 1 9 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.672 0.463 18135 7715 1 9 . 1 1 17 17 LEU H H 17 7.829 7.829 8.377 -0.548 18135 7716 1 9 . 1 1 18 18 LEU N N 18 118.280 118.280 118.784 -0.504 18135 7717 1 9 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.729 -0.223 18135 7718 1 9 . 1 1 18 18 LEU C C 18 175.739 175.739 178.339 -2.600 18135 7719 1 9 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.451 0.205 18135 7720 1 9 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.438 0.804 18135 7721 1 9 . 1 1 18 18 LEU H H 18 7.499 7.499 8.193 -0.694 18135 7722 1 9 . 1 1 19 19 ALA N N 19 121.961 121.961 121.202 0.759 18135 7723 1 9 . 1 1 19 19 ALA HA H 19 3.837 3.837 3.989 -0.152 18135 7724 1 9 . 1 1 19 19 ALA C C 19 180.736 180.736 180.054 0.682 18135 7725 1 9 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.624 0.442 18135 7726 1 9 . 1 1 19 19 ALA CB C 19 18.077 18.077 18.754 -0.677 18135 7727 1 9 . 1 1 19 19 ALA H H 19 7.950 7.950 7.824 0.126 18135 7728 1 9 . 1 1 20 20 GLN N N 20 118.605 118.605 117.391 1.214 18135 7729 1 9 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.030 -0.095 18135 7730 1 9 . 1 1 20 20 GLN C C 20 176.945 176.945 177.296 -0.351 18135 7731 1 9 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.638 0.377 18135 7732 1 9 . 1 1 20 20 GLN CB C 20 28.474 28.474 28.319 0.155 18135 7733 1 9 . 1 1 20 20 GLN H H 20 7.958 7.958 8.411 -0.453 18135 7734 1 9 . 1 1 21 21 MET N N 21 116.693 116.693 119.455 -2.762 18135 7735 1 9 . 1 1 21 21 MET HA H 21 3.861 3.861 4.133 -0.272 18135 7736 1 9 . 1 1 21 21 MET C C 21 174.671 174.671 175.044 -0.373 18135 7737 1 9 . 1 1 21 21 MET CA C 21 57.111 57.111 57.458 -0.347 18135 7738 1 9 . 1 1 21 21 MET CB C 21 34.073 34.073 33.093 0.980 18135 7739 1 9 . 1 1 21 21 MET H H 21 7.420 7.420 7.674 -0.254 18135 7740 1 9 . 1 1 22 22 ARG N N 22 115.451 115.451 118.475 -3.024 18135 7741 1 9 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.585 0.268 18135 7742 1 9 . 1 1 22 22 ARG C C 22 175.950 175.950 175.269 0.681 18135 7743 1 9 . 1 1 22 22 ARG CA C 22 58.452 58.452 54.394 4.058 18135 7744 1 9 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.389 1.125 18135 7745 1 9 . 1 1 22 22 ARG H H 22 6.484 6.484 7.162 -0.678 18135 7746 1 9 . 1 1 23 23 LYS N N 23 128.593 128.593 124.180 4.413 18135 7747 1 9 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.567 -0.082 18135 7748 1 9 . 1 1 23 23 LYS C C 23 176.643 176.643 174.878 1.765 18135 7749 1 9 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.809 1.478 18135 7750 1 9 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.277 4.984 18135 7751 1 9 . 1 1 23 23 LYS H H 23 10.212 10.212 8.760 1.452 18135 7752 1 9 . 1 1 24 24 ILE N N 24 118.605 118.605 122.518 -3.913 18135 7753 1 9 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.348 0.136 18135 7754 1 9 . 1 1 24 24 ILE C C 24 173.878 173.878 174.296 -0.418 18135 7755 1 9 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.979 -1.382 18135 7756 1 9 . 1 1 24 24 ILE CB C 24 41.456 41.456 40.624 0.832 18135 7757 1 9 . 1 1 24 24 ILE H H 24 8.465 8.465 8.443 0.022 18135 7758 1 9 . 1 1 25 25 SER N N 25 113.658 113.658 118.225 -4.567 18135 7759 1 9 . 1 1 25 25 SER HA H 25 4.481 4.481 4.960 -0.479 18135 7760 1 9 . 1 1 25 25 SER C C 25 176.359 176.359 175.870 0.489 18135 7761 1 9 . 1 1 25 25 SER CA C 25 56.975 56.975 57.192 -0.217 18135 7762 1 9 . 1 1 25 25 SER CB C 25 64.759 64.759 63.677 1.082 18135 7763 1 9 . 1 1 25 25 SER H H 25 8.104 8.104 8.530 -0.426 18135 7764 1 9 . 1 1 26 26 LEU N N 26 127.566 127.566 124.978 2.588 18135 7765 1 9 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.269 -0.392 18135 7766 1 9 . 1 1 26 26 LEU C C 26 178.946 178.946 177.604 1.342 18135 7767 1 9 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.250 0.428 18135 7768 1 9 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.829 -0.110 18135 7769 1 9 . 1 1 26 26 LEU H H 26 8.802 8.802 8.974 -0.172 18135 7770 1 9 . 1 1 27 27 PHE N N 27 117.143 117.143 117.486 -0.343 18135 7771 1 9 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.516 -0.278 18135 7772 1 9 . 1 1 27 27 PHE C C 27 177.067 177.067 176.881 0.186 18135 7773 1 9 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.834 1.256 18135 7774 1 9 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.267 -0.005 18135 7775 1 9 . 1 1 27 27 PHE H H 27 7.986 7.986 8.028 -0.042 18135 7776 1 9 . 1 1 28 28 SER N N 28 115.200 115.200 116.257 -1.057 18135 7777 1 9 . 1 1 28 28 SER HA H 28 4.505 4.505 4.400 0.105 18135 7778 1 9 . 1 1 28 28 SER C C 28 174.533 174.533 174.923 -0.390 18135 7779 1 9 . 1 1 28 28 SER CA C 28 59.447 59.447 60.637 -1.190 18135 7780 1 9 . 1 1 28 28 SER CB C 28 63.790 63.790 63.600 0.190 18135 7781 1 9 . 1 1 28 28 SER H H 28 7.929 7.929 8.170 -0.241 18135 7782 1 9 . 1 1 29 29 CYS N N 29 119.870 119.870 120.116 -0.246 18135 7783 1 9 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.662 0.420 18135 7784 1 9 . 1 1 29 29 CYS C C 29 176.475 176.475 174.374 2.101 18135 7785 1 9 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.514 -5.084 18135 7786 1 9 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.353 9.889 18135 7787 1 9 . 1 1 29 29 CYS H H 29 7.865 7.865 7.793 0.072 18135 7788 1 9 . 1 1 30 30 LEU N N 30 122.259 122.259 123.655 -1.396 18135 7789 1 9 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.159 -0.198 18135 7790 1 9 . 1 1 30 30 LEU C C 30 179.774 179.774 177.785 1.989 18135 7791 1 9 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.391 1.912 18135 7792 1 9 . 1 1 30 30 LEU CB C 30 41.576 41.576 41.706 -0.130 18135 7793 1 9 . 1 1 30 30 LEU H H 30 7.812 7.812 8.539 -0.727 18135 7794 1 9 . 1 1 31 31 LYS N N 31 117.731 117.731 114.768 2.963 18135 7795 1 9 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.202 0.488 18135 7796 1 9 . 1 1 31 31 LYS C C 31 176.692 176.692 176.256 0.436 18135 7797 1 9 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.639 -3.562 18135 7798 1 9 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.301 -0.714 18135 7799 1 9 . 1 1 31 31 LYS H H 31 8.597 8.597 8.226 0.371 18135 7800 1 9 . 1 1 32 32 ASP N N 32 117.841 117.841 118.061 -0.220 18135 7801 1 9 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.583 0.111 18135 7802 1 9 . 1 1 32 32 ASP C C 32 175.505 175.505 176.617 -1.112 18135 7803 1 9 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.199 -0.111 18135 7804 1 9 . 1 1 32 32 ASP CB C 32 41.808 41.808 41.488 0.320 18135 7805 1 9 . 1 1 32 32 ASP H H 32 7.808 7.808 7.724 0.084 18135 7806 1 9 . 1 1 33 33 ARG N N 33 120.876 120.876 117.778 3.098 18135 7807 1 9 . 1 1 33 33 ARG HA H 33 4.041 4.041 3.872 0.169 18135 7808 1 9 . 1 1 33 33 ARG C C 33 175.286 175.286 175.220 0.066 18135 7809 1 9 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.439 -0.356 18135 7810 1 9 . 1 1 33 33 ARG CB C 33 30.013 30.013 29.815 0.198 18135 7811 1 9 . 1 1 33 33 ARG H H 33 7.378 7.378 7.546 -0.168 18135 7812 1 9 . 1 1 34 34 HIS N N 34 120.555 120.555 112.148 8.407 18135 7813 1 9 . 1 1 34 34 HIS HA H 34 4.212 4.212 5.397 -1.185 18135 7814 1 9 . 1 1 34 34 HIS C C 34 170.494 170.494 173.847 -3.353 18135 7815 1 9 . 1 1 34 34 HIS CA C 34 54.607 54.607 53.233 1.374 18135 7816 1 9 . 1 1 34 34 HIS CB C 34 31.488 31.488 31.782 -0.294 18135 7817 1 9 . 1 1 34 34 HIS H H 34 7.974 7.974 7.080 0.894 18135 7818 1 9 . 1 1 35 35 ASP N N 35 125.061 125.061 122.414 2.647 18135 7819 1 9 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.497 0.141 18135 7820 1 9 . 1 1 35 35 ASP C C 35 175.943 175.943 177.015 -1.072 18135 7821 1 9 . 1 1 35 35 ASP CA C 35 52.369 52.369 55.004 -2.635 18135 7822 1 9 . 1 1 35 35 ASP CB C 35 40.362 40.362 42.131 -1.769 18135 7823 1 9 . 1 1 35 35 ASP H H 35 7.805 7.805 8.181 -0.376 18135 7824 1 9 . 1 1 36 36 PHE N N 36 122.860 122.860 119.956 2.904 18135 7825 1 9 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.297 0.028 18135 7826 1 9 . 1 1 36 36 PHE C C 36 176.643 176.643 177.534 -0.891 18135 7827 1 9 . 1 1 36 36 PHE CA C 36 59.639 59.639 59.502 0.137 18135 7828 1 9 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.190 1.501 18135 7829 1 9 . 1 1 36 36 PHE H H 36 8.973 8.973 7.238 1.735 18135 7830 1 9 . 1 1 37 37 GLY N N 37 111.856 111.856 107.266 4.590 18135 7831 1 9 . 1 1 37 37 GLY C C 37 175.185 175.185 173.335 1.850 18135 7832 1 9 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.707 3.436 18135 7833 1 9 . 1 1 37 37 GLY H H 37 8.727 8.727 8.524 0.203 18135 7834 1 9 . 1 1 38 38 PHE N N 38 123.178 123.178 120.226 2.952 18135 7835 1 9 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.784 -0.870 18135 7836 1 9 . 1 1 38 38 PHE CA C 38 55.804 55.804 52.627 3.178 18135 7837 1 9 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.278 0.379 18135 7838 1 9 . 1 1 38 38 PHE H H 38 9.169 9.169 7.241 1.928 18135 7839 1 9 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.435 0.094 18135 7840 1 9 . 1 1 39 39 PRO C C 39 174.634 174.634 177.024 -2.390 18135 7841 1 9 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.670 -1.127 18135 7842 1 9 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.810 -2.106 18135 7843 1 9 . 1 1 40 40 GLN N N 40 123.608 123.608 123.331 0.277 18135 7844 1 9 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.256 -0.637 18135 7845 1 9 . 1 1 40 40 GLN C C 40 176.958 176.958 177.444 -0.486 18135 7846 1 9 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.648 -0.575 18135 7847 1 9 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.920 0.897 18135 7848 1 9 . 1 1 40 40 GLN H H 40 7.966 7.966 8.294 -0.328 18135 7849 1 9 . 1 1 41 41 GLU N N 41 119.446 119.446 119.756 -0.310 18135 7850 1 9 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.062 0.075 18135 7851 1 9 . 1 1 41 41 GLU C C 41 177.346 177.346 178.279 -0.933 18135 7852 1 9 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.039 -1.110 18135 7853 1 9 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.034 -1.201 18135 7854 1 9 . 1 1 41 41 GLU H H 41 9.044 9.044 8.761 0.283 18135 7855 1 9 . 1 1 42 42 GLU N N 42 117.196 117.196 117.600 -0.404 18135 7856 1 9 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.251 -0.188 18135 7857 1 9 . 1 1 42 42 GLU C C 42 174.886 174.886 177.988 -3.102 18135 7858 1 9 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.565 -1.181 18135 7859 1 9 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.744 -2.186 18135 7860 1 9 . 1 1 42 42 GLU H H 42 7.646 7.646 7.906 -0.260 18135 7861 1 9 . 1 1 43 43 PHE N N 43 115.527 115.527 121.262 -5.735 18135 7862 1 9 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.596 -0.110 18135 7863 1 9 . 1 1 43 43 PHE C C 43 175.615 175.615 175.881 -0.266 18135 7864 1 9 . 1 1 43 43 PHE CA C 43 57.548 57.548 59.139 -1.591 18135 7865 1 9 . 1 1 43 43 PHE CB C 43 39.893 39.893 39.974 -0.081 18135 7866 1 9 . 1 1 43 43 PHE H H 43 7.601 7.601 7.852 -0.251 18135 7867 1 9 . 1 1 44 44 GLY N N 44 107.243 107.243 109.306 -2.063 18135 7868 1 9 . 1 1 44 44 GLY C C 44 174.032 174.032 173.538 0.494 18135 7869 1 9 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.004 0.608 18135 7870 1 9 . 1 1 44 44 GLY H H 44 7.733 7.733 7.695 0.038 18135 7871 1 9 . 1 1 45 45 ASN N N 45 117.599 117.599 116.091 1.508 18135 7872 1 9 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.519 0.032 18135 7873 1 9 . 1 1 45 45 ASN C C 45 175.894 175.894 175.018 0.876 18135 7874 1 9 . 1 1 45 45 ASN CA C 45 53.849 53.849 54.764 -0.915 18135 7875 1 9 . 1 1 45 45 ASN CB C 45 38.419 38.419 38.282 0.137 18135 7876 1 9 . 1 1 45 45 ASN H H 45 8.343 8.343 8.636 -0.293 18135 7877 1 9 . 1 1 46 46 GLN N N 46 118.916 118.916 114.658 4.258 18135 7878 1 9 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.331 -0.249 18135 7879 1 9 . 1 1 46 46 GLN C C 46 175.851 175.851 174.738 1.113 18135 7880 1 9 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.291 1.355 18135 7881 1 9 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.771 0.673 18135 7882 1 9 . 1 1 46 46 GLN H H 46 8.652 8.652 8.144 0.508 18135 7883 1 9 . 1 1 47 47 PHE N N 47 119.511 119.511 118.988 0.523 18135 7884 1 9 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.431 0.131 18135 7885 1 9 . 1 1 47 47 PHE C C 47 176.258 176.258 175.478 0.780 18135 7886 1 9 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.918 -0.998 18135 7887 1 9 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.155 0.703 18135 7888 1 9 . 1 1 47 47 PHE H H 47 7.904 7.904 8.236 -0.332 18135 7889 1 9 . 1 1 48 48 GLN N N 48 120.127 120.127 117.594 2.533 18135 7890 1 9 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.515 -0.140 18135 7891 1 9 . 1 1 48 48 GLN C C 48 181.265 181.265 176.450 4.815 18135 7892 1 9 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.403 1.173 18135 7893 1 9 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.632 -0.164 18135 7894 1 9 . 1 1 48 48 GLN H H 48 8.255 8.255 7.917 0.338 18135 7895 1 9 . 1 1 49 49 LYS N N 49 121.777 121.777 121.003 0.774 18135 7896 1 9 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.420 -0.317 18135 7897 1 9 . 1 1 49 49 LYS C C 49 177.968 177.968 177.220 0.748 18135 7898 1 9 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.145 0.004 18135 7899 1 9 . 1 1 49 49 LYS CB C 49 32.390 32.390 31.705 0.685 18135 7900 1 9 . 1 1 49 49 LYS H H 49 8.426 8.426 8.603 -0.177 18135 7901 1 9 . 1 1 50 50 ALA N N 50 120.573 120.573 119.584 0.989 18135 7902 1 9 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.332 -0.262 18135 7903 1 9 . 1 1 50 50 ALA C C 50 178.697 178.697 177.271 1.426 18135 7904 1 9 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.123 1.645 18135 7905 1 9 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.862 0.012 18135 7906 1 9 . 1 1 50 50 ALA H H 50 8.578 8.578 7.745 0.833 18135 7907 1 9 . 1 1 51 51 GLU N N 51 115.015 115.015 115.506 -0.491 18135 7908 1 9 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.269 -0.003 18135 7909 1 9 . 1 1 51 51 GLU C C 51 176.995 176.995 176.577 0.418 18135 7910 1 9 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.474 -0.481 18135 7911 1 9 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.914 -1.009 18135 7912 1 9 . 1 1 51 51 GLU H H 51 7.907 7.907 8.330 -0.423 18135 7913 1 9 . 1 1 52 52 THR N N 52 111.210 111.210 114.678 -3.468 18135 7914 1 9 . 1 1 52 52 THR HA H 52 4.114 4.114 4.302 -0.188 18135 7915 1 9 . 1 1 52 52 THR C C 52 175.271 175.271 175.703 -0.432 18135 7916 1 9 . 1 1 52 52 THR CA C 52 63.611 63.611 64.996 -1.385 18135 7917 1 9 . 1 1 52 52 THR CB C 52 69.673 69.673 68.516 1.157 18135 7918 1 9 . 1 1 52 52 THR H H 52 7.863 7.863 7.608 0.255 18135 7919 1 9 . 1 1 53 53 ILE N N 53 119.113 119.113 121.416 -2.303 18135 7920 1 9 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.067 -0.203 18135 7921 1 9 . 1 1 53 53 ILE CA C 53 66.907 66.907 66.320 0.587 18135 7922 1 9 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.240 -1.287 18135 7923 1 9 . 1 1 53 53 ILE H H 53 8.341 8.341 8.252 0.089 18135 7924 1 9 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.568 -0.282 18135 7925 1 9 . 1 1 54 54 PRO C C 54 179.655 179.655 179.157 0.498 18135 7926 1 9 . 1 1 54 54 PRO CA C 54 66.051 66.051 65.879 0.172 18135 7927 1 9 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.447 0.438 18135 7928 1 9 . 1 1 55 55 VAL N N 55 116.355 116.355 116.304 0.051 18135 7929 1 9 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.940 -0.259 18135 7930 1 9 . 1 1 55 55 VAL C C 55 177.649 177.649 178.082 -0.433 18135 7931 1 9 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.536 0.301 18135 7932 1 9 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.609 0.862 18135 7933 1 9 . 1 1 55 55 VAL H H 55 7.119 7.119 7.552 -0.433 18135 7934 1 9 . 1 1 56 56 LEU N N 56 123.038 123.038 121.703 1.335 18135 7935 1 9 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.063 0.247 18135 7936 1 9 . 1 1 56 56 LEU C C 56 178.637 178.637 177.712 0.925 18135 7937 1 9 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.428 -0.342 18135 7938 1 9 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.426 0.892 18135 7939 1 9 . 1 1 56 56 LEU H H 56 8.535 8.535 8.565 -0.030 18135 7940 1 9 . 1 1 57 57 HIS N N 57 117.041 117.041 118.285 -1.244 18135 7941 1 9 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.011 -0.225 18135 7942 1 9 . 1 1 57 57 HIS C C 57 175.640 175.640 177.231 -1.591 18135 7943 1 9 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.844 0.687 18135 7944 1 9 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.236 -2.027 18135 7945 1 9 . 1 1 57 57 HIS H H 57 9.047 9.047 8.140 0.907 18135 7946 1 9 . 1 1 58 58 GLU N N 58 119.521 119.521 118.630 0.891 18135 7947 1 9 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.857 0.150 18135 7948 1 9 . 1 1 58 58 GLU C C 58 179.029 179.029 178.764 0.265 18135 7949 1 9 . 1 1 58 58 GLU CA C 58 58.967 58.967 58.886 0.081 18135 7950 1 9 . 1 1 58 58 GLU CB C 58 28.290 28.290 28.861 -0.571 18135 7951 1 9 . 1 1 58 58 GLU H H 58 7.860 7.860 8.193 -0.333 18135 7952 1 9 . 1 1 59 59 MET N N 59 119.512 119.512 120.161 -0.649 18135 7953 1 9 . 1 1 59 59 MET HA H 59 4.074 4.074 4.250 -0.176 18135 7954 1 9 . 1 1 59 59 MET C C 59 177.031 177.031 178.728 -1.697 18135 7955 1 9 . 1 1 59 59 MET CA C 59 59.408 59.408 59.339 0.069 18135 7956 1 9 . 1 1 59 59 MET CB C 59 32.525 32.525 32.751 -0.225 18135 7957 1 9 . 1 1 59 59 MET H H 59 8.442 8.442 7.992 0.450 18135 7958 1 9 . 1 1 60 60 ILE N N 60 117.183 117.183 118.179 -0.996 18135 7959 1 9 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.461 -0.044 18135 7960 1 9 . 1 1 60 60 ILE C C 60 177.524 177.524 178.148 -0.624 18135 7961 1 9 . 1 1 60 60 ILE CA C 60 65.326 65.326 65.018 0.308 18135 7962 1 9 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.214 -0.354 18135 7963 1 9 . 1 1 60 60 ILE H H 60 8.338 8.338 7.721 0.617 18135 7964 1 9 . 1 1 61 61 GLN N N 61 120.191 120.191 119.755 0.436 18135 7965 1 9 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.914 -0.212 18135 7966 1 9 . 1 1 61 61 GLN C C 61 178.270 178.270 177.768 0.502 18135 7967 1 9 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.469 -0.683 18135 7968 1 9 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.253 0.413 18135 7969 1 9 . 1 1 61 61 GLN H H 61 8.234 8.234 8.204 0.030 18135 7970 1 9 . 1 1 62 62 GLN N N 62 116.795 116.795 118.938 -2.143 18135 7971 1 9 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.229 0.398 18135 7972 1 9 . 1 1 62 62 GLN C C 62 179.685 179.685 178.285 1.400 18135 7973 1 9 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.384 -0.376 18135 7974 1 9 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.816 -3.474 18135 7975 1 9 . 1 1 62 62 GLN H H 62 8.421 8.421 8.154 0.267 18135 7976 1 9 . 1 1 63 63 ILE N N 63 122.797 122.797 120.035 2.762 18135 7977 1 9 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.854 -0.205 18135 7978 1 9 . 1 1 63 63 ILE C C 63 177.279 177.279 177.831 -0.552 18135 7979 1 9 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.812 2.153 18135 7980 1 9 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.802 -0.487 18135 7981 1 9 . 1 1 63 63 ILE H H 63 8.164 8.164 7.558 0.606 18135 7982 1 9 . 1 1 64 64 PHE N N 64 120.820 120.820 121.198 -0.378 18135 7983 1 9 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.493 -0.777 18135 7984 1 9 . 1 1 64 64 PHE C C 64 178.402 178.402 177.002 1.400 18135 7985 1 9 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.206 0.945 18135 7986 1 9 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.431 0.079 18135 7987 1 9 . 1 1 64 64 PHE H H 64 8.405 8.405 7.903 0.502 18135 7988 1 9 . 1 1 65 65 ASN N N 65 119.981 119.981 118.211 1.770 18135 7989 1 9 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.489 0.574 18135 7990 1 9 . 1 1 65 65 ASN C C 65 177.944 177.944 177.143 0.801 18135 7991 1 9 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.963 -0.095 18135 7992 1 9 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.004 -0.748 18135 7993 1 9 . 1 1 65 65 ASN H H 65 8.812 8.812 7.692 1.120 18135 7994 1 9 . 1 1 66 66 LEU N N 66 121.533 121.533 119.739 1.794 18135 7995 1 9 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.159 0.064 18135 7996 1 9 . 1 1 66 66 LEU C C 66 177.777 177.777 179.360 -1.583 18135 7997 1 9 . 1 1 66 66 LEU CA C 66 58.268 58.268 58.057 0.211 18135 7998 1 9 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.569 0.038 18135 7999 1 9 . 1 1 66 66 LEU H H 66 8.177 8.177 7.693 0.484 18135 8000 1 9 . 1 1 67 67 PHE N N 67 110.842 110.842 114.575 -3.733 18135 8001 1 9 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.590 0.290 18135 8002 1 9 . 1 1 67 67 PHE C C 67 177.965 177.965 176.484 1.481 18135 8003 1 9 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.593 0.941 18135 8004 1 9 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.739 -0.123 18135 8005 1 9 . 1 1 67 67 PHE H H 67 8.160 8.160 8.566 -0.406 18135 8006 1 9 . 1 1 68 68 SER N N 68 119.131 119.131 113.084 6.047 18135 8007 1 9 . 1 1 68 68 SER HA H 68 4.580 4.580 4.475 0.105 18135 8008 1 9 . 1 1 68 68 SER C C 68 173.472 173.472 174.786 -1.314 18135 8009 1 9 . 1 1 68 68 SER CA C 68 59.191 59.191 58.731 0.460 18135 8010 1 9 . 1 1 68 68 SER CB C 68 63.123 63.123 63.897 -0.774 18135 8011 1 9 . 1 1 68 68 SER H H 68 8.016 8.016 7.780 0.236 18135 8012 1 9 . 1 1 69 69 THR N N 69 111.353 111.353 115.652 -4.299 18135 8013 1 9 . 1 1 69 69 THR HA H 69 4.345 4.345 4.491 -0.146 18135 8014 1 9 . 1 1 69 69 THR C C 69 175.661 175.661 174.335 1.326 18135 8015 1 9 . 1 1 69 69 THR CA C 69 61.411 61.411 60.706 0.705 18135 8016 1 9 . 1 1 69 69 THR CB C 69 72.209 72.209 70.594 1.615 18135 8017 1 9 . 1 1 69 69 THR H H 69 6.977 6.977 7.430 -0.453 18135 8018 1 9 . 1 1 70 70 LYS N N 70 121.120 121.120 122.551 -1.431 18135 8019 1 9 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.163 -0.074 18135 8020 1 9 . 1 1 70 70 LYS C C 70 179.259 179.259 177.717 1.542 18135 8021 1 9 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.746 -0.790 18135 8022 1 9 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.215 -0.465 18135 8023 1 9 . 1 1 70 70 LYS H H 70 9.065 9.065 8.594 0.471 18135 8024 1 9 . 1 1 71 71 ASP N N 71 116.374 116.374 120.280 -3.906 18135 8025 1 9 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.288 -0.113 18135 8026 1 9 . 1 1 71 71 ASP C C 71 178.372 178.372 177.155 1.217 18135 8027 1 9 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.089 -0.022 18135 8028 1 9 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.348 -0.042 18135 8029 1 9 . 1 1 71 71 ASP H H 71 7.518 7.518 7.836 -0.318 18135 8030 1 9 . 1 1 72 72 SER N N 72 117.341 117.341 115.070 2.271 18135 8031 1 9 . 1 1 72 72 SER HA H 72 3.715 3.715 3.368 0.347 18135 8032 1 9 . 1 1 72 72 SER C C 72 176.897 176.897 176.342 0.555 18135 8033 1 9 . 1 1 72 72 SER CA C 72 60.267 60.267 60.644 -0.377 18135 8034 1 9 . 1 1 72 72 SER CB C 72 62.616 62.616 63.166 -0.550 18135 8035 1 9 . 1 1 72 72 SER H H 72 8.066 8.066 7.986 0.080 18135 8036 1 9 . 1 1 73 73 SER N N 73 113.398 113.398 118.890 -5.492 18135 8037 1 9 . 1 1 73 73 SER HA H 73 4.094 4.094 4.091 0.003 18135 8038 1 9 . 1 1 73 73 SER C C 73 174.855 174.855 174.672 0.183 18135 8039 1 9 . 1 1 73 73 SER CA C 73 61.385 61.385 61.052 0.333 18135 8040 1 9 . 1 1 73 73 SER CB C 73 62.798 62.798 63.239 -0.440 18135 8041 1 9 . 1 1 73 73 SER H H 73 7.982 7.982 7.668 0.314 18135 8042 1 9 . 1 1 74 74 ALA N N 74 119.486 119.486 119.613 -0.127 18135 8043 1 9 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.200 -0.043 18135 8044 1 9 . 1 1 74 74 ALA C C 74 177.626 177.626 176.970 0.656 18135 8045 1 9 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.468 0.245 18135 8046 1 9 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.762 -0.014 18135 8047 1 9 . 1 1 74 74 ALA H H 74 7.095 7.095 7.712 -0.617 18135 8048 1 9 . 1 1 75 75 ALA N N 75 121.465 121.465 121.657 -0.192 18135 8049 1 9 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.791 -0.095 18135 8050 1 9 . 1 1 75 75 ALA C C 75 177.197 177.197 175.871 1.326 18135 8051 1 9 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.860 1.144 18135 8052 1 9 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.283 -1.023 18135 8053 1 9 . 1 1 75 75 ALA H H 75 7.159 7.159 7.575 -0.416 18135 8054 1 9 . 1 1 76 76 TRP N N 76 116.791 116.791 116.988 -0.197 18135 8055 1 9 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.727 0.323 18135 8056 1 9 . 1 1 76 76 TRP C C 76 177.617 177.617 174.894 2.723 18135 8057 1 9 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.242 -1.923 18135 8058 1 9 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.806 2.270 18135 8059 1 9 . 1 1 76 76 TRP H H 76 7.080 7.080 7.146 -0.066 18135 8060 1 9 . 1 1 77 77 ASP N N 77 119.928 119.928 120.968 -1.040 18135 8061 1 9 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.511 -0.154 18135 8062 1 9 . 1 1 77 77 ASP C C 77 176.877 176.877 177.873 -0.996 18135 8063 1 9 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.238 -0.420 18135 8064 1 9 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.285 0.330 18135 8065 1 9 . 1 1 77 77 ASP H H 77 8.259 8.259 8.966 -0.707 18135 8066 1 9 . 1 1 78 78 GLU N N 78 127.277 127.277 126.392 0.885 18135 8067 1 9 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.954 -0.069 18135 8068 1 9 . 1 1 78 78 GLU C C 78 177.439 177.439 177.986 -0.547 18135 8069 1 9 . 1 1 78 78 GLU CA C 78 59.384 59.384 60.339 -0.955 18135 8070 1 9 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.029 -0.387 18135 8071 1 9 . 1 1 78 78 GLU H H 78 8.920 8.920 8.902 0.018 18135 8072 1 9 . 1 1 79 79 THR N N 79 115.422 115.422 116.721 -1.299 18135 8073 1 9 . 1 1 79 79 THR HA H 79 3.907 3.907 4.103 -0.196 18135 8074 1 9 . 1 1 79 79 THR C C 79 177.330 177.330 176.136 1.194 18135 8075 1 9 . 1 1 79 79 THR CA C 79 66.263 66.263 65.476 0.787 18135 8076 1 9 . 1 1 79 79 THR CB C 79 68.002 68.002 68.077 -0.075 18135 8077 1 9 . 1 1 79 79 THR H H 79 8.124 8.124 8.271 -0.147 18135 8078 1 9 . 1 1 80 80 LEU N N 80 121.791 121.791 122.247 -0.456 18135 8079 1 9 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.095 -0.208 18135 8080 1 9 . 1 1 80 80 LEU C C 80 179.018 179.018 178.451 0.567 18135 8081 1 9 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.273 -0.034 18135 8082 1 9 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.008 0.644 18135 8083 1 9 . 1 1 80 80 LEU H H 80 7.725 7.725 7.892 -0.167 18135 8084 1 9 . 1 1 81 81 LEU N N 81 119.280 119.280 120.433 -1.153 18135 8085 1 9 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.234 -0.745 18135 8086 1 9 . 1 1 81 81 LEU C C 81 177.062 177.062 178.812 -1.750 18135 8087 1 9 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.803 -1.094 18135 8088 1 9 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.091 -1.143 18135 8089 1 9 . 1 1 81 81 LEU H H 81 8.344 8.344 8.726 -0.382 18135 8090 1 9 . 1 1 82 82 ASP N N 82 115.357 115.357 119.731 -4.374 18135 8091 1 9 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.396 -0.122 18135 8092 1 9 . 1 1 82 82 ASP C C 82 179.018 179.018 178.408 0.610 18135 8093 1 9 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.676 -0.861 18135 8094 1 9 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.934 -2.713 18135 8095 1 9 . 1 1 82 82 ASP H H 82 8.001 8.001 8.560 -0.559 18135 8096 1 9 . 1 1 83 83 LYS N N 83 119.603 119.603 119.179 0.424 18135 8097 1 9 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.858 0.124 18135 8098 1 9 . 1 1 83 83 LYS C C 83 178.624 178.624 178.945 -0.321 18135 8099 1 9 . 1 1 83 83 LYS CA C 83 59.745 59.745 59.092 0.653 18135 8100 1 9 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.389 0.717 18135 8101 1 9 . 1 1 83 83 LYS H H 83 7.342 7.342 7.697 -0.355 18135 8102 1 9 . 1 1 84 84 PHE N N 84 123.933 123.933 122.015 1.918 18135 8103 1 9 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.051 -0.016 18135 8104 1 9 . 1 1 84 84 PHE C C 84 177.210 177.210 176.606 0.604 18135 8105 1 9 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.602 -1.259 18135 8106 1 9 . 1 1 84 84 PHE CB C 84 39.316 39.316 39.100 0.216 18135 8107 1 9 . 1 1 84 84 PHE H H 84 8.471 8.471 8.334 0.137 18135 8108 1 9 . 1 1 85 85 TYR N N 85 118.387 118.387 117.503 0.884 18135 8109 1 9 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.723 0.345 18135 8110 1 9 . 1 1 85 85 TYR C C 85 178.104 178.104 177.472 0.632 18135 8111 1 9 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.579 -1.002 18135 8112 1 9 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.170 -0.194 18135 8113 1 9 . 1 1 85 85 TYR H H 85 9.011 9.011 8.984 0.027 18135 8114 1 9 . 1 1 86 86 THR N N 86 114.035 114.035 116.362 -2.327 18135 8115 1 9 . 1 1 86 86 THR HA H 86 3.945 3.945 3.245 0.700 18135 8116 1 9 . 1 1 86 86 THR C C 86 176.708 176.708 175.900 0.808 18135 8117 1 9 . 1 1 86 86 THR CA C 86 66.759 66.759 67.210 -0.452 18135 8118 1 9 . 1 1 86 86 THR CB C 86 68.853 68.853 68.096 0.757 18135 8119 1 9 . 1 1 86 86 THR H H 86 7.609 7.609 7.434 0.175 18135 8120 1 9 . 1 1 87 87 GLU N N 87 120.790 120.790 122.276 -1.486 18135 8121 1 9 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.896 0.151 18135 8122 1 9 . 1 1 87 87 GLU C C 87 179.606 179.606 178.951 0.655 18135 8123 1 9 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.304 -0.906 18135 8124 1 9 . 1 1 87 87 GLU CB C 87 28.286 28.286 28.960 -0.674 18135 8125 1 9 . 1 1 87 87 GLU H H 87 7.712 7.712 7.806 -0.094 18135 8126 1 9 . 1 1 88 88 LEU N N 88 120.729 120.729 120.447 0.282 18135 8127 1 9 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.939 -0.211 18135 8128 1 9 . 1 1 88 88 LEU C C 88 178.695 178.695 179.386 -0.691 18135 8129 1 9 . 1 1 88 88 LEU CA C 88 58.251 58.251 56.925 1.326 18135 8130 1 9 . 1 1 88 88 LEU CB C 88 41.587 41.587 39.959 1.628 18135 8131 1 9 . 1 1 88 88 LEU H H 88 8.393 8.393 7.405 0.988 18135 8132 1 9 . 1 1 89 89 TYR N N 89 118.654 118.654 119.183 -0.529 18135 8133 1 9 . 1 1 89 89 TYR HA H 89 3.931 3.931 3.934 -0.003 18135 8134 1 9 . 1 1 89 89 TYR C C 89 178.438 178.438 178.639 -0.201 18135 8135 1 9 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.053 0.354 18135 8136 1 9 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.332 0.535 18135 8137 1 9 . 1 1 89 89 TYR H H 89 8.637 8.637 8.171 0.466 18135 8138 1 9 . 1 1 90 90 GLN N N 90 118.263 118.263 116.414 1.849 18135 8139 1 9 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.982 0.004 18135 8140 1 9 . 1 1 90 90 GLN C C 90 178.411 178.411 178.726 -0.315 18135 8141 1 9 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.625 0.157 18135 8142 1 9 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.280 -0.134 18135 8143 1 9 . 1 1 90 90 GLN H H 90 7.796 7.796 7.829 -0.033 18135 8144 1 9 . 1 1 91 91 GLN N N 91 117.959 117.959 120.281 -2.322 18135 8145 1 9 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.057 0.025 18135 8146 1 9 . 1 1 91 91 GLN C C 91 178.705 178.705 178.551 0.154 18135 8147 1 9 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.840 -0.020 18135 8148 1 9 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.349 0.824 18135 8149 1 9 . 1 1 91 91 GLN H H 91 7.727 7.727 7.930 -0.203 18135 8150 1 9 . 1 1 92 92 LEU N N 92 119.965 119.965 118.602 1.363 18135 8151 1 9 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.986 -0.252 18135 8152 1 9 . 1 1 92 92 LEU C C 92 178.984 178.984 178.767 0.217 18135 8153 1 9 . 1 1 92 92 LEU CA C 92 58.492 58.492 59.025 -0.533 18135 8154 1 9 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.830 0.549 18135 8155 1 9 . 1 1 92 92 LEU H H 92 8.465 8.465 8.570 -0.105 18135 8156 1 9 . 1 1 93 93 ASN N N 93 117.793 117.793 118.510 -0.717 18135 8157 1 9 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.262 0.139 18135 8158 1 9 . 1 1 93 93 ASN C C 93 178.309 178.309 177.129 1.180 18135 8159 1 9 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.268 0.135 18135 8160 1 9 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.180 0.458 18135 8161 1 9 . 1 1 93 93 ASN H H 93 8.091 8.091 8.037 0.054 18135 8162 1 9 . 1 1 94 94 ASP N N 94 121.133 121.133 120.460 0.673 18135 8163 1 9 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.438 -0.033 18135 8164 1 9 . 1 1 94 94 ASP C C 94 178.328 178.328 178.747 -0.419 18135 8165 1 9 . 1 1 94 94 ASP CA C 94 56.547 56.547 56.687 -0.140 18135 8166 1 9 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.916 -2.267 18135 8167 1 9 . 1 1 94 94 ASP H H 94 8.362 8.362 7.995 0.367 18135 8168 1 9 . 1 1 95 95 LEU N N 95 119.160 119.160 120.159 -0.999 18135 8169 1 9 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.822 0.217 18135 8170 1 9 . 1 1 95 95 LEU C C 95 178.826 178.826 178.919 -0.093 18135 8171 1 9 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.514 -1.487 18135 8172 1 9 . 1 1 95 95 LEU CB C 95 42.210 42.210 41.833 0.377 18135 8173 1 9 . 1 1 95 95 LEU H H 95 8.143 8.143 8.449 -0.306 18135 8174 1 9 . 1 1 96 96 GLU N N 96 118.813 118.813 118.894 -0.081 18135 8175 1 9 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.709 0.252 18135 8176 1 9 . 1 1 96 96 GLU C C 96 177.640 177.640 178.241 -0.601 18135 8177 1 9 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.389 -1.675 18135 8178 1 9 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.483 -1.345 18135 8179 1 9 . 1 1 96 96 GLU H H 96 8.111 8.111 8.319 -0.208 18135 8180 1 9 . 1 1 97 97 ALA N N 97 120.549 120.549 121.074 -0.525 18135 8181 1 9 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.983 0.139 18135 8182 1 9 . 1 1 97 97 ALA C C 97 179.126 179.126 180.323 -1.197 18135 8183 1 9 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.729 -0.696 18135 8184 1 9 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.886 0.094 18135 8185 1 9 . 1 1 97 97 ALA H H 97 7.798 7.798 7.775 0.023 18135 8186 1 9 . 1 1 98 98 CYS N N 98 115.510 115.510 117.988 -2.478 18135 8187 1 9 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.147 0.303 18135 8188 1 9 . 1 1 98 98 CYS C C 98 175.363 175.363 176.166 -0.803 18135 8189 1 9 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.675 -5.509 18135 8190 1 9 . 1 1 98 98 CYS CB C 98 41.879 41.879 25.972 15.907 18135 8191 1 9 . 1 1 98 98 CYS H H 98 7.597 7.597 7.962 -0.365 18135 8192 1 9 . 1 1 99 99 VAL N N 99 121.713 121.713 119.621 2.092 18135 8193 1 9 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.794 0.000 18135 8194 1 9 . 1 1 99 99 VAL C C 99 177.357 177.357 177.120 0.237 18135 8195 1 9 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.516 -0.933 18135 8196 1 9 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.239 -0.208 18135 8197 1 9 . 1 1 99 99 VAL H H 99 7.828 7.828 7.483 0.345 18135 8198 1 9 . 1 1 100 100 ILE N N 100 122.333 122.333 117.599 4.734 18135 8199 1 9 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.734 0.190 18135 8200 1 9 . 1 1 100 100 ILE C C 100 176.827 176.827 176.946 -0.119 18135 8201 1 9 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.531 -1.293 18135 8202 1 9 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.646 0.632 18135 8203 1 9 . 1 1 100 100 ILE H H 100 8.067 8.067 8.141 -0.074 18135 8204 1 9 . 1 1 101 101 GLN N N 101 121.864 121.864 117.679 4.185 18135 8205 1 9 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.228 -0.002 18135 8206 1 9 . 1 1 101 101 GLN C C 101 176.438 176.438 177.514 -1.076 18135 8207 1 9 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.459 -0.140 18135 8208 1 9 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.190 -0.179 18135 8209 1 9 . 1 1 101 101 GLN H H 101 8.062 8.062 7.405 0.657 18135 8210 1 9 . 1 1 102 102 GLY N N 102 109.288 109.288 106.624 2.664 18135 8211 1 9 . 1 1 102 102 GLY C C 102 173.855 173.855 175.351 -1.496 18135 8212 1 9 . 1 1 102 102 GLY CA C 102 45.159 45.159 45.441 -0.282 18135 8213 1 9 . 1 1 102 102 GLY H H 102 8.087 8.087 8.627 -0.539 18135 8214 1 9 . 1 1 103 103 VAL N N 103 118.932 118.932 120.426 -1.494 18135 8215 1 9 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.749 0.325 18135 8216 1 9 . 1 1 103 103 VAL C C 103 176.299 176.299 176.938 -0.639 18135 8217 1 9 . 1 1 103 103 VAL CA C 103 62.499 62.499 64.496 -1.996 18135 8218 1 9 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.687 1.167 18135 8219 1 9 . 1 1 103 103 VAL H H 103 8.079 8.079 7.515 0.564 18135 8220 1 9 . 1 1 104 104 GLY N N 104 112.028 112.028 106.734 5.294 18135 8221 1 9 . 1 1 104 104 GLY C C 104 173.694 173.694 173.854 -0.160 18135 8222 1 9 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.506 -0.104 18135 8223 1 9 . 1 1 104 104 GLY H H 104 8.446 8.446 8.131 0.315 18135 8224 1 9 . 1 1 105 105 VAL N N 105 120.439 120.439 119.693 0.746 18135 8225 1 9 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.339 -0.151 18135 8226 1 9 . 1 1 105 105 VAL C C 105 175.963 175.963 174.361 1.602 18135 8227 1 9 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.081 1.055 18135 8228 1 9 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.719 -1.905 18135 8229 1 9 . 1 1 105 105 VAL H H 105 7.867 7.867 7.769 0.098 18135 8230 1 9 . 1 1 106 106 THR N N 106 116.366 116.366 113.747 2.619 18135 8231 1 9 . 1 1 106 106 THR HA H 106 4.548 4.548 4.561 -0.013 18135 8232 1 9 . 1 1 106 106 THR C C 106 173.731 173.731 173.625 0.106 18135 8233 1 9 . 1 1 106 106 THR CA C 106 59.419 59.419 61.075 -1.655 18135 8234 1 9 . 1 1 106 106 THR CB C 106 79.536 79.536 71.216 8.320 18135 8235 1 9 . 1 1 106 106 THR H H 106 8.565 8.565 7.998 0.567 18135 8236 1 9 . 1 1 107 107 GLU N N 107 119.743 119.743 122.302 -2.559 18135 8237 1 9 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.787 -0.325 18135 8238 1 9 . 1 1 107 107 GLU C C 107 175.639 175.639 176.487 -0.848 18135 8239 1 9 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.553 1.158 18135 8240 1 9 . 1 1 107 107 GLU CB C 107 30.499 30.499 33.240 -2.741 18135 8241 1 9 . 1 1 107 107 GLU H H 107 8.410 8.410 8.485 -0.075 18135 8242 1 9 . 1 1 108 108 THR N N 108 114.402 114.402 112.767 1.635 18135 8243 1 9 . 1 1 108 108 THR HA H 108 4.448 4.448 4.745 -0.297 18135 8244 1 9 . 1 1 108 108 THR CA C 108 60.348 60.348 59.635 0.713 18135 8245 1 9 . 1 1 108 108 THR CB C 108 68.544 68.544 68.564 -0.020 18135 8246 1 9 . 1 1 108 108 THR H H 108 8.155 8.155 8.562 -0.407 18135 8247 1 9 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.429 -0.191 18135 8248 1 9 . 1 1 109 109 PRO C C 109 178.666 178.666 177.891 0.775 18135 8249 1 9 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.317 1.059 18135 8250 1 9 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.916 -0.068 18135 8251 1 9 . 1 1 110 110 LEU N N 110 118.566 118.566 119.257 -0.691 18135 8252 1 9 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.089 0.027 18135 8253 1 9 . 1 1 110 110 LEU C C 110 178.293 178.293 179.310 -1.017 18135 8254 1 9 . 1 1 110 110 LEU CA C 110 56.686 56.686 58.262 -1.576 18135 8255 1 9 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.636 0.333 18135 8256 1 9 . 1 1 110 110 LEU H H 110 8.016 8.016 7.944 0.072 18135 8257 1 9 . 1 1 111 111 MET N N 111 118.982 118.982 115.696 3.286 18135 8258 1 9 . 1 1 111 111 MET HA H 111 4.210 4.210 4.166 0.044 18135 8259 1 9 . 1 1 111 111 MET C C 111 178.720 178.720 177.798 0.922 18135 8260 1 9 . 1 1 111 111 MET CA C 111 58.144 58.144 58.309 -0.165 18135 8261 1 9 . 1 1 111 111 MET CB C 111 32.374 32.374 32.384 -0.010 18135 8262 1 9 . 1 1 111 111 MET H H 111 7.705 7.705 8.140 -0.435 18135 8263 1 9 . 1 1 112 112 LYS N N 112 121.377 121.377 118.950 2.427 18135 8264 1 9 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.293 -0.185 18135 8265 1 9 . 1 1 112 112 LYS C C 112 178.000 178.000 178.539 -0.539 18135 8266 1 9 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.216 -1.911 18135 8267 1 9 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.221 0.146 18135 8268 1 9 . 1 1 112 112 LYS H H 112 8.257 8.257 7.612 0.645 18135 8269 1 9 . 1 1 113 113 GLU N N 113 119.104 119.104 118.830 0.274 18135 8270 1 9 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.994 0.072 18135 8271 1 9 . 1 1 113 113 GLU C C 113 178.289 178.289 178.135 0.154 18135 8272 1 9 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.358 -1.105 18135 8273 1 9 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.105 -0.967 18135 8274 1 9 . 1 1 113 113 GLU H H 113 8.270 8.270 7.717 0.553 18135 8275 1 9 . 1 1 114 114 ASP N N 114 119.224 119.224 118.558 0.666 18135 8276 1 9 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.555 -0.267 18135 8277 1 9 . 1 1 114 114 ASP C C 114 178.365 178.365 178.408 -0.043 18135 8278 1 9 . 1 1 114 114 ASP CA C 114 56.108 56.108 56.621 -0.513 18135 8279 1 9 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.949 -2.714 18135 8280 1 9 . 1 1 114 114 ASP H H 114 8.618 8.618 7.583 1.035 18135 8281 1 9 . 1 1 115 115 SER N N 115 118.195 118.195 117.623 0.572 18135 8282 1 9 . 1 1 115 115 SER HA H 115 4.200 4.200 4.097 0.103 18135 8283 1 9 . 1 1 115 115 SER C C 115 175.986 175.986 176.798 -0.812 18135 8284 1 9 . 1 1 115 115 SER CA C 115 61.588 61.588 61.438 0.150 18135 8285 1 9 . 1 1 115 115 SER CB C 115 62.653 62.653 62.847 -0.195 18135 8286 1 9 . 1 1 115 115 SER H H 115 8.181 8.181 7.583 0.598 18135 8287 1 9 . 1 1 116 116 ILE N N 116 123.340 123.340 121.344 1.996 18135 8288 1 9 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.890 -0.264 18135 8289 1 9 . 1 1 116 116 ILE C C 116 178.367 178.367 178.297 0.070 18135 8290 1 9 . 1 1 116 116 ILE CA C 116 64.817 64.817 62.953 1.864 18135 8291 1 9 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.575 0.843 18135 8292 1 9 . 1 1 116 116 ILE H H 116 7.773 7.773 8.345 -0.572 18135 8293 1 9 . 1 1 117 117 LEU N N 117 120.968 120.968 121.505 -0.537 18135 8294 1 9 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.937 -0.032 18135 8295 1 9 . 1 1 117 117 LEU C C 117 178.746 178.746 178.206 0.540 18135 8296 1 9 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.383 -0.240 18135 8297 1 9 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.626 -0.040 18135 8298 1 9 . 1 1 117 117 LEU H H 117 8.406 8.406 7.304 1.102 18135 8299 1 9 . 1 1 118 118 ALA N N 118 120.150 120.150 122.107 -1.957 18135 8300 1 9 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.681 0.431 18135 8301 1 9 . 1 1 118 118 ALA C C 118 181.633 181.633 178.627 3.006 18135 8302 1 9 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.198 0.115 18135 8303 1 9 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.370 -0.260 18135 8304 1 9 . 1 1 118 118 ALA H H 118 7.894 7.894 8.426 -0.532 18135 8305 1 9 . 1 1 119 119 VAL N N 119 118.873 118.873 115.728 3.145 18135 8306 1 9 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.250 0.505 18135 8307 1 9 . 1 1 119 119 VAL C C 119 177.896 177.896 177.679 0.217 18135 8308 1 9 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.967 1.214 18135 8309 1 9 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.097 0.797 18135 8310 1 9 . 1 1 119 119 VAL H H 119 7.572 7.572 7.772 -0.200 18135 8311 1 9 . 1 1 120 120 ARG N N 120 121.436 121.436 120.060 1.376 18135 8312 1 9 . 1 1 120 120 ARG HA H 120 4.027 4.027 3.982 0.045 18135 8313 1 9 . 1 1 120 120 ARG C C 120 179.848 179.848 178.440 1.408 18135 8314 1 9 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.867 1.400 18135 8315 1 9 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.909 -0.214 18135 8316 1 9 . 1 1 120 120 ARG H H 120 8.629 8.629 7.969 0.660 18135 8317 1 9 . 1 1 121 121 LYS N N 121 119.589 119.589 120.022 -0.433 18135 8318 1 9 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.919 0.155 18135 8319 1 9 . 1 1 121 121 LYS C C 121 178.331 178.331 179.170 -0.839 18135 8320 1 9 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.847 0.593 18135 8321 1 9 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.284 -0.177 18135 8322 1 9 . 1 1 121 121 LYS H H 121 9.015 9.015 8.121 0.894 18135 8323 1 9 . 1 1 122 122 TYR N N 122 121.546 121.546 117.928 3.618 18135 8324 1 9 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.146 0.186 18135 8325 1 9 . 1 1 122 122 TYR C C 122 176.527 176.527 178.345 -1.818 18135 8326 1 9 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.684 1.720 18135 8327 1 9 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.381 0.344 18135 8328 1 9 . 1 1 122 122 TYR H H 122 7.473 7.473 7.739 -0.266 18135 8329 1 9 . 1 1 123 123 PHE N N 123 116.026 116.026 119.588 -3.562 18135 8330 1 9 . 1 1 123 123 PHE HA H 123 3.740 3.740 4.052 -0.312 18135 8331 1 9 . 1 1 123 123 PHE C C 123 179.005 179.005 177.600 1.405 18135 8332 1 9 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.219 3.309 18135 8333 1 9 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.976 0.355 18135 8334 1 9 . 1 1 123 123 PHE H H 123 7.932 7.932 8.228 -0.296 18135 8335 1 9 . 1 1 124 124 GLN N N 124 123.043 123.043 119.529 3.514 18135 8336 1 9 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.514 0.665 18135 8337 1 9 . 1 1 124 124 GLN C C 124 178.772 178.772 178.260 0.512 18135 8338 1 9 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.273 0.043 18135 8339 1 9 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.355 -0.724 18135 8340 1 9 . 1 1 124 124 GLN H H 124 8.470 8.470 8.438 0.032 18135 8341 1 9 . 1 1 125 125 ARG N N 125 120.342 120.342 118.705 1.637 18135 8342 1 9 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.133 -0.055 18135 8343 1 9 . 1 1 125 125 ARG C C 125 180.340 180.340 179.116 1.224 18135 8344 1 9 . 1 1 125 125 ARG CA C 125 61.297 61.297 59.107 2.190 18135 8345 1 9 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.854 0.471 18135 8346 1 9 . 1 1 125 125 ARG H H 125 8.137 8.137 8.065 0.073 18135 8347 1 9 . 1 1 126 126 ILE N N 126 121.876 121.876 121.515 0.361 18135 8348 1 9 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.348 0.003 18135 8349 1 9 . 1 1 126 126 ILE C C 126 176.857 176.857 177.745 -0.888 18135 8350 1 9 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.447 1.385 18135 8351 1 9 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.573 0.711 18135 8352 1 9 . 1 1 126 126 ILE H H 126 7.526 7.526 8.076 -0.550 18135 8353 1 9 . 1 1 127 127 THR N N 127 115.613 115.613 115.228 0.385 18135 8354 1 9 . 1 1 127 127 THR HA H 127 3.633 3.633 3.841 -0.208 18135 8355 1 9 . 1 1 127 127 THR C C 127 176.645 176.645 177.033 -0.388 18135 8356 1 9 . 1 1 127 127 THR CA C 127 67.294 67.294 66.537 0.757 18135 8357 1 9 . 1 1 127 127 THR CB C 127 68.871 68.871 68.799 0.072 18135 8358 1 9 . 1 1 127 127 THR H H 127 8.288 8.288 7.903 0.385 18135 8359 1 9 . 1 1 128 128 LEU N N 128 122.627 122.627 122.437 0.190 18135 8360 1 9 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.941 0.015 18135 8361 1 9 . 1 1 128 128 LEU C C 128 178.331 178.331 177.836 0.495 18135 8362 1 9 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.799 0.289 18135 8363 1 9 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.325 0.249 18135 8364 1 9 . 1 1 128 128 LEU H H 128 8.263 8.263 8.129 0.134 18135 8365 1 9 . 1 1 129 129 TYR N N 129 120.955 120.955 120.583 0.372 18135 8366 1 9 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.424 -0.534 18135 8367 1 9 . 1 1 129 129 TYR C C 129 176.040 176.040 177.675 -1.635 18135 8368 1 9 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.299 0.194 18135 8369 1 9 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.433 0.492 18135 8370 1 9 . 1 1 129 129 TYR H H 129 7.518 7.518 8.282 -0.764 18135 8371 1 9 . 1 1 130 130 LEU N N 130 119.155 119.155 116.677 2.478 18135 8372 1 9 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.392 -0.547 18135 8373 1 9 . 1 1 130 130 LEU C C 130 177.948 177.948 178.319 -0.371 18135 8374 1 9 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.833 0.280 18135 8375 1 9 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.564 1.022 18135 8376 1 9 . 1 1 130 130 LEU H H 130 7.717 7.717 7.985 -0.268 18135 8377 1 9 . 1 1 131 131 LYS N N 131 116.832 116.832 119.945 -3.113 18135 8378 1 9 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.791 -0.383 18135 8379 1 9 . 1 1 131 131 LYS C C 131 181.265 181.265 179.684 1.581 18135 8380 1 9 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.689 0.042 18135 8381 1 9 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.018 0.654 18135 8382 1 9 . 1 1 131 131 LYS H H 131 7.493 7.493 7.938 -0.445 18135 8383 1 9 . 1 1 132 132 GLU N N 132 121.918 121.918 120.165 1.753 18135 8384 1 9 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.052 -0.208 18135 8385 1 9 . 1 1 132 132 GLU C C 132 178.377 178.377 178.604 -0.227 18135 8386 1 9 . 1 1 132 132 GLU CA C 132 58.887 58.887 59.208 -0.320 18135 8387 1 9 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.559 -0.892 18135 8388 1 9 . 1 1 132 132 GLU H H 132 8.430 8.430 8.001 0.429 18135 8389 1 9 . 1 1 133 133 LYS N N 133 116.079 116.079 117.173 -1.094 18135 8390 1 9 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.209 -0.243 18135 8391 1 9 . 1 1 133 133 LYS C C 133 175.282 175.282 175.943 -0.661 18135 8392 1 9 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.622 -0.324 18135 8393 1 9 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.723 0.275 18135 8394 1 9 . 1 1 133 133 LYS H H 133 7.390 7.390 7.375 0.015 18135 8395 1 9 . 1 1 134 134 LYS N N 134 117.759 117.759 115.968 1.791 18135 8396 1 9 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.060 -0.478 18135 8397 1 9 . 1 1 134 134 LYS C C 134 176.271 176.271 175.986 0.285 18135 8398 1 9 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.798 0.510 18135 8399 1 9 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.065 -0.263 18135 8400 1 9 . 1 1 134 134 LYS H H 134 7.716 7.716 7.572 0.144 18135 8401 1 9 . 1 1 135 135 TYR N N 135 110.598 110.598 112.690 -2.092 18135 8402 1 9 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.939 -1.062 18135 8403 1 9 . 1 1 135 135 TYR C C 135 174.148 174.148 175.397 -1.249 18135 8404 1 9 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.078 0.637 18135 8405 1 9 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.441 -0.735 18135 8406 1 9 . 1 1 135 135 TYR H H 135 8.428 8.428 8.928 -0.500 18135 8407 1 9 . 1 1 136 136 SER N N 136 113.712 113.712 115.189 -1.477 18135 8408 1 9 . 1 1 136 136 SER HA H 136 4.553 4.553 4.420 0.133 18135 8409 1 9 . 1 1 136 136 SER CA C 136 57.108 57.108 58.661 -1.553 18135 8410 1 9 . 1 1 136 136 SER CB C 136 62.500 62.500 63.833 -1.333 18135 8411 1 9 . 1 1 136 136 SER H H 136 6.744 6.744 7.353 -0.609 18135 8412 1 9 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.405 -0.240 18135 8413 1 9 . 1 1 137 137 PRO C C 137 180.675 180.675 177.517 3.158 18135 8414 1 9 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.836 0.821 18135 8415 1 9 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.838 0.145 18135 8416 1 9 . 1 1 138 138 CYS N N 138 113.914 113.914 115.551 -1.637 18135 8417 1 9 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.539 0.131 18135 8418 1 9 . 1 1 138 138 CYS C C 138 176.015 176.015 176.238 -0.223 18135 8419 1 9 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.948 -3.853 18135 8420 1 9 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.234 10.545 18135 8421 1 9 . 1 1 138 138 CYS H H 138 8.580 8.580 8.537 0.043 18135 8422 1 9 . 1 1 139 139 ALA N N 139 125.290 125.290 124.051 1.239 18135 8423 1 9 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.199 0.250 18135 8424 1 9 . 1 1 139 139 ALA C C 139 180.149 180.149 179.275 0.874 18135 8425 1 9 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.960 -0.182 18135 8426 1 9 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.191 0.727 18135 8427 1 9 . 1 1 139 139 ALA H H 139 8.087 8.087 8.049 0.038 18135 8428 1 9 . 1 1 140 140 TRP N N 140 116.599 116.599 118.818 -2.219 18135 8429 1 9 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.312 0.290 18135 8430 1 9 . 1 1 140 140 TRP C C 140 179.137 179.137 178.566 0.571 18135 8431 1 9 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.299 -0.765 18135 8432 1 9 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.354 -0.096 18135 8433 1 9 . 1 1 140 140 TRP H H 140 8.505 8.505 7.867 0.638 18135 8434 1 9 . 1 1 141 141 GLU N N 141 121.578 121.578 118.987 2.591 18135 8435 1 9 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.295 0.928 18135 8436 1 9 . 1 1 141 141 GLU C C 141 177.886 177.886 178.715 -0.829 18135 8437 1 9 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.246 -1.339 18135 8438 1 9 . 1 1 141 141 GLU CB C 141 28.717 28.717 28.725 -0.008 18135 8439 1 9 . 1 1 141 141 GLU H H 141 8.182 8.182 8.141 0.041 18135 8440 1 9 . 1 1 142 142 VAL N N 142 121.202 121.202 120.276 0.926 18135 8441 1 9 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.604 0.026 18135 8442 1 9 . 1 1 142 142 VAL C C 142 180.246 180.246 178.481 1.765 18135 8443 1 9 . 1 1 142 142 VAL CA C 142 66.983 66.983 67.135 -0.152 18135 8444 1 9 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.833 -0.011 18135 8445 1 9 . 1 1 142 142 VAL H H 142 8.623 8.623 8.015 0.608 18135 8446 1 9 . 1 1 143 143 VAL N N 143 120.119 120.119 119.450 0.669 18135 8447 1 9 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.709 -0.412 18135 8448 1 9 . 1 1 143 143 VAL C C 143 176.407 176.407 178.402 -1.995 18135 8449 1 9 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.713 1.265 18135 8450 1 9 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.587 0.068 18135 8451 1 9 . 1 1 143 143 VAL H H 143 8.323 8.323 8.336 -0.013 18135 8452 1 9 . 1 1 144 144 ARG N N 144 124.102 124.102 119.699 4.403 18135 8453 1 9 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.012 -0.315 18135 8454 1 9 . 1 1 144 144 ARG C C 144 178.127 178.127 178.218 -0.091 18135 8455 1 9 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.135 1.866 18135 8456 1 9 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.431 0.505 18135 8457 1 9 . 1 1 144 144 ARG H H 144 9.619 9.619 8.266 1.353 18135 8458 1 9 . 1 1 145 145 ALA N N 145 119.431 119.431 121.638 -2.207 18135 8459 1 9 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.038 -0.187 18135 8460 1 9 . 1 1 145 145 ALA C C 145 180.763 180.763 180.102 0.661 18135 8461 1 9 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.354 0.021 18135 8462 1 9 . 1 1 145 145 ALA CB C 145 18.185 18.185 17.973 0.212 18135 8463 1 9 . 1 1 145 145 ALA H H 145 8.867 8.867 8.299 0.568 18135 8464 1 9 . 1 1 146 146 GLU N N 146 121.815 121.815 118.075 3.740 18135 8465 1 9 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.170 0.041 18135 8466 1 9 . 1 1 146 146 GLU C C 146 177.296 177.296 179.299 -2.003 18135 8467 1 9 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.401 -1.022 18135 8468 1 9 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.493 -1.359 18135 8469 1 9 . 1 1 146 146 GLU H H 146 8.136 8.136 8.085 0.051 18135 8470 1 9 . 1 1 147 147 ILE N N 147 119.542 119.542 121.424 -1.882 18135 8471 1 9 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.857 0.113 18135 8472 1 9 . 1 1 147 147 ILE C C 147 178.283 178.283 178.539 -0.256 18135 8473 1 9 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.267 -3.014 18135 8474 1 9 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.564 -2.225 18135 8475 1 9 . 1 1 147 147 ILE H H 147 8.736 8.736 8.270 0.466 18135 8476 1 9 . 1 1 148 148 MET N N 148 119.501 119.501 118.534 0.967 18135 8477 1 9 . 1 1 148 148 MET HA H 148 3.801 3.801 4.135 -0.334 18135 8478 1 9 . 1 1 148 148 MET C C 148 178.210 178.210 178.694 -0.484 18135 8479 1 9 . 1 1 148 148 MET CA C 148 60.184 60.184 59.985 0.199 18135 8480 1 9 . 1 1 148 148 MET CB C 148 32.914 32.914 32.023 0.891 18135 8481 1 9 . 1 1 148 148 MET H H 148 8.440 8.440 8.489 -0.049 18135 8482 1 9 . 1 1 149 149 ARG N N 149 119.734 119.734 119.532 0.202 18135 8483 1 9 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.075 -0.160 18135 8484 1 9 . 1 1 149 149 ARG C C 149 178.978 178.978 178.916 0.062 18135 8485 1 9 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.280 0.583 18135 8486 1 9 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.755 0.525 18135 8487 1 9 . 1 1 149 149 ARG H H 149 7.648 7.648 8.441 -0.793 18135 8488 1 9 . 1 1 150 150 SER N N 150 118.109 118.109 115.179 2.930 18135 8489 1 9 . 1 1 150 150 SER HA H 150 3.339 3.339 4.117 -0.778 18135 8490 1 9 . 1 1 150 150 SER C C 150 177.292 177.292 176.267 1.025 18135 8491 1 9 . 1 1 150 150 SER CA C 150 61.316 61.316 61.544 -0.228 18135 8492 1 9 . 1 1 150 150 SER CB C 150 60.288 60.288 62.587 -2.299 18135 8493 1 9 . 1 1 150 150 SER H H 150 9.194 9.194 8.343 0.851 18135 8494 1 9 . 1 1 151 151 PHE N N 151 125.265 125.265 124.826 0.439 18135 8495 1 9 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.286 -0.250 18135 8496 1 9 . 1 1 151 151 PHE C C 151 178.696 178.696 177.674 1.022 18135 8497 1 9 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.330 2.090 18135 8498 1 9 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.434 0.453 18135 8499 1 9 . 1 1 151 151 PHE H H 151 9.455 9.455 8.491 0.964 18135 8500 1 9 . 1 1 152 152 SER N N 152 115.963 115.963 116.127 -0.164 18135 8501 1 9 . 1 1 152 152 SER HA H 152 3.880 3.880 3.859 0.021 18135 8502 1 9 . 1 1 152 152 SER C C 152 175.858 175.858 176.964 -1.106 18135 8503 1 9 . 1 1 152 152 SER CA C 152 62.388 62.388 61.539 0.849 18135 8504 1 9 . 1 1 152 152 SER CB C 152 62.519 62.519 63.109 -0.590 18135 8505 1 9 . 1 1 152 152 SER H H 152 7.839 7.839 8.169 -0.330 18135 8506 1 9 . 1 1 153 153 LEU N N 153 121.365 121.365 122.679 -1.314 18135 8507 1 9 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.133 -0.052 18135 8508 1 9 . 1 1 153 153 LEU C C 153 179.515 179.515 177.552 1.963 18135 8509 1 9 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.873 0.010 18135 8510 1 9 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.802 0.540 18135 8511 1 9 . 1 1 153 153 LEU H H 153 7.775 7.775 8.075 -0.300 18135 8512 1 9 . 1 1 154 154 SER N N 154 113.950 113.950 112.862 1.088 18135 8513 1 9 . 1 1 154 154 SER HA H 154 3.781 3.781 4.518 -0.737 18135 8514 1 9 . 1 1 154 154 SER C C 154 174.312 174.312 176.635 -2.323 18135 8515 1 9 . 1 1 154 154 SER CA C 154 61.366 61.366 60.888 0.478 18135 8516 1 9 . 1 1 154 154 SER CB C 154 63.242 63.242 63.621 -0.379 18135 8517 1 9 . 1 1 154 154 SER H H 154 7.874 7.874 8.410 -0.536 18135 8518 1 9 . 1 1 155 155 THR N N 155 109.346 109.346 112.471 -3.125 18135 8519 1 9 . 1 1 155 155 THR HA H 155 4.060 4.060 4.332 -0.272 18135 8520 1 9 . 1 1 155 155 THR C C 155 174.798 174.798 176.353 -1.555 18135 8521 1 9 . 1 1 155 155 THR CA C 155 62.275 62.275 64.763 -2.488 18135 8522 1 9 . 1 1 155 155 THR CB C 155 69.342 69.342 68.944 0.398 18135 8523 1 9 . 1 1 155 155 THR H H 155 7.176 7.176 7.883 -0.707 18135 8524 1 9 . 1 1 156 156 ASN N N 156 119.785 119.785 120.446 -0.661 18135 8525 1 9 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.728 -0.201 18135 8526 1 9 . 1 1 156 156 ASN C C 156 175.528 175.528 175.452 0.076 18135 8527 1 9 . 1 1 156 156 ASN CA C 156 53.937 53.937 53.155 0.782 18135 8528 1 9 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.908 0.430 18135 8529 1 9 . 1 1 156 156 ASN H H 156 7.749 7.749 7.869 -0.120 18135 8530 1 9 . 1 1 157 157 LEU N N 157 120.552 120.552 121.183 -0.631 18135 8531 1 9 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.574 -0.319 18135 8532 1 9 . 1 1 157 157 LEU C C 157 174.702 174.702 178.240 -3.538 18135 8533 1 9 . 1 1 157 157 LEU CA C 157 55.674 55.674 55.930 -0.256 18135 8534 1 9 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.230 0.121 18135 8535 1 9 . 1 1 157 157 LEU H H 157 8.097 8.097 8.290 -0.193 18135 8536 1 9 . 1 1 158 158 GLN N N 158 119.860 119.860 119.186 0.674 18135 8537 1 9 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.313 -0.133 18135 8538 1 9 . 1 1 158 158 GLN C C 158 176.434 176.434 175.641 0.793 18135 8539 1 9 . 1 1 158 158 GLN CA C 158 56.897 56.897 56.204 0.693 18135 8540 1 9 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.467 -0.457 18135 8541 1 9 . 1 1 158 158 GLN H H 158 8.230 8.230 7.937 0.293 18135 8542 1 9 . 1 1 159 159 GLU N N 159 120.461 120.461 117.758 2.703 18135 8543 1 9 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.991 0.228 18135 8544 1 9 . 1 1 159 159 GLU C C 159 175.251 175.251 175.178 0.073 18135 8545 1 9 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.431 -0.736 18135 8546 1 9 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.403 0.578 18135 8547 1 9 . 1 1 159 159 GLU H H 159 8.300 8.300 8.506 -0.206 18135 8548 1 9 . 1 1 160 160 SER N N 160 115.719 115.719 113.345 2.374 18135 8549 1 9 . 1 1 160 160 SER HA H 160 4.372 4.372 4.466 -0.094 18135 8550 1 9 . 1 1 160 160 SER C C 160 174.188 174.188 172.717 1.471 18135 8551 1 9 . 1 1 160 160 SER CA C 160 58.481 58.481 58.666 -0.185 18135 8552 1 9 . 1 1 160 160 SER CB C 160 63.731 63.731 63.572 0.159 18135 8553 1 9 . 1 1 160 160 SER H H 160 8.113 8.113 8.133 -0.020 18135 8554 1 9 . 1 1 161 161 LEU N N 161 123.794 123.794 125.405 -1.611 18135 8555 1 9 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.548 -0.268 18135 8556 1 9 . 1 1 161 161 LEU C C 161 177.293 177.293 176.678 0.615 18135 8557 1 9 . 1 1 161 161 LEU CA C 161 55.190 55.190 54.553 0.637 18135 8558 1 9 . 1 1 161 161 LEU CB C 161 42.284 42.284 43.430 -1.146 18135 8559 1 9 . 1 1 161 161 LEU H H 161 8.032 8.032 8.267 -0.235 18135 8560 1 9 . 1 1 162 162 ARG N N 162 120.715 120.715 121.009 -0.294 18135 8561 1 9 . 1 1 162 162 ARG HA H 162 4.169 4.169 3.977 0.192 18135 8562 1 9 . 1 1 162 162 ARG C C 162 176.288 176.288 175.672 0.616 18135 8563 1 9 . 1 1 162 162 ARG CA C 162 57.046 57.046 56.534 0.512 18135 8564 1 9 . 1 1 162 162 ARG CB C 162 30.935 30.935 29.093 1.843 18135 8565 1 9 . 1 1 162 162 ARG H H 162 8.094 8.094 8.928 -0.834 18135 8566 1 9 . 1 1 163 163 SER N N 163 116.670 116.670 114.216 2.454 18135 8567 1 9 . 1 1 163 163 SER HA H 163 4.372 4.372 4.252 0.120 18135 8568 1 9 . 1 1 163 163 SER C C 163 174.184 174.184 175.715 -1.531 18135 8569 1 9 . 1 1 163 163 SER CA C 163 58.481 58.481 59.578 -1.097 18135 8570 1 9 . 1 1 163 163 SER CB C 163 63.745 63.745 63.913 -0.168 18135 8571 1 9 . 1 1 163 163 SER H H 163 8.191 8.191 8.247 -0.056 18135 8572 1 9 . 1 1 164 164 LYS N N 164 123.100 123.100 124.456 -1.356 18135 8573 1 9 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.442 -0.165 18135 8574 1 9 . 1 1 164 164 LYS C C 164 175.617 175.617 176.786 -1.169 18135 8575 1 9 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.696 -0.383 18135 8576 1 9 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.573 0.392 18135 8577 1 9 . 1 1 164 164 LYS H H 164 8.251 8.251 8.487 -0.236 18135 8578 1 10 . 1 1 2 2 ASP N N 2 125.691 125.691 120.088 5.603 18135 8579 1 10 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.607 0.103 18135 8580 1 10 . 1 1 2 2 ASP C C 2 174.758 174.758 175.885 -1.127 18135 8581 1 10 . 1 1 2 2 ASP CA C 2 52.843 52.843 53.969 -1.126 18135 8582 1 10 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.228 -1.907 18135 8583 1 10 . 1 1 2 2 ASP H H 2 8.773 8.773 8.460 0.313 18135 8584 1 10 . 1 1 3 3 LEU N N 3 123.957 123.957 116.723 7.234 18135 8585 1 10 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.282 0.119 18135 8586 1 10 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.978 0.675 18135 8587 1 10 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.409 0.146 18135 8588 1 10 . 1 1 3 3 LEU H H 3 8.164 8.164 7.377 0.787 18135 8589 1 10 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.512 -0.198 18135 8590 1 10 . 1 1 4 4 PRO C C 4 176.213 176.213 176.712 -0.499 18135 8591 1 10 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.160 0.748 18135 8592 1 10 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.340 1.554 18135 8593 1 10 . 1 1 5 5 GLN N N 5 121.621 121.621 121.825 -0.204 18135 8594 1 10 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.174 0.052 18135 8595 1 10 . 1 1 5 5 GLN C C 5 176.995 176.995 176.539 0.456 18135 8596 1 10 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.139 -1.429 18135 8597 1 10 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.458 -0.507 18135 8598 1 10 . 1 1 5 5 GLN H H 5 8.767 8.767 8.761 0.006 18135 8599 1 10 . 1 1 6 6 THR N N 6 111.419 111.419 111.440 -0.021 18135 8600 1 10 . 1 1 6 6 THR HA H 6 4.135 4.135 4.455 -0.320 18135 8601 1 10 . 1 1 6 6 THR C C 6 174.695 174.695 174.639 0.056 18135 8602 1 10 . 1 1 6 6 THR CA C 6 62.661 62.661 62.760 -0.099 18135 8603 1 10 . 1 1 6 6 THR CB C 6 69.365 69.365 69.166 0.199 18135 8604 1 10 . 1 1 6 6 THR H H 6 7.865 7.865 8.450 -0.585 18135 8605 1 10 . 1 1 7 7 HIS N N 7 119.137 119.137 118.729 0.408 18135 8606 1 10 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.714 -0.129 18135 8607 1 10 . 1 1 7 7 HIS C C 7 174.980 174.980 176.384 -1.404 18135 8608 1 10 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.747 -2.743 18135 8609 1 10 . 1 1 7 7 HIS CB C 7 28.163 28.163 30.264 -2.101 18135 8610 1 10 . 1 1 7 7 HIS H H 7 8.567 8.567 8.456 0.111 18135 8611 1 10 . 1 1 8 8 SER N N 8 115.796 115.796 115.323 0.473 18135 8612 1 10 . 1 1 8 8 SER HA H 8 4.363 4.363 4.344 0.019 18135 8613 1 10 . 1 1 8 8 SER C C 8 175.312 175.312 175.332 -0.020 18135 8614 1 10 . 1 1 8 8 SER CA C 8 58.969 58.969 60.803 -1.833 18135 8615 1 10 . 1 1 8 8 SER CB C 8 63.439 63.439 63.196 0.243 18135 8616 1 10 . 1 1 8 8 SER H H 8 8.180 8.180 7.940 0.240 18135 8617 1 10 . 1 1 9 9 LEU N N 9 123.844 123.844 117.509 6.335 18135 8618 1 10 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.655 -0.500 18135 8619 1 10 . 1 1 9 9 LEU C C 9 178.568 178.568 178.819 -0.251 18135 8620 1 10 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.570 0.396 18135 8621 1 10 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.258 -0.462 18135 8622 1 10 . 1 1 9 9 LEU H H 9 8.404 8.404 7.657 0.747 18135 8623 1 10 . 1 1 10 10 GLY N N 10 107.582 107.582 107.837 -0.255 18135 8624 1 10 . 1 1 10 10 GLY C C 10 174.586 174.586 175.661 -1.075 18135 8625 1 10 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.458 -0.553 18135 8626 1 10 . 1 1 10 10 GLY H H 10 8.438 8.438 8.573 -0.135 18135 8627 1 10 . 1 1 11 11 SER N N 11 118.806 118.806 117.612 1.194 18135 8628 1 10 . 1 1 11 11 SER HA H 11 4.156 4.156 4.159 -0.003 18135 8629 1 10 . 1 1 11 11 SER C C 11 175.749 175.749 176.571 -0.822 18135 8630 1 10 . 1 1 11 11 SER CA C 11 61.299 61.299 62.011 -0.712 18135 8631 1 10 . 1 1 11 11 SER CB C 11 62.653 62.653 62.507 0.146 18135 8632 1 10 . 1 1 11 11 SER H H 11 8.249 8.249 8.295 -0.046 18135 8633 1 10 . 1 1 12 12 ARG N N 12 121.986 121.986 122.690 -0.704 18135 8634 1 10 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.167 -0.213 18135 8635 1 10 . 1 1 12 12 ARG C C 12 178.283 178.283 178.702 -0.419 18135 8636 1 10 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.478 1.352 18135 8637 1 10 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.106 -0.522 18135 8638 1 10 . 1 1 12 12 ARG H H 12 8.027 8.027 8.257 -0.230 18135 8639 1 10 . 1 1 13 13 ARG N N 13 119.432 119.432 118.808 0.624 18135 8640 1 10 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.059 -0.220 18135 8641 1 10 . 1 1 13 13 ARG C C 13 178.480 178.480 178.405 0.075 18135 8642 1 10 . 1 1 13 13 ARG CA C 13 60.491 60.491 60.228 0.263 18135 8643 1 10 . 1 1 13 13 ARG CB C 13 30.082 30.082 30.137 -0.055 18135 8644 1 10 . 1 1 13 13 ARG H H 13 8.437 8.437 8.111 0.326 18135 8645 1 10 . 1 1 14 14 THR N N 14 116.879 116.879 116.803 0.076 18135 8646 1 10 . 1 1 14 14 THR HA H 14 3.532 3.532 4.180 -0.648 18135 8647 1 10 . 1 1 14 14 THR C C 14 175.584 175.584 176.655 -1.071 18135 8648 1 10 . 1 1 14 14 THR CA C 14 68.036 68.036 67.502 0.534 18135 8649 1 10 . 1 1 14 14 THR CB C 14 67.969 67.969 68.588 -0.619 18135 8650 1 10 . 1 1 14 14 THR H H 14 7.957 7.957 8.181 -0.224 18135 8651 1 10 . 1 1 15 15 LEU N N 15 120.252 120.252 121.848 -1.596 18135 8652 1 10 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.996 -0.050 18135 8653 1 10 . 1 1 15 15 LEU C C 15 178.652 178.652 178.800 -0.148 18135 8654 1 10 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.294 -0.206 18135 8655 1 10 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.720 -0.166 18135 8656 1 10 . 1 1 15 15 LEU H H 15 7.550 7.550 8.136 -0.586 18135 8657 1 10 . 1 1 16 16 MET N N 16 118.788 118.788 117.562 1.226 18135 8658 1 10 . 1 1 16 16 MET HA H 16 4.023 4.023 3.948 0.075 18135 8659 1 10 . 1 1 16 16 MET C C 16 178.718 178.718 178.706 0.012 18135 8660 1 10 . 1 1 16 16 MET CA C 16 58.513 58.513 59.213 -0.700 18135 8661 1 10 . 1 1 16 16 MET CB C 16 32.150 32.150 32.378 -0.228 18135 8662 1 10 . 1 1 16 16 MET H H 16 7.985 7.985 8.140 -0.155 18135 8663 1 10 . 1 1 17 17 LEU N N 17 120.644 120.644 119.446 1.198 18135 8664 1 10 . 1 1 17 17 LEU HA H 17 3.972 3.972 4.011 -0.039 18135 8665 1 10 . 1 1 17 17 LEU C C 17 178.238 178.238 179.450 -1.212 18135 8666 1 10 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.025 -0.298 18135 8667 1 10 . 1 1 17 17 LEU CB C 17 42.135 42.135 40.831 1.304 18135 8668 1 10 . 1 1 17 17 LEU H H 17 7.829 7.829 8.171 -0.342 18135 8669 1 10 . 1 1 18 18 LEU N N 18 118.280 118.280 118.947 -0.667 18135 8670 1 10 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.761 -0.255 18135 8671 1 10 . 1 1 18 18 LEU C C 18 175.739 175.739 178.740 -3.001 18135 8672 1 10 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.395 0.261 18135 8673 1 10 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.282 0.960 18135 8674 1 10 . 1 1 18 18 LEU H H 18 7.499 7.499 8.445 -0.946 18135 8675 1 10 . 1 1 19 19 ALA N N 19 121.961 121.961 120.727 1.234 18135 8676 1 10 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.164 -0.327 18135 8677 1 10 . 1 1 19 19 ALA C C 19 180.736 180.736 178.675 2.061 18135 8678 1 10 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.121 0.945 18135 8679 1 10 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.209 -1.132 18135 8680 1 10 . 1 1 19 19 ALA H H 19 7.950 7.950 7.748 0.202 18135 8681 1 10 . 1 1 20 20 GLN N N 20 118.605 118.605 116.054 2.551 18135 8682 1 10 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.188 -0.253 18135 8683 1 10 . 1 1 20 20 GLN C C 20 176.945 176.945 177.198 -0.253 18135 8684 1 10 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.413 0.602 18135 8685 1 10 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.210 -0.736 18135 8686 1 10 . 1 1 20 20 GLN H H 20 7.958 7.958 7.994 -0.036 18135 8687 1 10 . 1 1 21 21 MET N N 21 116.693 116.693 117.420 -0.727 18135 8688 1 10 . 1 1 21 21 MET HA H 21 3.861 3.861 4.408 -0.547 18135 8689 1 10 . 1 1 21 21 MET C C 21 174.671 174.671 175.327 -0.656 18135 8690 1 10 . 1 1 21 21 MET CA C 21 57.111 57.111 57.143 -0.032 18135 8691 1 10 . 1 1 21 21 MET CB C 21 34.073 34.073 33.766 0.307 18135 8692 1 10 . 1 1 21 21 MET H H 21 7.420 7.420 7.873 -0.453 18135 8693 1 10 . 1 1 22 22 ARG N N 22 115.451 115.451 119.863 -4.412 18135 8694 1 10 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.781 0.072 18135 8695 1 10 . 1 1 22 22 ARG C C 22 175.950 175.950 175.113 0.837 18135 8696 1 10 . 1 1 22 22 ARG CA C 22 58.452 58.452 54.886 3.566 18135 8697 1 10 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.584 0.930 18135 8698 1 10 . 1 1 22 22 ARG H H 22 6.484 6.484 7.202 -0.718 18135 8699 1 10 . 1 1 23 23 LYS N N 23 128.593 128.593 123.338 5.255 18135 8700 1 10 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.553 -0.068 18135 8701 1 10 . 1 1 23 23 LYS C C 23 176.643 176.643 174.763 1.880 18135 8702 1 10 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.675 1.612 18135 8703 1 10 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.404 4.857 18135 8704 1 10 . 1 1 23 23 LYS H H 23 10.212 10.212 8.636 1.576 18135 8705 1 10 . 1 1 24 24 ILE N N 24 118.605 118.605 122.939 -4.334 18135 8706 1 10 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.406 0.078 18135 8707 1 10 . 1 1 24 24 ILE C C 24 173.878 173.878 174.538 -0.660 18135 8708 1 10 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.504 -0.907 18135 8709 1 10 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.188 0.268 18135 8710 1 10 . 1 1 24 24 ILE H H 24 8.465 8.465 8.435 0.030 18135 8711 1 10 . 1 1 25 25 SER N N 25 113.658 113.658 118.241 -4.583 18135 8712 1 10 . 1 1 25 25 SER HA H 25 4.481 4.481 4.947 -0.466 18135 8713 1 10 . 1 1 25 25 SER C C 25 176.359 176.359 175.681 0.678 18135 8714 1 10 . 1 1 25 25 SER CA C 25 56.975 56.975 56.804 0.171 18135 8715 1 10 . 1 1 25 25 SER CB C 25 64.759 64.759 63.940 0.819 18135 8716 1 10 . 1 1 25 25 SER H H 25 8.104 8.104 8.659 -0.555 18135 8717 1 10 . 1 1 26 26 LEU N N 26 127.566 127.566 126.346 1.220 18135 8718 1 10 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.246 -0.369 18135 8719 1 10 . 1 1 26 26 LEU C C 26 178.946 178.946 177.816 1.130 18135 8720 1 10 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.392 0.286 18135 8721 1 10 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.812 -0.093 18135 8722 1 10 . 1 1 26 26 LEU H H 26 8.802 8.802 8.978 -0.176 18135 8723 1 10 . 1 1 27 27 PHE N N 27 117.143 117.143 116.770 0.373 18135 8724 1 10 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.694 -0.456 18135 8725 1 10 . 1 1 27 27 PHE C C 27 177.067 177.067 176.850 0.217 18135 8726 1 10 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.527 1.563 18135 8727 1 10 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.218 0.044 18135 8728 1 10 . 1 1 27 27 PHE H H 27 7.986 7.986 7.988 -0.002 18135 8729 1 10 . 1 1 28 28 SER N N 28 115.200 115.200 116.169 -0.969 18135 8730 1 10 . 1 1 28 28 SER HA H 28 4.505 4.505 4.403 0.102 18135 8731 1 10 . 1 1 28 28 SER C C 28 174.533 174.533 174.451 0.082 18135 8732 1 10 . 1 1 28 28 SER CA C 28 59.447 59.447 60.802 -1.355 18135 8733 1 10 . 1 1 28 28 SER CB C 28 63.790 63.790 63.592 0.198 18135 8734 1 10 . 1 1 28 28 SER H H 28 7.929 7.929 8.082 -0.153 18135 8735 1 10 . 1 1 29 29 CYS N N 29 119.870 119.870 118.880 0.990 18135 8736 1 10 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.689 0.393 18135 8737 1 10 . 1 1 29 29 CYS C C 29 176.475 176.475 174.287 2.188 18135 8738 1 10 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.706 -5.277 18135 8739 1 10 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.340 9.902 18135 8740 1 10 . 1 1 29 29 CYS H H 29 7.865 7.865 8.322 -0.457 18135 8741 1 10 . 1 1 30 30 LEU N N 30 122.259 122.259 124.219 -1.960 18135 8742 1 10 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.376 -0.415 18135 8743 1 10 . 1 1 30 30 LEU C C 30 179.774 179.774 178.316 1.458 18135 8744 1 10 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.457 1.846 18135 8745 1 10 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.313 -0.737 18135 8746 1 10 . 1 1 30 30 LEU H H 30 7.812 7.812 8.479 -0.667 18135 8747 1 10 . 1 1 31 31 LYS N N 31 117.731 117.731 116.367 1.364 18135 8748 1 10 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.254 0.436 18135 8749 1 10 . 1 1 31 31 LYS C C 31 176.692 176.692 175.920 0.772 18135 8750 1 10 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.293 -3.216 18135 8751 1 10 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.663 -0.076 18135 8752 1 10 . 1 1 31 31 LYS H H 31 8.597 8.597 8.159 0.438 18135 8753 1 10 . 1 1 32 32 ASP N N 32 117.841 117.841 118.489 -0.648 18135 8754 1 10 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.690 0.004 18135 8755 1 10 . 1 1 32 32 ASP C C 32 175.505 175.505 176.744 -1.239 18135 8756 1 10 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.956 -0.868 18135 8757 1 10 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.740 -0.932 18135 8758 1 10 . 1 1 32 32 ASP H H 32 7.808 7.808 7.698 0.110 18135 8759 1 10 . 1 1 33 33 ARG N N 33 120.876 120.876 117.725 3.151 18135 8760 1 10 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.056 -0.015 18135 8761 1 10 . 1 1 33 33 ARG C C 33 175.286 175.286 176.617 -1.331 18135 8762 1 10 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.648 -0.565 18135 8763 1 10 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.147 -0.134 18135 8764 1 10 . 1 1 33 33 ARG H H 33 7.378 7.378 7.387 -0.009 18135 8765 1 10 . 1 1 34 34 HIS N N 34 120.555 120.555 117.065 3.490 18135 8766 1 10 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.831 -0.619 18135 8767 1 10 . 1 1 34 34 HIS C C 34 170.494 170.494 173.927 -3.433 18135 8768 1 10 . 1 1 34 34 HIS CA C 34 54.607 54.607 56.317 -1.710 18135 8769 1 10 . 1 1 34 34 HIS CB C 34 31.488 31.488 30.003 1.485 18135 8770 1 10 . 1 1 34 34 HIS H H 34 7.974 7.974 7.802 0.172 18135 8771 1 10 . 1 1 35 35 ASP N N 35 125.061 125.061 124.877 0.184 18135 8772 1 10 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.476 0.162 18135 8773 1 10 . 1 1 35 35 ASP C C 35 175.943 175.943 176.817 -0.874 18135 8774 1 10 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.672 -2.303 18135 8775 1 10 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.926 -1.564 18135 8776 1 10 . 1 1 35 35 ASP H H 35 7.805 7.805 8.634 -0.829 18135 8777 1 10 . 1 1 36 36 PHE N N 36 122.860 122.860 119.963 2.897 18135 8778 1 10 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.256 0.069 18135 8779 1 10 . 1 1 36 36 PHE C C 36 176.643 176.643 176.874 -0.231 18135 8780 1 10 . 1 1 36 36 PHE CA C 36 59.639 59.639 59.155 0.484 18135 8781 1 10 . 1 1 36 36 PHE CB C 36 40.691 40.691 38.880 1.811 18135 8782 1 10 . 1 1 36 36 PHE H H 36 8.973 8.973 7.014 1.959 18135 8783 1 10 . 1 1 37 37 GLY N N 37 111.856 111.856 108.782 3.074 18135 8784 1 10 . 1 1 37 37 GLY C C 37 175.185 175.185 174.310 0.875 18135 8785 1 10 . 1 1 37 37 GLY CA C 37 48.143 48.143 45.115 3.028 18135 8786 1 10 . 1 1 37 37 GLY H H 37 8.727 8.727 8.328 0.399 18135 8787 1 10 . 1 1 38 38 PHE N N 38 123.178 123.178 120.303 2.875 18135 8788 1 10 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.709 -0.795 18135 8789 1 10 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.491 2.313 18135 8790 1 10 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.543 0.114 18135 8791 1 10 . 1 1 38 38 PHE H H 38 9.169 9.169 8.176 0.993 18135 8792 1 10 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.455 0.074 18135 8793 1 10 . 1 1 39 39 PRO C C 39 174.634 174.634 176.957 -2.323 18135 8794 1 10 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.741 -1.198 18135 8795 1 10 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.242 -1.538 18135 8796 1 10 . 1 1 40 40 GLN N N 40 123.608 123.608 123.108 0.500 18135 8797 1 10 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.140 -0.521 18135 8798 1 10 . 1 1 40 40 GLN C C 40 176.958 176.958 176.887 0.071 18135 8799 1 10 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.148 -1.075 18135 8800 1 10 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.482 1.335 18135 8801 1 10 . 1 1 40 40 GLN H H 40 7.966 7.966 8.051 -0.085 18135 8802 1 10 . 1 1 41 41 GLU N N 41 119.446 119.446 118.054 1.392 18135 8803 1 10 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.053 0.084 18135 8804 1 10 . 1 1 41 41 GLU C C 41 177.346 177.346 177.309 0.037 18135 8805 1 10 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.580 -0.650 18135 8806 1 10 . 1 1 41 41 GLU CB C 41 27.833 27.833 28.921 -1.087 18135 8807 1 10 . 1 1 41 41 GLU H H 41 9.044 9.044 8.581 0.463 18135 8808 1 10 . 1 1 42 42 GLU N N 42 117.196 117.196 118.241 -1.045 18135 8809 1 10 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.271 -0.208 18135 8810 1 10 . 1 1 42 42 GLU C C 42 174.886 174.886 177.746 -2.860 18135 8811 1 10 . 1 1 42 42 GLU CA C 42 56.384 56.384 56.939 -0.555 18135 8812 1 10 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.166 -2.607 18135 8813 1 10 . 1 1 42 42 GLU H H 42 7.646 7.646 7.889 -0.243 18135 8814 1 10 . 1 1 43 43 PHE N N 43 115.527 115.527 123.099 -7.572 18135 8815 1 10 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.746 -0.260 18135 8816 1 10 . 1 1 43 43 PHE C C 43 175.615 175.615 176.673 -1.058 18135 8817 1 10 . 1 1 43 43 PHE CA C 43 57.548 57.548 59.014 -1.466 18135 8818 1 10 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.246 -0.353 18135 8819 1 10 . 1 1 43 43 PHE H H 43 7.601 7.601 8.841 -1.240 18135 8820 1 10 . 1 1 44 44 GLY N N 44 107.243 107.243 109.526 -2.283 18135 8821 1 10 . 1 1 44 44 GLY C C 44 174.032 174.032 174.054 -0.022 18135 8822 1 10 . 1 1 44 44 GLY CA C 44 45.612 45.612 44.834 0.778 18135 8823 1 10 . 1 1 44 44 GLY H H 44 7.733 7.733 7.870 -0.137 18135 8824 1 10 . 1 1 45 45 ASN N N 45 117.599 117.599 119.071 -1.472 18135 8825 1 10 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.814 -0.263 18135 8826 1 10 . 1 1 45 45 ASN C C 45 175.894 175.894 175.600 0.294 18135 8827 1 10 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.353 1.496 18135 8828 1 10 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.226 -0.807 18135 8829 1 10 . 1 1 45 45 ASN H H 45 8.343 8.343 8.000 0.343 18135 8830 1 10 . 1 1 46 46 GLN N N 46 118.916 118.916 119.100 -0.184 18135 8831 1 10 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.420 -0.338 18135 8832 1 10 . 1 1 46 46 GLN C C 46 175.851 175.851 175.677 0.174 18135 8833 1 10 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.726 0.920 18135 8834 1 10 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.579 0.865 18135 8835 1 10 . 1 1 46 46 GLN H H 46 8.652 8.652 8.081 0.571 18135 8836 1 10 . 1 1 47 47 PHE N N 47 119.511 119.511 120.107 -0.596 18135 8837 1 10 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.466 0.096 18135 8838 1 10 . 1 1 47 47 PHE C C 47 176.258 176.258 175.008 1.250 18135 8839 1 10 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.986 -1.066 18135 8840 1 10 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.619 0.239 18135 8841 1 10 . 1 1 47 47 PHE H H 47 7.904 7.904 8.260 -0.356 18135 8842 1 10 . 1 1 48 48 GLN N N 48 120.127 120.127 117.190 2.937 18135 8843 1 10 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.528 -0.153 18135 8844 1 10 . 1 1 48 48 GLN C C 48 181.265 181.265 176.353 4.912 18135 8845 1 10 . 1 1 48 48 GLN CA C 48 55.576 55.576 53.956 1.620 18135 8846 1 10 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.134 -0.666 18135 8847 1 10 . 1 1 48 48 GLN H H 48 8.255 8.255 7.553 0.702 18135 8848 1 10 . 1 1 49 49 LYS N N 49 121.777 121.777 122.059 -0.282 18135 8849 1 10 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.380 -0.277 18135 8850 1 10 . 1 1 49 49 LYS C C 49 177.968 177.968 177.451 0.517 18135 8851 1 10 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.364 -0.215 18135 8852 1 10 . 1 1 49 49 LYS CB C 49 32.390 32.390 31.995 0.395 18135 8853 1 10 . 1 1 49 49 LYS H H 49 8.426 8.426 8.680 -0.254 18135 8854 1 10 . 1 1 50 50 ALA N N 50 120.573 120.573 119.111 1.462 18135 8855 1 10 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.328 -0.258 18135 8856 1 10 . 1 1 50 50 ALA C C 50 178.697 178.697 177.605 1.092 18135 8857 1 10 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.105 1.663 18135 8858 1 10 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.317 0.557 18135 8859 1 10 . 1 1 50 50 ALA H H 50 8.578 8.578 7.980 0.598 18135 8860 1 10 . 1 1 51 51 GLU N N 51 115.015 115.015 115.871 -0.856 18135 8861 1 10 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.283 -0.017 18135 8862 1 10 . 1 1 51 51 GLU C C 51 176.995 176.995 176.107 0.888 18135 8863 1 10 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.259 -0.266 18135 8864 1 10 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.008 -1.103 18135 8865 1 10 . 1 1 51 51 GLU H H 51 7.907 7.907 8.374 -0.467 18135 8866 1 10 . 1 1 52 52 THR N N 52 111.210 111.210 114.489 -3.279 18135 8867 1 10 . 1 1 52 52 THR HA H 52 4.114 4.114 4.305 -0.191 18135 8868 1 10 . 1 1 52 52 THR C C 52 175.271 175.271 175.954 -0.683 18135 8869 1 10 . 1 1 52 52 THR CA C 52 63.611 63.611 64.621 -1.010 18135 8870 1 10 . 1 1 52 52 THR CB C 52 69.673 69.673 68.392 1.281 18135 8871 1 10 . 1 1 52 52 THR H H 52 7.863 7.863 7.580 0.283 18135 8872 1 10 . 1 1 53 53 ILE N N 53 119.113 119.113 121.548 -2.435 18135 8873 1 10 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.051 -0.187 18135 8874 1 10 . 1 1 53 53 ILE CA C 53 66.907 66.907 66.326 0.581 18135 8875 1 10 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.205 -1.252 18135 8876 1 10 . 1 1 53 53 ILE H H 53 8.341 8.341 8.244 0.097 18135 8877 1 10 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.395 -0.109 18135 8878 1 10 . 1 1 54 54 PRO C C 54 179.655 179.655 178.949 0.706 18135 8879 1 10 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.061 -0.009 18135 8880 1 10 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.366 0.519 18135 8881 1 10 . 1 1 55 55 VAL N N 55 116.355 116.355 116.414 -0.059 18135 8882 1 10 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.877 -0.196 18135 8883 1 10 . 1 1 55 55 VAL C C 55 177.649 177.649 178.055 -0.406 18135 8884 1 10 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.113 0.724 18135 8885 1 10 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.276 1.195 18135 8886 1 10 . 1 1 55 55 VAL H H 55 7.119 7.119 7.568 -0.449 18135 8887 1 10 . 1 1 56 56 LEU N N 56 123.038 123.038 121.633 1.405 18135 8888 1 10 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.053 0.257 18135 8889 1 10 . 1 1 56 56 LEU C C 56 178.637 178.637 177.571 1.066 18135 8890 1 10 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.415 -0.329 18135 8891 1 10 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.291 1.026 18135 8892 1 10 . 1 1 56 56 LEU H H 56 8.535 8.535 8.479 0.056 18135 8893 1 10 . 1 1 57 57 HIS N N 57 117.041 117.041 118.201 -1.160 18135 8894 1 10 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.003 -0.217 18135 8895 1 10 . 1 1 57 57 HIS C C 57 175.640 175.640 177.646 -2.006 18135 8896 1 10 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.875 0.656 18135 8897 1 10 . 1 1 57 57 HIS CB C 57 28.209 28.209 29.953 -1.744 18135 8898 1 10 . 1 1 57 57 HIS H H 57 9.047 9.047 8.053 0.994 18135 8899 1 10 . 1 1 58 58 GLU N N 58 119.521 119.521 118.450 1.071 18135 8900 1 10 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.769 0.238 18135 8901 1 10 . 1 1 58 58 GLU C C 58 179.029 179.029 178.678 0.351 18135 8902 1 10 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.244 -0.277 18135 8903 1 10 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.329 -1.039 18135 8904 1 10 . 1 1 58 58 GLU H H 58 7.860 7.860 8.110 -0.250 18135 8905 1 10 . 1 1 59 59 MET N N 59 119.512 119.512 120.383 -0.871 18135 8906 1 10 . 1 1 59 59 MET HA H 59 4.074 4.074 4.225 -0.151 18135 8907 1 10 . 1 1 59 59 MET C C 59 177.031 177.031 178.760 -1.729 18135 8908 1 10 . 1 1 59 59 MET CA C 59 59.408 59.408 59.490 -0.082 18135 8909 1 10 . 1 1 59 59 MET CB C 59 32.525 32.525 32.867 -0.342 18135 8910 1 10 . 1 1 59 59 MET H H 59 8.442 8.442 7.941 0.501 18135 8911 1 10 . 1 1 60 60 ILE N N 60 117.183 117.183 118.145 -0.962 18135 8912 1 10 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.472 -0.055 18135 8913 1 10 . 1 1 60 60 ILE C C 60 177.524 177.524 178.101 -0.577 18135 8914 1 10 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.914 0.412 18135 8915 1 10 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.171 -0.311 18135 8916 1 10 . 1 1 60 60 ILE H H 60 8.338 8.338 7.744 0.594 18135 8917 1 10 . 1 1 61 61 GLN N N 61 120.191 120.191 119.690 0.501 18135 8918 1 10 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.717 -0.015 18135 8919 1 10 . 1 1 61 61 GLN C C 61 178.270 178.270 177.749 0.521 18135 8920 1 10 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.236 -0.450 18135 8921 1 10 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.094 0.572 18135 8922 1 10 . 1 1 61 61 GLN H H 61 8.234 8.234 8.074 0.160 18135 8923 1 10 . 1 1 62 62 GLN N N 62 116.795 116.795 118.891 -2.096 18135 8924 1 10 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.261 0.366 18135 8925 1 10 . 1 1 62 62 GLN C C 62 179.685 179.685 178.342 1.343 18135 8926 1 10 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.432 -0.424 18135 8927 1 10 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.954 -3.612 18135 8928 1 10 . 1 1 62 62 GLN H H 62 8.421 8.421 8.027 0.394 18135 8929 1 10 . 1 1 63 63 ILE N N 63 122.797 122.797 120.036 2.761 18135 8930 1 10 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.930 -0.281 18135 8931 1 10 . 1 1 63 63 ILE C C 63 177.279 177.279 177.880 -0.601 18135 8932 1 10 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.632 2.333 18135 8933 1 10 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.812 -0.498 18135 8934 1 10 . 1 1 63 63 ILE H H 63 8.164 8.164 7.571 0.593 18135 8935 1 10 . 1 1 64 64 PHE N N 64 120.820 120.820 121.146 -0.326 18135 8936 1 10 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.408 -0.692 18135 8937 1 10 . 1 1 64 64 PHE C C 64 178.402 178.402 176.480 1.922 18135 8938 1 10 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.140 1.012 18135 8939 1 10 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.829 -0.319 18135 8940 1 10 . 1 1 64 64 PHE H H 64 8.405 8.405 7.903 0.502 18135 8941 1 10 . 1 1 65 65 ASN N N 65 119.981 119.981 117.804 2.177 18135 8942 1 10 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.709 0.354 18135 8943 1 10 . 1 1 65 65 ASN C C 65 177.944 177.944 177.582 0.362 18135 8944 1 10 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.063 -0.195 18135 8945 1 10 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.681 -1.425 18135 8946 1 10 . 1 1 65 65 ASN H H 65 8.812 8.812 7.898 0.914 18135 8947 1 10 . 1 1 66 66 LEU N N 66 121.533 121.533 120.797 0.736 18135 8948 1 10 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.211 0.012 18135 8949 1 10 . 1 1 66 66 LEU C C 66 177.777 177.777 178.152 -0.375 18135 8950 1 10 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.680 0.588 18135 8951 1 10 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.111 0.496 18135 8952 1 10 . 1 1 66 66 LEU H H 66 8.177 8.177 7.940 0.237 18135 8953 1 10 . 1 1 67 67 PHE N N 67 110.842 110.842 112.803 -1.961 18135 8954 1 10 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.629 0.251 18135 8955 1 10 . 1 1 67 67 PHE C C 67 177.965 177.965 176.258 1.707 18135 8956 1 10 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.477 1.057 18135 8957 1 10 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.963 -0.347 18135 8958 1 10 . 1 1 67 67 PHE H H 67 8.160 8.160 8.256 -0.096 18135 8959 1 10 . 1 1 68 68 SER N N 68 119.131 119.131 112.980 6.151 18135 8960 1 10 . 1 1 68 68 SER HA H 68 4.580 4.580 4.268 0.312 18135 8961 1 10 . 1 1 68 68 SER C C 68 173.472 173.472 175.156 -1.684 18135 8962 1 10 . 1 1 68 68 SER CA C 68 59.191 59.191 58.836 0.355 18135 8963 1 10 . 1 1 68 68 SER CB C 68 63.123 63.123 63.372 -0.249 18135 8964 1 10 . 1 1 68 68 SER H H 68 8.016 8.016 7.426 0.590 18135 8965 1 10 . 1 1 69 69 THR N N 69 111.353 111.353 114.917 -3.564 18135 8966 1 10 . 1 1 69 69 THR HA H 69 4.345 4.345 4.320 0.025 18135 8967 1 10 . 1 1 69 69 THR C C 69 175.661 175.661 174.729 0.932 18135 8968 1 10 . 1 1 69 69 THR CA C 69 61.411 61.411 60.516 0.895 18135 8969 1 10 . 1 1 69 69 THR CB C 69 72.209 72.209 70.516 1.693 18135 8970 1 10 . 1 1 69 69 THR H H 69 6.977 6.977 7.312 -0.335 18135 8971 1 10 . 1 1 70 70 LYS N N 70 121.120 121.120 122.927 -1.807 18135 8972 1 10 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.122 -0.033 18135 8973 1 10 . 1 1 70 70 LYS C C 70 179.259 179.259 177.445 1.814 18135 8974 1 10 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.974 -1.018 18135 8975 1 10 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.359 -0.609 18135 8976 1 10 . 1 1 70 70 LYS H H 70 9.065 9.065 8.564 0.501 18135 8977 1 10 . 1 1 71 71 ASP N N 71 116.374 116.374 120.245 -3.871 18135 8978 1 10 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.285 -0.110 18135 8979 1 10 . 1 1 71 71 ASP C C 71 178.372 178.372 177.297 1.075 18135 8980 1 10 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.196 -0.129 18135 8981 1 10 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.506 -0.200 18135 8982 1 10 . 1 1 71 71 ASP H H 71 7.518 7.518 7.965 -0.447 18135 8983 1 10 . 1 1 72 72 SER N N 72 117.341 117.341 113.785 3.556 18135 8984 1 10 . 1 1 72 72 SER HA H 72 3.715 3.715 3.253 0.462 18135 8985 1 10 . 1 1 72 72 SER C C 72 176.897 176.897 175.814 1.083 18135 8986 1 10 . 1 1 72 72 SER CA C 72 60.267 60.267 61.025 -0.758 18135 8987 1 10 . 1 1 72 72 SER CB C 72 62.616 62.616 63.549 -0.933 18135 8988 1 10 . 1 1 72 72 SER H H 72 8.066 8.066 7.665 0.401 18135 8989 1 10 . 1 1 73 73 SER N N 73 113.398 113.398 119.342 -5.944 18135 8990 1 10 . 1 1 73 73 SER HA H 73 4.094 4.094 4.094 -0.000 18135 8991 1 10 . 1 1 73 73 SER C C 73 174.855 174.855 175.520 -0.665 18135 8992 1 10 . 1 1 73 73 SER CA C 73 61.385 61.385 61.319 0.066 18135 8993 1 10 . 1 1 73 73 SER CB C 73 62.798 62.798 63.098 -0.300 18135 8994 1 10 . 1 1 73 73 SER H H 73 7.982 7.982 7.505 0.477 18135 8995 1 10 . 1 1 74 74 ALA N N 74 119.486 119.486 119.615 -0.129 18135 8996 1 10 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.232 -0.075 18135 8997 1 10 . 1 1 74 74 ALA C C 74 177.626 177.626 177.240 0.386 18135 8998 1 10 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.809 -0.096 18135 8999 1 10 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.800 -0.053 18135 9000 1 10 . 1 1 74 74 ALA H H 74 7.095 7.095 7.866 -0.771 18135 9001 1 10 . 1 1 75 75 ALA N N 75 121.465 121.465 121.636 -0.171 18135 9002 1 10 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.696 0.000 18135 9003 1 10 . 1 1 75 75 ALA C C 75 177.197 177.197 176.157 1.040 18135 9004 1 10 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.299 0.705 18135 9005 1 10 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.863 -0.603 18135 9006 1 10 . 1 1 75 75 ALA H H 75 7.159 7.159 7.434 -0.275 18135 9007 1 10 . 1 1 76 76 TRP N N 76 116.791 116.791 116.471 0.320 18135 9008 1 10 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.722 0.328 18135 9009 1 10 . 1 1 76 76 TRP C C 76 177.617 177.617 174.867 2.750 18135 9010 1 10 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.127 -1.808 18135 9011 1 10 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.873 2.203 18135 9012 1 10 . 1 1 76 76 TRP H H 76 7.080 7.080 7.080 -0.000 18135 9013 1 10 . 1 1 77 77 ASP N N 77 119.928 119.928 121.387 -1.459 18135 9014 1 10 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.496 -0.139 18135 9015 1 10 . 1 1 77 77 ASP C C 77 176.877 176.877 177.621 -0.744 18135 9016 1 10 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.468 -0.650 18135 9017 1 10 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.511 0.104 18135 9018 1 10 . 1 1 77 77 ASP H H 77 8.259 8.259 8.791 -0.532 18135 9019 1 10 . 1 1 78 78 GLU N N 78 127.277 127.277 127.174 0.103 18135 9020 1 10 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.957 -0.072 18135 9021 1 10 . 1 1 78 78 GLU C C 78 177.439 177.439 177.967 -0.528 18135 9022 1 10 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.836 -0.452 18135 9023 1 10 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.378 -0.736 18135 9024 1 10 . 1 1 78 78 GLU H H 78 8.920 8.920 8.883 0.037 18135 9025 1 10 . 1 1 79 79 THR N N 79 115.422 115.422 116.304 -0.882 18135 9026 1 10 . 1 1 79 79 THR HA H 79 3.907 3.907 4.079 -0.172 18135 9027 1 10 . 1 1 79 79 THR C C 79 177.330 177.330 176.179 1.151 18135 9028 1 10 . 1 1 79 79 THR CA C 79 66.263 66.263 66.345 -0.082 18135 9029 1 10 . 1 1 79 79 THR CB C 79 68.002 68.002 68.545 -0.543 18135 9030 1 10 . 1 1 79 79 THR H H 79 8.124 8.124 8.171 -0.047 18135 9031 1 10 . 1 1 80 80 LEU N N 80 121.791 121.791 122.644 -0.853 18135 9032 1 10 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.092 -0.205 18135 9033 1 10 . 1 1 80 80 LEU C C 80 179.018 179.018 178.791 0.227 18135 9034 1 10 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.406 -0.167 18135 9035 1 10 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.063 0.589 18135 9036 1 10 . 1 1 80 80 LEU H H 80 7.725 7.725 7.734 -0.009 18135 9037 1 10 . 1 1 81 81 LEU N N 81 119.280 119.280 120.763 -1.483 18135 9038 1 10 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.211 -0.722 18135 9039 1 10 . 1 1 81 81 LEU C C 81 177.062 177.062 178.953 -1.891 18135 9040 1 10 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.722 -1.013 18135 9041 1 10 . 1 1 81 81 LEU CB C 81 40.948 40.948 41.983 -1.035 18135 9042 1 10 . 1 1 81 81 LEU H H 81 8.344 8.344 8.783 -0.439 18135 9043 1 10 . 1 1 82 82 ASP N N 82 115.357 115.357 119.903 -4.546 18135 9044 1 10 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.460 -0.186 18135 9045 1 10 . 1 1 82 82 ASP C C 82 179.018 179.018 178.900 0.118 18135 9046 1 10 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.449 -0.634 18135 9047 1 10 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.260 -2.038 18135 9048 1 10 . 1 1 82 82 ASP H H 82 8.001 8.001 8.566 -0.565 18135 9049 1 10 . 1 1 83 83 LYS N N 83 119.603 119.603 119.023 0.580 18135 9050 1 10 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.917 0.065 18135 9051 1 10 . 1 1 83 83 LYS C C 83 178.624 178.624 178.897 -0.273 18135 9052 1 10 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.837 0.908 18135 9053 1 10 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.365 0.741 18135 9054 1 10 . 1 1 83 83 LYS H H 83 7.342 7.342 7.706 -0.364 18135 9055 1 10 . 1 1 84 84 PHE N N 84 123.933 123.933 122.006 1.927 18135 9056 1 10 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.049 -0.014 18135 9057 1 10 . 1 1 84 84 PHE C C 84 177.210 177.210 176.972 0.238 18135 9058 1 10 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.785 -1.442 18135 9059 1 10 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.957 0.359 18135 9060 1 10 . 1 1 84 84 PHE H H 84 8.471 8.471 8.492 -0.021 18135 9061 1 10 . 1 1 85 85 TYR N N 85 118.387 118.387 117.840 0.547 18135 9062 1 10 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.734 0.334 18135 9063 1 10 . 1 1 85 85 TYR C C 85 178.104 178.104 177.322 0.782 18135 9064 1 10 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.828 -1.251 18135 9065 1 10 . 1 1 85 85 TYR CB C 85 36.977 36.977 36.992 -0.015 18135 9066 1 10 . 1 1 85 85 TYR H H 85 9.011 9.011 8.992 0.019 18135 9067 1 10 . 1 1 86 86 THR N N 86 114.035 114.035 116.935 -2.900 18135 9068 1 10 . 1 1 86 86 THR HA H 86 3.945 3.945 3.178 0.767 18135 9069 1 10 . 1 1 86 86 THR C C 86 176.708 176.708 176.371 0.337 18135 9070 1 10 . 1 1 86 86 THR CA C 86 66.759 66.759 66.912 -0.153 18135 9071 1 10 . 1 1 86 86 THR CB C 86 68.853 68.853 68.033 0.820 18135 9072 1 10 . 1 1 86 86 THR H H 86 7.609 7.609 7.335 0.274 18135 9073 1 10 . 1 1 87 87 GLU N N 87 120.790 120.790 121.865 -1.075 18135 9074 1 10 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.872 0.175 18135 9075 1 10 . 1 1 87 87 GLU C C 87 179.606 179.606 178.870 0.736 18135 9076 1 10 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.592 -1.194 18135 9077 1 10 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.380 -1.094 18135 9078 1 10 . 1 1 87 87 GLU H H 87 7.712 7.712 7.597 0.115 18135 9079 1 10 . 1 1 88 88 LEU N N 88 120.729 120.729 119.870 0.859 18135 9080 1 10 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.923 -0.195 18135 9081 1 10 . 1 1 88 88 LEU C C 88 178.695 178.695 179.181 -0.486 18135 9082 1 10 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.266 0.985 18135 9083 1 10 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.051 1.536 18135 9084 1 10 . 1 1 88 88 LEU H H 88 8.393 8.393 7.440 0.953 18135 9085 1 10 . 1 1 89 89 TYR N N 89 118.654 118.654 118.804 -0.150 18135 9086 1 10 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.057 -0.126 18135 9087 1 10 . 1 1 89 89 TYR C C 89 178.438 178.438 178.542 -0.104 18135 9088 1 10 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.307 0.100 18135 9089 1 10 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.417 0.450 18135 9090 1 10 . 1 1 89 89 TYR H H 89 8.637 8.637 8.309 0.328 18135 9091 1 10 . 1 1 90 90 GLN N N 90 118.263 118.263 116.550 1.713 18135 9092 1 10 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.983 0.003 18135 9093 1 10 . 1 1 90 90 GLN C C 90 178.411 178.411 178.699 -0.288 18135 9094 1 10 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.692 0.090 18135 9095 1 10 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.334 -0.187 18135 9096 1 10 . 1 1 90 90 GLN H H 90 7.796 7.796 7.808 -0.012 18135 9097 1 10 . 1 1 91 91 GLN N N 91 117.959 117.959 120.126 -2.167 18135 9098 1 10 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.037 0.045 18135 9099 1 10 . 1 1 91 91 GLN C C 91 178.705 178.705 178.518 0.187 18135 9100 1 10 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.880 -0.060 18135 9101 1 10 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.331 0.842 18135 9102 1 10 . 1 1 91 91 GLN H H 91 7.727 7.727 8.129 -0.402 18135 9103 1 10 . 1 1 92 92 LEU N N 92 119.965 119.965 118.277 1.688 18135 9104 1 10 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.960 -0.226 18135 9105 1 10 . 1 1 92 92 LEU C C 92 178.984 178.984 178.643 0.341 18135 9106 1 10 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.901 -0.409 18135 9107 1 10 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.849 0.530 18135 9108 1 10 . 1 1 92 92 LEU H H 92 8.465 8.465 8.421 0.044 18135 9109 1 10 . 1 1 93 93 ASN N N 93 117.793 117.793 118.358 -0.565 18135 9110 1 10 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.223 0.178 18135 9111 1 10 . 1 1 93 93 ASN C C 93 178.309 178.309 177.061 1.248 18135 9112 1 10 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.354 0.049 18135 9113 1 10 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.182 0.456 18135 9114 1 10 . 1 1 93 93 ASN H H 93 8.091 8.091 8.002 0.089 18135 9115 1 10 . 1 1 94 94 ASP N N 94 121.133 121.133 120.396 0.737 18135 9116 1 10 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.387 0.018 18135 9117 1 10 . 1 1 94 94 ASP C C 94 178.328 178.328 178.475 -0.147 18135 9118 1 10 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.041 -0.494 18135 9119 1 10 . 1 1 94 94 ASP CB C 94 38.649 38.649 41.214 -2.565 18135 9120 1 10 . 1 1 94 94 ASP H H 94 8.362 8.362 7.916 0.446 18135 9121 1 10 . 1 1 95 95 LEU N N 95 119.160 119.160 120.915 -1.755 18135 9122 1 10 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.863 0.176 18135 9123 1 10 . 1 1 95 95 LEU C C 95 178.826 178.826 178.704 0.122 18135 9124 1 10 . 1 1 95 95 LEU CA C 95 57.027 57.027 57.817 -0.790 18135 9125 1 10 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.027 0.183 18135 9126 1 10 . 1 1 95 95 LEU H H 95 8.143 8.143 8.507 -0.364 18135 9127 1 10 . 1 1 96 96 GLU N N 96 118.813 118.813 118.906 -0.093 18135 9128 1 10 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.813 0.148 18135 9129 1 10 . 1 1 96 96 GLU C C 96 177.640 177.640 178.097 -0.457 18135 9130 1 10 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.237 -1.523 18135 9131 1 10 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.600 -1.462 18135 9132 1 10 . 1 1 96 96 GLU H H 96 8.111 8.111 8.275 -0.164 18135 9133 1 10 . 1 1 97 97 ALA N N 97 120.549 120.549 121.773 -1.224 18135 9134 1 10 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.945 0.177 18135 9135 1 10 . 1 1 97 97 ALA C C 97 179.126 179.126 180.244 -1.118 18135 9136 1 10 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.733 -0.700 18135 9137 1 10 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.891 0.089 18135 9138 1 10 . 1 1 97 97 ALA H H 97 7.798 7.798 7.750 0.048 18135 9139 1 10 . 1 1 98 98 CYS N N 98 115.510 115.510 117.245 -1.735 18135 9140 1 10 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.115 0.335 18135 9141 1 10 . 1 1 98 98 CYS C C 98 175.363 175.363 176.470 -1.107 18135 9142 1 10 . 1 1 98 98 CYS CA C 98 57.166 57.166 63.119 -5.953 18135 9143 1 10 . 1 1 98 98 CYS CB C 98 41.879 41.879 25.834 16.045 18135 9144 1 10 . 1 1 98 98 CYS H H 98 7.597 7.597 8.274 -0.677 18135 9145 1 10 . 1 1 99 99 VAL N N 99 121.713 121.713 119.549 2.164 18135 9146 1 10 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.911 -0.117 18135 9147 1 10 . 1 1 99 99 VAL C C 99 177.357 177.357 177.664 -0.307 18135 9148 1 10 . 1 1 99 99 VAL CA C 99 64.583 64.583 64.985 -0.402 18135 9149 1 10 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.068 -0.037 18135 9150 1 10 . 1 1 99 99 VAL H H 99 7.828 7.828 7.505 0.323 18135 9151 1 10 . 1 1 100 100 ILE N N 100 122.333 122.333 121.811 0.522 18135 9152 1 10 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.777 0.147 18135 9153 1 10 . 1 1 100 100 ILE C C 100 176.827 176.827 177.446 -0.619 18135 9154 1 10 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.910 -1.672 18135 9155 1 10 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.760 0.518 18135 9156 1 10 . 1 1 100 100 ILE H H 100 8.067 8.067 8.623 -0.556 18135 9157 1 10 . 1 1 101 101 GLN N N 101 121.864 121.864 117.137 4.727 18135 9158 1 10 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.346 -0.120 18135 9159 1 10 . 1 1 101 101 GLN C C 101 176.438 176.438 176.867 -0.429 18135 9160 1 10 . 1 1 101 101 GLN CA C 101 56.320 56.320 54.878 1.442 18135 9161 1 10 . 1 1 101 101 GLN CB C 101 29.011 29.011 28.500 0.511 18135 9162 1 10 . 1 1 101 101 GLN H H 101 8.062 8.062 7.656 0.406 18135 9163 1 10 . 1 1 102 102 GLY N N 102 109.288 109.288 108.544 0.744 18135 9164 1 10 . 1 1 102 102 GLY C C 102 173.855 173.855 175.497 -1.642 18135 9165 1 10 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.454 -1.295 18135 9166 1 10 . 1 1 102 102 GLY H H 102 8.087 8.087 8.261 -0.174 18135 9167 1 10 . 1 1 103 103 VAL N N 103 118.932 118.932 114.506 4.426 18135 9168 1 10 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.806 0.268 18135 9169 1 10 . 1 1 103 103 VAL C C 103 176.299 176.299 176.327 -0.028 18135 9170 1 10 . 1 1 103 103 VAL CA C 103 62.499 62.499 64.717 -2.218 18135 9171 1 10 . 1 1 103 103 VAL CB C 103 32.854 32.854 30.754 2.100 18135 9172 1 10 . 1 1 103 103 VAL H H 103 8.079 8.079 7.406 0.673 18135 9173 1 10 . 1 1 104 104 GLY N N 104 112.028 112.028 108.070 3.958 18135 9174 1 10 . 1 1 104 104 GLY C C 104 173.694 173.694 173.987 -0.293 18135 9175 1 10 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.334 0.069 18135 9176 1 10 . 1 1 104 104 GLY H H 104 8.446 8.446 8.415 0.031 18135 9177 1 10 . 1 1 105 105 VAL N N 105 120.439 120.439 121.088 -0.649 18135 9178 1 10 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.344 -0.156 18135 9179 1 10 . 1 1 105 105 VAL C C 105 175.963 175.963 174.429 1.534 18135 9180 1 10 . 1 1 105 105 VAL CA C 105 62.136 62.136 62.012 0.124 18135 9181 1 10 . 1 1 105 105 VAL CB C 105 32.814 32.814 35.334 -2.519 18135 9182 1 10 . 1 1 105 105 VAL H H 105 7.867 7.867 7.638 0.229 18135 9183 1 10 . 1 1 106 106 THR N N 106 116.366 116.366 117.538 -1.172 18135 9184 1 10 . 1 1 106 106 THR HA H 106 4.548 4.548 4.542 0.006 18135 9185 1 10 . 1 1 106 106 THR C C 106 173.731 173.731 173.914 -0.183 18135 9186 1 10 . 1 1 106 106 THR CA C 106 59.419 59.419 60.184 -0.765 18135 9187 1 10 . 1 1 106 106 THR CB C 106 79.536 79.536 70.804 8.732 18135 9188 1 10 . 1 1 106 106 THR H H 106 8.565 8.565 8.013 0.552 18135 9189 1 10 . 1 1 107 107 GLU N N 107 119.743 119.743 119.563 0.180 18135 9190 1 10 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.659 -0.197 18135 9191 1 10 . 1 1 107 107 GLU C C 107 175.639 175.639 176.369 -0.730 18135 9192 1 10 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.984 0.727 18135 9193 1 10 . 1 1 107 107 GLU CB C 107 30.499 30.499 30.998 -0.499 18135 9194 1 10 . 1 1 107 107 GLU H H 107 8.410 8.410 8.340 0.070 18135 9195 1 10 . 1 1 108 108 THR N N 108 114.402 114.402 112.152 2.250 18135 9196 1 10 . 1 1 108 108 THR HA H 108 4.448 4.448 4.640 -0.192 18135 9197 1 10 . 1 1 108 108 THR CA C 108 60.348 60.348 59.142 1.206 18135 9198 1 10 . 1 1 108 108 THR CB C 108 68.544 68.544 69.097 -0.553 18135 9199 1 10 . 1 1 108 108 THR H H 108 8.155 8.155 8.236 -0.081 18135 9200 1 10 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.416 -0.178 18135 9201 1 10 . 1 1 109 109 PRO C C 109 178.666 178.666 178.138 0.528 18135 9202 1 10 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.308 1.068 18135 9203 1 10 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.931 -0.083 18135 9204 1 10 . 1 1 110 110 LEU N N 110 118.566 118.566 119.174 -0.608 18135 9205 1 10 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.134 -0.018 18135 9206 1 10 . 1 1 110 110 LEU C C 110 178.293 178.293 178.716 -0.423 18135 9207 1 10 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.955 -1.268 18135 9208 1 10 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.743 0.226 18135 9209 1 10 . 1 1 110 110 LEU H H 110 8.016 8.016 7.810 0.206 18135 9210 1 10 . 1 1 111 111 MET N N 111 118.982 118.982 115.775 3.207 18135 9211 1 10 . 1 1 111 111 MET HA H 111 4.210 4.210 4.324 -0.114 18135 9212 1 10 . 1 1 111 111 MET C C 111 178.720 178.720 177.928 0.792 18135 9213 1 10 . 1 1 111 111 MET CA C 111 58.144 58.144 57.078 1.066 18135 9214 1 10 . 1 1 111 111 MET CB C 111 32.374 32.374 32.528 -0.154 18135 9215 1 10 . 1 1 111 111 MET H H 111 7.705 7.705 7.900 -0.195 18135 9216 1 10 . 1 1 112 112 LYS N N 112 121.377 121.377 120.499 0.878 18135 9217 1 10 . 1 1 112 112 LYS HA H 112 4.108 4.108 3.949 0.159 18135 9218 1 10 . 1 1 112 112 LYS C C 112 178.000 178.000 178.164 -0.164 18135 9219 1 10 . 1 1 112 112 LYS CA C 112 56.305 56.305 59.450 -3.145 18135 9220 1 10 . 1 1 112 112 LYS CB C 112 32.367 32.367 31.865 0.502 18135 9221 1 10 . 1 1 112 112 LYS H H 112 8.257 8.257 7.798 0.459 18135 9222 1 10 . 1 1 113 113 GLU N N 113 119.104 119.104 117.698 1.406 18135 9223 1 10 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.029 0.037 18135 9224 1 10 . 1 1 113 113 GLU C C 113 178.289 178.289 178.893 -0.604 18135 9225 1 10 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.839 -1.586 18135 9226 1 10 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.080 -0.942 18135 9227 1 10 . 1 1 113 113 GLU H H 113 8.270 8.270 7.844 0.426 18135 9228 1 10 . 1 1 114 114 ASP N N 114 119.224 119.224 121.003 -1.779 18135 9229 1 10 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.399 -0.111 18135 9230 1 10 . 1 1 114 114 ASP C C 114 178.365 178.365 178.448 -0.083 18135 9231 1 10 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.359 -1.251 18135 9232 1 10 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.585 -2.350 18135 9233 1 10 . 1 1 114 114 ASP H H 114 8.618 8.618 7.847 0.771 18135 9234 1 10 . 1 1 115 115 SER N N 115 118.195 118.195 115.936 2.259 18135 9235 1 10 . 1 1 115 115 SER HA H 115 4.200 4.200 4.155 0.045 18135 9236 1 10 . 1 1 115 115 SER C C 115 175.986 175.986 176.707 -0.721 18135 9237 1 10 . 1 1 115 115 SER CA C 115 61.588 61.588 62.324 -0.736 18135 9238 1 10 . 1 1 115 115 SER CB C 115 62.653 62.653 63.308 -0.655 18135 9239 1 10 . 1 1 115 115 SER H H 115 8.181 8.181 7.557 0.624 18135 9240 1 10 . 1 1 116 116 ILE N N 116 123.340 123.340 121.244 2.096 18135 9241 1 10 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.866 -0.240 18135 9242 1 10 . 1 1 116 116 ILE C C 116 178.367 178.367 177.972 0.395 18135 9243 1 10 . 1 1 116 116 ILE CA C 116 64.817 64.817 64.138 0.679 18135 9244 1 10 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.678 0.740 18135 9245 1 10 . 1 1 116 116 ILE H H 116 7.773 7.773 8.164 -0.391 18135 9246 1 10 . 1 1 117 117 LEU N N 117 120.968 120.968 121.998 -1.030 18135 9247 1 10 . 1 1 117 117 LEU HA H 117 3.905 3.905 4.018 -0.113 18135 9248 1 10 . 1 1 117 117 LEU C C 117 178.746 178.746 178.442 0.304 18135 9249 1 10 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.502 -0.359 18135 9250 1 10 . 1 1 117 117 LEU CB C 117 41.586 41.586 40.914 0.672 18135 9251 1 10 . 1 1 117 117 LEU H H 117 8.406 8.406 8.232 0.174 18135 9252 1 10 . 1 1 118 118 ALA N N 118 120.150 120.150 122.338 -2.188 18135 9253 1 10 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.998 0.114 18135 9254 1 10 . 1 1 118 118 ALA C C 118 181.633 181.633 179.737 1.896 18135 9255 1 10 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.467 -0.154 18135 9256 1 10 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.555 -0.445 18135 9257 1 10 . 1 1 118 118 ALA H H 118 7.894 7.894 8.238 -0.344 18135 9258 1 10 . 1 1 119 119 VAL N N 119 118.873 118.873 116.372 2.501 18135 9259 1 10 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.593 0.162 18135 9260 1 10 . 1 1 119 119 VAL C C 119 177.896 177.896 177.847 0.049 18135 9261 1 10 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.353 1.827 18135 9262 1 10 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.152 1.742 18135 9263 1 10 . 1 1 119 119 VAL H H 119 7.572 7.572 7.988 -0.416 18135 9264 1 10 . 1 1 120 120 ARG N N 120 121.436 121.436 120.616 0.820 18135 9265 1 10 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.108 -0.081 18135 9266 1 10 . 1 1 120 120 ARG C C 120 179.848 179.848 178.976 0.872 18135 9267 1 10 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.115 2.152 18135 9268 1 10 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.437 0.258 18135 9269 1 10 . 1 1 120 120 ARG H H 120 8.629 8.629 8.043 0.586 18135 9270 1 10 . 1 1 121 121 LYS N N 121 119.589 119.589 119.742 -0.153 18135 9271 1 10 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.006 0.068 18135 9272 1 10 . 1 1 121 121 LYS C C 121 178.331 178.331 179.192 -0.861 18135 9273 1 10 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.778 0.662 18135 9274 1 10 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.326 -0.219 18135 9275 1 10 . 1 1 121 121 LYS H H 121 9.015 9.015 8.107 0.908 18135 9276 1 10 . 1 1 122 122 TYR N N 122 121.546 121.546 120.483 1.063 18135 9277 1 10 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.033 0.299 18135 9278 1 10 . 1 1 122 122 TYR C C 122 176.527 176.527 177.764 -1.237 18135 9279 1 10 . 1 1 122 122 TYR CA C 122 60.404 60.404 61.748 -1.344 18135 9280 1 10 . 1 1 122 122 TYR CB C 122 37.725 37.725 38.370 -0.645 18135 9281 1 10 . 1 1 122 122 TYR H H 122 7.473 7.473 7.942 -0.469 18135 9282 1 10 . 1 1 123 123 PHE N N 123 116.026 116.026 119.207 -3.181 18135 9283 1 10 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.929 -0.189 18135 9284 1 10 . 1 1 123 123 PHE C C 123 179.005 179.005 177.530 1.475 18135 9285 1 10 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.562 2.966 18135 9286 1 10 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.731 0.600 18135 9287 1 10 . 1 1 123 123 PHE H H 123 7.932 7.932 8.478 -0.546 18135 9288 1 10 . 1 1 124 124 GLN N N 124 123.043 123.043 118.942 4.101 18135 9289 1 10 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.447 0.732 18135 9290 1 10 . 1 1 124 124 GLN C C 124 178.772 178.772 178.369 0.403 18135 9291 1 10 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.034 0.282 18135 9292 1 10 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.216 -0.585 18135 9293 1 10 . 1 1 124 124 GLN H H 124 8.470 8.470 8.636 -0.166 18135 9294 1 10 . 1 1 125 125 ARG N N 125 120.342 120.342 118.934 1.408 18135 9295 1 10 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.135 -0.057 18135 9296 1 10 . 1 1 125 125 ARG C C 125 180.340 180.340 179.114 1.226 18135 9297 1 10 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.365 2.932 18135 9298 1 10 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.864 0.461 18135 9299 1 10 . 1 1 125 125 ARG H H 125 8.137 8.137 8.104 0.033 18135 9300 1 10 . 1 1 126 126 ILE N N 126 121.876 121.876 121.508 0.368 18135 9301 1 10 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.501 -0.150 18135 9302 1 10 . 1 1 126 126 ILE C C 126 176.857 176.857 177.817 -0.960 18135 9303 1 10 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.875 0.957 18135 9304 1 10 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.666 0.618 18135 9305 1 10 . 1 1 126 126 ILE H H 126 7.526 7.526 8.249 -0.723 18135 9306 1 10 . 1 1 127 127 THR N N 127 115.613 115.613 115.080 0.533 18135 9307 1 10 . 1 1 127 127 THR HA H 127 3.633 3.633 3.810 -0.177 18135 9308 1 10 . 1 1 127 127 THR C C 127 176.645 176.645 177.015 -0.370 18135 9309 1 10 . 1 1 127 127 THR CA C 127 67.294 67.294 66.582 0.712 18135 9310 1 10 . 1 1 127 127 THR CB C 127 68.871 68.871 68.856 0.015 18135 9311 1 10 . 1 1 127 127 THR H H 127 8.288 8.288 8.068 0.220 18135 9312 1 10 . 1 1 128 128 LEU N N 128 122.627 122.627 122.288 0.339 18135 9313 1 10 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.935 0.021 18135 9314 1 10 . 1 1 128 128 LEU C C 128 178.331 178.331 177.514 0.817 18135 9315 1 10 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.831 0.257 18135 9316 1 10 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.271 0.303 18135 9317 1 10 . 1 1 128 128 LEU H H 128 8.263 8.263 7.878 0.385 18135 9318 1 10 . 1 1 129 129 TYR N N 129 120.955 120.955 120.131 0.824 18135 9319 1 10 . 1 1 129 129 TYR HA H 129 3.890 3.890 3.987 -0.097 18135 9320 1 10 . 1 1 129 129 TYR C C 129 176.040 176.040 177.280 -1.240 18135 9321 1 10 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.748 -0.255 18135 9322 1 10 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.183 0.742 18135 9323 1 10 . 1 1 129 129 TYR H H 129 7.518 7.518 8.296 -0.778 18135 9324 1 10 . 1 1 130 130 LEU N N 130 119.155 119.155 116.396 2.759 18135 9325 1 10 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.278 -0.433 18135 9326 1 10 . 1 1 130 130 LEU C C 130 177.948 177.948 178.368 -0.420 18135 9327 1 10 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.904 0.209 18135 9328 1 10 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.497 1.089 18135 9329 1 10 . 1 1 130 130 LEU H H 130 7.717 7.717 7.953 -0.236 18135 9330 1 10 . 1 1 131 131 LYS N N 131 116.832 116.832 119.941 -3.109 18135 9331 1 10 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.860 -0.452 18135 9332 1 10 . 1 1 131 131 LYS C C 131 181.265 181.265 179.741 1.524 18135 9333 1 10 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.626 0.105 18135 9334 1 10 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.019 0.653 18135 9335 1 10 . 1 1 131 131 LYS H H 131 7.493 7.493 7.836 -0.343 18135 9336 1 10 . 1 1 132 132 GLU N N 132 121.918 121.918 118.918 3.000 18135 9337 1 10 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.054 -0.210 18135 9338 1 10 . 1 1 132 132 GLU C C 132 178.377 178.377 177.621 0.756 18135 9339 1 10 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.614 0.273 18135 9340 1 10 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.518 -0.851 18135 9341 1 10 . 1 1 132 132 GLU H H 132 8.430 8.430 8.041 0.389 18135 9342 1 10 . 1 1 133 133 LYS N N 133 116.079 116.079 115.622 0.457 18135 9343 1 10 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.263 -0.297 18135 9344 1 10 . 1 1 133 133 LYS C C 133 175.282 175.282 176.251 -0.969 18135 9345 1 10 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.558 -0.260 18135 9346 1 10 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.990 0.008 18135 9347 1 10 . 1 1 133 133 LYS H H 133 7.390 7.390 7.365 0.025 18135 9348 1 10 . 1 1 134 134 LYS N N 134 117.759 117.759 115.925 1.834 18135 9349 1 10 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.050 -0.468 18135 9350 1 10 . 1 1 134 134 LYS C C 134 176.271 176.271 175.963 0.308 18135 9351 1 10 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.813 0.494 18135 9352 1 10 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.082 -0.280 18135 9353 1 10 . 1 1 134 134 LYS H H 134 7.716 7.716 7.564 0.152 18135 9354 1 10 . 1 1 135 135 TYR N N 135 110.598 110.598 113.127 -2.529 18135 9355 1 10 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.865 -0.988 18135 9356 1 10 . 1 1 135 135 TYR C C 135 174.148 174.148 175.197 -1.049 18135 9357 1 10 . 1 1 135 135 TYR CA C 135 59.715 59.715 58.945 0.770 18135 9358 1 10 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.328 -0.622 18135 9359 1 10 . 1 1 135 135 TYR H H 135 8.428 8.428 8.805 -0.377 18135 9360 1 10 . 1 1 136 136 SER N N 136 113.712 113.712 115.187 -1.475 18135 9361 1 10 . 1 1 136 136 SER HA H 136 4.553 4.553 4.408 0.145 18135 9362 1 10 . 1 1 136 136 SER CA C 136 57.108 57.108 58.849 -1.741 18135 9363 1 10 . 1 1 136 136 SER CB C 136 62.500 62.500 63.899 -1.399 18135 9364 1 10 . 1 1 136 136 SER H H 136 6.744 6.744 7.353 -0.609 18135 9365 1 10 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.413 -0.248 18135 9366 1 10 . 1 1 137 137 PRO C C 137 180.675 180.675 177.558 3.117 18135 9367 1 10 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.841 0.816 18135 9368 1 10 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.782 0.201 18135 9369 1 10 . 1 1 138 138 CYS N N 138 113.914 113.914 115.787 -1.873 18135 9370 1 10 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.649 0.021 18135 9371 1 10 . 1 1 138 138 CYS C C 138 176.015 176.015 176.140 -0.125 18135 9372 1 10 . 1 1 138 138 CYS CA C 138 57.095 57.095 59.516 -2.421 18135 9373 1 10 . 1 1 138 138 CYS CB C 138 36.779 36.779 25.928 10.851 18135 9374 1 10 . 1 1 138 138 CYS H H 138 8.580 8.580 8.458 0.122 18135 9375 1 10 . 1 1 139 139 ALA N N 139 125.290 125.290 124.885 0.405 18135 9376 1 10 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.173 0.276 18135 9377 1 10 . 1 1 139 139 ALA C C 139 180.149 180.149 179.183 0.966 18135 9378 1 10 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.914 -0.136 18135 9379 1 10 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.063 0.855 18135 9380 1 10 . 1 1 139 139 ALA H H 139 8.087 8.087 7.982 0.105 18135 9381 1 10 . 1 1 140 140 TRP N N 140 116.599 116.599 118.635 -2.036 18135 9382 1 10 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.287 0.315 18135 9383 1 10 . 1 1 140 140 TRP C C 140 179.137 179.137 178.591 0.546 18135 9384 1 10 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.291 -0.757 18135 9385 1 10 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.419 -0.161 18135 9386 1 10 . 1 1 140 140 TRP H H 140 8.505 8.505 7.794 0.711 18135 9387 1 10 . 1 1 141 141 GLU N N 141 121.578 121.578 119.720 1.858 18135 9388 1 10 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.262 0.961 18135 9389 1 10 . 1 1 141 141 GLU C C 141 177.886 177.886 178.982 -1.096 18135 9390 1 10 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.981 -2.074 18135 9391 1 10 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.506 -0.789 18135 9392 1 10 . 1 1 141 141 GLU H H 141 8.182 8.182 8.085 0.097 18135 9393 1 10 . 1 1 142 142 VAL N N 142 121.202 121.202 119.842 1.360 18135 9394 1 10 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.767 -0.137 18135 9395 1 10 . 1 1 142 142 VAL C C 142 180.246 180.246 178.612 1.634 18135 9396 1 10 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.769 0.214 18135 9397 1 10 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.213 0.609 18135 9398 1 10 . 1 1 142 142 VAL H H 142 8.623 8.623 8.191 0.432 18135 9399 1 10 . 1 1 143 143 VAL N N 143 120.119 120.119 119.814 0.305 18135 9400 1 10 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.762 -0.465 18135 9401 1 10 . 1 1 143 143 VAL C C 143 176.407 176.407 178.244 -1.837 18135 9402 1 10 . 1 1 143 143 VAL CA C 143 67.978 67.978 67.243 0.735 18135 9403 1 10 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.409 0.246 18135 9404 1 10 . 1 1 143 143 VAL H H 143 8.323 8.323 8.675 -0.352 18135 9405 1 10 . 1 1 144 144 ARG N N 144 124.102 124.102 120.047 4.055 18135 9406 1 10 . 1 1 144 144 ARG HA H 144 3.697 3.697 3.994 -0.297 18135 9407 1 10 . 1 1 144 144 ARG C C 144 178.127 178.127 178.231 -0.104 18135 9408 1 10 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.346 1.655 18135 9409 1 10 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.725 0.211 18135 9410 1 10 . 1 1 144 144 ARG H H 144 9.619 9.619 8.439 1.180 18135 9411 1 10 . 1 1 145 145 ALA N N 145 119.431 119.431 121.575 -2.144 18135 9412 1 10 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.051 -0.200 18135 9413 1 10 . 1 1 145 145 ALA C C 145 180.763 180.763 180.091 0.672 18135 9414 1 10 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.389 -0.014 18135 9415 1 10 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.010 0.175 18135 9416 1 10 . 1 1 145 145 ALA H H 145 8.867 8.867 8.412 0.455 18135 9417 1 10 . 1 1 146 146 GLU N N 146 121.815 121.815 118.330 3.485 18135 9418 1 10 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.163 0.048 18135 9419 1 10 . 1 1 146 146 GLU C C 146 177.296 177.296 179.327 -2.031 18135 9420 1 10 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.526 -1.147 18135 9421 1 10 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.512 -1.379 18135 9422 1 10 . 1 1 146 146 GLU H H 146 8.136 8.136 8.128 0.008 18135 9423 1 10 . 1 1 147 147 ILE N N 147 119.542 119.542 121.352 -1.810 18135 9424 1 10 . 1 1 147 147 ILE HA H 147 3.970 3.970 4.026 -0.056 18135 9425 1 10 . 1 1 147 147 ILE C C 147 178.283 178.283 178.753 -0.470 18135 9426 1 10 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.629 -3.376 18135 9427 1 10 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.653 -2.314 18135 9428 1 10 . 1 1 147 147 ILE H H 147 8.736 8.736 8.207 0.529 18135 9429 1 10 . 1 1 148 148 MET N N 148 119.501 119.501 118.663 0.838 18135 9430 1 10 . 1 1 148 148 MET HA H 148 3.801 3.801 4.240 -0.439 18135 9431 1 10 . 1 1 148 148 MET C C 148 178.210 178.210 178.675 -0.465 18135 9432 1 10 . 1 1 148 148 MET CA C 148 60.184 60.184 59.868 0.316 18135 9433 1 10 . 1 1 148 148 MET CB C 148 32.914 32.914 31.993 0.921 18135 9434 1 10 . 1 1 148 148 MET H H 148 8.440 8.440 8.268 0.172 18135 9435 1 10 . 1 1 149 149 ARG N N 149 119.734 119.734 120.346 -0.612 18135 9436 1 10 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.082 -0.167 18135 9437 1 10 . 1 1 149 149 ARG C C 149 178.978 178.978 178.731 0.247 18135 9438 1 10 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.475 0.388 18135 9439 1 10 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.788 0.492 18135 9440 1 10 . 1 1 149 149 ARG H H 149 7.648 7.648 8.401 -0.753 18135 9441 1 10 . 1 1 150 150 SER N N 150 118.109 118.109 116.235 1.874 18135 9442 1 10 . 1 1 150 150 SER HA H 150 3.339 3.339 4.326 -0.987 18135 9443 1 10 . 1 1 150 150 SER C C 150 177.292 177.292 176.633 0.659 18135 9444 1 10 . 1 1 150 150 SER CA C 150 61.316 61.316 61.766 -0.450 18135 9445 1 10 . 1 1 150 150 SER CB C 150 60.288 60.288 62.564 -2.276 18135 9446 1 10 . 1 1 150 150 SER H H 150 9.194 9.194 8.372 0.822 18135 9447 1 10 . 1 1 151 151 PHE N N 151 125.265 125.265 124.294 0.971 18135 9448 1 10 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.256 -0.220 18135 9449 1 10 . 1 1 151 151 PHE C C 151 178.696 178.696 177.640 1.056 18135 9450 1 10 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.304 2.116 18135 9451 1 10 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.453 0.433 18135 9452 1 10 . 1 1 151 151 PHE H H 151 9.455 9.455 8.380 1.075 18135 9453 1 10 . 1 1 152 152 SER N N 152 115.963 115.963 115.606 0.357 18135 9454 1 10 . 1 1 152 152 SER HA H 152 3.880 3.880 3.870 0.010 18135 9455 1 10 . 1 1 152 152 SER C C 152 175.858 175.858 176.724 -0.866 18135 9456 1 10 . 1 1 152 152 SER CA C 152 62.388 62.388 61.430 0.958 18135 9457 1 10 . 1 1 152 152 SER CB C 152 62.519 62.519 63.343 -0.824 18135 9458 1 10 . 1 1 152 152 SER H H 152 7.839 7.839 8.240 -0.401 18135 9459 1 10 . 1 1 153 153 LEU N N 153 121.365 121.365 121.712 -0.347 18135 9460 1 10 . 1 1 153 153 LEU HA H 153 4.081 4.081 3.948 0.133 18135 9461 1 10 . 1 1 153 153 LEU C C 153 179.515 179.515 178.566 0.949 18135 9462 1 10 . 1 1 153 153 LEU CA C 153 57.883 57.883 58.156 -0.273 18135 9463 1 10 . 1 1 153 153 LEU CB C 153 42.342 42.342 42.169 0.173 18135 9464 1 10 . 1 1 153 153 LEU H H 153 7.775 7.775 8.112 -0.337 18135 9465 1 10 . 1 1 154 154 SER N N 154 113.950 113.950 114.031 -0.081 18135 9466 1 10 . 1 1 154 154 SER HA H 154 3.781 3.781 4.378 -0.597 18135 9467 1 10 . 1 1 154 154 SER C C 154 174.312 174.312 177.220 -2.908 18135 9468 1 10 . 1 1 154 154 SER CA C 154 61.366 61.366 61.569 -0.203 18135 9469 1 10 . 1 1 154 154 SER CB C 154 63.242 63.242 63.112 0.130 18135 9470 1 10 . 1 1 154 154 SER H H 154 7.874 7.874 8.855 -0.981 18135 9471 1 10 . 1 1 155 155 THR N N 155 109.346 109.346 113.707 -4.361 18135 9472 1 10 . 1 1 155 155 THR HA H 155 4.060 4.060 4.248 -0.188 18135 9473 1 10 . 1 1 155 155 THR C C 155 174.798 174.798 175.989 -1.191 18135 9474 1 10 . 1 1 155 155 THR CA C 155 62.275 62.275 65.112 -2.837 18135 9475 1 10 . 1 1 155 155 THR CB C 155 69.342 69.342 68.061 1.281 18135 9476 1 10 . 1 1 155 155 THR H H 155 7.176 7.176 8.145 -0.969 18135 9477 1 10 . 1 1 156 156 ASN N N 156 119.785 119.785 119.807 -0.022 18135 9478 1 10 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.518 0.009 18135 9479 1 10 . 1 1 156 156 ASN C C 156 175.528 175.528 176.191 -0.663 18135 9480 1 10 . 1 1 156 156 ASN CA C 156 53.937 53.937 55.811 -1.874 18135 9481 1 10 . 1 1 156 156 ASN CB C 156 38.338 38.338 38.615 -0.277 18135 9482 1 10 . 1 1 156 156 ASN H H 156 7.749 7.749 7.916 -0.167 18135 9483 1 10 . 1 1 157 157 LEU N N 157 120.552 120.552 118.712 1.840 18135 9484 1 10 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.350 -0.095 18135 9485 1 10 . 1 1 157 157 LEU C C 157 174.702 174.702 178.465 -3.763 18135 9486 1 10 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.157 -0.483 18135 9487 1 10 . 1 1 157 157 LEU CB C 157 42.351 42.351 41.822 0.529 18135 9488 1 10 . 1 1 157 157 LEU H H 157 8.097 8.097 7.450 0.647 18135 9489 1 10 . 1 1 158 158 GLN N N 158 119.860 119.860 118.108 1.752 18135 9490 1 10 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.185 -0.005 18135 9491 1 10 . 1 1 158 158 GLN C C 158 176.434 176.434 176.428 0.006 18135 9492 1 10 . 1 1 158 158 GLN CA C 158 56.897 56.897 57.592 -0.695 18135 9493 1 10 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.246 -0.236 18135 9494 1 10 . 1 1 158 158 GLN H H 158 8.230 8.230 7.420 0.810 18135 9495 1 10 . 1 1 159 159 GLU N N 159 120.461 120.461 112.239 8.222 18135 9496 1 10 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.408 -0.189 18135 9497 1 10 . 1 1 159 159 GLU C C 159 175.251 175.251 174.359 0.892 18135 9498 1 10 . 1 1 159 159 GLU CA C 159 56.695 56.695 56.247 0.448 18135 9499 1 10 . 1 1 159 159 GLU CB C 159 28.981 28.981 31.864 -2.883 18135 9500 1 10 . 1 1 159 159 GLU H H 159 8.300 8.300 7.515 0.785 18135 9501 1 10 . 1 1 160 160 SER N N 160 115.719 115.719 115.334 0.385 18135 9502 1 10 . 1 1 160 160 SER HA H 160 4.372 4.372 4.651 -0.279 18135 9503 1 10 . 1 1 160 160 SER C C 160 174.188 174.188 175.373 -1.185 18135 9504 1 10 . 1 1 160 160 SER CA C 160 58.481 58.481 57.174 1.307 18135 9505 1 10 . 1 1 160 160 SER CB C 160 63.731 63.731 62.408 1.323 18135 9506 1 10 . 1 1 160 160 SER H H 160 8.113 8.113 8.546 -0.433 18135 9507 1 10 . 1 1 161 161 LEU N N 161 123.794 123.794 121.981 1.813 18135 9508 1 10 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.026 0.254 18135 9509 1 10 . 1 1 161 161 LEU C C 161 177.293 177.293 177.548 -0.255 18135 9510 1 10 . 1 1 161 161 LEU CA C 161 55.190 55.190 57.743 -2.553 18135 9511 1 10 . 1 1 161 161 LEU CB C 161 42.284 42.284 41.821 0.463 18135 9512 1 10 . 1 1 161 161 LEU H H 161 8.032 8.032 8.142 -0.110 18135 9513 1 10 . 1 1 162 162 ARG N N 162 120.715 120.715 119.145 1.570 18135 9514 1 10 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.539 -0.370 18135 9515 1 10 . 1 1 162 162 ARG C C 162 176.288 176.288 175.373 0.915 18135 9516 1 10 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.615 1.431 18135 9517 1 10 . 1 1 162 162 ARG CB C 162 30.935 30.935 28.932 2.003 18135 9518 1 10 . 1 1 162 162 ARG H H 162 8.094 8.094 8.393 -0.299 18135 9519 1 10 . 1 1 163 163 SER N N 163 116.670 116.670 117.315 -0.645 18135 9520 1 10 . 1 1 163 163 SER HA H 163 4.372 4.372 4.619 -0.247 18135 9521 1 10 . 1 1 163 163 SER C C 163 174.184 174.184 174.569 -0.385 18135 9522 1 10 . 1 1 163 163 SER CA C 163 58.481 58.481 58.130 0.351 18135 9523 1 10 . 1 1 163 163 SER CB C 163 63.745 63.745 64.565 -0.820 18135 9524 1 10 . 1 1 163 163 SER H H 163 8.191 8.191 8.152 0.039 18135 9525 1 10 . 1 1 164 164 LYS N N 164 123.100 123.100 120.589 2.511 18135 9526 1 10 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.445 -0.168 18135 9527 1 10 . 1 1 164 164 LYS C C 164 175.617 175.617 176.614 -0.997 18135 9528 1 10 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.142 -0.829 18135 9529 1 10 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.360 0.605 18135 9530 1 10 . 1 1 164 164 LYS H H 164 8.251 8.251 8.577 -0.326 18135 9531 1 11 . 1 1 2 2 ASP N N 2 125.691 125.691 122.957 2.734 18135 9532 1 11 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.834 -0.124 18135 9533 1 11 . 1 1 2 2 ASP C C 2 174.758 174.758 175.147 -0.389 18135 9534 1 11 . 1 1 2 2 ASP CA C 2 52.843 52.843 53.626 -0.783 18135 9535 1 11 . 1 1 2 2 ASP CB C 2 39.321 39.321 40.662 -1.341 18135 9536 1 11 . 1 1 2 2 ASP H H 2 8.773 8.773 8.484 0.289 18135 9537 1 11 . 1 1 3 3 LEU N N 3 123.957 123.957 120.853 3.104 18135 9538 1 11 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.680 -0.279 18135 9539 1 11 . 1 1 3 3 LEU CA C 3 53.653 53.653 51.967 1.686 18135 9540 1 11 . 1 1 3 3 LEU CB C 3 40.555 40.555 41.244 -0.689 18135 9541 1 11 . 1 1 3 3 LEU H H 3 8.164 8.164 7.438 0.726 18135 9542 1 11 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.740 -0.426 18135 9543 1 11 . 1 1 4 4 PRO C C 4 176.213 176.213 177.000 -0.787 18135 9544 1 11 . 1 1 4 4 PRO CA C 4 63.908 63.908 62.914 0.994 18135 9545 1 11 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.048 1.846 18135 9546 1 11 . 1 1 5 5 GLN N N 5 121.621 121.621 120.888 0.733 18135 9547 1 11 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.172 0.054 18135 9548 1 11 . 1 1 5 5 GLN C C 5 176.995 176.995 177.109 -0.114 18135 9549 1 11 . 1 1 5 5 GLN CA C 5 57.710 57.710 58.604 -0.894 18135 9550 1 11 . 1 1 5 5 GLN CB C 5 28.951 28.951 28.691 0.260 18135 9551 1 11 . 1 1 5 5 GLN H H 5 8.767 8.767 8.753 0.014 18135 9552 1 11 . 1 1 6 6 THR N N 6 111.419 111.419 111.402 0.017 18135 9553 1 11 . 1 1 6 6 THR HA H 6 4.135 4.135 4.467 -0.332 18135 9554 1 11 . 1 1 6 6 THR C C 6 174.695 174.695 174.471 0.224 18135 9555 1 11 . 1 1 6 6 THR CA C 6 62.661 62.661 62.362 0.299 18135 9556 1 11 . 1 1 6 6 THR CB C 6 69.365 69.365 69.225 0.139 18135 9557 1 11 . 1 1 6 6 THR H H 6 7.865 7.865 8.256 -0.391 18135 9558 1 11 . 1 1 7 7 HIS N N 7 119.137 119.137 118.083 1.054 18135 9559 1 11 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.704 -0.119 18135 9560 1 11 . 1 1 7 7 HIS C C 7 174.980 174.980 175.046 -0.066 18135 9561 1 11 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.815 -2.811 18135 9562 1 11 . 1 1 7 7 HIS CB C 7 28.163 28.163 30.442 -2.279 18135 9563 1 11 . 1 1 7 7 HIS H H 7 8.567 8.567 8.476 0.091 18135 9564 1 11 . 1 1 8 8 SER N N 8 115.796 115.796 113.011 2.785 18135 9565 1 11 . 1 1 8 8 SER HA H 8 4.363 4.363 4.474 -0.111 18135 9566 1 11 . 1 1 8 8 SER C C 8 175.312 175.312 176.084 -0.772 18135 9567 1 11 . 1 1 8 8 SER CA C 8 58.969 58.969 60.302 -1.333 18135 9568 1 11 . 1 1 8 8 SER CB C 8 63.439 63.439 64.136 -0.697 18135 9569 1 11 . 1 1 8 8 SER H H 8 8.180 8.180 7.776 0.404 18135 9570 1 11 . 1 1 9 9 LEU N N 9 123.844 123.844 118.938 4.906 18135 9571 1 11 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.797 -0.642 18135 9572 1 11 . 1 1 9 9 LEU C C 9 178.568 178.568 178.410 0.158 18135 9573 1 11 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.453 0.513 18135 9574 1 11 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.348 -0.552 18135 9575 1 11 . 1 1 9 9 LEU H H 9 8.404 8.404 7.563 0.841 18135 9576 1 11 . 1 1 10 10 GLY N N 10 107.582 107.582 107.610 -0.028 18135 9577 1 11 . 1 1 10 10 GLY C C 10 174.586 174.586 175.648 -1.062 18135 9578 1 11 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.079 -0.174 18135 9579 1 11 . 1 1 10 10 GLY H H 10 8.438 8.438 8.276 0.162 18135 9580 1 11 . 1 1 11 11 SER N N 11 118.806 118.806 117.333 1.473 18135 9581 1 11 . 1 1 11 11 SER HA H 11 4.156 4.156 4.149 0.007 18135 9582 1 11 . 1 1 11 11 SER C C 11 175.749 175.749 176.510 -0.761 18135 9583 1 11 . 1 1 11 11 SER CA C 11 61.299 61.299 61.887 -0.588 18135 9584 1 11 . 1 1 11 11 SER CB C 11 62.653 62.653 63.335 -0.682 18135 9585 1 11 . 1 1 11 11 SER H H 11 8.249 8.249 8.218 0.031 18135 9586 1 11 . 1 1 12 12 ARG N N 12 121.986 121.986 121.122 0.864 18135 9587 1 11 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.112 -0.158 18135 9588 1 11 . 1 1 12 12 ARG C C 12 178.283 178.283 178.358 -0.075 18135 9589 1 11 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.551 1.279 18135 9590 1 11 . 1 1 12 12 ARG CB C 12 29.584 29.584 29.960 -0.376 18135 9591 1 11 . 1 1 12 12 ARG H H 12 8.027 8.027 8.409 -0.382 18135 9592 1 11 . 1 1 13 13 ARG N N 13 119.432 119.432 119.083 0.349 18135 9593 1 11 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.089 -0.250 18135 9594 1 11 . 1 1 13 13 ARG C C 13 178.480 178.480 178.379 0.101 18135 9595 1 11 . 1 1 13 13 ARG CA C 13 60.491 60.491 60.132 0.359 18135 9596 1 11 . 1 1 13 13 ARG CB C 13 30.082 30.082 30.062 0.020 18135 9597 1 11 . 1 1 13 13 ARG H H 13 8.437 8.437 7.993 0.444 18135 9598 1 11 . 1 1 14 14 THR N N 14 116.879 116.879 117.007 -0.128 18135 9599 1 11 . 1 1 14 14 THR HA H 14 3.532 3.532 4.163 -0.631 18135 9600 1 11 . 1 1 14 14 THR C C 14 175.584 175.584 176.976 -1.392 18135 9601 1 11 . 1 1 14 14 THR CA C 14 68.036 68.036 67.257 0.779 18135 9602 1 11 . 1 1 14 14 THR CB C 14 67.969 67.969 68.602 -0.633 18135 9603 1 11 . 1 1 14 14 THR H H 14 7.957 7.957 8.223 -0.266 18135 9604 1 11 . 1 1 15 15 LEU N N 15 120.252 120.252 121.827 -1.575 18135 9605 1 11 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.051 -0.105 18135 9606 1 11 . 1 1 15 15 LEU C C 15 178.652 178.652 179.001 -0.349 18135 9607 1 11 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.328 -0.240 18135 9608 1 11 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.784 -0.230 18135 9609 1 11 . 1 1 15 15 LEU H H 15 7.550 7.550 8.296 -0.746 18135 9610 1 11 . 1 1 16 16 MET N N 16 118.788 118.788 117.317 1.471 18135 9611 1 11 . 1 1 16 16 MET HA H 16 4.023 4.023 4.045 -0.022 18135 9612 1 11 . 1 1 16 16 MET C C 16 178.718 178.718 178.868 -0.150 18135 9613 1 11 . 1 1 16 16 MET CA C 16 58.513 58.513 58.292 0.221 18135 9614 1 11 . 1 1 16 16 MET CB C 16 32.150 32.150 31.453 0.697 18135 9615 1 11 . 1 1 16 16 MET H H 16 7.985 7.985 8.202 -0.217 18135 9616 1 11 . 1 1 17 17 LEU N N 17 120.644 120.644 119.779 0.865 18135 9617 1 11 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.997 -0.025 18135 9618 1 11 . 1 1 17 17 LEU C C 17 178.238 178.238 179.309 -1.071 18135 9619 1 11 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.343 -0.616 18135 9620 1 11 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.138 0.997 18135 9621 1 11 . 1 1 17 17 LEU H H 17 7.829 7.829 8.127 -0.298 18135 9622 1 11 . 1 1 18 18 LEU N N 18 118.280 118.280 118.890 -0.610 18135 9623 1 11 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.739 -0.233 18135 9624 1 11 . 1 1 18 18 LEU C C 18 175.739 175.739 178.565 -2.826 18135 9625 1 11 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.242 0.414 18135 9626 1 11 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.257 0.985 18135 9627 1 11 . 1 1 18 18 LEU H H 18 7.499 7.499 8.341 -0.842 18135 9628 1 11 . 1 1 19 19 ALA N N 19 121.961 121.961 120.920 1.041 18135 9629 1 11 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.171 -0.334 18135 9630 1 11 . 1 1 19 19 ALA C C 19 180.736 180.736 179.060 1.676 18135 9631 1 11 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.239 0.827 18135 9632 1 11 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.232 -1.155 18135 9633 1 11 . 1 1 19 19 ALA H H 19 7.950 7.950 7.835 0.115 18135 9634 1 11 . 1 1 20 20 GLN N N 20 118.605 118.605 116.025 2.580 18135 9635 1 11 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.171 -0.236 18135 9636 1 11 . 1 1 20 20 GLN C C 20 176.945 176.945 177.120 -0.175 18135 9637 1 11 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.602 0.413 18135 9638 1 11 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.047 -0.573 18135 9639 1 11 . 1 1 20 20 GLN H H 20 7.958 7.958 8.019 -0.061 18135 9640 1 11 . 1 1 21 21 MET N N 21 116.693 116.693 116.978 -0.285 18135 9641 1 11 . 1 1 21 21 MET HA H 21 3.861 3.861 4.422 -0.561 18135 9642 1 11 . 1 1 21 21 MET C C 21 174.671 174.671 175.706 -1.035 18135 9643 1 11 . 1 1 21 21 MET CA C 21 57.111 57.111 56.956 0.155 18135 9644 1 11 . 1 1 21 21 MET CB C 21 34.073 34.073 33.845 0.228 18135 9645 1 11 . 1 1 21 21 MET H H 21 7.420 7.420 7.605 -0.185 18135 9646 1 11 . 1 1 22 22 ARG N N 22 115.451 115.451 121.026 -5.575 18135 9647 1 11 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.418 0.435 18135 9648 1 11 . 1 1 22 22 ARG C C 22 175.950 175.950 174.802 1.148 18135 9649 1 11 . 1 1 22 22 ARG CA C 22 58.452 58.452 54.987 3.465 18135 9650 1 11 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.304 1.210 18135 9651 1 11 . 1 1 22 22 ARG H H 22 6.484 6.484 7.252 -0.768 18135 9652 1 11 . 1 1 23 23 LYS N N 23 128.593 128.593 127.119 1.474 18135 9653 1 11 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.555 -0.070 18135 9654 1 11 . 1 1 23 23 LYS C C 23 176.643 176.643 174.902 1.741 18135 9655 1 11 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.546 1.741 18135 9656 1 11 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.901 4.360 18135 9657 1 11 . 1 1 23 23 LYS H H 23 10.212 10.212 8.532 1.680 18135 9658 1 11 . 1 1 24 24 ILE N N 24 118.605 118.605 122.231 -3.626 18135 9659 1 11 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.443 0.041 18135 9660 1 11 . 1 1 24 24 ILE C C 24 173.878 173.878 174.525 -0.647 18135 9661 1 11 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.931 -1.334 18135 9662 1 11 . 1 1 24 24 ILE CB C 24 41.456 41.456 40.770 0.686 18135 9663 1 11 . 1 1 24 24 ILE H H 24 8.465 8.465 8.362 0.103 18135 9664 1 11 . 1 1 25 25 SER N N 25 113.658 113.658 118.045 -4.387 18135 9665 1 11 . 1 1 25 25 SER HA H 25 4.481 4.481 4.886 -0.405 18135 9666 1 11 . 1 1 25 25 SER C C 25 176.359 176.359 175.683 0.676 18135 9667 1 11 . 1 1 25 25 SER CA C 25 56.975 56.975 57.358 -0.383 18135 9668 1 11 . 1 1 25 25 SER CB C 25 64.759 64.759 63.684 1.075 18135 9669 1 11 . 1 1 25 25 SER H H 25 8.104 8.104 8.597 -0.493 18135 9670 1 11 . 1 1 26 26 LEU N N 26 127.566 127.566 126.430 1.136 18135 9671 1 11 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.123 -0.246 18135 9672 1 11 . 1 1 26 26 LEU C C 26 178.946 178.946 178.249 0.697 18135 9673 1 11 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.505 0.173 18135 9674 1 11 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.006 -0.287 18135 9675 1 11 . 1 1 26 26 LEU H H 26 8.802 8.802 9.113 -0.311 18135 9676 1 11 . 1 1 27 27 PHE N N 27 117.143 117.143 117.074 0.069 18135 9677 1 11 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.566 -0.328 18135 9678 1 11 . 1 1 27 27 PHE C C 27 177.067 177.067 176.811 0.256 18135 9679 1 11 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.383 1.707 18135 9680 1 11 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.330 -0.068 18135 9681 1 11 . 1 1 27 27 PHE H H 27 7.986 7.986 8.140 -0.154 18135 9682 1 11 . 1 1 28 28 SER N N 28 115.200 115.200 116.236 -1.036 18135 9683 1 11 . 1 1 28 28 SER HA H 28 4.505 4.505 4.372 0.133 18135 9684 1 11 . 1 1 28 28 SER C C 28 174.533 174.533 174.657 -0.124 18135 9685 1 11 . 1 1 28 28 SER CA C 28 59.447 59.447 60.532 -1.085 18135 9686 1 11 . 1 1 28 28 SER CB C 28 63.790 63.790 63.690 0.100 18135 9687 1 11 . 1 1 28 28 SER H H 28 7.929 7.929 8.211 -0.282 18135 9688 1 11 . 1 1 29 29 CYS N N 29 119.870 119.870 119.033 0.837 18135 9689 1 11 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.684 0.398 18135 9690 1 11 . 1 1 29 29 CYS C C 29 176.475 176.475 174.559 1.916 18135 9691 1 11 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.114 -4.684 18135 9692 1 11 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.762 9.480 18135 9693 1 11 . 1 1 29 29 CYS H H 29 7.865 7.865 7.697 0.168 18135 9694 1 11 . 1 1 30 30 LEU N N 30 122.259 122.259 123.994 -1.735 18135 9695 1 11 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.222 -0.261 18135 9696 1 11 . 1 1 30 30 LEU C C 30 179.774 179.774 177.694 2.080 18135 9697 1 11 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.333 1.970 18135 9698 1 11 . 1 1 30 30 LEU CB C 30 41.576 41.576 41.715 -0.139 18135 9699 1 11 . 1 1 30 30 LEU H H 30 7.812 7.812 8.539 -0.727 18135 9700 1 11 . 1 1 31 31 LYS N N 31 117.731 117.731 117.050 0.681 18135 9701 1 11 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.249 0.441 18135 9702 1 11 . 1 1 31 31 LYS C C 31 176.692 176.692 176.611 0.081 18135 9703 1 11 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.061 -2.984 18135 9704 1 11 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.575 -0.988 18135 9705 1 11 . 1 1 31 31 LYS H H 31 8.597 8.597 7.707 0.890 18135 9706 1 11 . 1 1 32 32 ASP N N 32 117.841 117.841 117.437 0.404 18135 9707 1 11 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.693 0.001 18135 9708 1 11 . 1 1 32 32 ASP C C 32 175.505 175.505 176.783 -1.278 18135 9709 1 11 . 1 1 32 32 ASP CA C 32 54.088 54.088 53.841 0.247 18135 9710 1 11 . 1 1 32 32 ASP CB C 32 41.808 41.808 41.971 -0.163 18135 9711 1 11 . 1 1 32 32 ASP H H 32 7.808 7.808 7.826 -0.018 18135 9712 1 11 . 1 1 33 33 ARG N N 33 120.876 120.876 117.792 3.084 18135 9713 1 11 . 1 1 33 33 ARG HA H 33 4.041 4.041 3.912 0.129 18135 9714 1 11 . 1 1 33 33 ARG C C 33 175.286 175.286 175.360 -0.074 18135 9715 1 11 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.115 -0.032 18135 9716 1 11 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.101 -0.088 18135 9717 1 11 . 1 1 33 33 ARG H H 33 7.378 7.378 7.407 -0.029 18135 9718 1 11 . 1 1 34 34 HIS N N 34 120.555 120.555 116.488 4.067 18135 9719 1 11 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.718 -0.506 18135 9720 1 11 . 1 1 34 34 HIS C C 34 170.494 170.494 173.866 -3.372 18135 9721 1 11 . 1 1 34 34 HIS CA C 34 54.607 54.607 55.729 -1.122 18135 9722 1 11 . 1 1 34 34 HIS CB C 34 31.488 31.488 31.887 -0.399 18135 9723 1 11 . 1 1 34 34 HIS H H 34 7.974 7.974 7.852 0.122 18135 9724 1 11 . 1 1 35 35 ASP N N 35 125.061 125.061 123.147 1.914 18135 9725 1 11 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.377 0.261 18135 9726 1 11 . 1 1 35 35 ASP C C 35 175.943 175.943 176.813 -0.870 18135 9727 1 11 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.526 -2.157 18135 9728 1 11 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.664 -1.302 18135 9729 1 11 . 1 1 35 35 ASP H H 35 7.805 7.805 8.521 -0.716 18135 9730 1 11 . 1 1 36 36 PHE N N 36 122.860 122.860 120.722 2.138 18135 9731 1 11 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.389 -0.064 18135 9732 1 11 . 1 1 36 36 PHE C C 36 176.643 176.643 177.271 -0.628 18135 9733 1 11 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.634 1.005 18135 9734 1 11 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.149 1.542 18135 9735 1 11 . 1 1 36 36 PHE H H 36 8.973 8.973 7.659 1.314 18135 9736 1 11 . 1 1 37 37 GLY N N 37 111.856 111.856 109.004 2.852 18135 9737 1 11 . 1 1 37 37 GLY C C 37 175.185 175.185 174.760 0.425 18135 9738 1 11 . 1 1 37 37 GLY CA C 37 48.143 48.143 45.085 3.058 18135 9739 1 11 . 1 1 37 37 GLY H H 37 8.727 8.727 7.888 0.839 18135 9740 1 11 . 1 1 38 38 PHE N N 38 123.178 123.178 121.380 1.798 18135 9741 1 11 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.654 -0.740 18135 9742 1 11 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.715 2.089 18135 9743 1 11 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.089 0.568 18135 9744 1 11 . 1 1 38 38 PHE H H 38 9.169 9.169 7.434 1.735 18135 9745 1 11 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.473 0.056 18135 9746 1 11 . 1 1 39 39 PRO C C 39 174.634 174.634 176.919 -2.285 18135 9747 1 11 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.620 -1.077 18135 9748 1 11 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.476 -1.772 18135 9749 1 11 . 1 1 40 40 GLN N N 40 123.608 123.608 123.561 0.047 18135 9750 1 11 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.260 -0.641 18135 9751 1 11 . 1 1 40 40 GLN C C 40 176.958 176.958 177.644 -0.686 18135 9752 1 11 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.743 -0.670 18135 9753 1 11 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.888 0.929 18135 9754 1 11 . 1 1 40 40 GLN H H 40 7.966 7.966 8.414 -0.448 18135 9755 1 11 . 1 1 41 41 GLU N N 41 119.446 119.446 119.661 -0.215 18135 9756 1 11 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.145 -0.008 18135 9757 1 11 . 1 1 41 41 GLU C C 41 177.346 177.346 177.727 -0.381 18135 9758 1 11 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.882 -0.952 18135 9759 1 11 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.290 -1.457 18135 9760 1 11 . 1 1 41 41 GLU H H 41 9.044 9.044 8.726 0.318 18135 9761 1 11 . 1 1 42 42 GLU N N 42 117.196 117.196 117.811 -0.615 18135 9762 1 11 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.292 -0.229 18135 9763 1 11 . 1 1 42 42 GLU C C 42 174.886 174.886 177.871 -2.985 18135 9764 1 11 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.733 -1.349 18135 9765 1 11 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.123 -2.565 18135 9766 1 11 . 1 1 42 42 GLU H H 42 7.646 7.646 7.893 -0.247 18135 9767 1 11 . 1 1 43 43 PHE N N 43 115.527 115.527 121.271 -5.744 18135 9768 1 11 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.603 -0.117 18135 9769 1 11 . 1 1 43 43 PHE C C 43 175.615 175.615 175.828 -0.213 18135 9770 1 11 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.707 -1.159 18135 9771 1 11 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.428 -0.535 18135 9772 1 11 . 1 1 43 43 PHE H H 43 7.601 7.601 8.548 -0.947 18135 9773 1 11 . 1 1 44 44 GLY N N 44 107.243 107.243 108.859 -1.616 18135 9774 1 11 . 1 1 44 44 GLY C C 44 174.032 174.032 174.112 -0.080 18135 9775 1 11 . 1 1 44 44 GLY CA C 44 45.612 45.612 46.189 -0.577 18135 9776 1 11 . 1 1 44 44 GLY H H 44 7.733 7.733 7.820 -0.087 18135 9777 1 11 . 1 1 45 45 ASN N N 45 117.599 117.599 121.830 -4.231 18135 9778 1 11 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.913 -0.362 18135 9779 1 11 . 1 1 45 45 ASN C C 45 175.894 175.894 173.827 2.067 18135 9780 1 11 . 1 1 45 45 ASN CA C 45 53.849 53.849 53.149 0.700 18135 9781 1 11 . 1 1 45 45 ASN CB C 45 38.419 38.419 40.382 -1.963 18135 9782 1 11 . 1 1 45 45 ASN H H 45 8.343 8.343 7.558 0.785 18135 9783 1 11 . 1 1 46 46 GLN N N 46 118.916 118.916 118.111 0.805 18135 9784 1 11 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.511 -0.429 18135 9785 1 11 . 1 1 46 46 GLN C C 46 175.851 175.851 176.782 -0.931 18135 9786 1 11 . 1 1 46 46 GLN CA C 46 56.646 56.646 54.986 1.660 18135 9787 1 11 . 1 1 46 46 GLN CB C 46 28.444 28.444 29.103 -0.659 18135 9788 1 11 . 1 1 46 46 GLN H H 46 8.652 8.652 8.494 0.158 18135 9789 1 11 . 1 1 47 47 PHE N N 47 119.511 119.511 117.668 1.843 18135 9790 1 11 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.572 -0.010 18135 9791 1 11 . 1 1 47 47 PHE C C 47 176.258 176.258 175.457 0.801 18135 9792 1 11 . 1 1 47 47 PHE CA C 47 57.920 57.920 57.681 0.239 18135 9793 1 11 . 1 1 47 47 PHE CB C 47 39.858 39.858 38.796 1.062 18135 9794 1 11 . 1 1 47 47 PHE H H 47 7.904 7.904 7.868 0.036 18135 9795 1 11 . 1 1 48 48 GLN N N 48 120.127 120.127 119.172 0.955 18135 9796 1 11 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.279 0.096 18135 9797 1 11 . 1 1 48 48 GLN C C 48 181.265 181.265 175.253 6.012 18135 9798 1 11 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.485 1.091 18135 9799 1 11 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.670 -1.202 18135 9800 1 11 . 1 1 48 48 GLN H H 48 8.255 8.255 7.461 0.794 18135 9801 1 11 . 1 1 49 49 LYS N N 49 121.777 121.777 123.098 -1.321 18135 9802 1 11 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.162 -0.059 18135 9803 1 11 . 1 1 49 49 LYS C C 49 177.968 177.968 176.707 1.261 18135 9804 1 11 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.106 0.043 18135 9805 1 11 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.337 0.053 18135 9806 1 11 . 1 1 49 49 LYS H H 49 8.426 8.426 8.595 -0.169 18135 9807 1 11 . 1 1 50 50 ALA N N 50 120.573 120.573 120.302 0.271 18135 9808 1 11 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.261 -0.191 18135 9809 1 11 . 1 1 50 50 ALA C C 50 178.697 178.697 177.538 1.159 18135 9810 1 11 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.362 1.406 18135 9811 1 11 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.700 0.174 18135 9812 1 11 . 1 1 50 50 ALA H H 50 8.578 8.578 7.680 0.898 18135 9813 1 11 . 1 1 51 51 GLU N N 51 115.015 115.015 115.001 0.014 18135 9814 1 11 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.221 0.045 18135 9815 1 11 . 1 1 51 51 GLU C C 51 176.995 176.995 177.272 -0.277 18135 9816 1 11 . 1 1 51 51 GLU CA C 51 56.993 56.993 56.846 0.147 18135 9817 1 11 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.886 -0.981 18135 9818 1 11 . 1 1 51 51 GLU H H 51 7.907 7.907 8.181 -0.274 18135 9819 1 11 . 1 1 52 52 THR N N 52 111.210 111.210 114.599 -3.389 18135 9820 1 11 . 1 1 52 52 THR HA H 52 4.114 4.114 4.270 -0.156 18135 9821 1 11 . 1 1 52 52 THR C C 52 175.271 175.271 175.725 -0.454 18135 9822 1 11 . 1 1 52 52 THR CA C 52 63.611 63.611 64.369 -0.758 18135 9823 1 11 . 1 1 52 52 THR CB C 52 69.673 69.673 68.554 1.119 18135 9824 1 11 . 1 1 52 52 THR H H 52 7.863 7.863 7.500 0.363 18135 9825 1 11 . 1 1 53 53 ILE N N 53 119.113 119.113 122.110 -2.997 18135 9826 1 11 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.247 -0.383 18135 9827 1 11 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.769 1.138 18135 9828 1 11 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.419 -1.466 18135 9829 1 11 . 1 1 53 53 ILE H H 53 8.341 8.341 8.097 0.244 18135 9830 1 11 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.356 -0.070 18135 9831 1 11 . 1 1 54 54 PRO C C 54 179.655 179.655 178.806 0.849 18135 9832 1 11 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.302 -0.251 18135 9833 1 11 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.161 0.724 18135 9834 1 11 . 1 1 55 55 VAL N N 55 116.355 116.355 116.576 -0.221 18135 9835 1 11 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.837 -0.156 18135 9836 1 11 . 1 1 55 55 VAL C C 55 177.649 177.649 178.226 -0.577 18135 9837 1 11 . 1 1 55 55 VAL CA C 55 65.837 65.837 66.327 -0.490 18135 9838 1 11 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.310 0.161 18135 9839 1 11 . 1 1 55 55 VAL H H 55 7.119 7.119 7.425 -0.306 18135 9840 1 11 . 1 1 56 56 LEU N N 56 123.038 123.038 121.080 1.958 18135 9841 1 11 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.013 0.297 18135 9842 1 11 . 1 1 56 56 LEU C C 56 178.637 178.637 177.879 0.758 18135 9843 1 11 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.579 -0.493 18135 9844 1 11 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.398 0.920 18135 9845 1 11 . 1 1 56 56 LEU H H 56 8.535 8.535 8.444 0.091 18135 9846 1 11 . 1 1 57 57 HIS N N 57 117.041 117.041 118.179 -1.138 18135 9847 1 11 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.009 -0.223 18135 9848 1 11 . 1 1 57 57 HIS C C 57 175.640 175.640 177.642 -2.002 18135 9849 1 11 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.919 0.612 18135 9850 1 11 . 1 1 57 57 HIS CB C 57 28.209 28.209 29.959 -1.750 18135 9851 1 11 . 1 1 57 57 HIS H H 57 9.047 9.047 8.052 0.995 18135 9852 1 11 . 1 1 58 58 GLU N N 58 119.521 119.521 118.683 0.838 18135 9853 1 11 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.793 0.214 18135 9854 1 11 . 1 1 58 58 GLU C C 58 179.029 179.029 179.000 0.029 18135 9855 1 11 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.232 -0.265 18135 9856 1 11 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.269 -0.979 18135 9857 1 11 . 1 1 58 58 GLU H H 58 7.860 7.860 8.192 -0.332 18135 9858 1 11 . 1 1 59 59 MET N N 59 119.512 119.512 119.122 0.390 18135 9859 1 11 . 1 1 59 59 MET HA H 59 4.074 4.074 4.231 -0.157 18135 9860 1 11 . 1 1 59 59 MET C C 59 177.031 177.031 179.030 -1.999 18135 9861 1 11 . 1 1 59 59 MET CA C 59 59.408 59.408 59.867 -0.459 18135 9862 1 11 . 1 1 59 59 MET CB C 59 32.525 32.525 32.876 -0.350 18135 9863 1 11 . 1 1 59 59 MET H H 59 8.442 8.442 7.939 0.503 18135 9864 1 11 . 1 1 60 60 ILE N N 60 117.183 117.183 118.188 -1.005 18135 9865 1 11 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.493 -0.076 18135 9866 1 11 . 1 1 60 60 ILE C C 60 177.524 177.524 178.160 -0.636 18135 9867 1 11 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.964 0.362 18135 9868 1 11 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.151 -0.291 18135 9869 1 11 . 1 1 60 60 ILE H H 60 8.338 8.338 7.762 0.576 18135 9870 1 11 . 1 1 61 61 GLN N N 61 120.191 120.191 119.573 0.618 18135 9871 1 11 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.683 0.019 18135 9872 1 11 . 1 1 61 61 GLN C C 61 178.270 178.270 177.740 0.530 18135 9873 1 11 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.298 -0.512 18135 9874 1 11 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.105 0.561 18135 9875 1 11 . 1 1 61 61 GLN H H 61 8.234 8.234 8.100 0.134 18135 9876 1 11 . 1 1 62 62 GLN N N 62 116.795 116.795 118.952 -2.157 18135 9877 1 11 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.426 0.201 18135 9878 1 11 . 1 1 62 62 GLN C C 62 179.685 179.685 178.465 1.220 18135 9879 1 11 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.494 -0.486 18135 9880 1 11 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.959 -3.617 18135 9881 1 11 . 1 1 62 62 GLN H H 62 8.421 8.421 7.978 0.443 18135 9882 1 11 . 1 1 63 63 ILE N N 63 122.797 122.797 119.747 3.050 18135 9883 1 11 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.954 -0.305 18135 9884 1 11 . 1 1 63 63 ILE C C 63 177.279 177.279 177.896 -0.617 18135 9885 1 11 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.600 2.365 18135 9886 1 11 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.910 -0.595 18135 9887 1 11 . 1 1 63 63 ILE H H 63 8.164 8.164 7.570 0.594 18135 9888 1 11 . 1 1 64 64 PHE N N 64 120.820 120.820 121.668 -0.848 18135 9889 1 11 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.464 -0.748 18135 9890 1 11 . 1 1 64 64 PHE C C 64 178.402 178.402 176.512 1.890 18135 9891 1 11 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.261 0.891 18135 9892 1 11 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.931 -0.421 18135 9893 1 11 . 1 1 64 64 PHE H H 64 8.405 8.405 7.982 0.423 18135 9894 1 11 . 1 1 65 65 ASN N N 65 119.981 119.981 117.866 2.115 18135 9895 1 11 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.758 0.305 18135 9896 1 11 . 1 1 65 65 ASN C C 65 177.944 177.944 177.321 0.623 18135 9897 1 11 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.818 0.050 18135 9898 1 11 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.439 -1.183 18135 9899 1 11 . 1 1 65 65 ASN H H 65 8.812 8.812 8.129 0.683 18135 9900 1 11 . 1 1 66 66 LEU N N 66 121.533 121.533 119.978 1.555 18135 9901 1 11 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.235 -0.012 18135 9902 1 11 . 1 1 66 66 LEU C C 66 177.777 177.777 179.062 -1.285 18135 9903 1 11 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.665 0.603 18135 9904 1 11 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.482 0.125 18135 9905 1 11 . 1 1 66 66 LEU H H 66 8.177 8.177 7.865 0.312 18135 9906 1 11 . 1 1 67 67 PHE N N 67 110.842 110.842 115.430 -4.588 18135 9907 1 11 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.599 0.281 18135 9908 1 11 . 1 1 67 67 PHE C C 67 177.965 177.965 176.469 1.496 18135 9909 1 11 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.712 0.822 18135 9910 1 11 . 1 1 67 67 PHE CB C 67 38.616 38.616 39.004 -0.388 18135 9911 1 11 . 1 1 67 67 PHE H H 67 8.160 8.160 8.404 -0.244 18135 9912 1 11 . 1 1 68 68 SER N N 68 119.131 119.131 113.204 5.927 18135 9913 1 11 . 1 1 68 68 SER HA H 68 4.580 4.580 4.253 0.327 18135 9914 1 11 . 1 1 68 68 SER C C 68 173.472 173.472 174.807 -1.335 18135 9915 1 11 . 1 1 68 68 SER CA C 68 59.191 59.191 59.050 0.141 18135 9916 1 11 . 1 1 68 68 SER CB C 68 63.123 63.123 63.474 -0.351 18135 9917 1 11 . 1 1 68 68 SER H H 68 8.016 8.016 7.573 0.443 18135 9918 1 11 . 1 1 69 69 THR N N 69 111.353 111.353 115.727 -4.374 18135 9919 1 11 . 1 1 69 69 THR HA H 69 4.345 4.345 4.406 -0.061 18135 9920 1 11 . 1 1 69 69 THR C C 69 175.661 175.661 174.585 1.076 18135 9921 1 11 . 1 1 69 69 THR CA C 69 61.411 61.411 60.359 1.052 18135 9922 1 11 . 1 1 69 69 THR CB C 69 72.209 72.209 70.780 1.429 18135 9923 1 11 . 1 1 69 69 THR H H 69 6.977 6.977 7.303 -0.326 18135 9924 1 11 . 1 1 70 70 LYS N N 70 121.120 121.120 122.897 -1.777 18135 9925 1 11 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.118 -0.029 18135 9926 1 11 . 1 1 70 70 LYS C C 70 179.259 179.259 177.101 2.158 18135 9927 1 11 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.924 -0.968 18135 9928 1 11 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.544 -0.794 18135 9929 1 11 . 1 1 70 70 LYS H H 70 9.065 9.065 8.554 0.511 18135 9930 1 11 . 1 1 71 71 ASP N N 71 116.374 116.374 120.247 -3.873 18135 9931 1 11 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.296 -0.121 18135 9932 1 11 . 1 1 71 71 ASP C C 71 178.372 178.372 177.730 0.642 18135 9933 1 11 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.231 -0.164 18135 9934 1 11 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.293 0.013 18135 9935 1 11 . 1 1 71 71 ASP H H 71 7.518 7.518 7.749 -0.231 18135 9936 1 11 . 1 1 72 72 SER N N 72 117.341 117.341 114.135 3.206 18135 9937 1 11 . 1 1 72 72 SER HA H 72 3.715 3.715 3.175 0.540 18135 9938 1 11 . 1 1 72 72 SER C C 72 176.897 176.897 175.806 1.091 18135 9939 1 11 . 1 1 72 72 SER CA C 72 60.267 60.267 60.654 -0.387 18135 9940 1 11 . 1 1 72 72 SER CB C 72 62.616 62.616 62.798 -0.182 18135 9941 1 11 . 1 1 72 72 SER H H 72 8.066 8.066 7.918 0.148 18135 9942 1 11 . 1 1 73 73 SER N N 73 113.398 113.398 116.853 -3.455 18135 9943 1 11 . 1 1 73 73 SER HA H 73 4.094 4.094 4.139 -0.045 18135 9944 1 11 . 1 1 73 73 SER C C 73 174.855 174.855 175.706 -0.851 18135 9945 1 11 . 1 1 73 73 SER CA C 73 61.385 61.385 60.790 0.595 18135 9946 1 11 . 1 1 73 73 SER CB C 73 62.798 62.798 63.196 -0.398 18135 9947 1 11 . 1 1 73 73 SER H H 73 7.982 7.982 7.672 0.310 18135 9948 1 11 . 1 1 74 74 ALA N N 74 119.486 119.486 120.262 -0.776 18135 9949 1 11 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.241 -0.084 18135 9950 1 11 . 1 1 74 74 ALA C C 74 177.626 177.626 177.612 0.014 18135 9951 1 11 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.755 -0.042 18135 9952 1 11 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.881 -0.134 18135 9953 1 11 . 1 1 74 74 ALA H H 74 7.095 7.095 7.819 -0.724 18135 9954 1 11 . 1 1 75 75 ALA N N 75 121.465 121.465 120.924 0.541 18135 9955 1 11 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.739 -0.043 18135 9956 1 11 . 1 1 75 75 ALA C C 75 177.197 177.197 176.234 0.963 18135 9957 1 11 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.299 0.705 18135 9958 1 11 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.517 -0.257 18135 9959 1 11 . 1 1 75 75 ALA H H 75 7.159 7.159 7.311 -0.152 18135 9960 1 11 . 1 1 76 76 TRP N N 76 116.791 116.791 116.284 0.507 18135 9961 1 11 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.713 0.337 18135 9962 1 11 . 1 1 76 76 TRP C C 76 177.617 177.617 174.745 2.872 18135 9963 1 11 . 1 1 76 76 TRP CA C 76 53.319 53.319 54.975 -1.656 18135 9964 1 11 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.113 1.963 18135 9965 1 11 . 1 1 76 76 TRP H H 76 7.080 7.080 7.169 -0.089 18135 9966 1 11 . 1 1 77 77 ASP N N 77 119.928 119.928 122.055 -2.127 18135 9967 1 11 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.484 -0.127 18135 9968 1 11 . 1 1 77 77 ASP C C 77 176.877 176.877 177.468 -0.591 18135 9969 1 11 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.951 -1.133 18135 9970 1 11 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.616 -0.001 18135 9971 1 11 . 1 1 77 77 ASP H H 77 8.259 8.259 8.950 -0.692 18135 9972 1 11 . 1 1 78 78 GLU N N 78 127.277 127.277 126.426 0.851 18135 9973 1 11 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.979 -0.094 18135 9974 1 11 . 1 1 78 78 GLU C C 78 177.439 177.439 178.689 -1.250 18135 9975 1 11 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.344 0.039 18135 9976 1 11 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.708 -1.066 18135 9977 1 11 . 1 1 78 78 GLU H H 78 8.920 8.920 8.903 0.017 18135 9978 1 11 . 1 1 79 79 THR N N 79 115.422 115.422 116.468 -1.046 18135 9979 1 11 . 1 1 79 79 THR HA H 79 3.907 3.907 4.024 -0.117 18135 9980 1 11 . 1 1 79 79 THR C C 79 177.330 177.330 176.374 0.956 18135 9981 1 11 . 1 1 79 79 THR CA C 79 66.263 66.263 65.793 0.470 18135 9982 1 11 . 1 1 79 79 THR CB C 79 68.002 68.002 68.582 -0.580 18135 9983 1 11 . 1 1 79 79 THR H H 79 8.124 8.124 7.746 0.378 18135 9984 1 11 . 1 1 80 80 LEU N N 80 121.791 121.791 122.817 -1.026 18135 9985 1 11 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.103 -0.216 18135 9986 1 11 . 1 1 80 80 LEU C C 80 179.018 179.018 178.706 0.312 18135 9987 1 11 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.185 0.054 18135 9988 1 11 . 1 1 80 80 LEU CB C 80 41.652 41.652 40.979 0.673 18135 9989 1 11 . 1 1 80 80 LEU H H 80 7.725 7.725 7.795 -0.070 18135 9990 1 11 . 1 1 81 81 LEU N N 81 119.280 119.280 120.444 -1.164 18135 9991 1 11 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.246 -0.757 18135 9992 1 11 . 1 1 81 81 LEU C C 81 177.062 177.062 178.808 -1.746 18135 9993 1 11 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.860 -1.151 18135 9994 1 11 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.116 -1.168 18135 9995 1 11 . 1 1 81 81 LEU H H 81 8.344 8.344 8.812 -0.468 18135 9996 1 11 . 1 1 82 82 ASP N N 82 115.357 115.357 119.727 -4.370 18135 9997 1 11 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.411 -0.137 18135 9998 1 11 . 1 1 82 82 ASP C C 82 179.018 179.018 178.468 0.550 18135 9999 1 11 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.677 -0.862 18135 10000 1 11 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.926 -2.705 18135 10001 1 11 . 1 1 82 82 ASP H H 82 8.001 8.001 8.597 -0.596 18135 10002 1 11 . 1 1 83 83 LYS N N 83 119.603 119.603 118.805 0.798 18135 10003 1 11 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.888 0.094 18135 10004 1 11 . 1 1 83 83 LYS C C 83 178.624 178.624 178.904 -0.280 18135 10005 1 11 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.898 0.847 18135 10006 1 11 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.206 0.900 18135 10007 1 11 . 1 1 83 83 LYS H H 83 7.342 7.342 7.698 -0.356 18135 10008 1 11 . 1 1 84 84 PHE N N 84 123.933 123.933 121.912 2.021 18135 10009 1 11 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.040 -0.005 18135 10010 1 11 . 1 1 84 84 PHE C C 84 177.210 177.210 177.008 0.202 18135 10011 1 11 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.759 -1.416 18135 10012 1 11 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.916 0.400 18135 10013 1 11 . 1 1 84 84 PHE H H 84 8.471 8.471 8.412 0.059 18135 10014 1 11 . 1 1 85 85 TYR N N 85 118.387 118.387 117.826 0.561 18135 10015 1 11 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.702 0.366 18135 10016 1 11 . 1 1 85 85 TYR C C 85 178.104 178.104 177.337 0.767 18135 10017 1 11 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.825 -1.248 18135 10018 1 11 . 1 1 85 85 TYR CB C 85 36.977 36.977 36.995 -0.018 18135 10019 1 11 . 1 1 85 85 TYR H H 85 9.011 9.011 8.998 0.013 18135 10020 1 11 . 1 1 86 86 THR N N 86 114.035 114.035 116.823 -2.788 18135 10021 1 11 . 1 1 86 86 THR HA H 86 3.945 3.945 3.221 0.724 18135 10022 1 11 . 1 1 86 86 THR C C 86 176.708 176.708 176.155 0.553 18135 10023 1 11 . 1 1 86 86 THR CA C 86 66.759 66.759 67.379 -0.620 18135 10024 1 11 . 1 1 86 86 THR CB C 86 68.853 68.853 68.076 0.776 18135 10025 1 11 . 1 1 86 86 THR H H 86 7.609 7.609 7.295 0.314 18135 10026 1 11 . 1 1 87 87 GLU N N 87 120.790 120.790 121.307 -0.517 18135 10027 1 11 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.918 0.129 18135 10028 1 11 . 1 1 87 87 GLU C C 87 179.606 179.606 178.843 0.763 18135 10029 1 11 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.424 -1.026 18135 10030 1 11 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.229 -0.943 18135 10031 1 11 . 1 1 87 87 GLU H H 87 7.712 7.712 7.583 0.129 18135 10032 1 11 . 1 1 88 88 LEU N N 88 120.729 120.729 119.703 1.026 18135 10033 1 11 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.882 -0.154 18135 10034 1 11 . 1 1 88 88 LEU C C 88 178.695 178.695 179.238 -0.543 18135 10035 1 11 . 1 1 88 88 LEU CA C 88 58.251 58.251 56.816 1.435 18135 10036 1 11 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.113 1.474 18135 10037 1 11 . 1 1 88 88 LEU H H 88 8.393 8.393 7.526 0.867 18135 10038 1 11 . 1 1 89 89 TYR N N 89 118.654 118.654 119.073 -0.419 18135 10039 1 11 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.030 -0.099 18135 10040 1 11 . 1 1 89 89 TYR C C 89 178.438 178.438 178.631 -0.193 18135 10041 1 11 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.395 0.012 18135 10042 1 11 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.450 0.416 18135 10043 1 11 . 1 1 89 89 TYR H H 89 8.637 8.637 8.234 0.403 18135 10044 1 11 . 1 1 90 90 GLN N N 90 118.263 118.263 116.389 1.874 18135 10045 1 11 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.995 -0.009 18135 10046 1 11 . 1 1 90 90 GLN C C 90 178.411 178.411 178.807 -0.396 18135 10047 1 11 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.639 0.144 18135 10048 1 11 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.288 -0.141 18135 10049 1 11 . 1 1 90 90 GLN H H 90 7.796 7.796 7.842 -0.046 18135 10050 1 11 . 1 1 91 91 GLN N N 91 117.959 117.959 120.297 -2.338 18135 10051 1 11 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.052 0.030 18135 10052 1 11 . 1 1 91 91 GLN C C 91 178.705 178.705 178.429 0.276 18135 10053 1 11 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.840 -0.020 18135 10054 1 11 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.340 0.833 18135 10055 1 11 . 1 1 91 91 GLN H H 91 7.727 7.727 8.048 -0.321 18135 10056 1 11 . 1 1 92 92 LEU N N 92 119.965 119.965 118.472 1.493 18135 10057 1 11 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.963 -0.229 18135 10058 1 11 . 1 1 92 92 LEU C C 92 178.984 178.984 178.695 0.289 18135 10059 1 11 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.962 -0.470 18135 10060 1 11 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.828 0.551 18135 10061 1 11 . 1 1 92 92 LEU H H 92 8.465 8.465 8.460 0.005 18135 10062 1 11 . 1 1 93 93 ASN N N 93 117.793 117.793 118.166 -0.373 18135 10063 1 11 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.273 0.128 18135 10064 1 11 . 1 1 93 93 ASN C C 93 178.309 178.309 177.171 1.138 18135 10065 1 11 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.236 0.167 18135 10066 1 11 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.248 0.390 18135 10067 1 11 . 1 1 93 93 ASN H H 93 8.091 8.091 8.036 0.055 18135 10068 1 11 . 1 1 94 94 ASP N N 94 121.133 121.133 120.801 0.332 18135 10069 1 11 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.348 0.057 18135 10070 1 11 . 1 1 94 94 ASP C C 94 178.328 178.328 178.645 -0.317 18135 10071 1 11 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.416 -0.869 18135 10072 1 11 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.999 -2.350 18135 10073 1 11 . 1 1 94 94 ASP H H 94 8.362 8.362 7.953 0.409 18135 10074 1 11 . 1 1 95 95 LEU N N 95 119.160 119.160 121.181 -2.021 18135 10075 1 11 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.837 0.202 18135 10076 1 11 . 1 1 95 95 LEU C C 95 178.826 178.826 178.593 0.233 18135 10077 1 11 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.093 -1.066 18135 10078 1 11 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.076 0.134 18135 10079 1 11 . 1 1 95 95 LEU H H 95 8.143 8.143 8.538 -0.395 18135 10080 1 11 . 1 1 96 96 GLU N N 96 118.813 118.813 118.804 0.009 18135 10081 1 11 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.712 0.249 18135 10082 1 11 . 1 1 96 96 GLU C C 96 177.640 177.640 178.284 -0.644 18135 10083 1 11 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.505 -1.791 18135 10084 1 11 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.421 -1.283 18135 10085 1 11 . 1 1 96 96 GLU H H 96 8.111 8.111 8.268 -0.157 18135 10086 1 11 . 1 1 97 97 ALA N N 97 120.549 120.549 120.724 -0.175 18135 10087 1 11 . 1 1 97 97 ALA HA H 97 4.122 4.122 4.004 0.118 18135 10088 1 11 . 1 1 97 97 ALA C C 97 179.126 179.126 180.159 -1.033 18135 10089 1 11 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.635 -0.602 18135 10090 1 11 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.928 0.052 18135 10091 1 11 . 1 1 97 97 ALA H H 97 7.798 7.798 7.803 -0.005 18135 10092 1 11 . 1 1 98 98 CYS N N 98 115.510 115.510 116.970 -1.460 18135 10093 1 11 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.185 0.265 18135 10094 1 11 . 1 1 98 98 CYS C C 98 175.363 175.363 176.175 -0.812 18135 10095 1 11 . 1 1 98 98 CYS CA C 98 57.166 57.166 61.817 -4.651 18135 10096 1 11 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.798 15.081 18135 10097 1 11 . 1 1 98 98 CYS H H 98 7.597 7.597 7.684 -0.087 18135 10098 1 11 . 1 1 99 99 VAL N N 99 121.713 121.713 119.316 2.397 18135 10099 1 11 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.977 -0.183 18135 10100 1 11 . 1 1 99 99 VAL C C 99 177.357 177.357 177.605 -0.248 18135 10101 1 11 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.331 -0.748 18135 10102 1 11 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.060 -0.029 18135 10103 1 11 . 1 1 99 99 VAL H H 99 7.828 7.828 7.741 0.087 18135 10104 1 11 . 1 1 100 100 ILE N N 100 122.333 122.333 118.740 3.593 18135 10105 1 11 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.692 0.232 18135 10106 1 11 . 1 1 100 100 ILE C C 100 176.827 176.827 176.536 0.291 18135 10107 1 11 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.539 -1.301 18135 10108 1 11 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.674 0.604 18135 10109 1 11 . 1 1 100 100 ILE H H 100 8.067 8.067 8.237 -0.170 18135 10110 1 11 . 1 1 101 101 GLN N N 101 121.864 121.864 117.290 4.574 18135 10111 1 11 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.192 0.034 18135 10112 1 11 . 1 1 101 101 GLN C C 101 176.438 176.438 178.029 -1.591 18135 10113 1 11 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.615 -0.295 18135 10114 1 11 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.134 -0.123 18135 10115 1 11 . 1 1 101 101 GLN H H 101 8.062 8.062 7.465 0.597 18135 10116 1 11 . 1 1 102 102 GLY N N 102 109.288 109.288 108.237 1.051 18135 10117 1 11 . 1 1 102 102 GLY C C 102 173.855 173.855 175.404 -1.549 18135 10118 1 11 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.077 -0.917 18135 10119 1 11 . 1 1 102 102 GLY H H 102 8.087 8.087 8.797 -0.710 18135 10120 1 11 . 1 1 103 103 VAL N N 103 118.932 118.932 114.840 4.092 18135 10121 1 11 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.777 0.297 18135 10122 1 11 . 1 1 103 103 VAL C C 103 176.299 176.299 175.869 0.430 18135 10123 1 11 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.908 -1.409 18135 10124 1 11 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.445 1.409 18135 10125 1 11 . 1 1 103 103 VAL H H 103 8.079 8.079 7.629 0.450 18135 10126 1 11 . 1 1 104 104 GLY N N 104 112.028 112.028 107.919 4.109 18135 10127 1 11 . 1 1 104 104 GLY C C 104 173.694 173.694 173.723 -0.029 18135 10128 1 11 . 1 1 104 104 GLY CA C 104 45.402 45.402 44.751 0.651 18135 10129 1 11 . 1 1 104 104 GLY H H 104 8.446 8.446 7.579 0.867 18135 10130 1 11 . 1 1 105 105 VAL N N 105 120.439 120.439 122.019 -1.580 18135 10131 1 11 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.437 -0.249 18135 10132 1 11 . 1 1 105 105 VAL C C 105 175.963 175.963 174.025 1.938 18135 10133 1 11 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.635 1.501 18135 10134 1 11 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.070 -1.256 18135 10135 1 11 . 1 1 105 105 VAL H H 105 7.867 7.867 8.081 -0.214 18135 10136 1 11 . 1 1 106 106 THR N N 106 116.366 116.366 115.308 1.058 18135 10137 1 11 . 1 1 106 106 THR HA H 106 4.548 4.548 4.633 -0.085 18135 10138 1 11 . 1 1 106 106 THR C C 106 173.731 173.731 173.178 0.553 18135 10139 1 11 . 1 1 106 106 THR CA C 106 59.419 59.419 60.678 -1.260 18135 10140 1 11 . 1 1 106 106 THR CB C 106 79.536 79.536 70.902 8.634 18135 10141 1 11 . 1 1 106 106 THR H H 106 8.565 8.565 7.887 0.678 18135 10142 1 11 . 1 1 107 107 GLU N N 107 119.743 119.743 119.696 0.047 18135 10143 1 11 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.663 -0.201 18135 10144 1 11 . 1 1 107 107 GLU C C 107 175.639 175.639 175.566 0.073 18135 10145 1 11 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.393 1.318 18135 10146 1 11 . 1 1 107 107 GLU CB C 107 30.499 30.499 32.099 -1.600 18135 10147 1 11 . 1 1 107 107 GLU H H 107 8.410 8.410 8.380 0.030 18135 10148 1 11 . 1 1 108 108 THR N N 108 114.402 114.402 109.857 4.545 18135 10149 1 11 . 1 1 108 108 THR HA H 108 4.448 4.448 4.792 -0.344 18135 10150 1 11 . 1 1 108 108 THR CA C 108 60.348 60.348 57.776 2.572 18135 10151 1 11 . 1 1 108 108 THR CB C 108 68.544 68.544 70.013 -1.469 18135 10152 1 11 . 1 1 108 108 THR H H 108 8.155 8.155 8.186 -0.031 18135 10153 1 11 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.464 -0.226 18135 10154 1 11 . 1 1 109 109 PRO C C 109 178.666 178.666 177.306 1.360 18135 10155 1 11 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.325 1.051 18135 10156 1 11 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.639 0.209 18135 10157 1 11 . 1 1 110 110 LEU N N 110 118.566 118.566 118.040 0.526 18135 10158 1 11 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.145 -0.029 18135 10159 1 11 . 1 1 110 110 LEU C C 110 178.293 178.293 178.949 -0.656 18135 10160 1 11 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.422 -0.736 18135 10161 1 11 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.745 0.224 18135 10162 1 11 . 1 1 110 110 LEU H H 110 8.016 8.016 7.624 0.392 18135 10163 1 11 . 1 1 111 111 MET N N 111 118.982 118.982 115.235 3.747 18135 10164 1 11 . 1 1 111 111 MET HA H 111 4.210 4.210 4.394 -0.184 18135 10165 1 11 . 1 1 111 111 MET C C 111 178.720 178.720 177.694 1.026 18135 10166 1 11 . 1 1 111 111 MET CA C 111 58.144 58.144 57.815 0.329 18135 10167 1 11 . 1 1 111 111 MET CB C 111 32.374 32.374 33.077 -0.703 18135 10168 1 11 . 1 1 111 111 MET H H 111 7.705 7.705 7.612 0.093 18135 10169 1 11 . 1 1 112 112 LYS N N 112 121.377 121.377 119.564 1.813 18135 10170 1 11 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.186 -0.078 18135 10171 1 11 . 1 1 112 112 LYS C C 112 178.000 178.000 178.510 -0.510 18135 10172 1 11 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.665 -2.360 18135 10173 1 11 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.146 0.221 18135 10174 1 11 . 1 1 112 112 LYS H H 112 8.257 8.257 7.649 0.608 18135 10175 1 11 . 1 1 113 113 GLU N N 113 119.104 119.104 119.058 0.046 18135 10176 1 11 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.999 0.067 18135 10177 1 11 . 1 1 113 113 GLU C C 113 178.289 178.289 178.802 -0.513 18135 10178 1 11 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.497 -1.244 18135 10179 1 11 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.398 -1.260 18135 10180 1 11 . 1 1 113 113 GLU H H 113 8.270 8.270 7.892 0.378 18135 10181 1 11 . 1 1 114 114 ASP N N 114 119.224 119.224 119.154 0.070 18135 10182 1 11 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.525 -0.237 18135 10183 1 11 . 1 1 114 114 ASP C C 114 178.365 178.365 178.356 0.009 18135 10184 1 11 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.225 -1.117 18135 10185 1 11 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.984 -2.749 18135 10186 1 11 . 1 1 114 114 ASP H H 114 8.618 8.618 7.615 1.003 18135 10187 1 11 . 1 1 115 115 SER N N 115 118.195 118.195 116.864 1.331 18135 10188 1 11 . 1 1 115 115 SER HA H 115 4.200 4.200 4.091 0.109 18135 10189 1 11 . 1 1 115 115 SER C C 115 175.986 175.986 176.492 -0.506 18135 10190 1 11 . 1 1 115 115 SER CA C 115 61.588 61.588 62.133 -0.545 18135 10191 1 11 . 1 1 115 115 SER CB C 115 62.653 62.653 62.844 -0.191 18135 10192 1 11 . 1 1 115 115 SER H H 115 8.181 8.181 7.521 0.660 18135 10193 1 11 . 1 1 116 116 ILE N N 116 123.340 123.340 121.322 2.018 18135 10194 1 11 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.867 -0.241 18135 10195 1 11 . 1 1 116 116 ILE C C 116 178.367 178.367 177.897 0.470 18135 10196 1 11 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.208 1.609 18135 10197 1 11 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.792 0.626 18135 10198 1 11 . 1 1 116 116 ILE H H 116 7.773 7.773 8.508 -0.735 18135 10199 1 11 . 1 1 117 117 LEU N N 117 120.968 120.968 121.268 -0.300 18135 10200 1 11 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.912 -0.007 18135 10201 1 11 . 1 1 117 117 LEU C C 117 178.746 178.746 178.529 0.217 18135 10202 1 11 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.173 -0.030 18135 10203 1 11 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.633 -0.047 18135 10204 1 11 . 1 1 117 117 LEU H H 117 8.406 8.406 7.471 0.935 18135 10205 1 11 . 1 1 118 118 ALA N N 118 120.150 120.150 121.840 -1.690 18135 10206 1 11 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.701 0.411 18135 10207 1 11 . 1 1 118 118 ALA C C 118 181.633 181.633 178.618 3.015 18135 10208 1 11 . 1 1 118 118 ALA CA C 118 55.313 55.313 54.959 0.354 18135 10209 1 11 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.558 -0.448 18135 10210 1 11 . 1 1 118 118 ALA H H 118 7.894 7.894 8.168 -0.274 18135 10211 1 11 . 1 1 119 119 VAL N N 119 118.873 118.873 116.175 2.698 18135 10212 1 11 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.323 0.432 18135 10213 1 11 . 1 1 119 119 VAL C C 119 177.896 177.896 177.465 0.431 18135 10214 1 11 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.833 1.348 18135 10215 1 11 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.947 0.947 18135 10216 1 11 . 1 1 119 119 VAL H H 119 7.572 7.572 7.846 -0.274 18135 10217 1 11 . 1 1 120 120 ARG N N 120 121.436 121.436 119.080 2.356 18135 10218 1 11 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.132 -0.105 18135 10219 1 11 . 1 1 120 120 ARG C C 120 179.848 179.848 178.258 1.590 18135 10220 1 11 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.196 2.071 18135 10221 1 11 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.653 0.042 18135 10222 1 11 . 1 1 120 120 ARG H H 120 8.629 8.629 8.694 -0.065 18135 10223 1 11 . 1 1 121 121 LYS N N 121 119.589 119.589 120.658 -1.069 18135 10224 1 11 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.048 0.026 18135 10225 1 11 . 1 1 121 121 LYS C C 121 178.331 178.331 179.187 -0.856 18135 10226 1 11 . 1 1 121 121 LYS CA C 121 60.440 60.440 58.463 1.977 18135 10227 1 11 . 1 1 121 121 LYS CB C 121 32.107 32.107 31.676 0.431 18135 10228 1 11 . 1 1 121 121 LYS H H 121 9.015 9.015 7.431 1.584 18135 10229 1 11 . 1 1 122 122 TYR N N 122 121.546 121.546 118.777 2.769 18135 10230 1 11 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.213 0.119 18135 10231 1 11 . 1 1 122 122 TYR C C 122 176.527 176.527 177.976 -1.449 18135 10232 1 11 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.973 1.431 18135 10233 1 11 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.232 0.493 18135 10234 1 11 . 1 1 122 122 TYR H H 122 7.473 7.473 7.774 -0.301 18135 10235 1 11 . 1 1 123 123 PHE N N 123 116.026 116.026 120.188 -4.162 18135 10236 1 11 . 1 1 123 123 PHE HA H 123 3.740 3.740 4.010 -0.270 18135 10237 1 11 . 1 1 123 123 PHE C C 123 179.005 179.005 177.585 1.420 18135 10238 1 11 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.502 3.026 18135 10239 1 11 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.874 0.457 18135 10240 1 11 . 1 1 123 123 PHE H H 123 7.932 7.932 8.376 -0.444 18135 10241 1 11 . 1 1 124 124 GLN N N 124 123.043 123.043 118.706 4.337 18135 10242 1 11 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.448 0.731 18135 10243 1 11 . 1 1 124 124 GLN C C 124 178.772 178.772 178.641 0.131 18135 10244 1 11 . 1 1 124 124 GLN CA C 124 59.316 59.316 58.922 0.395 18135 10245 1 11 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.097 -0.466 18135 10246 1 11 . 1 1 124 124 GLN H H 124 8.470 8.470 8.118 0.352 18135 10247 1 11 . 1 1 125 125 ARG N N 125 120.342 120.342 118.619 1.723 18135 10248 1 11 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.182 -0.104 18135 10249 1 11 . 1 1 125 125 ARG C C 125 180.340 180.340 179.294 1.046 18135 10250 1 11 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.576 2.721 18135 10251 1 11 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.168 0.157 18135 10252 1 11 . 1 1 125 125 ARG H H 125 8.137 8.137 7.977 0.160 18135 10253 1 11 . 1 1 126 126 ILE N N 126 121.876 121.876 121.407 0.469 18135 10254 1 11 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.823 -0.472 18135 10255 1 11 . 1 1 126 126 ILE C C 126 176.857 176.857 177.969 -1.112 18135 10256 1 11 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.950 0.882 18135 10257 1 11 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.821 0.463 18135 10258 1 11 . 1 1 126 126 ILE H H 126 7.526 7.526 8.492 -0.966 18135 10259 1 11 . 1 1 127 127 THR N N 127 115.613 115.613 115.033 0.580 18135 10260 1 11 . 1 1 127 127 THR HA H 127 3.633 3.633 3.893 -0.260 18135 10261 1 11 . 1 1 127 127 THR C C 127 176.645 176.645 176.840 -0.195 18135 10262 1 11 . 1 1 127 127 THR CA C 127 67.294 67.294 66.599 0.695 18135 10263 1 11 . 1 1 127 127 THR CB C 127 68.871 68.871 68.877 -0.006 18135 10264 1 11 . 1 1 127 127 THR H H 127 8.288 8.288 8.250 0.038 18135 10265 1 11 . 1 1 128 128 LEU N N 128 122.627 122.627 122.053 0.574 18135 10266 1 11 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.932 0.024 18135 10267 1 11 . 1 1 128 128 LEU C C 128 178.331 178.331 177.587 0.744 18135 10268 1 11 . 1 1 128 128 LEU CA C 128 58.088 58.088 58.344 -0.256 18135 10269 1 11 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.556 0.018 18135 10270 1 11 . 1 1 128 128 LEU H H 128 8.263 8.263 8.008 0.255 18135 10271 1 11 . 1 1 129 129 TYR N N 129 120.955 120.955 120.344 0.611 18135 10272 1 11 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.276 -0.386 18135 10273 1 11 . 1 1 129 129 TYR C C 129 176.040 176.040 177.581 -1.541 18135 10274 1 11 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.238 0.255 18135 10275 1 11 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.205 0.720 18135 10276 1 11 . 1 1 129 129 TYR H H 129 7.518 7.518 8.334 -0.816 18135 10277 1 11 . 1 1 130 130 LEU N N 130 119.155 119.155 116.210 2.945 18135 10278 1 11 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.321 -0.476 18135 10279 1 11 . 1 1 130 130 LEU C C 130 177.948 177.948 178.174 -0.226 18135 10280 1 11 . 1 1 130 130 LEU CA C 130 58.113 58.113 58.026 0.087 18135 10281 1 11 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.439 1.147 18135 10282 1 11 . 1 1 130 130 LEU H H 130 7.717 7.717 8.141 -0.424 18135 10283 1 11 . 1 1 131 131 LYS N N 131 116.832 116.832 120.133 -3.301 18135 10284 1 11 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.881 -0.473 18135 10285 1 11 . 1 1 131 131 LYS C C 131 181.265 181.265 179.729 1.536 18135 10286 1 11 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.738 -0.007 18135 10287 1 11 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.051 0.621 18135 10288 1 11 . 1 1 131 131 LYS H H 131 7.493 7.493 7.904 -0.411 18135 10289 1 11 . 1 1 132 132 GLU N N 132 121.918 121.918 119.934 1.984 18135 10290 1 11 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.093 -0.249 18135 10291 1 11 . 1 1 132 132 GLU C C 132 178.377 178.377 178.160 0.217 18135 10292 1 11 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.724 0.163 18135 10293 1 11 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.578 -0.911 18135 10294 1 11 . 1 1 132 132 GLU H H 132 8.430 8.430 8.163 0.267 18135 10295 1 11 . 1 1 133 133 LYS N N 133 116.079 116.079 115.899 0.180 18135 10296 1 11 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.299 -0.333 18135 10297 1 11 . 1 1 133 133 LYS C C 133 175.282 175.282 175.233 0.049 18135 10298 1 11 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.818 -0.520 18135 10299 1 11 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.924 0.074 18135 10300 1 11 . 1 1 133 133 LYS H H 133 7.390 7.390 7.377 0.013 18135 10301 1 11 . 1 1 134 134 LYS N N 134 117.759 117.759 114.982 2.777 18135 10302 1 11 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.060 -0.478 18135 10303 1 11 . 1 1 134 134 LYS C C 134 176.271 176.271 176.177 0.094 18135 10304 1 11 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.782 0.526 18135 10305 1 11 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.257 -0.455 18135 10306 1 11 . 1 1 134 134 LYS H H 134 7.716 7.716 7.471 0.245 18135 10307 1 11 . 1 1 135 135 TYR N N 135 110.598 110.598 113.618 -3.020 18135 10308 1 11 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.952 -1.075 18135 10309 1 11 . 1 1 135 135 TYR C C 135 174.148 174.148 175.275 -1.127 18135 10310 1 11 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.057 0.658 18135 10311 1 11 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.148 -0.442 18135 10312 1 11 . 1 1 135 135 TYR H H 135 8.428 8.428 8.853 -0.425 18135 10313 1 11 . 1 1 136 136 SER N N 136 113.712 113.712 115.315 -1.603 18135 10314 1 11 . 1 1 136 136 SER HA H 136 4.553 4.553 4.383 0.170 18135 10315 1 11 . 1 1 136 136 SER CA C 136 57.108 57.108 59.208 -2.100 18135 10316 1 11 . 1 1 136 136 SER CB C 136 62.500 62.500 64.108 -1.608 18135 10317 1 11 . 1 1 136 136 SER H H 136 6.744 6.744 7.374 -0.630 18135 10318 1 11 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.381 -0.216 18135 10319 1 11 . 1 1 137 137 PRO C C 137 180.675 180.675 177.483 3.192 18135 10320 1 11 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.763 0.894 18135 10321 1 11 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.746 0.237 18135 10322 1 11 . 1 1 138 138 CYS N N 138 113.914 113.914 115.742 -1.828 18135 10323 1 11 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.513 0.157 18135 10324 1 11 . 1 1 138 138 CYS C C 138 176.015 176.015 175.956 0.059 18135 10325 1 11 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.034 -2.939 18135 10326 1 11 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.026 10.752 18135 10327 1 11 . 1 1 138 138 CYS H H 138 8.580 8.580 8.477 0.103 18135 10328 1 11 . 1 1 139 139 ALA N N 139 125.290 125.290 124.958 0.332 18135 10329 1 11 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.143 0.306 18135 10330 1 11 . 1 1 139 139 ALA C C 139 180.149 180.149 179.152 0.997 18135 10331 1 11 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.934 -0.156 18135 10332 1 11 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.086 0.832 18135 10333 1 11 . 1 1 139 139 ALA H H 139 8.087 8.087 7.983 0.104 18135 10334 1 11 . 1 1 140 140 TRP N N 140 116.599 116.599 118.591 -1.992 18135 10335 1 11 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.322 0.280 18135 10336 1 11 . 1 1 140 140 TRP C C 140 179.137 179.137 178.667 0.470 18135 10337 1 11 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.583 -1.049 18135 10338 1 11 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.349 -0.091 18135 10339 1 11 . 1 1 140 140 TRP H H 140 8.505 8.505 7.786 0.719 18135 10340 1 11 . 1 1 141 141 GLU N N 141 121.578 121.578 119.335 2.243 18135 10341 1 11 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.295 0.928 18135 10342 1 11 . 1 1 141 141 GLU C C 141 177.886 177.886 179.013 -1.127 18135 10343 1 11 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.830 -1.923 18135 10344 1 11 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.371 -0.654 18135 10345 1 11 . 1 1 141 141 GLU H H 141 8.182 8.182 8.078 0.104 18135 10346 1 11 . 1 1 142 142 VAL N N 142 121.202 121.202 120.092 1.110 18135 10347 1 11 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.698 -0.068 18135 10348 1 11 . 1 1 142 142 VAL C C 142 180.246 180.246 178.636 1.610 18135 10349 1 11 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.719 0.265 18135 10350 1 11 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.258 0.564 18135 10351 1 11 . 1 1 142 142 VAL H H 142 8.623 8.623 8.099 0.524 18135 10352 1 11 . 1 1 143 143 VAL N N 143 120.119 120.119 119.743 0.376 18135 10353 1 11 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.695 -0.398 18135 10354 1 11 . 1 1 143 143 VAL C C 143 176.407 176.407 178.470 -2.063 18135 10355 1 11 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.950 1.028 18135 10356 1 11 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.500 0.155 18135 10357 1 11 . 1 1 143 143 VAL H H 143 8.323 8.323 8.504 -0.181 18135 10358 1 11 . 1 1 144 144 ARG N N 144 124.102 124.102 118.905 5.197 18135 10359 1 11 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.019 -0.322 18135 10360 1 11 . 1 1 144 144 ARG C C 144 178.127 178.127 178.522 -0.395 18135 10361 1 11 . 1 1 144 144 ARG CA C 144 61.001 61.001 58.810 2.191 18135 10362 1 11 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.528 0.408 18135 10363 1 11 . 1 1 144 144 ARG H H 144 9.619 9.619 8.214 1.405 18135 10364 1 11 . 1 1 145 145 ALA N N 145 119.431 119.431 121.832 -2.401 18135 10365 1 11 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.055 -0.204 18135 10366 1 11 . 1 1 145 145 ALA C C 145 180.763 180.763 179.934 0.829 18135 10367 1 11 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.397 -0.022 18135 10368 1 11 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.010 0.175 18135 10369 1 11 . 1 1 145 145 ALA H H 145 8.867 8.867 8.337 0.530 18135 10370 1 11 . 1 1 146 146 GLU N N 146 121.815 121.815 118.945 2.870 18135 10371 1 11 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.257 -0.046 18135 10372 1 11 . 1 1 146 146 GLU C C 146 177.296 177.296 179.051 -1.755 18135 10373 1 11 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.174 -0.795 18135 10374 1 11 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.628 -1.494 18135 10375 1 11 . 1 1 146 146 GLU H H 146 8.136 8.136 8.001 0.135 18135 10376 1 11 . 1 1 147 147 ILE N N 147 119.542 119.542 120.560 -1.018 18135 10377 1 11 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.715 0.255 18135 10378 1 11 . 1 1 147 147 ILE C C 147 178.283 178.283 178.048 0.235 18135 10379 1 11 . 1 1 147 147 ILE CA C 147 61.253 61.253 65.026 -3.773 18135 10380 1 11 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.596 -2.257 18135 10381 1 11 . 1 1 147 147 ILE H H 147 8.736 8.736 8.151 0.585 18135 10382 1 11 . 1 1 148 148 MET N N 148 119.501 119.501 118.455 1.046 18135 10383 1 11 . 1 1 148 148 MET HA H 148 3.801 3.801 4.217 -0.416 18135 10384 1 11 . 1 1 148 148 MET C C 148 178.210 178.210 178.733 -0.523 18135 10385 1 11 . 1 1 148 148 MET CA C 148 60.184 60.184 59.731 0.453 18135 10386 1 11 . 1 1 148 148 MET CB C 148 32.914 32.914 31.986 0.928 18135 10387 1 11 . 1 1 148 148 MET H H 148 8.440 8.440 8.408 0.032 18135 10388 1 11 . 1 1 149 149 ARG N N 149 119.734 119.734 120.125 -0.391 18135 10389 1 11 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.171 -0.256 18135 10390 1 11 . 1 1 149 149 ARG C C 149 178.978 178.978 179.222 -0.244 18135 10391 1 11 . 1 1 149 149 ARG CA C 149 59.863 59.863 58.596 1.267 18135 10392 1 11 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.373 0.907 18135 10393 1 11 . 1 1 149 149 ARG H H 149 7.648 7.648 8.405 -0.757 18135 10394 1 11 . 1 1 150 150 SER N N 150 118.109 118.109 114.707 3.402 18135 10395 1 11 . 1 1 150 150 SER HA H 150 3.339 3.339 3.662 -0.323 18135 10396 1 11 . 1 1 150 150 SER C C 150 177.292 177.292 176.268 1.024 18135 10397 1 11 . 1 1 150 150 SER CA C 150 61.316 61.316 60.787 0.529 18135 10398 1 11 . 1 1 150 150 SER CB C 150 60.288 60.288 62.079 -1.791 18135 10399 1 11 . 1 1 150 150 SER H H 150 9.194 9.194 8.464 0.730 18135 10400 1 11 . 1 1 151 151 PHE N N 151 125.265 125.265 123.854 1.411 18135 10401 1 11 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.409 -0.373 18135 10402 1 11 . 1 1 151 151 PHE C C 151 178.696 178.696 178.034 0.662 18135 10403 1 11 . 1 1 151 151 PHE CA C 151 61.420 61.420 60.007 1.413 18135 10404 1 11 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.751 0.135 18135 10405 1 11 . 1 1 151 151 PHE H H 151 9.455 9.455 8.422 1.033 18135 10406 1 11 . 1 1 152 152 SER N N 152 115.963 115.963 116.659 -0.696 18135 10407 1 11 . 1 1 152 152 SER HA H 152 3.880 3.880 3.843 0.037 18135 10408 1 11 . 1 1 152 152 SER C C 152 175.858 175.858 176.700 -0.842 18135 10409 1 11 . 1 1 152 152 SER CA C 152 62.388 62.388 61.297 1.091 18135 10410 1 11 . 1 1 152 152 SER CB C 152 62.519 62.519 63.261 -0.742 18135 10411 1 11 . 1 1 152 152 SER H H 152 7.839 7.839 8.639 -0.800 18135 10412 1 11 . 1 1 153 153 LEU N N 153 121.365 121.365 122.860 -1.495 18135 10413 1 11 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.197 -0.116 18135 10414 1 11 . 1 1 153 153 LEU C C 153 179.515 179.515 177.893 1.622 18135 10415 1 11 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.770 0.113 18135 10416 1 11 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.414 0.928 18135 10417 1 11 . 1 1 153 153 LEU H H 153 7.775 7.775 8.277 -0.502 18135 10418 1 11 . 1 1 154 154 SER N N 154 113.950 113.950 112.752 1.198 18135 10419 1 11 . 1 1 154 154 SER HA H 154 3.781 3.781 4.480 -0.699 18135 10420 1 11 . 1 1 154 154 SER C C 154 174.312 174.312 176.707 -2.395 18135 10421 1 11 . 1 1 154 154 SER CA C 154 61.366 61.366 61.371 -0.005 18135 10422 1 11 . 1 1 154 154 SER CB C 154 63.242 63.242 63.862 -0.620 18135 10423 1 11 . 1 1 154 154 SER H H 154 7.874 7.874 8.351 -0.477 18135 10424 1 11 . 1 1 155 155 THR N N 155 109.346 109.346 111.120 -1.774 18135 10425 1 11 . 1 1 155 155 THR HA H 155 4.060 4.060 4.311 -0.251 18135 10426 1 11 . 1 1 155 155 THR C C 155 174.798 174.798 176.037 -1.239 18135 10427 1 11 . 1 1 155 155 THR CA C 155 62.275 62.275 64.820 -2.545 18135 10428 1 11 . 1 1 155 155 THR CB C 155 69.342 69.342 69.008 0.334 18135 10429 1 11 . 1 1 155 155 THR H H 155 7.176 7.176 7.955 -0.779 18135 10430 1 11 . 1 1 156 156 ASN N N 156 119.785 119.785 121.332 -1.547 18135 10431 1 11 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.805 -0.278 18135 10432 1 11 . 1 1 156 156 ASN C C 156 175.528 175.528 174.962 0.566 18135 10433 1 11 . 1 1 156 156 ASN CA C 156 53.937 53.937 51.724 2.212 18135 10434 1 11 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.136 1.202 18135 10435 1 11 . 1 1 156 156 ASN H H 156 7.749 7.749 8.065 -0.316 18135 10436 1 11 . 1 1 157 157 LEU N N 157 120.552 120.552 121.560 -1.008 18135 10437 1 11 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.481 -0.226 18135 10438 1 11 . 1 1 157 157 LEU C C 157 174.702 174.702 178.136 -3.434 18135 10439 1 11 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.415 -0.741 18135 10440 1 11 . 1 1 157 157 LEU CB C 157 42.351 42.351 41.908 0.443 18135 10441 1 11 . 1 1 157 157 LEU H H 157 8.097 8.097 7.689 0.408 18135 10442 1 11 . 1 1 158 158 GLN N N 158 119.860 119.860 118.003 1.857 18135 10443 1 11 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.264 -0.084 18135 10444 1 11 . 1 1 158 158 GLN C C 158 176.434 176.434 175.723 0.711 18135 10445 1 11 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.357 1.540 18135 10446 1 11 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.705 -0.695 18135 10447 1 11 . 1 1 158 158 GLN H H 158 8.230 8.230 7.889 0.341 18135 10448 1 11 . 1 1 159 159 GLU N N 159 120.461 120.461 119.103 1.358 18135 10449 1 11 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.105 0.114 18135 10450 1 11 . 1 1 159 159 GLU C C 159 175.251 175.251 174.860 0.391 18135 10451 1 11 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.421 -0.726 18135 10452 1 11 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.199 0.782 18135 10453 1 11 . 1 1 159 159 GLU H H 159 8.300 8.300 8.630 -0.330 18135 10454 1 11 . 1 1 160 160 SER N N 160 115.719 115.719 113.619 2.100 18135 10455 1 11 . 1 1 160 160 SER HA H 160 4.372 4.372 4.645 -0.273 18135 10456 1 11 . 1 1 160 160 SER C C 160 174.188 174.188 174.154 0.034 18135 10457 1 11 . 1 1 160 160 SER CA C 160 58.481 58.481 57.941 0.541 18135 10458 1 11 . 1 1 160 160 SER CB C 160 63.731 63.731 63.574 0.157 18135 10459 1 11 . 1 1 160 160 SER H H 160 8.113 8.113 8.528 -0.415 18135 10460 1 11 . 1 1 161 161 LEU N N 161 123.794 123.794 123.103 0.691 18135 10461 1 11 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.318 -0.038 18135 10462 1 11 . 1 1 161 161 LEU C C 161 177.293 177.293 177.996 -0.703 18135 10463 1 11 . 1 1 161 161 LEU CA C 161 55.190 55.190 56.640 -1.450 18135 10464 1 11 . 1 1 161 161 LEU CB C 161 42.284 42.284 41.910 0.374 18135 10465 1 11 . 1 1 161 161 LEU H H 161 8.032 8.032 8.211 -0.179 18135 10466 1 11 . 1 1 162 162 ARG N N 162 120.715 120.715 119.215 1.500 18135 10467 1 11 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.247 -0.078 18135 10468 1 11 . 1 1 162 162 ARG C C 162 176.288 176.288 176.112 0.176 18135 10469 1 11 . 1 1 162 162 ARG CA C 162 57.046 57.046 56.768 0.278 18135 10470 1 11 . 1 1 162 162 ARG CB C 162 30.935 30.935 31.279 -0.344 18135 10471 1 11 . 1 1 162 162 ARG H H 162 8.094 8.094 8.478 -0.384 18135 10472 1 11 . 1 1 163 163 SER N N 163 116.670 116.670 112.978 3.692 18135 10473 1 11 . 1 1 163 163 SER HA H 163 4.372 4.372 4.134 0.238 18135 10474 1 11 . 1 1 163 163 SER C C 163 174.184 174.184 174.784 -0.600 18135 10475 1 11 . 1 1 163 163 SER CA C 163 58.481 58.481 58.833 -0.352 18135 10476 1 11 . 1 1 163 163 SER CB C 163 63.745 63.745 62.347 1.398 18135 10477 1 11 . 1 1 163 163 SER H H 163 8.191 8.191 8.611 -0.419 18135 10478 1 11 . 1 1 164 164 LYS N N 164 123.100 123.100 119.853 3.247 18135 10479 1 11 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.161 0.116 18135 10480 1 11 . 1 1 164 164 LYS C C 164 175.617 175.617 176.890 -1.273 18135 10481 1 11 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.341 -1.028 18135 10482 1 11 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.560 0.405 18135 10483 1 11 . 1 1 164 164 LYS H H 164 8.251 8.251 8.190 0.061 18135 10484 1 12 . 1 1 2 2 ASP N N 2 125.691 125.691 122.060 3.631 18135 10485 1 12 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.747 -0.037 18135 10486 1 12 . 1 1 2 2 ASP C C 2 174.758 174.758 175.465 -0.707 18135 10487 1 12 . 1 1 2 2 ASP CA C 2 52.843 52.843 53.933 -1.090 18135 10488 1 12 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.101 -1.780 18135 10489 1 12 . 1 1 2 2 ASP H H 2 8.773 8.773 8.357 0.416 18135 10490 1 12 . 1 1 3 3 LEU N N 3 123.957 123.957 117.056 6.901 18135 10491 1 12 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.328 0.073 18135 10492 1 12 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.709 0.944 18135 10493 1 12 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.637 -0.082 18135 10494 1 12 . 1 1 3 3 LEU H H 3 8.164 8.164 7.416 0.748 18135 10495 1 12 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.477 -0.163 18135 10496 1 12 . 1 1 4 4 PRO C C 4 176.213 176.213 176.499 -0.286 18135 10497 1 12 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.168 0.740 18135 10498 1 12 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.296 1.598 18135 10499 1 12 . 1 1 5 5 GLN N N 5 121.621 121.621 122.109 -0.488 18135 10500 1 12 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.125 0.101 18135 10501 1 12 . 1 1 5 5 GLN C C 5 176.995 176.995 176.685 0.310 18135 10502 1 12 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.314 -1.604 18135 10503 1 12 . 1 1 5 5 GLN CB C 5 28.951 28.951 28.951 0.000 18135 10504 1 12 . 1 1 5 5 GLN H H 5 8.767 8.767 8.657 0.110 18135 10505 1 12 . 1 1 6 6 THR N N 6 111.419 111.419 111.062 0.357 18135 10506 1 12 . 1 1 6 6 THR HA H 6 4.135 4.135 4.461 -0.326 18135 10507 1 12 . 1 1 6 6 THR C C 6 174.695 174.695 174.931 -0.236 18135 10508 1 12 . 1 1 6 6 THR CA C 6 62.661 62.661 63.140 -0.479 18135 10509 1 12 . 1 1 6 6 THR CB C 6 69.365 69.365 68.629 0.736 18135 10510 1 12 . 1 1 6 6 THR H H 6 7.865 7.865 8.482 -0.617 18135 10511 1 12 . 1 1 7 7 HIS N N 7 119.137 119.137 119.384 -0.247 18135 10512 1 12 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.634 -0.049 18135 10513 1 12 . 1 1 7 7 HIS C C 7 174.980 174.980 175.413 -0.433 18135 10514 1 12 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.620 -2.616 18135 10515 1 12 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.882 -1.719 18135 10516 1 12 . 1 1 7 7 HIS H H 7 8.567 8.567 8.563 0.004 18135 10517 1 12 . 1 1 8 8 SER N N 8 115.796 115.796 113.728 2.068 18135 10518 1 12 . 1 1 8 8 SER HA H 8 4.363 4.363 4.446 -0.083 18135 10519 1 12 . 1 1 8 8 SER C C 8 175.312 175.312 175.826 -0.514 18135 10520 1 12 . 1 1 8 8 SER CA C 8 58.969 58.969 60.720 -1.751 18135 10521 1 12 . 1 1 8 8 SER CB C 8 63.439 63.439 64.181 -0.742 18135 10522 1 12 . 1 1 8 8 SER H H 8 8.180 8.180 7.934 0.246 18135 10523 1 12 . 1 1 9 9 LEU N N 9 123.844 123.844 118.729 5.115 18135 10524 1 12 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.684 -0.529 18135 10525 1 12 . 1 1 9 9 LEU C C 9 178.568 178.568 178.214 0.354 18135 10526 1 12 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.556 0.410 18135 10527 1 12 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.493 -0.697 18135 10528 1 12 . 1 1 9 9 LEU H H 9 8.404 8.404 7.669 0.735 18135 10529 1 12 . 1 1 10 10 GLY N N 10 107.582 107.582 107.593 -0.011 18135 10530 1 12 . 1 1 10 10 GLY C C 10 174.586 174.586 175.621 -1.035 18135 10531 1 12 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.147 -0.242 18135 10532 1 12 . 1 1 10 10 GLY H H 10 8.438 8.438 8.521 -0.083 18135 10533 1 12 . 1 1 11 11 SER N N 11 118.806 118.806 117.189 1.617 18135 10534 1 12 . 1 1 11 11 SER HA H 11 4.156 4.156 4.113 0.043 18135 10535 1 12 . 1 1 11 11 SER C C 11 175.749 175.749 176.505 -0.756 18135 10536 1 12 . 1 1 11 11 SER CA C 11 61.299 61.299 61.811 -0.512 18135 10537 1 12 . 1 1 11 11 SER CB C 11 62.653 62.653 63.101 -0.448 18135 10538 1 12 . 1 1 11 11 SER H H 11 8.249 8.249 8.227 0.022 18135 10539 1 12 . 1 1 12 12 ARG N N 12 121.986 121.986 121.453 0.533 18135 10540 1 12 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.096 -0.142 18135 10541 1 12 . 1 1 12 12 ARG C C 12 178.283 178.283 178.542 -0.259 18135 10542 1 12 . 1 1 12 12 ARG CA C 12 59.830 59.830 59.019 0.811 18135 10543 1 12 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.010 -0.426 18135 10544 1 12 . 1 1 12 12 ARG H H 12 8.027 8.027 8.063 -0.036 18135 10545 1 12 . 1 1 13 13 ARG N N 13 119.432 119.432 118.958 0.474 18135 10546 1 12 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.068 -0.229 18135 10547 1 12 . 1 1 13 13 ARG C C 13 178.480 178.480 178.799 -0.319 18135 10548 1 12 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.734 0.757 18135 10549 1 12 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.817 0.265 18135 10550 1 12 . 1 1 13 13 ARG H H 13 8.437 8.437 7.929 0.508 18135 10551 1 12 . 1 1 14 14 THR N N 14 116.879 116.879 117.597 -0.718 18135 10552 1 12 . 1 1 14 14 THR HA H 14 3.532 3.532 4.076 -0.544 18135 10553 1 12 . 1 1 14 14 THR C C 14 175.584 175.584 176.918 -1.334 18135 10554 1 12 . 1 1 14 14 THR CA C 14 68.036 68.036 66.694 1.342 18135 10555 1 12 . 1 1 14 14 THR CB C 14 67.969 67.969 68.765 -0.796 18135 10556 1 12 . 1 1 14 14 THR H H 14 7.957 7.957 8.181 -0.224 18135 10557 1 12 . 1 1 15 15 LEU N N 15 120.252 120.252 122.726 -2.474 18135 10558 1 12 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.951 -0.005 18135 10559 1 12 . 1 1 15 15 LEU C C 15 178.652 178.652 179.070 -0.418 18135 10560 1 12 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.556 -0.468 18135 10561 1 12 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.796 -0.242 18135 10562 1 12 . 1 1 15 15 LEU H H 15 7.550 7.550 8.189 -0.639 18135 10563 1 12 . 1 1 16 16 MET N N 16 118.788 118.788 117.085 1.703 18135 10564 1 12 . 1 1 16 16 MET HA H 16 4.023 4.023 3.999 0.024 18135 10565 1 12 . 1 1 16 16 MET C C 16 178.718 178.718 178.816 -0.098 18135 10566 1 12 . 1 1 16 16 MET CA C 16 58.513 58.513 58.616 -0.103 18135 10567 1 12 . 1 1 16 16 MET CB C 16 32.150 32.150 31.661 0.489 18135 10568 1 12 . 1 1 16 16 MET H H 16 7.985 7.985 8.317 -0.332 18135 10569 1 12 . 1 1 17 17 LEU N N 17 120.644 120.644 119.656 0.988 18135 10570 1 12 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.933 0.039 18135 10571 1 12 . 1 1 17 17 LEU C C 17 178.238 178.238 179.301 -1.063 18135 10572 1 12 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.047 -0.320 18135 10573 1 12 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.601 0.534 18135 10574 1 12 . 1 1 17 17 LEU H H 17 7.829 7.829 8.154 -0.325 18135 10575 1 12 . 1 1 18 18 LEU N N 18 118.280 118.280 118.795 -0.515 18135 10576 1 12 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.800 -0.294 18135 10577 1 12 . 1 1 18 18 LEU C C 18 175.739 175.739 178.499 -2.760 18135 10578 1 12 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.289 0.367 18135 10579 1 12 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.460 0.782 18135 10580 1 12 . 1 1 18 18 LEU H H 18 7.499 7.499 8.312 -0.813 18135 10581 1 12 . 1 1 19 19 ALA N N 19 121.961 121.961 120.833 1.128 18135 10582 1 12 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.130 -0.293 18135 10583 1 12 . 1 1 19 19 ALA C C 19 180.736 180.736 179.046 1.690 18135 10584 1 12 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.257 0.809 18135 10585 1 12 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.240 -1.163 18135 10586 1 12 . 1 1 19 19 ALA H H 19 7.950 7.950 7.845 0.105 18135 10587 1 12 . 1 1 20 20 GLN N N 20 118.605 118.605 116.207 2.398 18135 10588 1 12 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.164 -0.229 18135 10589 1 12 . 1 1 20 20 GLN C C 20 176.945 176.945 177.088 -0.143 18135 10590 1 12 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.634 0.381 18135 10591 1 12 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.078 -0.604 18135 10592 1 12 . 1 1 20 20 GLN H H 20 7.958 7.958 8.174 -0.216 18135 10593 1 12 . 1 1 21 21 MET N N 21 116.693 116.693 116.719 -0.026 18135 10594 1 12 . 1 1 21 21 MET HA H 21 3.861 3.861 4.432 -0.571 18135 10595 1 12 . 1 1 21 21 MET C C 21 174.671 174.671 175.885 -1.214 18135 10596 1 12 . 1 1 21 21 MET CA C 21 57.111 57.111 56.924 0.187 18135 10597 1 12 . 1 1 21 21 MET CB C 21 34.073 34.073 33.810 0.263 18135 10598 1 12 . 1 1 21 21 MET H H 21 7.420 7.420 7.587 -0.167 18135 10599 1 12 . 1 1 22 22 ARG N N 22 115.451 115.451 121.604 -6.153 18135 10600 1 12 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.523 0.330 18135 10601 1 12 . 1 1 22 22 ARG C C 22 175.950 175.950 174.521 1.429 18135 10602 1 12 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.534 2.918 18135 10603 1 12 . 1 1 22 22 ARG CB C 22 31.514 31.514 29.937 1.577 18135 10604 1 12 . 1 1 22 22 ARG H H 22 6.484 6.484 7.240 -0.756 18135 10605 1 12 . 1 1 23 23 LYS N N 23 128.593 128.593 127.577 1.016 18135 10606 1 12 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.598 -0.113 18135 10607 1 12 . 1 1 23 23 LYS C C 23 176.643 176.643 175.627 1.016 18135 10608 1 12 . 1 1 23 23 LYS CA C 23 57.287 57.287 56.019 1.268 18135 10609 1 12 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.244 4.017 18135 10610 1 12 . 1 1 23 23 LYS H H 23 10.212 10.212 8.685 1.527 18135 10611 1 12 . 1 1 24 24 ILE N N 24 118.605 118.605 121.521 -2.916 18135 10612 1 12 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.428 0.056 18135 10613 1 12 . 1 1 24 24 ILE C C 24 173.878 173.878 174.506 -0.628 18135 10614 1 12 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.721 -1.124 18135 10615 1 12 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.011 0.445 18135 10616 1 12 . 1 1 24 24 ILE H H 24 8.465 8.465 8.349 0.116 18135 10617 1 12 . 1 1 25 25 SER N N 25 113.658 113.658 118.266 -4.608 18135 10618 1 12 . 1 1 25 25 SER HA H 25 4.481 4.481 4.938 -0.457 18135 10619 1 12 . 1 1 25 25 SER C C 25 176.359 176.359 175.919 0.440 18135 10620 1 12 . 1 1 25 25 SER CA C 25 56.975 56.975 57.246 -0.271 18135 10621 1 12 . 1 1 25 25 SER CB C 25 64.759 64.759 63.632 1.127 18135 10622 1 12 . 1 1 25 25 SER H H 25 8.104 8.104 8.547 -0.443 18135 10623 1 12 . 1 1 26 26 LEU N N 26 127.566 127.566 124.836 2.730 18135 10624 1 12 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.247 -0.370 18135 10625 1 12 . 1 1 26 26 LEU C C 26 178.946 178.946 177.091 1.855 18135 10626 1 12 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.178 0.499 18135 10627 1 12 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.741 -0.022 18135 10628 1 12 . 1 1 26 26 LEU H H 26 8.802 8.802 8.935 -0.133 18135 10629 1 12 . 1 1 27 27 PHE N N 27 117.143 117.143 116.587 0.556 18135 10630 1 12 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.648 -0.410 18135 10631 1 12 . 1 1 27 27 PHE C C 27 177.067 177.067 176.811 0.256 18135 10632 1 12 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.566 1.524 18135 10633 1 12 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.506 -0.244 18135 10634 1 12 . 1 1 27 27 PHE H H 27 7.986 7.986 7.930 0.056 18135 10635 1 12 . 1 1 28 28 SER N N 28 115.200 115.200 116.194 -0.994 18135 10636 1 12 . 1 1 28 28 SER HA H 28 4.505 4.505 4.396 0.109 18135 10637 1 12 . 1 1 28 28 SER C C 28 174.533 174.533 174.431 0.102 18135 10638 1 12 . 1 1 28 28 SER CA C 28 59.447 59.447 60.712 -1.265 18135 10639 1 12 . 1 1 28 28 SER CB C 28 63.790 63.790 63.691 0.099 18135 10640 1 12 . 1 1 28 28 SER H H 28 7.929 7.929 8.143 -0.214 18135 10641 1 12 . 1 1 29 29 CYS N N 29 119.870 119.870 118.735 1.135 18135 10642 1 12 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.676 0.406 18135 10643 1 12 . 1 1 29 29 CYS C C 29 176.475 176.475 174.086 2.389 18135 10644 1 12 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.800 -5.370 18135 10645 1 12 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.432 9.810 18135 10646 1 12 . 1 1 29 29 CYS H H 29 7.865 7.865 7.915 -0.050 18135 10647 1 12 . 1 1 30 30 LEU N N 30 122.259 122.259 123.097 -0.838 18135 10648 1 12 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.365 -0.404 18135 10649 1 12 . 1 1 30 30 LEU C C 30 179.774 179.774 178.183 1.591 18135 10650 1 12 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.216 2.087 18135 10651 1 12 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.498 -0.922 18135 10652 1 12 . 1 1 30 30 LEU H H 30 7.812 7.812 8.347 -0.535 18135 10653 1 12 . 1 1 31 31 LYS N N 31 117.731 117.731 118.143 -0.412 18135 10654 1 12 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.155 0.535 18135 10655 1 12 . 1 1 31 31 LYS C C 31 176.692 176.692 176.011 0.681 18135 10656 1 12 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.329 -3.252 18135 10657 1 12 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.021 -0.434 18135 10658 1 12 . 1 1 31 31 LYS H H 31 8.597 8.597 8.072 0.525 18135 10659 1 12 . 1 1 32 32 ASP N N 32 117.841 117.841 116.636 1.205 18135 10660 1 12 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.682 0.012 18135 10661 1 12 . 1 1 32 32 ASP C C 32 175.505 175.505 176.391 -0.886 18135 10662 1 12 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.339 -0.251 18135 10663 1 12 . 1 1 32 32 ASP CB C 32 41.808 41.808 41.708 0.100 18135 10664 1 12 . 1 1 32 32 ASP H H 32 7.808 7.808 8.157 -0.349 18135 10665 1 12 . 1 1 33 33 ARG N N 33 120.876 120.876 117.979 2.897 18135 10666 1 12 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.164 -0.123 18135 10667 1 12 . 1 1 33 33 ARG C C 33 175.286 175.286 176.540 -1.254 18135 10668 1 12 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.315 -0.232 18135 10669 1 12 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.276 -0.262 18135 10670 1 12 . 1 1 33 33 ARG H H 33 7.378 7.378 7.287 0.091 18135 10671 1 12 . 1 1 34 34 HIS N N 34 120.555 120.555 118.310 2.245 18135 10672 1 12 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.639 -0.427 18135 10673 1 12 . 1 1 34 34 HIS C C 34 170.494 170.494 173.814 -3.320 18135 10674 1 12 . 1 1 34 34 HIS CA C 34 54.607 54.607 56.743 -2.136 18135 10675 1 12 . 1 1 34 34 HIS CB C 34 31.488 31.488 29.949 1.539 18135 10676 1 12 . 1 1 34 34 HIS H H 34 7.974 7.974 7.903 0.071 18135 10677 1 12 . 1 1 35 35 ASP N N 35 125.061 125.061 124.840 0.221 18135 10678 1 12 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.443 0.195 18135 10679 1 12 . 1 1 35 35 ASP C C 35 175.943 175.943 176.277 -0.334 18135 10680 1 12 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.907 -2.538 18135 10681 1 12 . 1 1 35 35 ASP CB C 35 40.362 40.362 42.132 -1.770 18135 10682 1 12 . 1 1 35 35 ASP H H 35 7.805 7.805 8.128 -0.323 18135 10683 1 12 . 1 1 36 36 PHE N N 36 122.860 122.860 119.227 3.633 18135 10684 1 12 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.455 -0.130 18135 10685 1 12 . 1 1 36 36 PHE C C 36 176.643 176.643 176.701 -0.058 18135 10686 1 12 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.141 1.498 18135 10687 1 12 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.567 1.124 18135 10688 1 12 . 1 1 36 36 PHE H H 36 8.973 8.973 7.013 1.960 18135 10689 1 12 . 1 1 37 37 GLY N N 37 111.856 111.856 108.381 3.475 18135 10690 1 12 . 1 1 37 37 GLY C C 37 175.185 175.185 174.109 1.076 18135 10691 1 12 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.798 3.345 18135 10692 1 12 . 1 1 37 37 GLY H H 37 8.727 8.727 8.084 0.643 18135 10693 1 12 . 1 1 38 38 PHE N N 38 123.178 123.178 119.911 3.267 18135 10694 1 12 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.459 -0.545 18135 10695 1 12 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.775 2.029 18135 10696 1 12 . 1 1 38 38 PHE CB C 38 38.657 38.657 37.881 0.776 18135 10697 1 12 . 1 1 38 38 PHE H H 38 9.169 9.169 7.309 1.860 18135 10698 1 12 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.422 0.107 18135 10699 1 12 . 1 1 39 39 PRO C C 39 174.634 174.634 176.959 -2.325 18135 10700 1 12 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.517 -0.974 18135 10701 1 12 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.300 -1.596 18135 10702 1 12 . 1 1 40 40 GLN N N 40 123.608 123.608 123.301 0.307 18135 10703 1 12 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.223 -0.604 18135 10704 1 12 . 1 1 40 40 GLN C C 40 176.958 176.958 177.713 -0.755 18135 10705 1 12 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.954 -0.881 18135 10706 1 12 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.783 1.034 18135 10707 1 12 . 1 1 40 40 GLN H H 40 7.966 7.966 8.359 -0.393 18135 10708 1 12 . 1 1 41 41 GLU N N 41 119.446 119.446 119.563 -0.117 18135 10709 1 12 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.101 0.036 18135 10710 1 12 . 1 1 41 41 GLU C C 41 177.346 177.346 178.000 -0.654 18135 10711 1 12 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.041 -1.112 18135 10712 1 12 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.131 -1.298 18135 10713 1 12 . 1 1 41 41 GLU H H 41 9.044 9.044 8.768 0.276 18135 10714 1 12 . 1 1 42 42 GLU N N 42 117.196 117.196 117.768 -0.572 18135 10715 1 12 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.306 -0.243 18135 10716 1 12 . 1 1 42 42 GLU C C 42 174.886 174.886 177.903 -3.017 18135 10717 1 12 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.170 -0.786 18135 10718 1 12 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.077 -2.519 18135 10719 1 12 . 1 1 42 42 GLU H H 42 7.646 7.646 7.952 -0.306 18135 10720 1 12 . 1 1 43 43 PHE N N 43 115.527 115.527 121.696 -6.169 18135 10721 1 12 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.605 -0.119 18135 10722 1 12 . 1 1 43 43 PHE C C 43 175.615 175.615 176.154 -0.539 18135 10723 1 12 . 1 1 43 43 PHE CA C 43 57.548 57.548 59.464 -1.916 18135 10724 1 12 . 1 1 43 43 PHE CB C 43 39.893 39.893 39.785 0.108 18135 10725 1 12 . 1 1 43 43 PHE H H 43 7.601 7.601 8.304 -0.703 18135 10726 1 12 . 1 1 44 44 GLY N N 44 107.243 107.243 108.968 -1.725 18135 10727 1 12 . 1 1 44 44 GLY C C 44 174.032 174.032 173.340 0.692 18135 10728 1 12 . 1 1 44 44 GLY CA C 44 45.612 45.612 44.325 1.286 18135 10729 1 12 . 1 1 44 44 GLY H H 44 7.733 7.733 7.724 0.009 18135 10730 1 12 . 1 1 45 45 ASN N N 45 117.599 117.599 115.910 1.689 18135 10731 1 12 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.555 -0.004 18135 10732 1 12 . 1 1 45 45 ASN C C 45 175.894 175.894 174.881 1.013 18135 10733 1 12 . 1 1 45 45 ASN CA C 45 53.849 53.849 53.794 0.055 18135 10734 1 12 . 1 1 45 45 ASN CB C 45 38.419 38.419 38.179 0.240 18135 10735 1 12 . 1 1 45 45 ASN H H 45 8.343 8.343 8.642 -0.299 18135 10736 1 12 . 1 1 46 46 GLN N N 46 118.916 118.916 117.284 1.632 18135 10737 1 12 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.391 -0.309 18135 10738 1 12 . 1 1 46 46 GLN C C 46 175.851 175.851 175.255 0.596 18135 10739 1 12 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.425 1.221 18135 10740 1 12 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.142 0.302 18135 10741 1 12 . 1 1 46 46 GLN H H 46 8.652 8.652 8.421 0.231 18135 10742 1 12 . 1 1 47 47 PHE N N 47 119.511 119.511 120.587 -1.076 18135 10743 1 12 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.371 0.191 18135 10744 1 12 . 1 1 47 47 PHE C C 47 176.258 176.258 175.311 0.947 18135 10745 1 12 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.758 -0.838 18135 10746 1 12 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.215 0.643 18135 10747 1 12 . 1 1 47 47 PHE H H 47 7.904 7.904 7.952 -0.048 18135 10748 1 12 . 1 1 48 48 GLN N N 48 120.127 120.127 117.415 2.712 18135 10749 1 12 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.535 -0.160 18135 10750 1 12 . 1 1 48 48 GLN C C 48 181.265 181.265 175.952 5.313 18135 10751 1 12 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.392 1.184 18135 10752 1 12 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.411 0.057 18135 10753 1 12 . 1 1 48 48 GLN H H 48 8.255 8.255 7.955 0.300 18135 10754 1 12 . 1 1 49 49 LYS N N 49 121.777 121.777 123.139 -1.362 18135 10755 1 12 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.093 0.010 18135 10756 1 12 . 1 1 49 49 LYS C C 49 177.968 177.968 177.957 0.011 18135 10757 1 12 . 1 1 49 49 LYS CA C 49 58.149 58.149 59.172 -1.023 18135 10758 1 12 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.198 0.192 18135 10759 1 12 . 1 1 49 49 LYS H H 49 8.426 8.426 8.763 -0.337 18135 10760 1 12 . 1 1 50 50 ALA N N 50 120.573 120.573 119.389 1.184 18135 10761 1 12 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.275 -0.205 18135 10762 1 12 . 1 1 50 50 ALA C C 50 178.697 178.697 178.075 0.622 18135 10763 1 12 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.923 0.845 18135 10764 1 12 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.794 0.080 18135 10765 1 12 . 1 1 50 50 ALA H H 50 8.578 8.578 7.835 0.743 18135 10766 1 12 . 1 1 51 51 GLU N N 51 115.015 115.015 114.235 0.780 18135 10767 1 12 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.261 0.005 18135 10768 1 12 . 1 1 51 51 GLU C C 51 176.995 176.995 177.206 -0.211 18135 10769 1 12 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.470 -0.477 18135 10770 1 12 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.312 -1.407 18135 10771 1 12 . 1 1 51 51 GLU H H 51 7.907 7.907 8.246 -0.339 18135 10772 1 12 . 1 1 52 52 THR N N 52 111.210 111.210 115.822 -4.612 18135 10773 1 12 . 1 1 52 52 THR HA H 52 4.114 4.114 4.293 -0.179 18135 10774 1 12 . 1 1 52 52 THR C C 52 175.271 175.271 175.529 -0.258 18135 10775 1 12 . 1 1 52 52 THR CA C 52 63.611 63.611 64.470 -0.859 18135 10776 1 12 . 1 1 52 52 THR CB C 52 69.673 69.673 68.612 1.061 18135 10777 1 12 . 1 1 52 52 THR H H 52 7.863 7.863 7.363 0.500 18135 10778 1 12 . 1 1 53 53 ILE N N 53 119.113 119.113 122.480 -3.367 18135 10779 1 12 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.405 -0.541 18135 10780 1 12 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.928 0.979 18135 10781 1 12 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.348 -1.395 18135 10782 1 12 . 1 1 53 53 ILE H H 53 8.341 8.341 7.592 0.749 18135 10783 1 12 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.395 -0.109 18135 10784 1 12 . 1 1 54 54 PRO C C 54 179.655 179.655 178.892 0.763 18135 10785 1 12 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.146 -0.095 18135 10786 1 12 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.378 0.507 18135 10787 1 12 . 1 1 55 55 VAL N N 55 116.355 116.355 116.648 -0.293 18135 10788 1 12 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.875 -0.194 18135 10789 1 12 . 1 1 55 55 VAL C C 55 177.649 177.649 178.213 -0.564 18135 10790 1 12 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.205 0.632 18135 10791 1 12 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.595 0.876 18135 10792 1 12 . 1 1 55 55 VAL H H 55 7.119 7.119 7.571 -0.452 18135 10793 1 12 . 1 1 56 56 LEU N N 56 123.038 123.038 121.342 1.696 18135 10794 1 12 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.041 0.269 18135 10795 1 12 . 1 1 56 56 LEU C C 56 178.637 178.637 177.889 0.748 18135 10796 1 12 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.689 -0.603 18135 10797 1 12 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.467 0.851 18135 10798 1 12 . 1 1 56 56 LEU H H 56 8.535 8.535 8.506 0.029 18135 10799 1 12 . 1 1 57 57 HIS N N 57 117.041 117.041 118.286 -1.245 18135 10800 1 12 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.031 -0.245 18135 10801 1 12 . 1 1 57 57 HIS C C 57 175.640 175.640 177.689 -2.049 18135 10802 1 12 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.785 0.746 18135 10803 1 12 . 1 1 57 57 HIS CB C 57 28.209 28.209 29.989 -1.780 18135 10804 1 12 . 1 1 57 57 HIS H H 57 9.047 9.047 7.986 1.061 18135 10805 1 12 . 1 1 58 58 GLU N N 58 119.521 119.521 118.434 1.087 18135 10806 1 12 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.830 0.177 18135 10807 1 12 . 1 1 58 58 GLU C C 58 179.029 179.029 178.834 0.195 18135 10808 1 12 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.284 -0.317 18135 10809 1 12 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.362 -1.072 18135 10810 1 12 . 1 1 58 58 GLU H H 58 7.860 7.860 8.239 -0.379 18135 10811 1 12 . 1 1 59 59 MET N N 59 119.512 119.512 120.417 -0.905 18135 10812 1 12 . 1 1 59 59 MET HA H 59 4.074 4.074 4.332 -0.259 18135 10813 1 12 . 1 1 59 59 MET C C 59 177.031 177.031 178.799 -1.768 18135 10814 1 12 . 1 1 59 59 MET CA C 59 59.408 59.408 58.279 1.129 18135 10815 1 12 . 1 1 59 59 MET CB C 59 32.525 32.525 32.609 -0.084 18135 10816 1 12 . 1 1 59 59 MET H H 59 8.442 8.442 7.990 0.452 18135 10817 1 12 . 1 1 60 60 ILE N N 60 117.183 117.183 118.437 -1.254 18135 10818 1 12 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.440 -0.023 18135 10819 1 12 . 1 1 60 60 ILE C C 60 177.524 177.524 178.116 -0.592 18135 10820 1 12 . 1 1 60 60 ILE CA C 60 65.326 65.326 65.131 0.195 18135 10821 1 12 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.298 -0.438 18135 10822 1 12 . 1 1 60 60 ILE H H 60 8.338 8.338 7.859 0.479 18135 10823 1 12 . 1 1 61 61 GLN N N 61 120.191 120.191 119.491 0.700 18135 10824 1 12 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.898 -0.196 18135 10825 1 12 . 1 1 61 61 GLN C C 61 178.270 178.270 177.802 0.468 18135 10826 1 12 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.496 -0.710 18135 10827 1 12 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.267 0.399 18135 10828 1 12 . 1 1 61 61 GLN H H 61 8.234 8.234 8.293 -0.059 18135 10829 1 12 . 1 1 62 62 GLN N N 62 116.795 116.795 118.824 -2.029 18135 10830 1 12 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.359 0.268 18135 10831 1 12 . 1 1 62 62 GLN C C 62 179.685 179.685 178.293 1.392 18135 10832 1 12 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.352 -0.344 18135 10833 1 12 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.659 -3.317 18135 10834 1 12 . 1 1 62 62 GLN H H 62 8.421 8.421 7.921 0.500 18135 10835 1 12 . 1 1 63 63 ILE N N 63 122.797 122.797 120.089 2.708 18135 10836 1 12 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.852 -0.203 18135 10837 1 12 . 1 1 63 63 ILE C C 63 177.279 177.279 177.860 -0.581 18135 10838 1 12 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.804 2.161 18135 10839 1 12 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.763 -0.448 18135 10840 1 12 . 1 1 63 63 ILE H H 63 8.164 8.164 7.565 0.599 18135 10841 1 12 . 1 1 64 64 PHE N N 64 120.820 120.820 121.291 -0.471 18135 10842 1 12 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.518 -0.802 18135 10843 1 12 . 1 1 64 64 PHE C C 64 178.402 178.402 176.989 1.413 18135 10844 1 12 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.260 0.893 18135 10845 1 12 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.505 0.005 18135 10846 1 12 . 1 1 64 64 PHE H H 64 8.405 8.405 7.948 0.457 18135 10847 1 12 . 1 1 65 65 ASN N N 65 119.981 119.981 117.970 2.011 18135 10848 1 12 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.518 0.545 18135 10849 1 12 . 1 1 65 65 ASN C C 65 177.944 177.944 176.783 1.161 18135 10850 1 12 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.880 -0.012 18135 10851 1 12 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.076 -0.820 18135 10852 1 12 . 1 1 65 65 ASN H H 65 8.812 8.812 7.592 1.220 18135 10853 1 12 . 1 1 66 66 LEU N N 66 121.533 121.533 119.122 2.411 18135 10854 1 12 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.207 0.016 18135 10855 1 12 . 1 1 66 66 LEU C C 66 177.777 177.777 179.155 -1.378 18135 10856 1 12 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.976 0.292 18135 10857 1 12 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.654 -0.047 18135 10858 1 12 . 1 1 66 66 LEU H H 66 8.177 8.177 7.745 0.432 18135 10859 1 12 . 1 1 67 67 PHE N N 67 110.842 110.842 114.831 -3.989 18135 10860 1 12 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.564 0.316 18135 10861 1 12 . 1 1 67 67 PHE C C 67 177.965 177.965 176.720 1.245 18135 10862 1 12 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.717 0.817 18135 10863 1 12 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.747 -0.131 18135 10864 1 12 . 1 1 67 67 PHE H H 67 8.160 8.160 8.745 -0.585 18135 10865 1 12 . 1 1 68 68 SER N N 68 119.131 119.131 113.067 6.064 18135 10866 1 12 . 1 1 68 68 SER HA H 68 4.580 4.580 4.458 0.122 18135 10867 1 12 . 1 1 68 68 SER C C 68 173.472 173.472 174.663 -1.191 18135 10868 1 12 . 1 1 68 68 SER CA C 68 59.191 59.191 59.322 -0.131 18135 10869 1 12 . 1 1 68 68 SER CB C 68 63.123 63.123 63.981 -0.858 18135 10870 1 12 . 1 1 68 68 SER H H 68 8.016 8.016 7.757 0.259 18135 10871 1 12 . 1 1 69 69 THR N N 69 111.353 111.353 115.543 -4.190 18135 10872 1 12 . 1 1 69 69 THR HA H 69 4.345 4.345 4.480 -0.135 18135 10873 1 12 . 1 1 69 69 THR C C 69 175.661 175.661 174.536 1.125 18135 10874 1 12 . 1 1 69 69 THR CA C 69 61.411 61.411 60.230 1.181 18135 10875 1 12 . 1 1 69 69 THR CB C 69 72.209 72.209 70.492 1.717 18135 10876 1 12 . 1 1 69 69 THR H H 69 6.977 6.977 7.477 -0.500 18135 10877 1 12 . 1 1 70 70 LYS N N 70 121.120 121.120 122.826 -1.706 18135 10878 1 12 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.139 -0.050 18135 10879 1 12 . 1 1 70 70 LYS C C 70 179.259 179.259 177.272 1.987 18135 10880 1 12 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.676 -0.720 18135 10881 1 12 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.452 -0.702 18135 10882 1 12 . 1 1 70 70 LYS H H 70 9.065 9.065 8.578 0.487 18135 10883 1 12 . 1 1 71 71 ASP N N 71 116.374 116.374 120.266 -3.892 18135 10884 1 12 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.303 -0.128 18135 10885 1 12 . 1 1 71 71 ASP C C 71 178.372 178.372 177.247 1.125 18135 10886 1 12 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.035 0.032 18135 10887 1 12 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.246 0.060 18135 10888 1 12 . 1 1 71 71 ASP H H 71 7.518 7.518 7.772 -0.254 18135 10889 1 12 . 1 1 72 72 SER N N 72 117.341 117.341 114.266 3.075 18135 10890 1 12 . 1 1 72 72 SER HA H 72 3.715 3.715 3.237 0.478 18135 10891 1 12 . 1 1 72 72 SER C C 72 176.897 176.897 176.004 0.893 18135 10892 1 12 . 1 1 72 72 SER CA C 72 60.267 60.267 60.709 -0.442 18135 10893 1 12 . 1 1 72 72 SER CB C 72 62.616 62.616 62.787 -0.171 18135 10894 1 12 . 1 1 72 72 SER H H 72 8.066 8.066 7.959 0.107 18135 10895 1 12 . 1 1 73 73 SER N N 73 113.398 113.398 116.485 -3.087 18135 10896 1 12 . 1 1 73 73 SER HA H 73 4.094 4.094 4.099 -0.005 18135 10897 1 12 . 1 1 73 73 SER C C 73 174.855 174.855 174.935 -0.080 18135 10898 1 12 . 1 1 73 73 SER CA C 73 61.385 61.385 60.312 1.073 18135 10899 1 12 . 1 1 73 73 SER CB C 73 62.798 62.798 62.922 -0.124 18135 10900 1 12 . 1 1 73 73 SER H H 73 7.982 7.982 7.791 0.191 18135 10901 1 12 . 1 1 74 74 ALA N N 74 119.486 119.486 119.883 -0.397 18135 10902 1 12 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.167 -0.010 18135 10903 1 12 . 1 1 74 74 ALA C C 74 177.626 177.626 177.580 0.046 18135 10904 1 12 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.665 0.048 18135 10905 1 12 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.817 -0.070 18135 10906 1 12 . 1 1 74 74 ALA H H 74 7.095 7.095 7.602 -0.507 18135 10907 1 12 . 1 1 75 75 ALA N N 75 121.465 121.465 120.751 0.714 18135 10908 1 12 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.933 -0.237 18135 10909 1 12 . 1 1 75 75 ALA C C 75 177.197 177.197 176.165 1.032 18135 10910 1 12 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.876 1.128 18135 10911 1 12 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.044 -0.784 18135 10912 1 12 . 1 1 75 75 ALA H H 75 7.159 7.159 7.450 -0.291 18135 10913 1 12 . 1 1 76 76 TRP N N 76 116.791 116.791 116.362 0.429 18135 10914 1 12 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.724 0.326 18135 10915 1 12 . 1 1 76 76 TRP C C 76 177.617 177.617 174.803 2.814 18135 10916 1 12 . 1 1 76 76 TRP CA C 76 53.319 53.319 54.940 -1.621 18135 10917 1 12 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.137 1.939 18135 10918 1 12 . 1 1 76 76 TRP H H 76 7.080 7.080 7.293 -0.213 18135 10919 1 12 . 1 1 77 77 ASP N N 77 119.928 119.928 121.369 -1.441 18135 10920 1 12 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.524 -0.167 18135 10921 1 12 . 1 1 77 77 ASP C C 77 176.877 176.877 177.738 -0.861 18135 10922 1 12 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.013 -0.195 18135 10923 1 12 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.104 0.511 18135 10924 1 12 . 1 1 77 77 ASP H H 77 8.259 8.259 8.538 -0.279 18135 10925 1 12 . 1 1 78 78 GLU N N 78 127.277 127.277 126.727 0.550 18135 10926 1 12 . 1 1 78 78 GLU HA H 78 3.885 3.885 4.000 -0.115 18135 10927 1 12 . 1 1 78 78 GLU C C 78 177.439 177.439 178.311 -0.872 18135 10928 1 12 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.713 -0.329 18135 10929 1 12 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.446 -0.804 18135 10930 1 12 . 1 1 78 78 GLU H H 78 8.920 8.920 8.951 -0.031 18135 10931 1 12 . 1 1 79 79 THR N N 79 115.422 115.422 117.681 -2.259 18135 10932 1 12 . 1 1 79 79 THR HA H 79 3.907 3.907 4.011 -0.104 18135 10933 1 12 . 1 1 79 79 THR C C 79 177.330 177.330 176.698 0.632 18135 10934 1 12 . 1 1 79 79 THR CA C 79 66.263 66.263 65.669 0.594 18135 10935 1 12 . 1 1 79 79 THR CB C 79 68.002 68.002 68.618 -0.616 18135 10936 1 12 . 1 1 79 79 THR H H 79 8.124 8.124 7.763 0.361 18135 10937 1 12 . 1 1 80 80 LEU N N 80 121.791 121.791 122.115 -0.324 18135 10938 1 12 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.112 -0.225 18135 10939 1 12 . 1 1 80 80 LEU C C 80 179.018 179.018 178.618 0.400 18135 10940 1 12 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.748 -0.509 18135 10941 1 12 . 1 1 80 80 LEU CB C 80 41.652 41.652 40.946 0.706 18135 10942 1 12 . 1 1 80 80 LEU H H 80 7.725 7.725 8.097 -0.372 18135 10943 1 12 . 1 1 81 81 LEU N N 81 119.280 119.280 120.462 -1.182 18135 10944 1 12 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.240 -0.751 18135 10945 1 12 . 1 1 81 81 LEU C C 81 177.062 177.062 178.851 -1.789 18135 10946 1 12 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.916 -1.207 18135 10947 1 12 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.093 -1.145 18135 10948 1 12 . 1 1 81 81 LEU H H 81 8.344 8.344 8.816 -0.472 18135 10949 1 12 . 1 1 82 82 ASP N N 82 115.357 115.357 119.785 -4.428 18135 10950 1 12 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.430 -0.156 18135 10951 1 12 . 1 1 82 82 ASP C C 82 179.018 179.018 178.482 0.536 18135 10952 1 12 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.633 -0.818 18135 10953 1 12 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.894 -2.672 18135 10954 1 12 . 1 1 82 82 ASP H H 82 8.001 8.001 8.603 -0.602 18135 10955 1 12 . 1 1 83 83 LYS N N 83 119.603 119.603 118.795 0.808 18135 10956 1 12 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.882 0.100 18135 10957 1 12 . 1 1 83 83 LYS C C 83 178.624 178.624 178.891 -0.267 18135 10958 1 12 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.881 0.864 18135 10959 1 12 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.215 0.891 18135 10960 1 12 . 1 1 83 83 LYS H H 83 7.342 7.342 7.705 -0.363 18135 10961 1 12 . 1 1 84 84 PHE N N 84 123.933 123.933 121.814 2.119 18135 10962 1 12 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.022 0.013 18135 10963 1 12 . 1 1 84 84 PHE C C 84 177.210 177.210 177.047 0.163 18135 10964 1 12 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.798 -1.455 18135 10965 1 12 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.923 0.393 18135 10966 1 12 . 1 1 84 84 PHE H H 84 8.471 8.471 8.402 0.069 18135 10967 1 12 . 1 1 85 85 TYR N N 85 118.387 118.387 117.425 0.962 18135 10968 1 12 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.718 0.350 18135 10969 1 12 . 1 1 85 85 TYR C C 85 178.104 178.104 177.469 0.635 18135 10970 1 12 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.562 -0.985 18135 10971 1 12 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.149 -0.172 18135 10972 1 12 . 1 1 85 85 TYR H H 85 9.011 9.011 8.967 0.044 18135 10973 1 12 . 1 1 86 86 THR N N 86 114.035 114.035 116.129 -2.094 18135 10974 1 12 . 1 1 86 86 THR HA H 86 3.945 3.945 3.222 0.723 18135 10975 1 12 . 1 1 86 86 THR C C 86 176.708 176.708 175.993 0.715 18135 10976 1 12 . 1 1 86 86 THR CA C 86 66.759 66.759 67.032 -0.273 18135 10977 1 12 . 1 1 86 86 THR CB C 86 68.853 68.853 68.019 0.834 18135 10978 1 12 . 1 1 86 86 THR H H 86 7.609 7.609 7.234 0.376 18135 10979 1 12 . 1 1 87 87 GLU N N 87 120.790 120.790 121.938 -1.148 18135 10980 1 12 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.964 0.083 18135 10981 1 12 . 1 1 87 87 GLU C C 87 179.606 179.606 178.726 0.880 18135 10982 1 12 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.044 -0.646 18135 10983 1 12 . 1 1 87 87 GLU CB C 87 28.286 28.286 28.916 -0.630 18135 10984 1 12 . 1 1 87 87 GLU H H 87 7.712 7.712 7.583 0.129 18135 10985 1 12 . 1 1 88 88 LEU N N 88 120.729 120.729 119.897 0.832 18135 10986 1 12 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.918 -0.190 18135 10987 1 12 . 1 1 88 88 LEU C C 88 178.695 178.695 179.466 -0.771 18135 10988 1 12 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.434 0.817 18135 10989 1 12 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.010 1.577 18135 10990 1 12 . 1 1 88 88 LEU H H 88 8.393 8.393 7.406 0.987 18135 10991 1 12 . 1 1 89 89 TYR N N 89 118.654 118.654 119.386 -0.732 18135 10992 1 12 . 1 1 89 89 TYR HA H 89 3.931 3.931 3.949 -0.018 18135 10993 1 12 . 1 1 89 89 TYR C C 89 178.438 178.438 178.582 -0.144 18135 10994 1 12 . 1 1 89 89 TYR CA C 89 61.407 61.407 60.845 0.562 18135 10995 1 12 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.301 0.566 18135 10996 1 12 . 1 1 89 89 TYR H H 89 8.637 8.637 8.067 0.570 18135 10997 1 12 . 1 1 90 90 GLN N N 90 118.263 118.263 116.676 1.587 18135 10998 1 12 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.965 0.021 18135 10999 1 12 . 1 1 90 90 GLN C C 90 178.411 178.411 178.646 -0.235 18135 11000 1 12 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.946 -0.164 18135 11001 1 12 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.479 -0.332 18135 11002 1 12 . 1 1 90 90 GLN H H 90 7.796 7.796 7.748 0.048 18135 11003 1 12 . 1 1 91 91 GLN N N 91 117.959 117.959 119.051 -1.092 18135 11004 1 12 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.035 0.047 18135 11005 1 12 . 1 1 91 91 GLN C C 91 178.705 178.705 178.692 0.013 18135 11006 1 12 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.980 -0.160 18135 11007 1 12 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.573 0.600 18135 11008 1 12 . 1 1 91 91 GLN H H 91 7.727 7.727 8.481 -0.754 18135 11009 1 12 . 1 1 92 92 LEU N N 92 119.965 119.965 118.301 1.664 18135 11010 1 12 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.985 -0.251 18135 11011 1 12 . 1 1 92 92 LEU C C 92 178.984 178.984 178.728 0.256 18135 11012 1 12 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.672 -0.180 18135 11013 1 12 . 1 1 92 92 LEU CB C 92 41.379 41.379 41.017 0.362 18135 11014 1 12 . 1 1 92 92 LEU H H 92 8.465 8.465 8.485 -0.020 18135 11015 1 12 . 1 1 93 93 ASN N N 93 117.793 117.793 118.339 -0.546 18135 11016 1 12 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.348 0.053 18135 11017 1 12 . 1 1 93 93 ASN C C 93 178.309 178.309 177.111 1.198 18135 11018 1 12 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.081 0.322 18135 11019 1 12 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.319 0.320 18135 11020 1 12 . 1 1 93 93 ASN H H 93 8.091 8.091 7.830 0.261 18135 11021 1 12 . 1 1 94 94 ASP N N 94 121.133 121.133 121.007 0.126 18135 11022 1 12 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.344 0.061 18135 11023 1 12 . 1 1 94 94 ASP C C 94 178.328 178.328 178.693 -0.365 18135 11024 1 12 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.784 -1.237 18135 11025 1 12 . 1 1 94 94 ASP CB C 94 38.649 38.649 41.078 -2.429 18135 11026 1 12 . 1 1 94 94 ASP H H 94 8.362 8.362 8.244 0.118 18135 11027 1 12 . 1 1 95 95 LEU N N 95 119.160 119.160 120.858 -1.698 18135 11028 1 12 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.857 0.182 18135 11029 1 12 . 1 1 95 95 LEU C C 95 178.826 178.826 178.571 0.255 18135 11030 1 12 . 1 1 95 95 LEU CA C 95 57.027 57.027 57.972 -0.945 18135 11031 1 12 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.105 0.105 18135 11032 1 12 . 1 1 95 95 LEU H H 95 8.143 8.143 8.585 -0.442 18135 11033 1 12 . 1 1 96 96 GLU N N 96 118.813 118.813 118.917 -0.104 18135 11034 1 12 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.709 0.252 18135 11035 1 12 . 1 1 96 96 GLU C C 96 177.640 177.640 178.153 -0.513 18135 11036 1 12 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.404 -1.690 18135 11037 1 12 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.376 -1.238 18135 11038 1 12 . 1 1 96 96 GLU H H 96 8.111 8.111 7.788 0.323 18135 11039 1 12 . 1 1 97 97 ALA N N 97 120.549 120.549 121.065 -0.516 18135 11040 1 12 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.992 0.130 18135 11041 1 12 . 1 1 97 97 ALA C C 97 179.126 179.126 180.314 -1.188 18135 11042 1 12 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.699 -0.666 18135 11043 1 12 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.895 0.085 18135 11044 1 12 . 1 1 97 97 ALA H H 97 7.798 7.798 7.812 -0.014 18135 11045 1 12 . 1 1 98 98 CYS N N 98 115.510 115.510 117.053 -1.543 18135 11046 1 12 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.123 0.327 18135 11047 1 12 . 1 1 98 98 CYS C C 98 175.363 175.363 176.010 -0.647 18135 11048 1 12 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.358 -5.191 18135 11049 1 12 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.562 15.317 18135 11050 1 12 . 1 1 98 98 CYS H H 98 7.597 7.597 7.759 -0.162 18135 11051 1 12 . 1 1 99 99 VAL N N 99 121.713 121.713 118.952 2.761 18135 11052 1 12 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.973 -0.179 18135 11053 1 12 . 1 1 99 99 VAL C C 99 177.357 177.357 177.665 -0.308 18135 11054 1 12 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.439 -0.855 18135 11055 1 12 . 1 1 99 99 VAL CB C 99 32.031 32.031 31.983 0.047 18135 11056 1 12 . 1 1 99 99 VAL H H 99 7.828 7.828 7.406 0.422 18135 11057 1 12 . 1 1 100 100 ILE N N 100 122.333 122.333 118.051 4.282 18135 11058 1 12 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.726 0.198 18135 11059 1 12 . 1 1 100 100 ILE C C 100 176.827 176.827 176.704 0.123 18135 11060 1 12 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.675 -1.437 18135 11061 1 12 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.778 0.500 18135 11062 1 12 . 1 1 100 100 ILE H H 100 8.067 8.067 8.276 -0.209 18135 11063 1 12 . 1 1 101 101 GLN N N 101 121.864 121.864 117.305 4.559 18135 11064 1 12 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.215 0.011 18135 11065 1 12 . 1 1 101 101 GLN C C 101 176.438 176.438 177.927 -1.489 18135 11066 1 12 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.608 -0.288 18135 11067 1 12 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.097 -0.086 18135 11068 1 12 . 1 1 101 101 GLN H H 101 8.062 8.062 7.432 0.630 18135 11069 1 12 . 1 1 102 102 GLY N N 102 109.288 109.288 106.561 2.727 18135 11070 1 12 . 1 1 102 102 GLY C C 102 173.855 173.855 175.355 -1.500 18135 11071 1 12 . 1 1 102 102 GLY CA C 102 45.159 45.159 45.438 -0.279 18135 11072 1 12 . 1 1 102 102 GLY H H 102 8.087 8.087 8.764 -0.677 18135 11073 1 12 . 1 1 103 103 VAL N N 103 118.932 118.932 115.051 3.881 18135 11074 1 12 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.991 0.083 18135 11075 1 12 . 1 1 103 103 VAL C C 103 176.299 176.299 175.373 0.926 18135 11076 1 12 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.610 -1.111 18135 11077 1 12 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.004 1.850 18135 11078 1 12 . 1 1 103 103 VAL H H 103 8.079 8.079 7.606 0.473 18135 11079 1 12 . 1 1 104 104 GLY N N 104 112.028 112.028 109.605 2.423 18135 11080 1 12 . 1 1 104 104 GLY C C 104 173.694 173.694 173.229 0.465 18135 11081 1 12 . 1 1 104 104 GLY CA C 104 45.402 45.402 44.899 0.503 18135 11082 1 12 . 1 1 104 104 GLY H H 104 8.446 8.446 7.590 0.856 18135 11083 1 12 . 1 1 105 105 VAL N N 105 120.439 120.439 122.089 -1.650 18135 11084 1 12 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.421 -0.233 18135 11085 1 12 . 1 1 105 105 VAL C C 105 175.963 175.963 174.365 1.598 18135 11086 1 12 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.573 1.563 18135 11087 1 12 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.278 -1.464 18135 11088 1 12 . 1 1 105 105 VAL H H 105 7.867 7.867 7.990 -0.123 18135 11089 1 12 . 1 1 106 106 THR N N 106 116.366 116.366 116.807 -0.441 18135 11090 1 12 . 1 1 106 106 THR HA H 106 4.548 4.548 4.635 -0.087 18135 11091 1 12 . 1 1 106 106 THR C C 106 173.731 173.731 173.551 0.180 18135 11092 1 12 . 1 1 106 106 THR CA C 106 59.419 59.419 60.605 -1.186 18135 11093 1 12 . 1 1 106 106 THR CB C 106 79.536 79.536 70.517 9.019 18135 11094 1 12 . 1 1 106 106 THR H H 106 8.565 8.565 8.116 0.449 18135 11095 1 12 . 1 1 107 107 GLU N N 107 119.743 119.743 120.495 -0.752 18135 11096 1 12 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.671 -0.209 18135 11097 1 12 . 1 1 107 107 GLU C C 107 175.639 175.639 175.828 -0.189 18135 11098 1 12 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.770 0.941 18135 11099 1 12 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.562 -1.063 18135 11100 1 12 . 1 1 107 107 GLU H H 107 8.410 8.410 8.408 0.002 18135 11101 1 12 . 1 1 108 108 THR N N 108 114.402 114.402 110.847 3.555 18135 11102 1 12 . 1 1 108 108 THR HA H 108 4.448 4.448 4.821 -0.373 18135 11103 1 12 . 1 1 108 108 THR CA C 108 60.348 60.348 58.089 2.259 18135 11104 1 12 . 1 1 108 108 THR CB C 108 68.544 68.544 69.620 -1.076 18135 11105 1 12 . 1 1 108 108 THR H H 108 8.155 8.155 8.421 -0.266 18135 11106 1 12 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.440 -0.202 18135 11107 1 12 . 1 1 109 109 PRO C C 109 178.666 178.666 177.724 0.942 18135 11108 1 12 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.203 1.173 18135 11109 1 12 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.949 -0.101 18135 11110 1 12 . 1 1 110 110 LEU N N 110 118.566 118.566 118.464 0.102 18135 11111 1 12 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.128 -0.012 18135 11112 1 12 . 1 1 110 110 LEU C C 110 178.293 178.293 178.915 -0.622 18135 11113 1 12 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.496 -0.810 18135 11114 1 12 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.388 0.581 18135 11115 1 12 . 1 1 110 110 LEU H H 110 8.016 8.016 7.769 0.247 18135 11116 1 12 . 1 1 111 111 MET N N 111 118.982 118.982 115.562 3.420 18135 11117 1 12 . 1 1 111 111 MET HA H 111 4.210 4.210 4.395 -0.185 18135 11118 1 12 . 1 1 111 111 MET C C 111 178.720 178.720 177.721 0.999 18135 11119 1 12 . 1 1 111 111 MET CA C 111 58.144 58.144 57.686 0.458 18135 11120 1 12 . 1 1 111 111 MET CB C 111 32.374 32.374 32.584 -0.210 18135 11121 1 12 . 1 1 111 111 MET H H 111 7.705 7.705 7.901 -0.196 18135 11122 1 12 . 1 1 112 112 LYS N N 112 121.377 121.377 120.848 0.529 18135 11123 1 12 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.080 0.028 18135 11124 1 12 . 1 1 112 112 LYS C C 112 178.000 178.000 178.361 -0.361 18135 11125 1 12 . 1 1 112 112 LYS CA C 112 56.305 56.305 59.221 -2.917 18135 11126 1 12 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.162 0.205 18135 11127 1 12 . 1 1 112 112 LYS H H 112 8.257 8.257 7.744 0.513 18135 11128 1 12 . 1 1 113 113 GLU N N 113 119.104 119.104 119.204 -0.100 18135 11129 1 12 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.948 0.118 18135 11130 1 12 . 1 1 113 113 GLU C C 113 178.289 178.289 178.516 -0.227 18135 11131 1 12 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.980 -1.726 18135 11132 1 12 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.132 -0.994 18135 11133 1 12 . 1 1 113 113 GLU H H 113 8.270 8.270 7.632 0.638 18135 11134 1 12 . 1 1 114 114 ASP N N 114 119.224 119.224 119.454 -0.230 18135 11135 1 12 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.463 -0.174 18135 11136 1 12 . 1 1 114 114 ASP C C 114 178.365 178.365 178.695 -0.330 18135 11137 1 12 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.186 -1.078 18135 11138 1 12 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.628 -2.393 18135 11139 1 12 . 1 1 114 114 ASP H H 114 8.618 8.618 7.990 0.628 18135 11140 1 12 . 1 1 115 115 SER N N 115 118.195 118.195 115.918 2.277 18135 11141 1 12 . 1 1 115 115 SER HA H 115 4.200 4.200 4.082 0.118 18135 11142 1 12 . 1 1 115 115 SER C C 115 175.986 175.986 176.676 -0.690 18135 11143 1 12 . 1 1 115 115 SER CA C 115 61.588 61.588 62.235 -0.647 18135 11144 1 12 . 1 1 115 115 SER CB C 115 62.653 62.653 62.809 -0.156 18135 11145 1 12 . 1 1 115 115 SER H H 115 8.181 8.181 7.625 0.556 18135 11146 1 12 . 1 1 116 116 ILE N N 116 123.340 123.340 122.351 0.989 18135 11147 1 12 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.884 -0.258 18135 11148 1 12 . 1 1 116 116 ILE C C 116 178.367 178.367 178.338 0.029 18135 11149 1 12 . 1 1 116 116 ILE CA C 116 64.817 64.817 62.725 2.091 18135 11150 1 12 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.606 0.812 18135 11151 1 12 . 1 1 116 116 ILE H H 116 7.773 7.773 8.312 -0.539 18135 11152 1 12 . 1 1 117 117 LEU N N 117 120.968 120.968 121.985 -1.017 18135 11153 1 12 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.859 0.046 18135 11154 1 12 . 1 1 117 117 LEU C C 117 178.746 178.746 178.492 0.254 18135 11155 1 12 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.570 -0.427 18135 11156 1 12 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.614 -0.028 18135 11157 1 12 . 1 1 117 117 LEU H H 117 8.406 8.406 8.178 0.228 18135 11158 1 12 . 1 1 118 118 ALA N N 118 120.150 120.150 121.299 -1.149 18135 11159 1 12 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.716 0.396 18135 11160 1 12 . 1 1 118 118 ALA C C 118 181.633 181.633 178.858 2.775 18135 11161 1 12 . 1 1 118 118 ALA CA C 118 55.313 55.313 54.881 0.432 18135 11162 1 12 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.425 -0.315 18135 11163 1 12 . 1 1 118 118 ALA H H 118 7.894 7.894 8.004 -0.110 18135 11164 1 12 . 1 1 119 119 VAL N N 119 118.873 118.873 119.003 -0.130 18135 11165 1 12 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.406 0.349 18135 11166 1 12 . 1 1 119 119 VAL C C 119 177.896 177.896 177.910 -0.014 18135 11167 1 12 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.741 0.440 18135 11168 1 12 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.046 0.848 18135 11169 1 12 . 1 1 119 119 VAL H H 119 7.572 7.572 7.973 -0.401 18135 11170 1 12 . 1 1 120 120 ARG N N 120 121.436 121.436 118.617 2.819 18135 11171 1 12 . 1 1 120 120 ARG HA H 120 4.027 4.027 3.975 0.052 18135 11172 1 12 . 1 1 120 120 ARG C C 120 179.848 179.848 178.285 1.563 18135 11173 1 12 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.626 1.641 18135 11174 1 12 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.364 0.331 18135 11175 1 12 . 1 1 120 120 ARG H H 120 8.629 8.629 8.541 0.088 18135 11176 1 12 . 1 1 121 121 LYS N N 121 119.589 119.589 120.495 -0.906 18135 11177 1 12 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.984 0.090 18135 11178 1 12 . 1 1 121 121 LYS C C 121 178.331 178.331 179.128 -0.797 18135 11179 1 12 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.222 1.218 18135 11180 1 12 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.086 0.021 18135 11181 1 12 . 1 1 121 121 LYS H H 121 9.015 9.015 7.601 1.414 18135 11182 1 12 . 1 1 122 122 TYR N N 122 121.546 121.546 118.751 2.795 18135 11183 1 12 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.183 0.149 18135 11184 1 12 . 1 1 122 122 TYR C C 122 176.527 176.527 178.391 -1.864 18135 11185 1 12 . 1 1 122 122 TYR CA C 122 60.404 60.404 59.247 1.157 18135 11186 1 12 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.369 0.356 18135 11187 1 12 . 1 1 122 122 TYR H H 122 7.473 7.473 7.478 -0.005 18135 11188 1 12 . 1 1 123 123 PHE N N 123 116.026 116.026 120.192 -4.166 18135 11189 1 12 . 1 1 123 123 PHE HA H 123 3.740 3.740 4.004 -0.264 18135 11190 1 12 . 1 1 123 123 PHE C C 123 179.005 179.005 177.517 1.488 18135 11191 1 12 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.326 3.202 18135 11192 1 12 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.879 0.452 18135 11193 1 12 . 1 1 123 123 PHE H H 123 7.932 7.932 8.355 -0.423 18135 11194 1 12 . 1 1 124 124 GLN N N 124 123.043 123.043 118.178 4.865 18135 11195 1 12 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.425 0.754 18135 11196 1 12 . 1 1 124 124 GLN C C 124 178.772 178.772 178.746 0.026 18135 11197 1 12 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.072 0.244 18135 11198 1 12 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.033 -0.402 18135 11199 1 12 . 1 1 124 124 GLN H H 124 8.470 8.470 8.382 0.088 18135 11200 1 12 . 1 1 125 125 ARG N N 125 120.342 120.342 119.647 0.695 18135 11201 1 12 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.179 -0.101 18135 11202 1 12 . 1 1 125 125 ARG C C 125 180.340 180.340 179.249 1.091 18135 11203 1 12 . 1 1 125 125 ARG CA C 125 61.297 61.297 59.361 1.936 18135 11204 1 12 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.352 -0.027 18135 11205 1 12 . 1 1 125 125 ARG H H 125 8.137 8.137 7.904 0.233 18135 11206 1 12 . 1 1 126 126 ILE N N 126 121.876 121.876 120.635 1.241 18135 11207 1 12 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.636 -0.285 18135 11208 1 12 . 1 1 126 126 ILE C C 126 176.857 176.857 177.476 -0.619 18135 11209 1 12 . 1 1 126 126 ILE CA C 126 65.832 65.832 65.149 0.683 18135 11210 1 12 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.895 0.389 18135 11211 1 12 . 1 1 126 126 ILE H H 126 7.526 7.526 8.303 -0.777 18135 11212 1 12 . 1 1 127 127 THR N N 127 115.613 115.613 115.080 0.533 18135 11213 1 12 . 1 1 127 127 THR HA H 127 3.633 3.633 3.824 -0.191 18135 11214 1 12 . 1 1 127 127 THR C C 127 176.645 176.645 177.098 -0.453 18135 11215 1 12 . 1 1 127 127 THR CA C 127 67.294 67.294 66.613 0.681 18135 11216 1 12 . 1 1 127 127 THR CB C 127 68.871 68.871 68.870 0.001 18135 11217 1 12 . 1 1 127 127 THR H H 127 8.288 8.288 8.285 0.003 18135 11218 1 12 . 1 1 128 128 LEU N N 128 122.627 122.627 122.234 0.393 18135 11219 1 12 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.968 -0.012 18135 11220 1 12 . 1 1 128 128 LEU C C 128 178.331 178.331 177.689 0.642 18135 11221 1 12 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.972 0.116 18135 11222 1 12 . 1 1 128 128 LEU CB C 128 41.574 41.574 40.945 0.629 18135 11223 1 12 . 1 1 128 128 LEU H H 128 8.263 8.263 7.955 0.308 18135 11224 1 12 . 1 1 129 129 TYR N N 129 120.955 120.955 120.815 0.140 18135 11225 1 12 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.049 -0.159 18135 11226 1 12 . 1 1 129 129 TYR C C 129 176.040 176.040 177.562 -1.522 18135 11227 1 12 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.840 -0.347 18135 11228 1 12 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.226 0.699 18135 11229 1 12 . 1 1 129 129 TYR H H 129 7.518 7.518 8.357 -0.839 18135 11230 1 12 . 1 1 130 130 LEU N N 130 119.155 119.155 116.352 2.803 18135 11231 1 12 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.330 -0.485 18135 11232 1 12 . 1 1 130 130 LEU C C 130 177.948 177.948 178.387 -0.439 18135 11233 1 12 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.886 0.227 18135 11234 1 12 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.525 1.061 18135 11235 1 12 . 1 1 130 130 LEU H H 130 7.717 7.717 7.997 -0.280 18135 11236 1 12 . 1 1 131 131 LYS N N 131 116.832 116.832 120.160 -3.328 18135 11237 1 12 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.934 -0.526 18135 11238 1 12 . 1 1 131 131 LYS C C 131 181.265 181.265 179.774 1.491 18135 11239 1 12 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.736 -0.005 18135 11240 1 12 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.045 0.626 18135 11241 1 12 . 1 1 131 131 LYS H H 131 7.493 7.493 7.844 -0.351 18135 11242 1 12 . 1 1 132 132 GLU N N 132 121.918 121.918 118.992 2.926 18135 11243 1 12 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.078 -0.234 18135 11244 1 12 . 1 1 132 132 GLU C C 132 178.377 178.377 177.737 0.640 18135 11245 1 12 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.709 0.178 18135 11246 1 12 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.544 -0.877 18135 11247 1 12 . 1 1 132 132 GLU H H 132 8.430 8.430 8.131 0.299 18135 11248 1 12 . 1 1 133 133 LYS N N 133 116.079 116.079 116.005 0.074 18135 11249 1 12 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.283 -0.317 18135 11250 1 12 . 1 1 133 133 LYS C C 133 175.282 175.282 176.263 -0.981 18135 11251 1 12 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.669 -0.371 18135 11252 1 12 . 1 1 133 133 LYS CB C 133 31.998 31.998 32.094 -0.096 18135 11253 1 12 . 1 1 133 133 LYS H H 133 7.390 7.390 7.403 -0.013 18135 11254 1 12 . 1 1 134 134 LYS N N 134 117.759 117.759 115.882 1.877 18135 11255 1 12 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.064 -0.482 18135 11256 1 12 . 1 1 134 134 LYS C C 134 176.271 176.271 176.005 0.266 18135 11257 1 12 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.837 0.471 18135 11258 1 12 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.113 -0.311 18135 11259 1 12 . 1 1 134 134 LYS H H 134 7.716 7.716 7.657 0.059 18135 11260 1 12 . 1 1 135 135 TYR N N 135 110.598 110.598 113.776 -3.178 18135 11261 1 12 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.938 -1.061 18135 11262 1 12 . 1 1 135 135 TYR C C 135 174.148 174.148 175.173 -1.025 18135 11263 1 12 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.003 0.712 18135 11264 1 12 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.028 -0.322 18135 11265 1 12 . 1 1 135 135 TYR H H 135 8.428 8.428 8.828 -0.400 18135 11266 1 12 . 1 1 136 136 SER N N 136 113.712 113.712 115.550 -1.838 18135 11267 1 12 . 1 1 136 136 SER HA H 136 4.553 4.553 4.386 0.167 18135 11268 1 12 . 1 1 136 136 SER CA C 136 57.108 57.108 58.630 -1.522 18135 11269 1 12 . 1 1 136 136 SER CB C 136 62.500 62.500 64.010 -1.510 18135 11270 1 12 . 1 1 136 136 SER H H 136 6.744 6.744 7.387 -0.643 18135 11271 1 12 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.390 -0.225 18135 11272 1 12 . 1 1 137 137 PRO C C 137 180.675 180.675 177.629 3.046 18135 11273 1 12 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.909 0.748 18135 11274 1 12 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.751 0.232 18135 11275 1 12 . 1 1 138 138 CYS N N 138 113.914 113.914 115.967 -2.053 18135 11276 1 12 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.501 0.169 18135 11277 1 12 . 1 1 138 138 CYS C C 138 176.015 176.015 175.963 0.052 18135 11278 1 12 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.240 -3.145 18135 11279 1 12 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.057 10.722 18135 11280 1 12 . 1 1 138 138 CYS H H 138 8.580 8.580 8.477 0.103 18135 11281 1 12 . 1 1 139 139 ALA N N 139 125.290 125.290 124.852 0.438 18135 11282 1 12 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.102 0.347 18135 11283 1 12 . 1 1 139 139 ALA C C 139 180.149 180.149 179.169 0.980 18135 11284 1 12 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.973 -0.195 18135 11285 1 12 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.047 0.870 18135 11286 1 12 . 1 1 139 139 ALA H H 139 8.087 8.087 8.016 0.071 18135 11287 1 12 . 1 1 140 140 TRP N N 140 116.599 116.599 118.725 -2.126 18135 11288 1 12 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.273 0.329 18135 11289 1 12 . 1 1 140 140 TRP C C 140 179.137 179.137 178.453 0.684 18135 11290 1 12 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.521 -0.987 18135 11291 1 12 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.287 -0.029 18135 11292 1 12 . 1 1 140 140 TRP H H 140 8.505 8.505 7.703 0.802 18135 11293 1 12 . 1 1 141 141 GLU N N 141 121.578 121.578 119.049 2.529 18135 11294 1 12 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.252 0.971 18135 11295 1 12 . 1 1 141 141 GLU C C 141 177.886 177.886 179.070 -1.184 18135 11296 1 12 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.863 -1.956 18135 11297 1 12 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.343 -0.626 18135 11298 1 12 . 1 1 141 141 GLU H H 141 8.182 8.182 8.143 0.039 18135 11299 1 12 . 1 1 142 142 VAL N N 142 121.202 121.202 119.736 1.466 18135 11300 1 12 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.664 -0.034 18135 11301 1 12 . 1 1 142 142 VAL C C 142 180.246 180.246 178.449 1.797 18135 11302 1 12 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.615 0.368 18135 11303 1 12 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.753 0.069 18135 11304 1 12 . 1 1 142 142 VAL H H 142 8.623 8.623 8.122 0.501 18135 11305 1 12 . 1 1 143 143 VAL N N 143 120.119 120.119 119.807 0.312 18135 11306 1 12 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.739 -0.442 18135 11307 1 12 . 1 1 143 143 VAL C C 143 176.407 176.407 178.389 -1.982 18135 11308 1 12 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.794 1.184 18135 11309 1 12 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.181 0.474 18135 11310 1 12 . 1 1 143 143 VAL H H 143 8.323 8.323 8.589 -0.266 18135 11311 1 12 . 1 1 144 144 ARG N N 144 124.102 124.102 118.729 5.373 18135 11312 1 12 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.037 -0.340 18135 11313 1 12 . 1 1 144 144 ARG C C 144 178.127 178.127 178.805 -0.678 18135 11314 1 12 . 1 1 144 144 ARG CA C 144 61.001 61.001 57.909 3.092 18135 11315 1 12 . 1 1 144 144 ARG CB C 144 29.936 29.936 28.701 1.235 18135 11316 1 12 . 1 1 144 144 ARG H H 144 9.619 9.619 8.780 0.839 18135 11317 1 12 . 1 1 145 145 ALA N N 145 119.431 119.431 122.233 -2.802 18135 11318 1 12 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.064 -0.213 18135 11319 1 12 . 1 1 145 145 ALA C C 145 180.763 180.763 180.036 0.727 18135 11320 1 12 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.304 0.071 18135 11321 1 12 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.073 0.112 18135 11322 1 12 . 1 1 145 145 ALA H H 145 8.867 8.867 8.384 0.483 18135 11323 1 12 . 1 1 146 146 GLU N N 146 121.815 121.815 118.956 2.859 18135 11324 1 12 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.220 -0.009 18135 11325 1 12 . 1 1 146 146 GLU C C 146 177.296 177.296 179.028 -1.732 18135 11326 1 12 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.159 -0.780 18135 11327 1 12 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.600 -1.466 18135 11328 1 12 . 1 1 146 146 GLU H H 146 8.136 8.136 7.953 0.183 18135 11329 1 12 . 1 1 147 147 ILE N N 147 119.542 119.542 120.838 -1.296 18135 11330 1 12 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.768 0.202 18135 11331 1 12 . 1 1 147 147 ILE C C 147 178.283 178.283 178.333 -0.050 18135 11332 1 12 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.896 -3.643 18135 11333 1 12 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.602 -2.263 18135 11334 1 12 . 1 1 147 147 ILE H H 147 8.736 8.736 8.179 0.557 18135 11335 1 12 . 1 1 148 148 MET N N 148 119.501 119.501 118.385 1.116 18135 11336 1 12 . 1 1 148 148 MET HA H 148 3.801 3.801 4.187 -0.386 18135 11337 1 12 . 1 1 148 148 MET C C 148 178.210 178.210 178.810 -0.600 18135 11338 1 12 . 1 1 148 148 MET CA C 148 60.184 60.184 60.013 0.171 18135 11339 1 12 . 1 1 148 148 MET CB C 148 32.914 32.914 32.019 0.895 18135 11340 1 12 . 1 1 148 148 MET H H 148 8.440 8.440 8.440 0.000 18135 11341 1 12 . 1 1 149 149 ARG N N 149 119.734 119.734 120.199 -0.465 18135 11342 1 12 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.116 -0.201 18135 11343 1 12 . 1 1 149 149 ARG C C 149 178.978 178.978 179.117 -0.139 18135 11344 1 12 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.605 0.258 18135 11345 1 12 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.851 0.429 18135 11346 1 12 . 1 1 149 149 ARG H H 149 7.648 7.648 8.322 -0.673 18135 11347 1 12 . 1 1 150 150 SER N N 150 118.109 118.109 115.056 3.053 18135 11348 1 12 . 1 1 150 150 SER HA H 150 3.339 3.339 3.368 -0.029 18135 11349 1 12 . 1 1 150 150 SER C C 150 177.292 177.292 176.092 1.200 18135 11350 1 12 . 1 1 150 150 SER CA C 150 61.316 61.316 61.297 0.019 18135 11351 1 12 . 1 1 150 150 SER CB C 150 60.288 60.288 62.337 -2.049 18135 11352 1 12 . 1 1 150 150 SER H H 150 9.194 9.194 8.150 1.044 18135 11353 1 12 . 1 1 151 151 PHE N N 151 125.265 125.265 124.298 0.967 18135 11354 1 12 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.301 -0.265 18135 11355 1 12 . 1 1 151 151 PHE C C 151 178.696 178.696 177.057 1.639 18135 11356 1 12 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.906 1.514 18135 11357 1 12 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.950 -0.064 18135 11358 1 12 . 1 1 151 151 PHE H H 151 9.455 9.455 8.235 1.220 18135 11359 1 12 . 1 1 152 152 SER N N 152 115.963 115.963 116.223 -0.260 18135 11360 1 12 . 1 1 152 152 SER HA H 152 3.880 3.880 3.834 0.046 18135 11361 1 12 . 1 1 152 152 SER C C 152 175.858 175.858 176.602 -0.744 18135 11362 1 12 . 1 1 152 152 SER CA C 152 62.388 62.388 61.714 0.674 18135 11363 1 12 . 1 1 152 152 SER CB C 152 62.519 62.519 63.154 -0.635 18135 11364 1 12 . 1 1 152 152 SER H H 152 7.839 7.839 8.654 -0.815 18135 11365 1 12 . 1 1 153 153 LEU N N 153 121.365 121.365 123.226 -1.861 18135 11366 1 12 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.207 -0.126 18135 11367 1 12 . 1 1 153 153 LEU C C 153 179.515 179.515 177.805 1.710 18135 11368 1 12 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.273 0.610 18135 11369 1 12 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.502 0.840 18135 11370 1 12 . 1 1 153 153 LEU H H 153 7.775 7.775 8.066 -0.291 18135 11371 1 12 . 1 1 154 154 SER N N 154 113.950 113.950 112.475 1.475 18135 11372 1 12 . 1 1 154 154 SER HA H 154 3.781 3.781 4.472 -0.691 18135 11373 1 12 . 1 1 154 154 SER C C 154 174.312 174.312 176.281 -1.969 18135 11374 1 12 . 1 1 154 154 SER CA C 154 61.366 61.366 61.137 0.229 18135 11375 1 12 . 1 1 154 154 SER CB C 154 63.242 63.242 63.845 -0.603 18135 11376 1 12 . 1 1 154 154 SER H H 154 7.874 7.874 8.362 -0.488 18135 11377 1 12 . 1 1 155 155 THR N N 155 109.346 109.346 110.684 -1.338 18135 11378 1 12 . 1 1 155 155 THR HA H 155 4.060 4.060 4.363 -0.303 18135 11379 1 12 . 1 1 155 155 THR C C 155 174.798 174.798 175.676 -0.878 18135 11380 1 12 . 1 1 155 155 THR CA C 155 62.275 62.275 64.008 -1.734 18135 11381 1 12 . 1 1 155 155 THR CB C 155 69.342 69.342 69.427 -0.085 18135 11382 1 12 . 1 1 155 155 THR H H 155 7.176 7.176 7.761 -0.585 18135 11383 1 12 . 1 1 156 156 ASN N N 156 119.785 119.785 120.952 -1.167 18135 11384 1 12 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.751 -0.224 18135 11385 1 12 . 1 1 156 156 ASN C C 156 175.528 175.528 174.955 0.573 18135 11386 1 12 . 1 1 156 156 ASN CA C 156 53.937 53.937 51.785 2.152 18135 11387 1 12 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.206 1.132 18135 11388 1 12 . 1 1 156 156 ASN H H 156 7.749 7.749 8.017 -0.268 18135 11389 1 12 . 1 1 157 157 LEU N N 157 120.552 120.552 123.568 -3.016 18135 11390 1 12 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.388 -0.133 18135 11391 1 12 . 1 1 157 157 LEU C C 157 174.702 174.702 178.290 -3.588 18135 11392 1 12 . 1 1 157 157 LEU CA C 157 55.674 55.674 57.044 -1.371 18135 11393 1 12 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.477 -0.126 18135 11394 1 12 . 1 1 157 157 LEU H H 157 8.097 8.097 7.635 0.462 18135 11395 1 12 . 1 1 158 158 GLN N N 158 119.860 119.860 116.651 3.209 18135 11396 1 12 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.349 -0.169 18135 11397 1 12 . 1 1 158 158 GLN C C 158 176.434 176.434 175.002 1.432 18135 11398 1 12 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.421 1.476 18135 11399 1 12 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.525 -0.515 18135 11400 1 12 . 1 1 158 158 GLN H H 158 8.230 8.230 8.122 0.108 18135 11401 1 12 . 1 1 159 159 GLU N N 159 120.461 120.461 118.273 2.188 18135 11402 1 12 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.127 0.092 18135 11403 1 12 . 1 1 159 159 GLU C C 159 175.251 175.251 175.248 0.003 18135 11404 1 12 . 1 1 159 159 GLU CA C 159 56.695 56.695 56.916 -0.221 18135 11405 1 12 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.585 0.396 18135 11406 1 12 . 1 1 159 159 GLU H H 159 8.300 8.300 8.315 -0.015 18135 11407 1 12 . 1 1 160 160 SER N N 160 115.719 115.719 113.923 1.796 18135 11408 1 12 . 1 1 160 160 SER HA H 160 4.372 4.372 4.651 -0.279 18135 11409 1 12 . 1 1 160 160 SER C C 160 174.188 174.188 175.018 -0.830 18135 11410 1 12 . 1 1 160 160 SER CA C 160 58.481 58.481 58.528 -0.047 18135 11411 1 12 . 1 1 160 160 SER CB C 160 63.731 63.731 63.835 -0.104 18135 11412 1 12 . 1 1 160 160 SER H H 160 8.113 8.113 8.540 -0.427 18135 11413 1 12 . 1 1 161 161 LEU N N 161 123.794 123.794 122.357 1.437 18135 11414 1 12 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.204 0.076 18135 11415 1 12 . 1 1 161 161 LEU C C 161 177.293 177.293 176.960 0.333 18135 11416 1 12 . 1 1 161 161 LEU CA C 161 55.190 55.190 56.590 -1.400 18135 11417 1 12 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.321 -0.037 18135 11418 1 12 . 1 1 161 161 LEU H H 161 8.032 8.032 8.120 -0.088 18135 11419 1 12 . 1 1 162 162 ARG N N 162 120.715 120.715 118.863 1.852 18135 11420 1 12 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.521 -0.352 18135 11421 1 12 . 1 1 162 162 ARG C C 162 176.288 176.288 175.208 1.080 18135 11422 1 12 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.839 1.208 18135 11423 1 12 . 1 1 162 162 ARG CB C 162 30.935 30.935 31.871 -0.936 18135 11424 1 12 . 1 1 162 162 ARG H H 162 8.094 8.094 7.658 0.436 18135 11425 1 12 . 1 1 163 163 SER N N 163 116.670 116.670 117.945 -1.275 18135 11426 1 12 . 1 1 163 163 SER HA H 163 4.372 4.372 4.748 -0.376 18135 11427 1 12 . 1 1 163 163 SER C C 163 174.184 174.184 174.182 0.002 18135 11428 1 12 . 1 1 163 163 SER CA C 163 58.481 58.481 58.617 -0.136 18135 11429 1 12 . 1 1 163 163 SER CB C 163 63.745 63.745 64.442 -0.697 18135 11430 1 12 . 1 1 163 163 SER H H 163 8.191 8.191 8.249 -0.058 18135 11431 1 12 . 1 1 164 164 LYS N N 164 123.100 123.100 120.936 2.164 18135 11432 1 12 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.290 -0.013 18135 11433 1 12 . 1 1 164 164 LYS C C 164 175.617 175.617 176.460 -0.843 18135 11434 1 12 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.316 -1.003 18135 11435 1 12 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.387 0.578 18135 11436 1 12 . 1 1 164 164 LYS H H 164 8.251 8.251 8.591 -0.340 18135 11437 1 13 . 1 1 2 2 ASP N N 2 125.691 125.691 121.207 4.484 18135 11438 1 13 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.749 -0.039 18135 11439 1 13 . 1 1 2 2 ASP C C 2 174.758 174.758 175.917 -1.159 18135 11440 1 13 . 1 1 2 2 ASP CA C 2 52.843 52.843 53.644 -0.801 18135 11441 1 13 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.830 -2.509 18135 11442 1 13 . 1 1 2 2 ASP H H 2 8.773 8.773 8.296 0.477 18135 11443 1 13 . 1 1 3 3 LEU N N 3 123.957 123.957 119.465 4.492 18135 11444 1 13 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.326 0.075 18135 11445 1 13 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.171 0.482 18135 11446 1 13 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.257 0.298 18135 11447 1 13 . 1 1 3 3 LEU H H 3 8.164 8.164 7.477 0.687 18135 11448 1 13 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.570 -0.256 18135 11449 1 13 . 1 1 4 4 PRO C C 4 176.213 176.213 176.697 -0.484 18135 11450 1 13 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.071 0.837 18135 11451 1 13 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.761 1.133 18135 11452 1 13 . 1 1 5 5 GLN N N 5 121.621 121.621 122.935 -1.314 18135 11453 1 13 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.127 0.099 18135 11454 1 13 . 1 1 5 5 GLN C C 5 176.995 176.995 176.379 0.616 18135 11455 1 13 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.271 -1.561 18135 11456 1 13 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.260 -0.309 18135 11457 1 13 . 1 1 5 5 GLN H H 5 8.767 8.767 8.534 0.233 18135 11458 1 13 . 1 1 6 6 THR N N 6 111.419 111.419 109.822 1.597 18135 11459 1 13 . 1 1 6 6 THR HA H 6 4.135 4.135 4.425 -0.290 18135 11460 1 13 . 1 1 6 6 THR C C 6 174.695 174.695 175.715 -1.020 18135 11461 1 13 . 1 1 6 6 THR CA C 6 62.661 62.661 62.539 0.122 18135 11462 1 13 . 1 1 6 6 THR CB C 6 69.365 69.365 68.767 0.598 18135 11463 1 13 . 1 1 6 6 THR H H 6 7.865 7.865 8.390 -0.525 18135 11464 1 13 . 1 1 7 7 HIS N N 7 119.137 119.137 119.017 0.120 18135 11465 1 13 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.676 -0.091 18135 11466 1 13 . 1 1 7 7 HIS C C 7 174.980 174.980 175.294 -0.314 18135 11467 1 13 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.468 -2.464 18135 11468 1 13 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.867 -1.704 18135 11469 1 13 . 1 1 7 7 HIS H H 7 8.567 8.567 8.426 0.141 18135 11470 1 13 . 1 1 8 8 SER N N 8 115.796 115.796 113.217 2.579 18135 11471 1 13 . 1 1 8 8 SER HA H 8 4.363 4.363 4.473 -0.110 18135 11472 1 13 . 1 1 8 8 SER C C 8 175.312 175.312 175.609 -0.297 18135 11473 1 13 . 1 1 8 8 SER CA C 8 58.969 58.969 61.203 -2.235 18135 11474 1 13 . 1 1 8 8 SER CB C 8 63.439 63.439 64.555 -1.116 18135 11475 1 13 . 1 1 8 8 SER H H 8 8.180 8.180 7.920 0.260 18135 11476 1 13 . 1 1 9 9 LEU N N 9 123.844 123.844 117.590 6.254 18135 11477 1 13 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.698 -0.543 18135 11478 1 13 . 1 1 9 9 LEU C C 9 178.568 178.568 178.332 0.236 18135 11479 1 13 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.826 0.140 18135 11480 1 13 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.268 -0.472 18135 11481 1 13 . 1 1 9 9 LEU H H 9 8.404 8.404 7.666 0.738 18135 11482 1 13 . 1 1 10 10 GLY N N 10 107.582 107.582 107.413 0.169 18135 11483 1 13 . 1 1 10 10 GLY C C 10 174.586 174.586 176.287 -1.701 18135 11484 1 13 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.265 -0.360 18135 11485 1 13 . 1 1 10 10 GLY H H 10 8.438 8.438 8.511 -0.073 18135 11486 1 13 . 1 1 11 11 SER N N 11 118.806 118.806 116.035 2.771 18135 11487 1 13 . 1 1 11 11 SER HA H 11 4.156 4.156 4.126 0.030 18135 11488 1 13 . 1 1 11 11 SER C C 11 175.749 175.749 176.490 -0.741 18135 11489 1 13 . 1 1 11 11 SER CA C 11 61.299 61.299 62.250 -0.951 18135 11490 1 13 . 1 1 11 11 SER CB C 11 62.653 62.653 62.926 -0.273 18135 11491 1 13 . 1 1 11 11 SER H H 11 8.249 8.249 8.302 -0.053 18135 11492 1 13 . 1 1 12 12 ARG N N 12 121.986 121.986 120.756 1.230 18135 11493 1 13 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.148 -0.194 18135 11494 1 13 . 1 1 12 12 ARG C C 12 178.283 178.283 178.296 -0.013 18135 11495 1 13 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.697 1.133 18135 11496 1 13 . 1 1 12 12 ARG CB C 12 29.584 29.584 29.838 -0.254 18135 11497 1 13 . 1 1 12 12 ARG H H 12 8.027 8.027 7.948 0.079 18135 11498 1 13 . 1 1 13 13 ARG N N 13 119.432 119.432 118.957 0.475 18135 11499 1 13 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.060 -0.221 18135 11500 1 13 . 1 1 13 13 ARG C C 13 178.480 178.480 178.468 0.012 18135 11501 1 13 . 1 1 13 13 ARG CA C 13 60.491 60.491 60.149 0.342 18135 11502 1 13 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.979 0.103 18135 11503 1 13 . 1 1 13 13 ARG H H 13 8.437 8.437 7.815 0.622 18135 11504 1 13 . 1 1 14 14 THR N N 14 116.879 116.879 116.646 0.233 18135 11505 1 13 . 1 1 14 14 THR HA H 14 3.532 3.532 4.160 -0.628 18135 11506 1 13 . 1 1 14 14 THR C C 14 175.584 175.584 177.027 -1.443 18135 11507 1 13 . 1 1 14 14 THR CA C 14 68.036 68.036 67.246 0.790 18135 11508 1 13 . 1 1 14 14 THR CB C 14 67.969 67.969 68.591 -0.622 18135 11509 1 13 . 1 1 14 14 THR H H 14 7.957 7.957 8.278 -0.321 18135 11510 1 13 . 1 1 15 15 LEU N N 15 120.252 120.252 122.078 -1.826 18135 11511 1 13 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.034 -0.088 18135 11512 1 13 . 1 1 15 15 LEU C C 15 178.652 178.652 178.929 -0.277 18135 11513 1 13 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.367 -0.279 18135 11514 1 13 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.817 -0.263 18135 11515 1 13 . 1 1 15 15 LEU H H 15 7.550 7.550 8.202 -0.652 18135 11516 1 13 . 1 1 16 16 MET N N 16 118.788 118.788 117.170 1.618 18135 11517 1 13 . 1 1 16 16 MET HA H 16 4.023 4.023 4.041 -0.018 18135 11518 1 13 . 1 1 16 16 MET C C 16 178.718 178.718 178.951 -0.233 18135 11519 1 13 . 1 1 16 16 MET CA C 16 58.513 58.513 58.113 0.400 18135 11520 1 13 . 1 1 16 16 MET CB C 16 32.150 32.150 31.362 0.788 18135 11521 1 13 . 1 1 16 16 MET H H 16 7.985 7.985 8.403 -0.418 18135 11522 1 13 . 1 1 17 17 LEU N N 17 120.644 120.644 119.613 1.031 18135 11523 1 13 . 1 1 17 17 LEU HA H 17 3.972 3.972 4.007 -0.035 18135 11524 1 13 . 1 1 17 17 LEU C C 17 178.238 178.238 179.494 -1.256 18135 11525 1 13 . 1 1 17 17 LEU CA C 17 57.727 57.727 57.979 -0.252 18135 11526 1 13 . 1 1 17 17 LEU CB C 17 42.135 42.135 40.711 1.424 18135 11527 1 13 . 1 1 17 17 LEU H H 17 7.829 7.829 8.266 -0.437 18135 11528 1 13 . 1 1 18 18 LEU N N 18 118.280 118.280 117.771 0.509 18135 11529 1 13 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.801 -0.295 18135 11530 1 13 . 1 1 18 18 LEU C C 18 175.739 175.739 178.403 -2.664 18135 11531 1 13 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.302 0.354 18135 11532 1 13 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.177 1.065 18135 11533 1 13 . 1 1 18 18 LEU H H 18 7.499 7.499 8.450 -0.951 18135 11534 1 13 . 1 1 19 19 ALA N N 19 121.961 121.961 120.293 1.668 18135 11535 1 13 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.169 -0.332 18135 11536 1 13 . 1 1 19 19 ALA C C 19 180.736 180.736 178.250 2.486 18135 11537 1 13 . 1 1 19 19 ALA CA C 19 55.066 55.066 53.990 1.076 18135 11538 1 13 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.339 -1.262 18135 11539 1 13 . 1 1 19 19 ALA H H 19 7.950 7.950 7.511 0.439 18135 11540 1 13 . 1 1 20 20 GLN N N 20 118.605 118.605 115.908 2.697 18135 11541 1 13 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.186 -0.251 18135 11542 1 13 . 1 1 20 20 GLN C C 20 176.945 176.945 177.510 -0.565 18135 11543 1 13 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.369 0.646 18135 11544 1 13 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.362 -0.888 18135 11545 1 13 . 1 1 20 20 GLN H H 20 7.958 7.958 7.932 0.026 18135 11546 1 13 . 1 1 21 21 MET N N 21 116.693 116.693 118.481 -1.788 18135 11547 1 13 . 1 1 21 21 MET HA H 21 3.861 3.861 4.306 -0.445 18135 11548 1 13 . 1 1 21 21 MET C C 21 174.671 174.671 175.405 -0.734 18135 11549 1 13 . 1 1 21 21 MET CA C 21 57.111 57.111 57.392 -0.280 18135 11550 1 13 . 1 1 21 21 MET CB C 21 34.073 34.073 33.350 0.723 18135 11551 1 13 . 1 1 21 21 MET H H 21 7.420 7.420 7.933 -0.513 18135 11552 1 13 . 1 1 22 22 ARG N N 22 115.451 115.451 119.884 -4.433 18135 11553 1 13 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.880 -0.027 18135 11554 1 13 . 1 1 22 22 ARG C C 22 175.950 175.950 175.237 0.713 18135 11555 1 13 . 1 1 22 22 ARG CA C 22 58.452 58.452 54.951 3.501 18135 11556 1 13 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.477 1.037 18135 11557 1 13 . 1 1 22 22 ARG H H 22 6.484 6.484 7.211 -0.727 18135 11558 1 13 . 1 1 23 23 LYS N N 23 128.593 128.593 123.545 5.048 18135 11559 1 13 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.575 -0.090 18135 11560 1 13 . 1 1 23 23 LYS C C 23 176.643 176.643 174.827 1.816 18135 11561 1 13 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.720 1.567 18135 11562 1 13 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.336 4.925 18135 11563 1 13 . 1 1 23 23 LYS H H 23 10.212 10.212 8.761 1.451 18135 11564 1 13 . 1 1 24 24 ILE N N 24 118.605 118.605 122.477 -3.872 18135 11565 1 13 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.367 0.117 18135 11566 1 13 . 1 1 24 24 ILE C C 24 173.878 173.878 174.283 -0.405 18135 11567 1 13 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.965 -1.368 18135 11568 1 13 . 1 1 24 24 ILE CB C 24 41.456 41.456 40.545 0.911 18135 11569 1 13 . 1 1 24 24 ILE H H 24 8.465 8.465 8.488 -0.023 18135 11570 1 13 . 1 1 25 25 SER N N 25 113.658 113.658 118.049 -4.391 18135 11571 1 13 . 1 1 25 25 SER HA H 25 4.481 4.481 4.947 -0.466 18135 11572 1 13 . 1 1 25 25 SER C C 25 176.359 176.359 175.853 0.506 18135 11573 1 13 . 1 1 25 25 SER CA C 25 56.975 56.975 57.045 -0.070 18135 11574 1 13 . 1 1 25 25 SER CB C 25 64.759 64.759 63.659 1.100 18135 11575 1 13 . 1 1 25 25 SER H H 25 8.104 8.104 8.528 -0.424 18135 11576 1 13 . 1 1 26 26 LEU N N 26 127.566 127.566 124.383 3.183 18135 11577 1 13 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.230 -0.353 18135 11578 1 13 . 1 1 26 26 LEU C C 26 178.946 178.946 176.799 2.147 18135 11579 1 13 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.128 0.550 18135 11580 1 13 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.065 -0.346 18135 11581 1 13 . 1 1 26 26 LEU H H 26 8.802 8.802 8.900 -0.098 18135 11582 1 13 . 1 1 27 27 PHE N N 27 117.143 117.143 115.458 1.685 18135 11583 1 13 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.579 -0.341 18135 11584 1 13 . 1 1 27 27 PHE C C 27 177.067 177.067 176.785 0.282 18135 11585 1 13 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.833 1.257 18135 11586 1 13 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.746 -0.484 18135 11587 1 13 . 1 1 27 27 PHE H H 27 7.986 7.986 7.964 0.022 18135 11588 1 13 . 1 1 28 28 SER N N 28 115.200 115.200 115.703 -0.503 18135 11589 1 13 . 1 1 28 28 SER HA H 28 4.505 4.505 4.444 0.061 18135 11590 1 13 . 1 1 28 28 SER C C 28 174.533 174.533 174.305 0.228 18135 11591 1 13 . 1 1 28 28 SER CA C 28 59.447 59.447 60.080 -0.633 18135 11592 1 13 . 1 1 28 28 SER CB C 28 63.790 63.790 63.590 0.200 18135 11593 1 13 . 1 1 28 28 SER H H 28 7.929 7.929 8.179 -0.250 18135 11594 1 13 . 1 1 29 29 CYS N N 29 119.870 119.870 119.276 0.594 18135 11595 1 13 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.663 0.419 18135 11596 1 13 . 1 1 29 29 CYS C C 29 176.475 176.475 174.182 2.293 18135 11597 1 13 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.861 -5.431 18135 11598 1 13 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.412 9.830 18135 11599 1 13 . 1 1 29 29 CYS H H 29 7.865 7.865 7.742 0.123 18135 11600 1 13 . 1 1 30 30 LEU N N 30 122.259 122.259 123.272 -1.013 18135 11601 1 13 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.306 -0.345 18135 11602 1 13 . 1 1 30 30 LEU C C 30 179.774 179.774 178.547 1.227 18135 11603 1 13 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.306 1.997 18135 11604 1 13 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.155 -0.579 18135 11605 1 13 . 1 1 30 30 LEU H H 30 7.812 7.812 8.438 -0.626 18135 11606 1 13 . 1 1 31 31 LYS N N 31 117.731 117.731 118.449 -0.718 18135 11607 1 13 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.204 0.486 18135 11608 1 13 . 1 1 31 31 LYS C C 31 176.692 176.692 176.442 0.250 18135 11609 1 13 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.517 -3.440 18135 11610 1 13 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.017 -0.430 18135 11611 1 13 . 1 1 31 31 LYS H H 31 8.597 8.597 8.200 0.397 18135 11612 1 13 . 1 1 32 32 ASP N N 32 117.841 117.841 116.738 1.103 18135 11613 1 13 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.692 0.002 18135 11614 1 13 . 1 1 32 32 ASP C C 32 175.505 175.505 175.992 -0.487 18135 11615 1 13 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.615 -0.527 18135 11616 1 13 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.216 -0.408 18135 11617 1 13 . 1 1 32 32 ASP H H 32 7.808 7.808 8.333 -0.525 18135 11618 1 13 . 1 1 33 33 ARG N N 33 120.876 120.876 120.251 0.625 18135 11619 1 13 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.220 -0.179 18135 11620 1 13 . 1 1 33 33 ARG C C 33 175.286 175.286 175.756 -0.470 18135 11621 1 13 . 1 1 33 33 ARG CA C 33 58.083 58.083 56.232 1.851 18135 11622 1 13 . 1 1 33 33 ARG CB C 33 30.013 30.013 31.046 -1.033 18135 11623 1 13 . 1 1 33 33 ARG H H 33 7.378 7.378 7.251 0.127 18135 11624 1 13 . 1 1 34 34 HIS N N 34 120.555 120.555 115.388 5.167 18135 11625 1 13 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.351 -0.139 18135 11626 1 13 . 1 1 34 34 HIS C C 34 170.494 170.494 173.489 -2.995 18135 11627 1 13 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.456 -2.849 18135 11628 1 13 . 1 1 34 34 HIS CB C 34 31.488 31.488 28.123 3.365 18135 11629 1 13 . 1 1 34 34 HIS H H 34 7.974 7.974 8.762 -0.788 18135 11630 1 13 . 1 1 35 35 ASP N N 35 125.061 125.061 120.844 4.217 18135 11631 1 13 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.421 0.217 18135 11632 1 13 . 1 1 35 35 ASP C C 35 175.943 175.943 176.423 -0.480 18135 11633 1 13 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.229 -1.860 18135 11634 1 13 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.828 -1.466 18135 11635 1 13 . 1 1 35 35 ASP H H 35 7.805 7.805 8.355 -0.550 18135 11636 1 13 . 1 1 36 36 PHE N N 36 122.860 122.860 118.806 4.054 18135 11637 1 13 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.410 -0.085 18135 11638 1 13 . 1 1 36 36 PHE C C 36 176.643 176.643 176.667 -0.024 18135 11639 1 13 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.137 1.502 18135 11640 1 13 . 1 1 36 36 PHE CB C 36 40.691 40.691 38.930 1.761 18135 11641 1 13 . 1 1 36 36 PHE H H 36 8.973 8.973 7.197 1.776 18135 11642 1 13 . 1 1 37 37 GLY N N 37 111.856 111.856 108.325 3.531 18135 11643 1 13 . 1 1 37 37 GLY C C 37 175.185 175.185 174.218 0.967 18135 11644 1 13 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.942 3.201 18135 11645 1 13 . 1 1 37 37 GLY H H 37 8.727 8.727 7.795 0.932 18135 11646 1 13 . 1 1 38 38 PHE N N 38 123.178 123.178 120.911 2.267 18135 11647 1 13 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.632 -0.718 18135 11648 1 13 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.623 2.181 18135 11649 1 13 . 1 1 38 38 PHE CB C 38 38.657 38.657 37.927 0.730 18135 11650 1 13 . 1 1 38 38 PHE H H 38 9.169 9.169 7.059 2.110 18135 11651 1 13 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.528 0.001 18135 11652 1 13 . 1 1 39 39 PRO C C 39 174.634 174.634 177.136 -2.502 18135 11653 1 13 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.630 -1.087 18135 11654 1 13 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.974 -2.270 18135 11655 1 13 . 1 1 40 40 GLN N N 40 123.608 123.608 123.658 -0.050 18135 11656 1 13 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.277 -0.658 18135 11657 1 13 . 1 1 40 40 GLN C C 40 176.958 176.958 177.650 -0.692 18135 11658 1 13 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.592 -0.519 18135 11659 1 13 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.898 0.919 18135 11660 1 13 . 1 1 40 40 GLN H H 40 7.966 7.966 8.372 -0.406 18135 11661 1 13 . 1 1 41 41 GLU N N 41 119.446 119.446 119.812 -0.366 18135 11662 1 13 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.100 0.037 18135 11663 1 13 . 1 1 41 41 GLU C C 41 177.346 177.346 177.880 -0.534 18135 11664 1 13 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.103 -1.174 18135 11665 1 13 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.128 -1.295 18135 11666 1 13 . 1 1 41 41 GLU H H 41 9.044 9.044 8.778 0.266 18135 11667 1 13 . 1 1 42 42 GLU N N 42 117.196 117.196 117.637 -0.441 18135 11668 1 13 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.317 -0.254 18135 11669 1 13 . 1 1 42 42 GLU C C 42 174.886 174.886 177.624 -2.738 18135 11670 1 13 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.707 -1.323 18135 11671 1 13 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.913 -2.355 18135 11672 1 13 . 1 1 42 42 GLU H H 42 7.646 7.646 7.800 -0.154 18135 11673 1 13 . 1 1 43 43 PHE N N 43 115.527 115.527 122.775 -7.248 18135 11674 1 13 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.588 -0.102 18135 11675 1 13 . 1 1 43 43 PHE C C 43 175.615 175.615 176.056 -0.441 18135 11676 1 13 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.359 -0.811 18135 11677 1 13 . 1 1 43 43 PHE CB C 43 39.893 39.893 39.787 0.106 18135 11678 1 13 . 1 1 43 43 PHE H H 43 7.601 7.601 8.380 -0.779 18135 11679 1 13 . 1 1 44 44 GLY N N 44 107.243 107.243 108.718 -1.475 18135 11680 1 13 . 1 1 44 44 GLY C C 44 174.032 174.032 174.271 -0.239 18135 11681 1 13 . 1 1 44 44 GLY CA C 44 45.612 45.612 46.252 -0.640 18135 11682 1 13 . 1 1 44 44 GLY H H 44 7.733 7.733 7.753 -0.020 18135 11683 1 13 . 1 1 45 45 ASN N N 45 117.599 117.599 121.962 -4.363 18135 11684 1 13 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.758 -0.207 18135 11685 1 13 . 1 1 45 45 ASN C C 45 175.894 175.894 174.427 1.467 18135 11686 1 13 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.984 0.865 18135 11687 1 13 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.958 -1.539 18135 11688 1 13 . 1 1 45 45 ASN H H 45 8.343 8.343 7.712 0.631 18135 11689 1 13 . 1 1 46 46 GLN N N 46 118.916 118.916 118.849 0.067 18135 11690 1 13 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.551 -0.469 18135 11691 1 13 . 1 1 46 46 GLN C C 46 175.851 175.851 175.965 -0.114 18135 11692 1 13 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.805 0.841 18135 11693 1 13 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.565 -0.121 18135 11694 1 13 . 1 1 46 46 GLN H H 46 8.652 8.652 8.430 0.222 18135 11695 1 13 . 1 1 47 47 PHE N N 47 119.511 119.511 120.089 -0.578 18135 11696 1 13 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.470 0.092 18135 11697 1 13 . 1 1 47 47 PHE C C 47 176.258 176.258 175.598 0.660 18135 11698 1 13 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.795 -0.876 18135 11699 1 13 . 1 1 47 47 PHE CB C 47 39.858 39.858 40.029 -0.170 18135 11700 1 13 . 1 1 47 47 PHE H H 47 7.904 7.904 7.938 -0.034 18135 11701 1 13 . 1 1 48 48 GLN N N 48 120.127 120.127 117.479 2.648 18135 11702 1 13 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.562 -0.187 18135 11703 1 13 . 1 1 48 48 GLN C C 48 181.265 181.265 175.629 5.636 18135 11704 1 13 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.602 0.974 18135 11705 1 13 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.673 -0.205 18135 11706 1 13 . 1 1 48 48 GLN H H 48 8.255 8.255 8.180 0.075 18135 11707 1 13 . 1 1 49 49 LYS N N 49 121.777 121.777 122.895 -1.118 18135 11708 1 13 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.119 -0.016 18135 11709 1 13 . 1 1 49 49 LYS C C 49 177.968 177.968 176.865 1.103 18135 11710 1 13 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.333 -0.184 18135 11711 1 13 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.069 0.321 18135 11712 1 13 . 1 1 49 49 LYS H H 49 8.426 8.426 8.699 -0.273 18135 11713 1 13 . 1 1 50 50 ALA N N 50 120.573 120.573 120.950 -0.377 18135 11714 1 13 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.294 -0.224 18135 11715 1 13 . 1 1 50 50 ALA C C 50 178.697 178.697 177.945 0.752 18135 11716 1 13 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.563 1.205 18135 11717 1 13 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.571 0.303 18135 11718 1 13 . 1 1 50 50 ALA H H 50 8.578 8.578 7.887 0.691 18135 11719 1 13 . 1 1 51 51 GLU N N 51 115.015 115.015 114.694 0.321 18135 11720 1 13 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.241 0.025 18135 11721 1 13 . 1 1 51 51 GLU C C 51 176.995 176.995 177.504 -0.509 18135 11722 1 13 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.420 -0.427 18135 11723 1 13 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.226 -1.321 18135 11724 1 13 . 1 1 51 51 GLU H H 51 7.907 7.907 8.167 -0.260 18135 11725 1 13 . 1 1 52 52 THR N N 52 111.210 111.210 115.100 -3.890 18135 11726 1 13 . 1 1 52 52 THR HA H 52 4.114 4.114 4.350 -0.236 18135 11727 1 13 . 1 1 52 52 THR C C 52 175.271 175.271 175.662 -0.391 18135 11728 1 13 . 1 1 52 52 THR CA C 52 63.611 63.611 65.278 -1.667 18135 11729 1 13 . 1 1 52 52 THR CB C 52 69.673 69.673 68.988 0.685 18135 11730 1 13 . 1 1 52 52 THR H H 52 7.863 7.863 7.330 0.533 18135 11731 1 13 . 1 1 53 53 ILE N N 53 119.113 119.113 122.492 -3.379 18135 11732 1 13 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.441 -0.577 18135 11733 1 13 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.988 0.919 18135 11734 1 13 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.285 -1.332 18135 11735 1 13 . 1 1 53 53 ILE H H 53 8.341 8.341 7.731 0.610 18135 11736 1 13 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.390 -0.104 18135 11737 1 13 . 1 1 54 54 PRO C C 54 179.655 179.655 178.975 0.680 18135 11738 1 13 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.025 0.026 18135 11739 1 13 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.378 0.507 18135 11740 1 13 . 1 1 55 55 VAL N N 55 116.355 116.355 116.723 -0.368 18135 11741 1 13 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.853 -0.172 18135 11742 1 13 . 1 1 55 55 VAL C C 55 177.649 177.649 178.040 -0.391 18135 11743 1 13 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.461 0.376 18135 11744 1 13 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.386 1.085 18135 11745 1 13 . 1 1 55 55 VAL H H 55 7.119 7.119 7.707 -0.588 18135 11746 1 13 . 1 1 56 56 LEU N N 56 123.038 123.038 121.073 1.965 18135 11747 1 13 . 1 1 56 56 LEU HA H 56 4.310 4.310 3.988 0.322 18135 11748 1 13 . 1 1 56 56 LEU C C 56 178.637 178.637 178.495 0.142 18135 11749 1 13 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.452 -0.366 18135 11750 1 13 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.798 0.520 18135 11751 1 13 . 1 1 56 56 LEU H H 56 8.535 8.535 8.578 -0.043 18135 11752 1 13 . 1 1 57 57 HIS N N 57 117.041 117.041 118.735 -1.694 18135 11753 1 13 . 1 1 57 57 HIS HA H 57 3.786 3.786 3.972 -0.186 18135 11754 1 13 . 1 1 57 57 HIS C C 57 175.640 175.640 177.627 -1.987 18135 11755 1 13 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.533 0.998 18135 11756 1 13 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.077 -1.868 18135 11757 1 13 . 1 1 57 57 HIS H H 57 9.047 9.047 8.216 0.831 18135 11758 1 13 . 1 1 58 58 GLU N N 58 119.521 119.521 118.259 1.262 18135 11759 1 13 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.781 0.226 18135 11760 1 13 . 1 1 58 58 GLU C C 58 179.029 179.029 178.749 0.280 18135 11761 1 13 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.174 -0.207 18135 11762 1 13 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.323 -1.033 18135 11763 1 13 . 1 1 58 58 GLU H H 58 7.860 7.860 8.502 -0.642 18135 11764 1 13 . 1 1 59 59 MET N N 59 119.512 119.512 120.254 -0.742 18135 11765 1 13 . 1 1 59 59 MET HA H 59 4.074 4.074 4.315 -0.241 18135 11766 1 13 . 1 1 59 59 MET C C 59 177.031 177.031 178.677 -1.646 18135 11767 1 13 . 1 1 59 59 MET CA C 59 59.408 59.408 58.403 1.006 18135 11768 1 13 . 1 1 59 59 MET CB C 59 32.525 32.525 32.632 -0.107 18135 11769 1 13 . 1 1 59 59 MET H H 59 8.442 8.442 7.905 0.537 18135 11770 1 13 . 1 1 60 60 ILE N N 60 117.183 117.183 117.799 -0.616 18135 11771 1 13 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.517 -0.100 18135 11772 1 13 . 1 1 60 60 ILE C C 60 177.524 177.524 178.139 -0.615 18135 11773 1 13 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.646 0.680 18135 11774 1 13 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.121 -0.261 18135 11775 1 13 . 1 1 60 60 ILE H H 60 8.338 8.338 7.738 0.600 18135 11776 1 13 . 1 1 61 61 GLN N N 61 120.191 120.191 120.213 -0.022 18135 11777 1 13 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.736 -0.034 18135 11778 1 13 . 1 1 61 61 GLN C C 61 178.270 178.270 177.785 0.485 18135 11779 1 13 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.269 -0.483 18135 11780 1 13 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.215 0.451 18135 11781 1 13 . 1 1 61 61 GLN H H 61 8.234 8.234 8.060 0.174 18135 11782 1 13 . 1 1 62 62 GLN N N 62 116.795 116.795 118.670 -1.875 18135 11783 1 13 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.125 0.502 18135 11784 1 13 . 1 1 62 62 GLN C C 62 179.685 179.685 178.411 1.274 18135 11785 1 13 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.154 -0.146 18135 11786 1 13 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.639 -3.297 18135 11787 1 13 . 1 1 62 62 GLN H H 62 8.421 8.421 7.939 0.482 18135 11788 1 13 . 1 1 63 63 ILE N N 63 122.797 122.797 120.037 2.760 18135 11789 1 13 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.889 -0.240 18135 11790 1 13 . 1 1 63 63 ILE C C 63 177.279 177.279 177.880 -0.601 18135 11791 1 13 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.515 2.450 18135 11792 1 13 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.781 -0.466 18135 11793 1 13 . 1 1 63 63 ILE H H 63 8.164 8.164 7.585 0.579 18135 11794 1 13 . 1 1 64 64 PHE N N 64 120.820 120.820 121.201 -0.381 18135 11795 1 13 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.413 -0.697 18135 11796 1 13 . 1 1 64 64 PHE C C 64 178.402 178.402 176.570 1.832 18135 11797 1 13 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.135 1.017 18135 11798 1 13 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.696 -0.186 18135 11799 1 13 . 1 1 64 64 PHE H H 64 8.405 8.405 7.914 0.491 18135 11800 1 13 . 1 1 65 65 ASN N N 65 119.981 119.981 118.188 1.793 18135 11801 1 13 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.778 0.285 18135 11802 1 13 . 1 1 65 65 ASN C C 65 177.944 177.944 177.568 0.376 18135 11803 1 13 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.236 -0.368 18135 11804 1 13 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.666 -1.411 18135 11805 1 13 . 1 1 65 65 ASN H H 65 8.812 8.812 7.935 0.877 18135 11806 1 13 . 1 1 66 66 LEU N N 66 121.533 121.533 120.904 0.629 18135 11807 1 13 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.223 0.000 18135 11808 1 13 . 1 1 66 66 LEU C C 66 177.777 177.777 179.228 -1.451 18135 11809 1 13 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.913 0.355 18135 11810 1 13 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.059 0.548 18135 11811 1 13 . 1 1 66 66 LEU H H 66 8.177 8.177 7.974 0.203 18135 11812 1 13 . 1 1 67 67 PHE N N 67 110.842 110.842 114.028 -3.186 18135 11813 1 13 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.662 0.218 18135 11814 1 13 . 1 1 67 67 PHE C C 67 177.965 177.965 176.446 1.519 18135 11815 1 13 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.568 0.966 18135 11816 1 13 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.958 -0.342 18135 11817 1 13 . 1 1 67 67 PHE H H 67 8.160 8.160 8.391 -0.231 18135 11818 1 13 . 1 1 68 68 SER N N 68 119.131 119.131 113.639 5.492 18135 11819 1 13 . 1 1 68 68 SER HA H 68 4.580 4.580 4.237 0.343 18135 11820 1 13 . 1 1 68 68 SER C C 68 173.472 173.472 174.956 -1.484 18135 11821 1 13 . 1 1 68 68 SER CA C 68 59.191 59.191 59.575 -0.384 18135 11822 1 13 . 1 1 68 68 SER CB C 68 63.123 63.123 63.324 -0.201 18135 11823 1 13 . 1 1 68 68 SER H H 68 8.016 8.016 7.546 0.470 18135 11824 1 13 . 1 1 69 69 THR N N 69 111.353 111.353 116.095 -4.742 18135 11825 1 13 . 1 1 69 69 THR HA H 69 4.345 4.345 4.478 -0.133 18135 11826 1 13 . 1 1 69 69 THR C C 69 175.661 175.661 175.184 0.477 18135 11827 1 13 . 1 1 69 69 THR CA C 69 61.411 61.411 60.660 0.751 18135 11828 1 13 . 1 1 69 69 THR CB C 69 72.209 72.209 70.652 1.557 18135 11829 1 13 . 1 1 69 69 THR H H 69 6.977 6.977 7.367 -0.390 18135 11830 1 13 . 1 1 70 70 LYS N N 70 121.120 121.120 123.097 -1.977 18135 11831 1 13 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.112 -0.023 18135 11832 1 13 . 1 1 70 70 LYS C C 70 179.259 179.259 177.562 1.697 18135 11833 1 13 . 1 1 70 70 LYS CA C 70 57.956 57.956 59.120 -1.164 18135 11834 1 13 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.378 -0.628 18135 11835 1 13 . 1 1 70 70 LYS H H 70 9.065 9.065 8.619 0.446 18135 11836 1 13 . 1 1 71 71 ASP N N 71 116.374 116.374 120.530 -4.156 18135 11837 1 13 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.299 -0.124 18135 11838 1 13 . 1 1 71 71 ASP C C 71 178.372 178.372 177.202 1.170 18135 11839 1 13 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.050 0.017 18135 11840 1 13 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.475 -0.169 18135 11841 1 13 . 1 1 71 71 ASP H H 71 7.518 7.518 7.905 -0.387 18135 11842 1 13 . 1 1 72 72 SER N N 72 117.341 117.341 114.982 2.359 18135 11843 1 13 . 1 1 72 72 SER HA H 72 3.715 3.715 3.323 0.392 18135 11844 1 13 . 1 1 72 72 SER C C 72 176.897 176.897 176.198 0.699 18135 11845 1 13 . 1 1 72 72 SER CA C 72 60.267 60.267 60.404 -0.137 18135 11846 1 13 . 1 1 72 72 SER CB C 72 62.616 62.616 62.996 -0.380 18135 11847 1 13 . 1 1 72 72 SER H H 72 8.066 8.066 7.896 0.170 18135 11848 1 13 . 1 1 73 73 SER N N 73 113.398 113.398 119.354 -5.956 18135 11849 1 13 . 1 1 73 73 SER HA H 73 4.094 4.094 4.115 -0.021 18135 11850 1 13 . 1 1 73 73 SER C C 73 174.855 174.855 175.397 -0.542 18135 11851 1 13 . 1 1 73 73 SER CA C 73 61.385 61.385 60.550 0.835 18135 11852 1 13 . 1 1 73 73 SER CB C 73 62.798 62.798 62.897 -0.099 18135 11853 1 13 . 1 1 73 73 SER H H 73 7.982 7.982 7.600 0.382 18135 11854 1 13 . 1 1 74 74 ALA N N 74 119.486 119.486 119.996 -0.510 18135 11855 1 13 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.255 -0.098 18135 11856 1 13 . 1 1 74 74 ALA C C 74 177.626 177.626 177.192 0.434 18135 11857 1 13 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.603 0.110 18135 11858 1 13 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.907 -0.160 18135 11859 1 13 . 1 1 74 74 ALA H H 74 7.095 7.095 7.744 -0.649 18135 11860 1 13 . 1 1 75 75 ALA N N 75 121.465 121.465 121.614 -0.149 18135 11861 1 13 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.752 -0.056 18135 11862 1 13 . 1 1 75 75 ALA C C 75 177.197 177.197 175.961 1.236 18135 11863 1 13 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.029 0.975 18135 11864 1 13 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.096 -0.836 18135 11865 1 13 . 1 1 75 75 ALA H H 75 7.159 7.159 7.521 -0.362 18135 11866 1 13 . 1 1 76 76 TRP N N 76 116.791 116.791 116.344 0.447 18135 11867 1 13 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.721 0.329 18135 11868 1 13 . 1 1 76 76 TRP C C 76 177.617 177.617 174.743 2.874 18135 11869 1 13 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.162 -1.843 18135 11870 1 13 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.959 2.117 18135 11871 1 13 . 1 1 76 76 TRP H H 76 7.080 7.080 7.115 -0.035 18135 11872 1 13 . 1 1 77 77 ASP N N 77 119.928 119.928 121.324 -1.396 18135 11873 1 13 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.503 -0.146 18135 11874 1 13 . 1 1 77 77 ASP C C 77 176.877 176.877 177.792 -0.915 18135 11875 1 13 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.060 -0.242 18135 11876 1 13 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.152 0.463 18135 11877 1 13 . 1 1 77 77 ASP H H 77 8.259 8.259 8.613 -0.354 18135 11878 1 13 . 1 1 78 78 GLU N N 78 127.277 127.277 126.399 0.878 18135 11879 1 13 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.994 -0.109 18135 11880 1 13 . 1 1 78 78 GLU C C 78 177.439 177.439 178.177 -0.738 18135 11881 1 13 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.799 -0.415 18135 11882 1 13 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.538 -0.895 18135 11883 1 13 . 1 1 78 78 GLU H H 78 8.920 8.920 8.925 -0.005 18135 11884 1 13 . 1 1 79 79 THR N N 79 115.422 115.422 117.433 -2.011 18135 11885 1 13 . 1 1 79 79 THR HA H 79 3.907 3.907 4.027 -0.120 18135 11886 1 13 . 1 1 79 79 THR C C 79 177.330 177.330 176.489 0.841 18135 11887 1 13 . 1 1 79 79 THR CA C 79 66.263 66.263 66.904 -0.641 18135 11888 1 13 . 1 1 79 79 THR CB C 79 68.002 68.002 68.442 -0.440 18135 11889 1 13 . 1 1 79 79 THR H H 79 8.124 8.124 7.868 0.256 18135 11890 1 13 . 1 1 80 80 LEU N N 80 121.791 121.791 121.658 0.133 18135 11891 1 13 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.152 -0.265 18135 11892 1 13 . 1 1 80 80 LEU C C 80 179.018 179.018 178.793 0.225 18135 11893 1 13 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.740 -0.501 18135 11894 1 13 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.232 0.420 18135 11895 1 13 . 1 1 80 80 LEU H H 80 7.725 7.725 8.016 -0.291 18135 11896 1 13 . 1 1 81 81 LEU N N 81 119.280 119.280 120.578 -1.298 18135 11897 1 13 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.229 -0.740 18135 11898 1 13 . 1 1 81 81 LEU C C 81 177.062 177.062 178.846 -1.784 18135 11899 1 13 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.755 -1.046 18135 11900 1 13 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.045 -1.097 18135 11901 1 13 . 1 1 81 81 LEU H H 81 8.344 8.344 8.801 -0.457 18135 11902 1 13 . 1 1 82 82 ASP N N 82 115.357 115.357 119.793 -4.436 18135 11903 1 13 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.433 -0.159 18135 11904 1 13 . 1 1 82 82 ASP C C 82 179.018 179.018 178.501 0.517 18135 11905 1 13 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.456 -0.641 18135 11906 1 13 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.729 -2.508 18135 11907 1 13 . 1 1 82 82 ASP H H 82 8.001 8.001 8.573 -0.572 18135 11908 1 13 . 1 1 83 83 LYS N N 83 119.603 119.603 118.868 0.735 18135 11909 1 13 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.870 0.112 18135 11910 1 13 . 1 1 83 83 LYS C C 83 178.624 178.624 178.876 -0.252 18135 11911 1 13 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.940 0.805 18135 11912 1 13 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.185 0.921 18135 11913 1 13 . 1 1 83 83 LYS H H 83 7.342 7.342 7.665 -0.323 18135 11914 1 13 . 1 1 84 84 PHE N N 84 123.933 123.933 121.789 2.144 18135 11915 1 13 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.024 0.011 18135 11916 1 13 . 1 1 84 84 PHE C C 84 177.210 177.210 177.040 0.170 18135 11917 1 13 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.817 -1.474 18135 11918 1 13 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.898 0.418 18135 11919 1 13 . 1 1 84 84 PHE H H 84 8.471 8.471 8.441 0.030 18135 11920 1 13 . 1 1 85 85 TYR N N 85 118.387 118.387 117.417 0.970 18135 11921 1 13 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.716 0.352 18135 11922 1 13 . 1 1 85 85 TYR C C 85 178.104 178.104 177.404 0.700 18135 11923 1 13 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.824 -1.247 18135 11924 1 13 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.157 -0.180 18135 11925 1 13 . 1 1 85 85 TYR H H 85 9.011 9.011 8.923 0.088 18135 11926 1 13 . 1 1 86 86 THR N N 86 114.035 114.035 116.421 -2.386 18135 11927 1 13 . 1 1 86 86 THR HA H 86 3.945 3.945 3.194 0.751 18135 11928 1 13 . 1 1 86 86 THR C C 86 176.708 176.708 176.465 0.243 18135 11929 1 13 . 1 1 86 86 THR CA C 86 66.759 66.759 66.856 -0.097 18135 11930 1 13 . 1 1 86 86 THR CB C 86 68.853 68.853 68.053 0.800 18135 11931 1 13 . 1 1 86 86 THR H H 86 7.609 7.609 7.263 0.346 18135 11932 1 13 . 1 1 87 87 GLU N N 87 120.790 120.790 121.423 -0.633 18135 11933 1 13 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.922 0.125 18135 11934 1 13 . 1 1 87 87 GLU C C 87 179.606 179.606 178.832 0.774 18135 11935 1 13 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.317 -0.919 18135 11936 1 13 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.172 -0.886 18135 11937 1 13 . 1 1 87 87 GLU H H 87 7.712 7.712 7.610 0.102 18135 11938 1 13 . 1 1 88 88 LEU N N 88 120.729 120.729 120.017 0.712 18135 11939 1 13 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.886 -0.158 18135 11940 1 13 . 1 1 88 88 LEU C C 88 178.695 178.695 179.288 -0.593 18135 11941 1 13 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.284 0.967 18135 11942 1 13 . 1 1 88 88 LEU CB C 88 41.587 41.587 39.991 1.596 18135 11943 1 13 . 1 1 88 88 LEU H H 88 8.393 8.393 7.471 0.922 18135 11944 1 13 . 1 1 89 89 TYR N N 89 118.654 118.654 118.663 -0.009 18135 11945 1 13 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.076 -0.145 18135 11946 1 13 . 1 1 89 89 TYR C C 89 178.438 178.438 178.612 -0.174 18135 11947 1 13 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.271 0.136 18135 11948 1 13 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.406 0.461 18135 11949 1 13 . 1 1 89 89 TYR H H 89 8.637 8.637 8.275 0.362 18135 11950 1 13 . 1 1 90 90 GLN N N 90 118.263 118.263 116.528 1.735 18135 11951 1 13 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.995 -0.009 18135 11952 1 13 . 1 1 90 90 GLN C C 90 178.411 178.411 178.736 -0.325 18135 11953 1 13 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.638 0.144 18135 11954 1 13 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.330 -0.183 18135 11955 1 13 . 1 1 90 90 GLN H H 90 7.796 7.796 7.810 -0.014 18135 11956 1 13 . 1 1 91 91 GLN N N 91 117.959 117.959 120.212 -2.253 18135 11957 1 13 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.059 0.023 18135 11958 1 13 . 1 1 91 91 GLN C C 91 178.705 178.705 178.579 0.126 18135 11959 1 13 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.799 0.021 18135 11960 1 13 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.368 0.805 18135 11961 1 13 . 1 1 91 91 GLN H H 91 7.727 7.727 8.224 -0.497 18135 11962 1 13 . 1 1 92 92 LEU N N 92 119.965 119.965 118.607 1.358 18135 11963 1 13 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.970 -0.236 18135 11964 1 13 . 1 1 92 92 LEU C C 92 178.984 178.984 178.762 0.222 18135 11965 1 13 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.898 -0.406 18135 11966 1 13 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.846 0.533 18135 11967 1 13 . 1 1 92 92 LEU H H 92 8.465 8.465 8.556 -0.091 18135 11968 1 13 . 1 1 93 93 ASN N N 93 117.793 117.793 118.233 -0.440 18135 11969 1 13 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.226 0.175 18135 11970 1 13 . 1 1 93 93 ASN C C 93 178.309 178.309 177.135 1.174 18135 11971 1 13 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.397 0.006 18135 11972 1 13 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.193 0.445 18135 11973 1 13 . 1 1 93 93 ASN H H 93 8.091 8.091 8.065 0.026 18135 11974 1 13 . 1 1 94 94 ASP N N 94 121.133 121.133 120.197 0.936 18135 11975 1 13 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.406 -0.001 18135 11976 1 13 . 1 1 94 94 ASP C C 94 178.328 178.328 178.578 -0.250 18135 11977 1 13 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.454 -0.907 18135 11978 1 13 . 1 1 94 94 ASP CB C 94 38.649 38.649 41.186 -2.537 18135 11979 1 13 . 1 1 94 94 ASP H H 94 8.362 8.362 7.905 0.457 18135 11980 1 13 . 1 1 95 95 LEU N N 95 119.160 119.160 120.543 -1.383 18135 11981 1 13 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.902 0.137 18135 11982 1 13 . 1 1 95 95 LEU C C 95 178.826 178.826 178.664 0.162 18135 11983 1 13 . 1 1 95 95 LEU CA C 95 57.027 57.027 57.765 -0.738 18135 11984 1 13 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.037 0.173 18135 11985 1 13 . 1 1 95 95 LEU H H 95 8.143 8.143 8.479 -0.336 18135 11986 1 13 . 1 1 96 96 GLU N N 96 118.813 118.813 119.404 -0.591 18135 11987 1 13 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.797 0.164 18135 11988 1 13 . 1 1 96 96 GLU C C 96 177.640 177.640 178.039 -0.399 18135 11989 1 13 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.150 -1.436 18135 11990 1 13 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.378 -1.240 18135 11991 1 13 . 1 1 96 96 GLU H H 96 8.111 8.111 8.216 -0.105 18135 11992 1 13 . 1 1 97 97 ALA N N 97 120.549 120.549 121.656 -1.107 18135 11993 1 13 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.992 0.130 18135 11994 1 13 . 1 1 97 97 ALA C C 97 179.126 179.126 180.453 -1.327 18135 11995 1 13 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.677 -0.644 18135 11996 1 13 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.940 0.040 18135 11997 1 13 . 1 1 97 97 ALA H H 97 7.798 7.798 7.764 0.034 18135 11998 1 13 . 1 1 98 98 CYS N N 98 115.510 115.510 117.236 -1.726 18135 11999 1 13 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.183 0.267 18135 12000 1 13 . 1 1 98 98 CYS C C 98 175.363 175.363 175.886 -0.523 18135 12001 1 13 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.894 -5.728 18135 12002 1 13 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.317 15.562 18135 12003 1 13 . 1 1 98 98 CYS H H 98 7.597 7.597 8.009 -0.412 18135 12004 1 13 . 1 1 99 99 VAL N N 99 121.713 121.713 118.388 3.325 18135 12005 1 13 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.912 -0.118 18135 12006 1 13 . 1 1 99 99 VAL C C 99 177.357 177.357 177.616 -0.259 18135 12007 1 13 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.209 -0.626 18135 12008 1 13 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.137 -0.106 18135 12009 1 13 . 1 1 99 99 VAL H H 99 7.828 7.828 7.326 0.502 18135 12010 1 13 . 1 1 100 100 ILE N N 100 122.333 122.333 117.889 4.444 18135 12011 1 13 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.749 0.175 18135 12012 1 13 . 1 1 100 100 ILE C C 100 176.827 176.827 176.662 0.165 18135 12013 1 13 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.419 -1.181 18135 12014 1 13 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.638 0.640 18135 12015 1 13 . 1 1 100 100 ILE H H 100 8.067 8.067 8.139 -0.072 18135 12016 1 13 . 1 1 101 101 GLN N N 101 121.864 121.864 117.570 4.294 18135 12017 1 13 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.286 -0.060 18135 12018 1 13 . 1 1 101 101 GLN C C 101 176.438 176.438 177.989 -1.551 18135 12019 1 13 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.184 0.136 18135 12020 1 13 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.348 -0.337 18135 12021 1 13 . 1 1 101 101 GLN H H 101 8.062 8.062 7.384 0.678 18135 12022 1 13 . 1 1 102 102 GLY N N 102 109.288 109.288 109.046 0.242 18135 12023 1 13 . 1 1 102 102 GLY C C 102 173.855 173.855 175.302 -1.447 18135 12024 1 13 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.519 -1.359 18135 12025 1 13 . 1 1 102 102 GLY H H 102 8.087 8.087 8.870 -0.783 18135 12026 1 13 . 1 1 103 103 VAL N N 103 118.932 118.932 115.904 3.028 18135 12027 1 13 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.804 0.270 18135 12028 1 13 . 1 1 103 103 VAL C C 103 176.299 176.299 175.854 0.445 18135 12029 1 13 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.568 -1.069 18135 12030 1 13 . 1 1 103 103 VAL CB C 103 32.854 32.854 30.508 2.346 18135 12031 1 13 . 1 1 103 103 VAL H H 103 8.079 8.079 7.614 0.465 18135 12032 1 13 . 1 1 104 104 GLY N N 104 112.028 112.028 109.074 2.954 18135 12033 1 13 . 1 1 104 104 GLY C C 104 173.694 173.694 173.358 0.336 18135 12034 1 13 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.097 0.305 18135 12035 1 13 . 1 1 104 104 GLY H H 104 8.446 8.446 7.699 0.747 18135 12036 1 13 . 1 1 105 105 VAL N N 105 120.439 120.439 121.191 -0.752 18135 12037 1 13 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.374 -0.186 18135 12038 1 13 . 1 1 105 105 VAL C C 105 175.963 175.963 174.650 1.313 18135 12039 1 13 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.395 0.741 18135 12040 1 13 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.863 -2.049 18135 12041 1 13 . 1 1 105 105 VAL H H 105 7.867 7.867 8.041 -0.174 18135 12042 1 13 . 1 1 106 106 THR N N 106 116.366 116.366 114.348 2.018 18135 12043 1 13 . 1 1 106 106 THR HA H 106 4.548 4.548 4.591 -0.043 18135 12044 1 13 . 1 1 106 106 THR C C 106 173.731 173.731 173.526 0.205 18135 12045 1 13 . 1 1 106 106 THR CA C 106 59.419 59.419 60.666 -1.247 18135 12046 1 13 . 1 1 106 106 THR CB C 106 79.536 79.536 70.893 8.643 18135 12047 1 13 . 1 1 106 106 THR H H 106 8.565 8.565 8.070 0.495 18135 12048 1 13 . 1 1 107 107 GLU N N 107 119.743 119.743 122.942 -3.199 18135 12049 1 13 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.764 -0.302 18135 12050 1 13 . 1 1 107 107 GLU C C 107 175.639 175.639 175.593 0.046 18135 12051 1 13 . 1 1 107 107 GLU CA C 107 55.711 55.711 55.005 0.706 18135 12052 1 13 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.951 -1.452 18135 12053 1 13 . 1 1 107 107 GLU H H 107 8.410 8.410 8.643 -0.233 18135 12054 1 13 . 1 1 108 108 THR N N 108 114.402 114.402 113.617 0.785 18135 12055 1 13 . 1 1 108 108 THR HA H 108 4.448 4.448 4.809 -0.361 18135 12056 1 13 . 1 1 108 108 THR CA C 108 60.348 60.348 58.641 1.707 18135 12057 1 13 . 1 1 108 108 THR CB C 108 68.544 68.544 68.894 -0.350 18135 12058 1 13 . 1 1 108 108 THR H H 108 8.155 8.155 8.178 -0.023 18135 12059 1 13 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.415 -0.177 18135 12060 1 13 . 1 1 109 109 PRO C C 109 178.666 178.666 177.857 0.809 18135 12061 1 13 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.438 0.938 18135 12062 1 13 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.801 0.047 18135 12063 1 13 . 1 1 110 110 LEU N N 110 118.566 118.566 119.068 -0.502 18135 12064 1 13 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.094 0.022 18135 12065 1 13 . 1 1 110 110 LEU C C 110 178.293 178.293 178.679 -0.386 18135 12066 1 13 . 1 1 110 110 LEU CA C 110 56.686 56.686 58.346 -1.660 18135 12067 1 13 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.598 0.371 18135 12068 1 13 . 1 1 110 110 LEU H H 110 8.016 8.016 7.839 0.177 18135 12069 1 13 . 1 1 111 111 MET N N 111 118.982 118.982 115.149 3.833 18135 12070 1 13 . 1 1 111 111 MET HA H 111 4.210 4.210 4.238 -0.028 18135 12071 1 13 . 1 1 111 111 MET C C 111 178.720 178.720 177.786 0.934 18135 12072 1 13 . 1 1 111 111 MET CA C 111 58.144 58.144 56.755 1.389 18135 12073 1 13 . 1 1 111 111 MET CB C 111 32.374 32.374 32.351 0.023 18135 12074 1 13 . 1 1 111 111 MET H H 111 7.705 7.705 7.764 -0.059 18135 12075 1 13 . 1 1 112 112 LYS N N 112 121.377 121.377 120.749 0.628 18135 12076 1 13 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.132 -0.024 18135 12077 1 13 . 1 1 112 112 LYS C C 112 178.000 178.000 178.788 -0.788 18135 12078 1 13 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.864 -2.559 18135 12079 1 13 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.054 0.313 18135 12080 1 13 . 1 1 112 112 LYS H H 112 8.257 8.257 7.546 0.711 18135 12081 1 13 . 1 1 113 113 GLU N N 113 119.104 119.104 119.605 -0.501 18135 12082 1 13 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.959 0.107 18135 12083 1 13 . 1 1 113 113 GLU C C 113 178.289 178.289 178.808 -0.519 18135 12084 1 13 . 1 1 113 113 GLU CA C 113 58.253 58.253 60.039 -1.786 18135 12085 1 13 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.246 -1.108 18135 12086 1 13 . 1 1 113 113 GLU H H 113 8.270 8.270 7.850 0.420 18135 12087 1 13 . 1 1 114 114 ASP N N 114 119.224 119.224 118.899 0.325 18135 12088 1 13 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.385 -0.097 18135 12089 1 13 . 1 1 114 114 ASP C C 114 178.365 178.365 178.587 -0.222 18135 12090 1 13 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.690 -1.582 18135 12091 1 13 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.227 -1.992 18135 12092 1 13 . 1 1 114 114 ASP H H 114 8.618 8.618 8.137 0.481 18135 12093 1 13 . 1 1 115 115 SER N N 115 118.195 118.195 115.955 2.240 18135 12094 1 13 . 1 1 115 115 SER HA H 115 4.200 4.200 4.146 0.054 18135 12095 1 13 . 1 1 115 115 SER C C 115 175.986 175.986 176.596 -0.610 18135 12096 1 13 . 1 1 115 115 SER CA C 115 61.588 61.588 62.113 -0.525 18135 12097 1 13 . 1 1 115 115 SER CB C 115 62.653 62.653 62.742 -0.089 18135 12098 1 13 . 1 1 115 115 SER H H 115 8.181 8.181 7.502 0.679 18135 12099 1 13 . 1 1 116 116 ILE N N 116 123.340 123.340 122.488 0.852 18135 12100 1 13 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.856 -0.230 18135 12101 1 13 . 1 1 116 116 ILE C C 116 178.367 178.367 178.152 0.215 18135 12102 1 13 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.017 1.800 18135 12103 1 13 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.556 0.862 18135 12104 1 13 . 1 1 116 116 ILE H H 116 7.773 7.773 8.430 -0.657 18135 12105 1 13 . 1 1 117 117 LEU N N 117 120.968 120.968 121.517 -0.549 18135 12106 1 13 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.845 0.060 18135 12107 1 13 . 1 1 117 117 LEU C C 117 178.746 178.746 178.478 0.268 18135 12108 1 13 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.475 -0.332 18135 12109 1 13 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.588 -0.002 18135 12110 1 13 . 1 1 117 117 LEU H H 117 8.406 8.406 8.118 0.288 18135 12111 1 13 . 1 1 118 118 ALA N N 118 120.150 120.150 121.933 -1.783 18135 12112 1 13 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.674 0.438 18135 12113 1 13 . 1 1 118 118 ALA C C 118 181.633 181.633 178.589 3.044 18135 12114 1 13 . 1 1 118 118 ALA CA C 118 55.313 55.313 54.982 0.331 18135 12115 1 13 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.251 -0.141 18135 12116 1 13 . 1 1 118 118 ALA H H 118 7.894 7.894 8.152 -0.258 18135 12117 1 13 . 1 1 119 119 VAL N N 119 118.873 118.873 118.941 -0.068 18135 12118 1 13 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.252 0.502 18135 12119 1 13 . 1 1 119 119 VAL C C 119 177.896 177.896 178.205 -0.309 18135 12120 1 13 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.346 0.835 18135 12121 1 13 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.808 1.086 18135 12122 1 13 . 1 1 119 119 VAL H H 119 7.572 7.572 7.858 -0.286 18135 12123 1 13 . 1 1 120 120 ARG N N 120 121.436 121.436 118.135 3.301 18135 12124 1 13 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.023 0.004 18135 12125 1 13 . 1 1 120 120 ARG C C 120 179.848 179.848 178.734 1.114 18135 12126 1 13 . 1 1 120 120 ARG CA C 120 61.267 61.267 58.675 2.592 18135 12127 1 13 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.162 0.533 18135 12128 1 13 . 1 1 120 120 ARG H H 120 8.629 8.629 8.348 0.281 18135 12129 1 13 . 1 1 121 121 LYS N N 121 119.589 119.589 120.071 -0.482 18135 12130 1 13 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.947 0.127 18135 12131 1 13 . 1 1 121 121 LYS C C 121 178.331 178.331 179.292 -0.961 18135 12132 1 13 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.669 0.771 18135 12133 1 13 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.185 -0.078 18135 12134 1 13 . 1 1 121 121 LYS H H 121 9.015 9.015 7.852 1.163 18135 12135 1 13 . 1 1 122 122 TYR N N 122 121.546 121.546 118.221 3.325 18135 12136 1 13 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.201 0.131 18135 12137 1 13 . 1 1 122 122 TYR C C 122 176.527 176.527 178.302 -1.775 18135 12138 1 13 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.881 1.523 18135 12139 1 13 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.371 0.353 18135 12140 1 13 . 1 1 122 122 TYR H H 122 7.473 7.473 7.461 0.012 18135 12141 1 13 . 1 1 123 123 PHE N N 123 116.026 116.026 120.181 -4.155 18135 12142 1 13 . 1 1 123 123 PHE HA H 123 3.740 3.740 4.005 -0.265 18135 12143 1 13 . 1 1 123 123 PHE C C 123 179.005 179.005 177.605 1.400 18135 12144 1 13 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.502 3.026 18135 12145 1 13 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.882 0.449 18135 12146 1 13 . 1 1 123 123 PHE H H 123 7.932 7.932 8.306 -0.374 18135 12147 1 13 . 1 1 124 124 GLN N N 124 123.043 123.043 117.921 5.122 18135 12148 1 13 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.439 0.740 18135 12149 1 13 . 1 1 124 124 GLN C C 124 178.772 178.772 178.859 -0.087 18135 12150 1 13 . 1 1 124 124 GLN CA C 124 59.316 59.316 58.991 0.325 18135 12151 1 13 . 1 1 124 124 GLN CB C 124 27.631 27.631 27.990 -0.359 18135 12152 1 13 . 1 1 124 124 GLN H H 124 8.470 8.470 8.489 -0.019 18135 12153 1 13 . 1 1 125 125 ARG N N 125 120.342 120.342 118.715 1.627 18135 12154 1 13 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.189 -0.111 18135 12155 1 13 . 1 1 125 125 ARG C C 125 180.340 180.340 179.207 1.133 18135 12156 1 13 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.614 2.683 18135 12157 1 13 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.217 0.108 18135 12158 1 13 . 1 1 125 125 ARG H H 125 8.137 8.137 8.026 0.111 18135 12159 1 13 . 1 1 126 126 ILE N N 126 121.876 121.876 122.007 -0.131 18135 12160 1 13 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.849 -0.498 18135 12161 1 13 . 1 1 126 126 ILE C C 126 176.857 176.857 178.132 -1.275 18135 12162 1 13 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.903 0.929 18135 12163 1 13 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.707 0.577 18135 12164 1 13 . 1 1 126 126 ILE H H 126 7.526 7.526 8.513 -0.987 18135 12165 1 13 . 1 1 127 127 THR N N 127 115.613 115.613 115.343 0.270 18135 12166 1 13 . 1 1 127 127 THR HA H 127 3.633 3.633 3.904 -0.271 18135 12167 1 13 . 1 1 127 127 THR C C 127 176.645 176.645 177.149 -0.504 18135 12168 1 13 . 1 1 127 127 THR CA C 127 67.294 67.294 66.075 1.219 18135 12169 1 13 . 1 1 127 127 THR CB C 127 68.871 68.871 68.744 0.127 18135 12170 1 13 . 1 1 127 127 THR H H 127 8.288 8.288 8.156 0.132 18135 12171 1 13 . 1 1 128 128 LEU N N 128 122.627 122.627 122.560 0.067 18135 12172 1 13 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.987 -0.031 18135 12173 1 13 . 1 1 128 128 LEU C C 128 178.331 178.331 177.802 0.529 18135 12174 1 13 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.859 0.229 18135 12175 1 13 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.195 0.379 18135 12176 1 13 . 1 1 128 128 LEU H H 128 8.263 8.263 7.865 0.398 18135 12177 1 13 . 1 1 129 129 TYR N N 129 120.955 120.955 120.573 0.382 18135 12178 1 13 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.398 -0.508 18135 12179 1 13 . 1 1 129 129 TYR C C 129 176.040 176.040 177.769 -1.729 18135 12180 1 13 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.319 0.174 18135 12181 1 13 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.223 0.702 18135 12182 1 13 . 1 1 129 129 TYR H H 129 7.518 7.518 8.333 -0.815 18135 12183 1 13 . 1 1 130 130 LEU N N 130 119.155 119.155 116.407 2.748 18135 12184 1 13 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.332 -0.487 18135 12185 1 13 . 1 1 130 130 LEU C C 130 177.948 177.948 178.382 -0.434 18135 12186 1 13 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.931 0.182 18135 12187 1 13 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.544 1.042 18135 12188 1 13 . 1 1 130 130 LEU H H 130 7.717 7.717 8.026 -0.309 18135 12189 1 13 . 1 1 131 131 LYS N N 131 116.832 116.832 120.005 -3.173 18135 12190 1 13 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.794 -0.386 18135 12191 1 13 . 1 1 131 131 LYS C C 131 181.265 181.265 179.705 1.560 18135 12192 1 13 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.686 0.045 18135 12193 1 13 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.018 0.654 18135 12194 1 13 . 1 1 131 131 LYS H H 131 7.493 7.493 7.881 -0.388 18135 12195 1 13 . 1 1 132 132 GLU N N 132 121.918 121.918 119.854 2.064 18135 12196 1 13 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.061 -0.217 18135 12197 1 13 . 1 1 132 132 GLU C C 132 178.377 178.377 178.501 -0.124 18135 12198 1 13 . 1 1 132 132 GLU CA C 132 58.887 58.887 59.105 -0.218 18135 12199 1 13 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.559 -0.892 18135 12200 1 13 . 1 1 132 132 GLU H H 132 8.430 8.430 8.146 0.284 18135 12201 1 13 . 1 1 133 133 LYS N N 133 116.079 116.079 116.874 -0.795 18135 12202 1 13 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.225 -0.259 18135 12203 1 13 . 1 1 133 133 LYS C C 133 175.282 175.282 175.962 -0.680 18135 12204 1 13 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.590 -0.292 18135 12205 1 13 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.700 0.298 18135 12206 1 13 . 1 1 133 133 LYS H H 133 7.390 7.390 7.346 0.044 18135 12207 1 13 . 1 1 134 134 LYS N N 134 117.759 117.759 115.919 1.840 18135 12208 1 13 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.073 -0.491 18135 12209 1 13 . 1 1 134 134 LYS C C 134 176.271 176.271 175.983 0.288 18135 12210 1 13 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.837 0.471 18135 12211 1 13 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.092 -0.290 18135 12212 1 13 . 1 1 134 134 LYS H H 134 7.716 7.716 7.579 0.137 18135 12213 1 13 . 1 1 135 135 TYR N N 135 110.598 110.598 113.728 -3.130 18135 12214 1 13 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.952 -1.075 18135 12215 1 13 . 1 1 135 135 TYR C C 135 174.148 174.148 175.242 -1.094 18135 12216 1 13 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.025 0.690 18135 12217 1 13 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.017 -0.310 18135 12218 1 13 . 1 1 135 135 TYR H H 135 8.428 8.428 8.801 -0.373 18135 12219 1 13 . 1 1 136 136 SER N N 136 113.712 113.712 115.417 -1.705 18135 12220 1 13 . 1 1 136 136 SER HA H 136 4.553 4.553 4.385 0.168 18135 12221 1 13 . 1 1 136 136 SER CA C 136 57.108 57.108 58.834 -1.726 18135 12222 1 13 . 1 1 136 136 SER CB C 136 62.500 62.500 64.091 -1.591 18135 12223 1 13 . 1 1 136 136 SER H H 136 6.744 6.744 7.388 -0.644 18135 12224 1 13 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.409 -0.244 18135 12225 1 13 . 1 1 137 137 PRO C C 137 180.675 180.675 177.285 3.390 18135 12226 1 13 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.759 0.898 18135 12227 1 13 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.763 0.220 18135 12228 1 13 . 1 1 138 138 CYS N N 138 113.914 113.914 115.789 -1.875 18135 12229 1 13 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.509 0.161 18135 12230 1 13 . 1 1 138 138 CYS C C 138 176.015 176.015 175.949 0.066 18135 12231 1 13 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.209 -3.114 18135 12232 1 13 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.146 10.633 18135 12233 1 13 . 1 1 138 138 CYS H H 138 8.580 8.580 8.490 0.090 18135 12234 1 13 . 1 1 139 139 ALA N N 139 125.290 125.290 124.683 0.607 18135 12235 1 13 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.147 0.302 18135 12236 1 13 . 1 1 139 139 ALA C C 139 180.149 180.149 179.220 0.929 18135 12237 1 13 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.949 -0.171 18135 12238 1 13 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.094 0.824 18135 12239 1 13 . 1 1 139 139 ALA H H 139 8.087 8.087 8.044 0.043 18135 12240 1 13 . 1 1 140 140 TRP N N 140 116.599 116.599 118.414 -1.815 18135 12241 1 13 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.357 0.245 18135 12242 1 13 . 1 1 140 140 TRP C C 140 179.137 179.137 178.745 0.392 18135 12243 1 13 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.468 -0.934 18135 12244 1 13 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.336 -0.078 18135 12245 1 13 . 1 1 140 140 TRP H H 140 8.505 8.505 7.784 0.721 18135 12246 1 13 . 1 1 141 141 GLU N N 141 121.578 121.578 119.657 1.921 18135 12247 1 13 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.322 0.901 18135 12248 1 13 . 1 1 141 141 GLU C C 141 177.886 177.886 178.952 -1.066 18135 12249 1 13 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.898 -1.992 18135 12250 1 13 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.415 -0.698 18135 12251 1 13 . 1 1 141 141 GLU H H 141 8.182 8.182 8.062 0.120 18135 12252 1 13 . 1 1 142 142 VAL N N 142 121.202 121.202 120.368 0.834 18135 12253 1 13 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.623 0.007 18135 12254 1 13 . 1 1 142 142 VAL C C 142 180.246 180.246 178.507 1.739 18135 12255 1 13 . 1 1 142 142 VAL CA C 142 66.983 66.983 67.037 -0.054 18135 12256 1 13 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.861 -0.039 18135 12257 1 13 . 1 1 142 142 VAL H H 142 8.623 8.623 8.070 0.553 18135 12258 1 13 . 1 1 143 143 VAL N N 143 120.119 120.119 119.521 0.598 18135 12259 1 13 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.651 -0.354 18135 12260 1 13 . 1 1 143 143 VAL C C 143 176.407 176.407 178.115 -1.708 18135 12261 1 13 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.924 1.054 18135 12262 1 13 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.605 0.051 18135 12263 1 13 . 1 1 143 143 VAL H H 143 8.323 8.323 8.458 -0.135 18135 12264 1 13 . 1 1 144 144 ARG N N 144 124.102 124.102 119.691 4.411 18135 12265 1 13 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.058 -0.361 18135 12266 1 13 . 1 1 144 144 ARG C C 144 178.127 178.127 178.272 -0.145 18135 12267 1 13 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.545 1.456 18135 12268 1 13 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.853 0.083 18135 12269 1 13 . 1 1 144 144 ARG H H 144 9.619 9.619 8.350 1.269 18135 12270 1 13 . 1 1 145 145 ALA N N 145 119.431 119.431 121.153 -1.722 18135 12271 1 13 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.029 -0.178 18135 12272 1 13 . 1 1 145 145 ALA C C 145 180.763 180.763 179.897 0.866 18135 12273 1 13 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.371 0.004 18135 12274 1 13 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.097 0.088 18135 12275 1 13 . 1 1 145 145 ALA H H 145 8.867 8.867 8.135 0.732 18135 12276 1 13 . 1 1 146 146 GLU N N 146 121.815 121.815 119.004 2.811 18135 12277 1 13 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.240 -0.029 18135 12278 1 13 . 1 1 146 146 GLU C C 146 177.296 177.296 179.030 -1.734 18135 12279 1 13 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.228 -0.849 18135 12280 1 13 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.607 -1.473 18135 12281 1 13 . 1 1 146 146 GLU H H 146 8.136 8.136 7.996 0.140 18135 12282 1 13 . 1 1 147 147 ILE N N 147 119.542 119.542 120.881 -1.339 18135 12283 1 13 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.804 0.166 18135 12284 1 13 . 1 1 147 147 ILE C C 147 178.283 178.283 178.378 -0.095 18135 12285 1 13 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.875 -3.622 18135 12286 1 13 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.584 -2.245 18135 12287 1 13 . 1 1 147 147 ILE H H 147 8.736 8.736 8.227 0.509 18135 12288 1 13 . 1 1 148 148 MET N N 148 119.501 119.501 117.992 1.509 18135 12289 1 13 . 1 1 148 148 MET HA H 148 3.801 3.801 4.150 -0.349 18135 12290 1 13 . 1 1 148 148 MET C C 148 178.210 178.210 178.729 -0.519 18135 12291 1 13 . 1 1 148 148 MET CA C 148 60.184 60.184 59.857 0.327 18135 12292 1 13 . 1 1 148 148 MET CB C 148 32.914 32.914 31.954 0.960 18135 12293 1 13 . 1 1 148 148 MET H H 148 8.440 8.440 8.493 -0.053 18135 12294 1 13 . 1 1 149 149 ARG N N 149 119.734 119.734 119.783 -0.049 18135 12295 1 13 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.131 -0.216 18135 12296 1 13 . 1 1 149 149 ARG C C 149 178.978 178.978 178.994 -0.016 18135 12297 1 13 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.243 0.619 18135 12298 1 13 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.802 0.478 18135 12299 1 13 . 1 1 149 149 ARG H H 149 7.648 7.648 8.444 -0.796 18135 12300 1 13 . 1 1 150 150 SER N N 150 118.109 118.109 115.037 3.072 18135 12301 1 13 . 1 1 150 150 SER HA H 150 3.339 3.339 3.265 0.074 18135 12302 1 13 . 1 1 150 150 SER C C 150 177.292 177.292 176.453 0.839 18135 12303 1 13 . 1 1 150 150 SER CA C 150 61.316 61.316 61.099 0.217 18135 12304 1 13 . 1 1 150 150 SER CB C 150 60.288 60.288 62.536 -2.248 18135 12305 1 13 . 1 1 150 150 SER H H 150 9.194 9.194 8.490 0.704 18135 12306 1 13 . 1 1 151 151 PHE N N 151 125.265 125.265 123.595 1.670 18135 12307 1 13 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.333 -0.297 18135 12308 1 13 . 1 1 151 151 PHE C C 151 178.696 178.696 177.141 1.555 18135 12309 1 13 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.047 2.373 18135 12310 1 13 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.834 0.053 18135 12311 1 13 . 1 1 151 151 PHE H H 151 9.455 9.455 8.428 1.027 18135 12312 1 13 . 1 1 152 152 SER N N 152 115.963 115.963 115.305 0.658 18135 12313 1 13 . 1 1 152 152 SER HA H 152 3.880 3.880 3.699 0.181 18135 12314 1 13 . 1 1 152 152 SER C C 152 175.858 175.858 176.894 -1.036 18135 12315 1 13 . 1 1 152 152 SER CA C 152 62.388 62.388 61.671 0.717 18135 12316 1 13 . 1 1 152 152 SER CB C 152 62.519 62.519 63.090 -0.570 18135 12317 1 13 . 1 1 152 152 SER H H 152 7.839 7.839 8.410 -0.571 18135 12318 1 13 . 1 1 153 153 LEU N N 153 121.365 121.365 121.997 -0.632 18135 12319 1 13 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.209 -0.128 18135 12320 1 13 . 1 1 153 153 LEU C C 153 179.515 179.515 177.643 1.872 18135 12321 1 13 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.633 0.249 18135 12322 1 13 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.524 0.818 18135 12323 1 13 . 1 1 153 153 LEU H H 153 7.775 7.775 8.114 -0.339 18135 12324 1 13 . 1 1 154 154 SER N N 154 113.950 113.950 112.580 1.370 18135 12325 1 13 . 1 1 154 154 SER HA H 154 3.781 3.781 4.503 -0.722 18135 12326 1 13 . 1 1 154 154 SER C C 154 174.312 174.312 176.464 -2.152 18135 12327 1 13 . 1 1 154 154 SER CA C 154 61.366 61.366 61.126 0.240 18135 12328 1 13 . 1 1 154 154 SER CB C 154 63.242 63.242 63.789 -0.547 18135 12329 1 13 . 1 1 154 154 SER H H 154 7.874 7.874 8.346 -0.472 18135 12330 1 13 . 1 1 155 155 THR N N 155 109.346 109.346 114.368 -5.022 18135 12331 1 13 . 1 1 155 155 THR HA H 155 4.060 4.060 4.282 -0.222 18135 12332 1 13 . 1 1 155 155 THR C C 155 174.798 174.798 175.916 -1.118 18135 12333 1 13 . 1 1 155 155 THR CA C 155 62.275 62.275 64.210 -1.935 18135 12334 1 13 . 1 1 155 155 THR CB C 155 69.342 69.342 69.508 -0.166 18135 12335 1 13 . 1 1 155 155 THR H H 155 7.176 7.176 7.897 -0.721 18135 12336 1 13 . 1 1 156 156 ASN N N 156 119.785 119.785 120.985 -1.200 18135 12337 1 13 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.745 -0.218 18135 12338 1 13 . 1 1 156 156 ASN C C 156 175.528 175.528 174.716 0.812 18135 12339 1 13 . 1 1 156 156 ASN CA C 156 53.937 53.937 53.181 0.756 18135 12340 1 13 . 1 1 156 156 ASN CB C 156 38.338 38.338 36.845 1.493 18135 12341 1 13 . 1 1 156 156 ASN H H 156 7.749 7.749 7.953 -0.204 18135 12342 1 13 . 1 1 157 157 LEU N N 157 120.552 120.552 121.136 -0.584 18135 12343 1 13 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.532 -0.277 18135 12344 1 13 . 1 1 157 157 LEU C C 157 174.702 174.702 178.245 -3.543 18135 12345 1 13 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.206 -0.532 18135 12346 1 13 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.254 0.097 18135 12347 1 13 . 1 1 157 157 LEU H H 157 8.097 8.097 8.271 -0.174 18135 12348 1 13 . 1 1 158 158 GLN N N 158 119.860 119.860 118.219 1.641 18135 12349 1 13 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.300 -0.120 18135 12350 1 13 . 1 1 158 158 GLN C C 158 176.434 176.434 176.247 0.187 18135 12351 1 13 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.507 1.391 18135 12352 1 13 . 1 1 158 158 GLN CB C 158 29.010 29.010 28.963 0.047 18135 12353 1 13 . 1 1 158 158 GLN H H 158 8.230 8.230 8.276 -0.046 18135 12354 1 13 . 1 1 159 159 GLU N N 159 120.461 120.461 116.837 3.624 18135 12355 1 13 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.037 0.182 18135 12356 1 13 . 1 1 159 159 GLU C C 159 175.251 175.251 175.449 -0.198 18135 12357 1 13 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.533 -0.838 18135 12358 1 13 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.789 0.192 18135 12359 1 13 . 1 1 159 159 GLU H H 159 8.300 8.300 8.915 -0.615 18135 12360 1 13 . 1 1 160 160 SER N N 160 115.719 115.719 111.980 3.739 18135 12361 1 13 . 1 1 160 160 SER HA H 160 4.372 4.372 4.555 -0.183 18135 12362 1 13 . 1 1 160 160 SER C C 160 174.188 174.188 173.958 0.230 18135 12363 1 13 . 1 1 160 160 SER CA C 160 58.481 58.481 58.290 0.191 18135 12364 1 13 . 1 1 160 160 SER CB C 160 63.731 63.731 63.719 0.012 18135 12365 1 13 . 1 1 160 160 SER H H 160 8.113 8.113 8.366 -0.253 18135 12366 1 13 . 1 1 161 161 LEU N N 161 123.794 123.794 120.842 2.952 18135 12367 1 13 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.327 -0.047 18135 12368 1 13 . 1 1 161 161 LEU C C 161 177.293 177.293 177.094 0.199 18135 12369 1 13 . 1 1 161 161 LEU CA C 161 55.190 55.190 54.836 0.354 18135 12370 1 13 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.682 -0.398 18135 12371 1 13 . 1 1 161 161 LEU H H 161 8.032 8.032 7.713 0.319 18135 12372 1 13 . 1 1 162 162 ARG N N 162 120.715 120.715 118.090 2.625 18135 12373 1 13 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.040 0.129 18135 12374 1 13 . 1 1 162 162 ARG C C 162 176.288 176.288 174.894 1.394 18135 12375 1 13 . 1 1 162 162 ARG CA C 162 57.046 57.046 56.888 0.158 18135 12376 1 13 . 1 1 162 162 ARG CB C 162 30.935 30.935 28.648 2.288 18135 12377 1 13 . 1 1 162 162 ARG H H 162 8.094 8.094 8.548 -0.454 18135 12378 1 13 . 1 1 163 163 SER N N 163 116.670 116.670 114.340 2.330 18135 12379 1 13 . 1 1 163 163 SER HA H 163 4.372 4.372 4.624 -0.252 18135 12380 1 13 . 1 1 163 163 SER C C 163 174.184 174.184 175.285 -1.101 18135 12381 1 13 . 1 1 163 163 SER CA C 163 58.481 58.481 56.849 1.632 18135 12382 1 13 . 1 1 163 163 SER CB C 163 63.745 63.745 65.890 -2.145 18135 12383 1 13 . 1 1 163 163 SER H H 163 8.191 8.191 7.885 0.306 18135 12384 1 13 . 1 1 164 164 LYS N N 164 123.100 123.100 120.948 2.152 18135 12385 1 13 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.197 0.080 18135 12386 1 13 . 1 1 164 164 LYS C C 164 175.617 175.617 176.473 -0.856 18135 12387 1 13 . 1 1 164 164 LYS CA C 164 56.313 56.313 58.076 -1.763 18135 12388 1 13 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.419 0.547 18135 12389 1 13 . 1 1 164 164 LYS H H 164 8.251 8.251 8.530 -0.279 18135 12390 1 14 . 1 1 2 2 ASP N N 2 125.691 125.691 120.805 4.886 18135 12391 1 14 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.547 0.163 18135 12392 1 14 . 1 1 2 2 ASP C C 2 174.758 174.758 175.955 -1.197 18135 12393 1 14 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.333 -1.490 18135 12394 1 14 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.148 -1.827 18135 12395 1 14 . 1 1 2 2 ASP H H 2 8.773 8.773 8.364 0.409 18135 12396 1 14 . 1 1 3 3 LEU N N 3 123.957 123.957 116.241 7.716 18135 12397 1 14 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.324 0.077 18135 12398 1 14 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.444 1.209 18135 12399 1 14 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.779 -0.224 18135 12400 1 14 . 1 1 3 3 LEU H H 3 8.164 8.164 7.317 0.847 18135 12401 1 14 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.644 -0.330 18135 12402 1 14 . 1 1 4 4 PRO C C 4 176.213 176.213 176.657 -0.444 18135 12403 1 14 . 1 1 4 4 PRO CA C 4 63.908 63.908 62.882 1.026 18135 12404 1 14 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.387 1.507 18135 12405 1 14 . 1 1 5 5 GLN N N 5 121.621 121.621 120.642 0.979 18135 12406 1 14 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.131 0.095 18135 12407 1 14 . 1 1 5 5 GLN C C 5 176.995 176.995 177.356 -0.361 18135 12408 1 14 . 1 1 5 5 GLN CA C 5 57.710 57.710 58.611 -0.901 18135 12409 1 14 . 1 1 5 5 GLN CB C 5 28.951 28.951 28.596 0.355 18135 12410 1 14 . 1 1 5 5 GLN H H 5 8.767 8.767 8.699 0.068 18135 12411 1 14 . 1 1 6 6 THR N N 6 111.419 111.419 109.588 1.831 18135 12412 1 14 . 1 1 6 6 THR HA H 6 4.135 4.135 4.402 -0.267 18135 12413 1 14 . 1 1 6 6 THR C C 6 174.695 174.695 174.412 0.283 18135 12414 1 14 . 1 1 6 6 THR CA C 6 62.661 62.661 62.753 -0.092 18135 12415 1 14 . 1 1 6 6 THR CB C 6 69.365 69.365 69.147 0.218 18135 12416 1 14 . 1 1 6 6 THR H H 6 7.865 7.865 8.251 -0.386 18135 12417 1 14 . 1 1 7 7 HIS N N 7 119.137 119.137 117.419 1.718 18135 12418 1 14 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.573 0.012 18135 12419 1 14 . 1 1 7 7 HIS C C 7 174.980 174.980 175.430 -0.450 18135 12420 1 14 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.664 -2.660 18135 12421 1 14 . 1 1 7 7 HIS CB C 7 28.163 28.163 30.441 -2.277 18135 12422 1 14 . 1 1 7 7 HIS H H 7 8.567 8.567 8.567 0.000 18135 12423 1 14 . 1 1 8 8 SER N N 8 115.796 115.796 113.890 1.906 18135 12424 1 14 . 1 1 8 8 SER HA H 8 4.363 4.363 4.438 -0.075 18135 12425 1 14 . 1 1 8 8 SER C C 8 175.312 175.312 175.723 -0.411 18135 12426 1 14 . 1 1 8 8 SER CA C 8 58.969 58.969 60.610 -1.641 18135 12427 1 14 . 1 1 8 8 SER CB C 8 63.439 63.439 64.199 -0.760 18135 12428 1 14 . 1 1 8 8 SER H H 8 8.180 8.180 7.879 0.301 18135 12429 1 14 . 1 1 9 9 LEU N N 9 123.844 123.844 119.088 4.756 18135 12430 1 14 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.658 -0.503 18135 12431 1 14 . 1 1 9 9 LEU C C 9 178.568 178.568 178.209 0.359 18135 12432 1 14 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.536 0.430 18135 12433 1 14 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.500 -0.704 18135 12434 1 14 . 1 1 9 9 LEU H H 9 8.404 8.404 7.698 0.706 18135 12435 1 14 . 1 1 10 10 GLY N N 10 107.582 107.582 107.523 0.059 18135 12436 1 14 . 1 1 10 10 GLY C C 10 174.586 174.586 175.663 -1.077 18135 12437 1 14 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.118 -0.213 18135 12438 1 14 . 1 1 10 10 GLY H H 10 8.438 8.438 8.378 0.060 18135 12439 1 14 . 1 1 11 11 SER N N 11 118.806 118.806 117.556 1.250 18135 12440 1 14 . 1 1 11 11 SER HA H 11 4.156 4.156 4.087 0.069 18135 12441 1 14 . 1 1 11 11 SER C C 11 175.749 175.749 176.230 -0.481 18135 12442 1 14 . 1 1 11 11 SER CA C 11 61.299 61.299 61.917 -0.618 18135 12443 1 14 . 1 1 11 11 SER CB C 11 62.653 62.653 63.063 -0.410 18135 12444 1 14 . 1 1 11 11 SER H H 11 8.249 8.249 8.220 0.029 18135 12445 1 14 . 1 1 12 12 ARG N N 12 121.986 121.986 121.463 0.523 18135 12446 1 14 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.118 -0.164 18135 12447 1 14 . 1 1 12 12 ARG C C 12 178.283 178.283 178.561 -0.278 18135 12448 1 14 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.905 0.925 18135 12449 1 14 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.200 -0.616 18135 12450 1 14 . 1 1 12 12 ARG H H 12 8.027 8.027 8.234 -0.207 18135 12451 1 14 . 1 1 13 13 ARG N N 13 119.432 119.432 118.479 0.953 18135 12452 1 14 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.081 -0.242 18135 12453 1 14 . 1 1 13 13 ARG C C 13 178.480 178.480 178.406 0.074 18135 12454 1 14 . 1 1 13 13 ARG CA C 13 60.491 60.491 60.183 0.308 18135 12455 1 14 . 1 1 13 13 ARG CB C 13 30.082 30.082 30.172 -0.090 18135 12456 1 14 . 1 1 13 13 ARG H H 13 8.437 8.437 7.952 0.485 18135 12457 1 14 . 1 1 14 14 THR N N 14 116.879 116.879 117.060 -0.181 18135 12458 1 14 . 1 1 14 14 THR HA H 14 3.532 3.532 4.138 -0.606 18135 12459 1 14 . 1 1 14 14 THR C C 14 175.584 175.584 176.778 -1.194 18135 12460 1 14 . 1 1 14 14 THR CA C 14 68.036 68.036 67.115 0.921 18135 12461 1 14 . 1 1 14 14 THR CB C 14 67.969 67.969 68.568 -0.599 18135 12462 1 14 . 1 1 14 14 THR H H 14 7.957 7.957 8.210 -0.253 18135 12463 1 14 . 1 1 15 15 LEU N N 15 120.252 120.252 121.938 -1.686 18135 12464 1 14 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.042 -0.096 18135 12465 1 14 . 1 1 15 15 LEU C C 15 178.652 178.652 178.792 -0.140 18135 12466 1 14 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.373 -0.285 18135 12467 1 14 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.717 -0.163 18135 12468 1 14 . 1 1 15 15 LEU H H 15 7.550 7.550 8.211 -0.661 18135 12469 1 14 . 1 1 16 16 MET N N 16 118.788 118.788 117.449 1.339 18135 12470 1 14 . 1 1 16 16 MET HA H 16 4.023 4.023 3.933 0.090 18135 12471 1 14 . 1 1 16 16 MET C C 16 178.718 178.718 178.713 0.005 18135 12472 1 14 . 1 1 16 16 MET CA C 16 58.513 58.513 59.208 -0.695 18135 12473 1 14 . 1 1 16 16 MET CB C 16 32.150 32.150 32.336 -0.186 18135 12474 1 14 . 1 1 16 16 MET H H 16 7.985 7.985 8.120 -0.135 18135 12475 1 14 . 1 1 17 17 LEU N N 17 120.644 120.644 119.513 1.131 18135 12476 1 14 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.981 -0.009 18135 12477 1 14 . 1 1 17 17 LEU C C 17 178.238 178.238 179.157 -0.919 18135 12478 1 14 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.550 -0.823 18135 12479 1 14 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.401 0.734 18135 12480 1 14 . 1 1 17 17 LEU H H 17 7.829 7.829 8.061 -0.232 18135 12481 1 14 . 1 1 18 18 LEU N N 18 118.280 118.280 119.006 -0.726 18135 12482 1 14 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.803 -0.297 18135 12483 1 14 . 1 1 18 18 LEU C C 18 175.739 175.739 178.571 -2.832 18135 12484 1 14 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.335 0.321 18135 12485 1 14 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.292 0.950 18135 12486 1 14 . 1 1 18 18 LEU H H 18 7.499 7.499 8.378 -0.879 18135 12487 1 14 . 1 1 19 19 ALA N N 19 121.961 121.961 120.682 1.279 18135 12488 1 14 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.158 -0.321 18135 12489 1 14 . 1 1 19 19 ALA C C 19 180.736 180.736 178.667 2.069 18135 12490 1 14 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.116 0.950 18135 12491 1 14 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.219 -1.142 18135 12492 1 14 . 1 1 19 19 ALA H H 19 7.950 7.950 7.770 0.180 18135 12493 1 14 . 1 1 20 20 GLN N N 20 118.605 118.605 116.030 2.575 18135 12494 1 14 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.189 -0.254 18135 12495 1 14 . 1 1 20 20 GLN C C 20 176.945 176.945 177.031 -0.086 18135 12496 1 14 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.382 0.633 18135 12497 1 14 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.230 -0.755 18135 12498 1 14 . 1 1 20 20 GLN H H 20 7.958 7.958 8.026 -0.068 18135 12499 1 14 . 1 1 21 21 MET N N 21 116.693 116.693 116.679 0.014 18135 12500 1 14 . 1 1 21 21 MET HA H 21 3.861 3.861 4.555 -0.694 18135 12501 1 14 . 1 1 21 21 MET C C 21 174.671 174.671 175.144 -0.473 18135 12502 1 14 . 1 1 21 21 MET CA C 21 57.111 57.111 57.111 0.000 18135 12503 1 14 . 1 1 21 21 MET CB C 21 34.073 34.073 33.924 0.149 18135 12504 1 14 . 1 1 21 21 MET H H 21 7.420 7.420 7.796 -0.376 18135 12505 1 14 . 1 1 22 22 ARG N N 22 115.451 115.451 120.155 -4.704 18135 12506 1 14 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.994 -0.141 18135 12507 1 14 . 1 1 22 22 ARG C C 22 175.950 175.950 174.994 0.956 18135 12508 1 14 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.356 3.096 18135 12509 1 14 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.438 1.076 18135 12510 1 14 . 1 1 22 22 ARG H H 22 6.484 6.484 7.196 -0.712 18135 12511 1 14 . 1 1 23 23 LYS N N 23 128.593 128.593 123.179 5.414 18135 12512 1 14 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.600 -0.115 18135 12513 1 14 . 1 1 23 23 LYS C C 23 176.643 176.643 175.423 1.220 18135 12514 1 14 . 1 1 23 23 LYS CA C 23 57.287 57.287 56.151 1.135 18135 12515 1 14 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.173 4.088 18135 12516 1 14 . 1 1 23 23 LYS H H 23 10.212 10.212 8.733 1.479 18135 12517 1 14 . 1 1 24 24 ILE N N 24 118.605 118.605 121.965 -3.360 18135 12518 1 14 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.375 0.109 18135 12519 1 14 . 1 1 24 24 ILE C C 24 173.878 173.878 174.463 -0.585 18135 12520 1 14 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.433 -0.836 18135 12521 1 14 . 1 1 24 24 ILE CB C 24 41.456 41.456 40.735 0.721 18135 12522 1 14 . 1 1 24 24 ILE H H 24 8.465 8.465 8.570 -0.105 18135 12523 1 14 . 1 1 25 25 SER N N 25 113.658 113.658 118.098 -4.440 18135 12524 1 14 . 1 1 25 25 SER HA H 25 4.481 4.481 4.949 -0.468 18135 12525 1 14 . 1 1 25 25 SER C C 25 176.359 176.359 175.726 0.633 18135 12526 1 14 . 1 1 25 25 SER CA C 25 56.975 56.975 57.376 -0.401 18135 12527 1 14 . 1 1 25 25 SER CB C 25 64.759 64.759 63.934 0.825 18135 12528 1 14 . 1 1 25 25 SER H H 25 8.104 8.104 8.533 -0.429 18135 12529 1 14 . 1 1 26 26 LEU N N 26 127.566 127.566 125.573 1.993 18135 12530 1 14 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.191 -0.314 18135 12531 1 14 . 1 1 26 26 LEU C C 26 178.946 178.946 176.768 2.178 18135 12532 1 14 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.266 0.412 18135 12533 1 14 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.744 -0.025 18135 12534 1 14 . 1 1 26 26 LEU H H 26 8.802 8.802 9.050 -0.247 18135 12535 1 14 . 1 1 27 27 PHE N N 27 117.143 117.143 116.450 0.693 18135 12536 1 14 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.635 -0.397 18135 12537 1 14 . 1 1 27 27 PHE C C 27 177.067 177.067 176.740 0.327 18135 12538 1 14 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.555 1.535 18135 12539 1 14 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.556 -0.294 18135 12540 1 14 . 1 1 27 27 PHE H H 27 7.986 7.986 7.922 0.064 18135 12541 1 14 . 1 1 28 28 SER N N 28 115.200 115.200 116.400 -1.200 18135 12542 1 14 . 1 1 28 28 SER HA H 28 4.505 4.505 4.405 0.100 18135 12543 1 14 . 1 1 28 28 SER C C 28 174.533 174.533 174.830 -0.297 18135 12544 1 14 . 1 1 28 28 SER CA C 28 59.447 59.447 60.754 -1.307 18135 12545 1 14 . 1 1 28 28 SER CB C 28 63.790 63.790 63.672 0.118 18135 12546 1 14 . 1 1 28 28 SER H H 28 7.929 7.929 8.136 -0.207 18135 12547 1 14 . 1 1 29 29 CYS N N 29 119.870 119.870 120.330 -0.460 18135 12548 1 14 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.709 0.373 18135 12549 1 14 . 1 1 29 29 CYS C C 29 176.475 176.475 175.238 1.237 18135 12550 1 14 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.246 -4.816 18135 12551 1 14 . 1 1 29 29 CYS CB C 29 37.242 37.242 26.900 10.342 18135 12552 1 14 . 1 1 29 29 CYS H H 29 7.865 7.865 7.799 0.066 18135 12553 1 14 . 1 1 30 30 LEU N N 30 122.259 122.259 123.966 -1.707 18135 12554 1 14 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.318 -0.357 18135 12555 1 14 . 1 1 30 30 LEU C C 30 179.774 179.774 177.182 2.592 18135 12556 1 14 . 1 1 30 30 LEU CA C 30 58.303 58.303 55.331 2.972 18135 12557 1 14 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.005 -0.429 18135 12558 1 14 . 1 1 30 30 LEU H H 30 7.812 7.812 8.475 -0.663 18135 12559 1 14 . 1 1 31 31 LYS N N 31 117.731 117.731 112.375 5.356 18135 12560 1 14 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.272 0.418 18135 12561 1 14 . 1 1 31 31 LYS C C 31 176.692 176.692 175.982 0.710 18135 12562 1 14 . 1 1 31 31 LYS CA C 31 54.077 54.077 55.939 -1.862 18135 12563 1 14 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.847 -0.260 18135 12564 1 14 . 1 1 31 31 LYS H H 31 8.597 8.597 8.136 0.461 18135 12565 1 14 . 1 1 32 32 ASP N N 32 117.841 117.841 118.975 -1.134 18135 12566 1 14 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.750 -0.056 18135 12567 1 14 . 1 1 32 32 ASP C C 32 175.505 175.505 176.070 -0.565 18135 12568 1 14 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.371 -0.283 18135 12569 1 14 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.201 -0.393 18135 12570 1 14 . 1 1 32 32 ASP H H 32 7.808 7.808 7.645 0.163 18135 12571 1 14 . 1 1 33 33 ARG N N 33 120.876 120.876 120.739 0.137 18135 12572 1 14 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.154 -0.113 18135 12573 1 14 . 1 1 33 33 ARG C C 33 175.286 175.286 175.943 -0.657 18135 12574 1 14 . 1 1 33 33 ARG CA C 33 58.083 58.083 55.788 2.295 18135 12575 1 14 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.743 -0.730 18135 12576 1 14 . 1 1 33 33 ARG H H 33 7.378 7.378 7.492 -0.114 18135 12577 1 14 . 1 1 34 34 HIS N N 34 120.555 120.555 115.830 4.725 18135 12578 1 14 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.271 -0.059 18135 12579 1 14 . 1 1 34 34 HIS C C 34 170.494 170.494 173.665 -3.171 18135 12580 1 14 . 1 1 34 34 HIS CA C 34 54.607 54.607 56.070 -1.463 18135 12581 1 14 . 1 1 34 34 HIS CB C 34 31.488 31.488 29.015 2.473 18135 12582 1 14 . 1 1 34 34 HIS H H 34 7.974 7.974 8.614 -0.640 18135 12583 1 14 . 1 1 35 35 ASP N N 35 125.061 125.061 118.970 6.091 18135 12584 1 14 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.377 0.261 18135 12585 1 14 . 1 1 35 35 ASP C C 35 175.943 175.943 176.702 -0.759 18135 12586 1 14 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.081 -1.712 18135 12587 1 14 . 1 1 35 35 ASP CB C 35 40.362 40.362 40.792 -0.430 18135 12588 1 14 . 1 1 35 35 ASP H H 35 7.805 7.805 7.750 0.055 18135 12589 1 14 . 1 1 36 36 PHE N N 36 122.860 122.860 119.503 3.357 18135 12590 1 14 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.323 0.002 18135 12591 1 14 . 1 1 36 36 PHE C C 36 176.643 176.643 176.945 -0.302 18135 12592 1 14 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.604 1.035 18135 12593 1 14 . 1 1 36 36 PHE CB C 36 40.691 40.691 38.914 1.777 18135 12594 1 14 . 1 1 36 36 PHE H H 36 8.973 8.973 7.329 1.644 18135 12595 1 14 . 1 1 37 37 GLY N N 37 111.856 111.856 108.192 3.664 18135 12596 1 14 . 1 1 37 37 GLY C C 37 175.185 175.185 174.263 0.922 18135 12597 1 14 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.984 3.159 18135 12598 1 14 . 1 1 37 37 GLY H H 37 8.727 8.727 7.957 0.770 18135 12599 1 14 . 1 1 38 38 PHE N N 38 123.178 123.178 121.692 1.486 18135 12600 1 14 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.807 -0.893 18135 12601 1 14 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.615 2.189 18135 12602 1 14 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.038 0.619 18135 12603 1 14 . 1 1 38 38 PHE H H 38 9.169 9.169 7.052 2.117 18135 12604 1 14 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.496 0.033 18135 12605 1 14 . 1 1 39 39 PRO C C 39 174.634 174.634 177.153 -2.519 18135 12606 1 14 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.729 -1.186 18135 12607 1 14 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.396 -1.692 18135 12608 1 14 . 1 1 40 40 GLN N N 40 123.608 123.608 122.796 0.812 18135 12609 1 14 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.237 -0.618 18135 12610 1 14 . 1 1 40 40 GLN C C 40 176.958 176.958 177.600 -0.642 18135 12611 1 14 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.149 -1.076 18135 12612 1 14 . 1 1 40 40 GLN CB C 40 28.817 28.817 28.051 0.766 18135 12613 1 14 . 1 1 40 40 GLN H H 40 7.966 7.966 8.346 -0.380 18135 12614 1 14 . 1 1 41 41 GLU N N 41 119.446 119.446 120.252 -0.806 18135 12615 1 14 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.143 -0.006 18135 12616 1 14 . 1 1 41 41 GLU C C 41 177.346 177.346 178.008 -0.662 18135 12617 1 14 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.033 -1.105 18135 12618 1 14 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.216 -1.383 18135 12619 1 14 . 1 1 41 41 GLU H H 41 9.044 9.044 8.720 0.324 18135 12620 1 14 . 1 1 42 42 GLU N N 42 117.196 117.196 117.727 -0.531 18135 12621 1 14 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.280 -0.217 18135 12622 1 14 . 1 1 42 42 GLU C C 42 174.886 174.886 177.961 -3.075 18135 12623 1 14 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.886 -1.502 18135 12624 1 14 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.835 -2.277 18135 12625 1 14 . 1 1 42 42 GLU H H 42 7.646 7.646 7.904 -0.258 18135 12626 1 14 . 1 1 43 43 PHE N N 43 115.527 115.527 121.809 -6.282 18135 12627 1 14 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.601 -0.115 18135 12628 1 14 . 1 1 43 43 PHE C C 43 175.615 175.615 175.922 -0.307 18135 12629 1 14 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.743 -1.195 18135 12630 1 14 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.286 -0.393 18135 12631 1 14 . 1 1 43 43 PHE H H 43 7.601 7.601 8.303 -0.702 18135 12632 1 14 . 1 1 44 44 GLY N N 44 107.243 107.243 108.686 -1.443 18135 12633 1 14 . 1 1 44 44 GLY C C 44 174.032 174.032 174.260 -0.228 18135 12634 1 14 . 1 1 44 44 GLY CA C 44 45.612 45.612 46.233 -0.621 18135 12635 1 14 . 1 1 44 44 GLY H H 44 7.733 7.733 7.825 -0.092 18135 12636 1 14 . 1 1 45 45 ASN N N 45 117.599 117.599 120.760 -3.161 18135 12637 1 14 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.753 -0.202 18135 12638 1 14 . 1 1 45 45 ASN C C 45 175.894 175.894 174.969 0.925 18135 12639 1 14 . 1 1 45 45 ASN CA C 45 53.849 53.849 53.004 0.845 18135 12640 1 14 . 1 1 45 45 ASN CB C 45 38.419 38.419 40.231 -1.812 18135 12641 1 14 . 1 1 45 45 ASN H H 45 8.343 8.343 7.740 0.603 18135 12642 1 14 . 1 1 46 46 GLN N N 46 118.916 118.916 118.634 0.282 18135 12643 1 14 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.381 -0.299 18135 12644 1 14 . 1 1 46 46 GLN C C 46 175.851 175.851 176.960 -1.109 18135 12645 1 14 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.506 1.140 18135 12646 1 14 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.937 0.507 18135 12647 1 14 . 1 1 46 46 GLN H H 46 8.652 8.652 8.618 0.034 18135 12648 1 14 . 1 1 47 47 PHE N N 47 119.511 119.511 119.284 0.227 18135 12649 1 14 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.383 0.179 18135 12650 1 14 . 1 1 47 47 PHE C C 47 176.258 176.258 175.690 0.568 18135 12651 1 14 . 1 1 47 47 PHE CA C 47 57.920 57.920 59.597 -1.677 18135 12652 1 14 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.569 0.289 18135 12653 1 14 . 1 1 47 47 PHE H H 47 7.904 7.904 7.977 -0.073 18135 12654 1 14 . 1 1 48 48 GLN N N 48 120.127 120.127 117.684 2.443 18135 12655 1 14 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.595 -0.220 18135 12656 1 14 . 1 1 48 48 GLN C C 48 181.265 181.265 175.206 6.059 18135 12657 1 14 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.679 0.897 18135 12658 1 14 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.460 -0.993 18135 12659 1 14 . 1 1 48 48 GLN H H 48 8.255 8.255 7.553 0.702 18135 12660 1 14 . 1 1 49 49 LYS N N 49 121.777 121.777 120.860 0.917 18135 12661 1 14 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.108 -0.005 18135 12662 1 14 . 1 1 49 49 LYS C C 49 177.968 177.968 176.671 1.297 18135 12663 1 14 . 1 1 49 49 LYS CA C 49 58.149 58.149 57.687 0.462 18135 12664 1 14 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.132 0.258 18135 12665 1 14 . 1 1 49 49 LYS H H 49 8.426 8.426 8.667 -0.241 18135 12666 1 14 . 1 1 50 50 ALA N N 50 120.573 120.573 121.484 -0.911 18135 12667 1 14 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.302 -0.232 18135 12668 1 14 . 1 1 50 50 ALA C C 50 178.697 178.697 177.665 1.032 18135 12669 1 14 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.822 0.946 18135 12670 1 14 . 1 1 50 50 ALA CB C 50 18.874 18.874 19.159 -0.285 18135 12671 1 14 . 1 1 50 50 ALA H H 50 8.578 8.578 7.658 0.920 18135 12672 1 14 . 1 1 51 51 GLU N N 51 115.015 115.015 114.362 0.653 18135 12673 1 14 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.286 -0.020 18135 12674 1 14 . 1 1 51 51 GLU C C 51 176.995 176.995 176.970 0.025 18135 12675 1 14 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.968 -0.975 18135 12676 1 14 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.564 -0.659 18135 12677 1 14 . 1 1 51 51 GLU H H 51 7.907 7.907 8.410 -0.503 18135 12678 1 14 . 1 1 52 52 THR N N 52 111.210 111.210 115.271 -4.061 18135 12679 1 14 . 1 1 52 52 THR HA H 52 4.114 4.114 4.308 -0.194 18135 12680 1 14 . 1 1 52 52 THR C C 52 175.271 175.271 175.626 -0.355 18135 12681 1 14 . 1 1 52 52 THR CA C 52 63.611 63.611 64.831 -1.220 18135 12682 1 14 . 1 1 52 52 THR CB C 52 69.673 69.673 68.767 0.906 18135 12683 1 14 . 1 1 52 52 THR H H 52 7.863 7.863 7.517 0.346 18135 12684 1 14 . 1 1 53 53 ILE N N 53 119.113 119.113 121.915 -2.802 18135 12685 1 14 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.220 -0.356 18135 12686 1 14 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.916 0.991 18135 12687 1 14 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.393 -1.440 18135 12688 1 14 . 1 1 53 53 ILE H H 53 8.341 8.341 8.061 0.280 18135 12689 1 14 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.404 -0.118 18135 12690 1 14 . 1 1 54 54 PRO C C 54 179.655 179.655 178.954 0.701 18135 12691 1 14 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.199 -0.148 18135 12692 1 14 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.455 0.430 18135 12693 1 14 . 1 1 55 55 VAL N N 55 116.355 116.355 116.641 -0.286 18135 12694 1 14 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.914 -0.233 18135 12695 1 14 . 1 1 55 55 VAL C C 55 177.649 177.649 178.207 -0.558 18135 12696 1 14 . 1 1 55 55 VAL CA C 55 65.837 65.837 66.252 -0.415 18135 12697 1 14 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.216 0.255 18135 12698 1 14 . 1 1 55 55 VAL H H 55 7.119 7.119 7.420 -0.301 18135 12699 1 14 . 1 1 56 56 LEU N N 56 123.038 123.038 120.985 2.053 18135 12700 1 14 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.106 0.204 18135 12701 1 14 . 1 1 56 56 LEU C C 56 178.637 178.637 178.116 0.521 18135 12702 1 14 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.401 -0.315 18135 12703 1 14 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.248 1.070 18135 12704 1 14 . 1 1 56 56 LEU H H 56 8.535 8.535 8.450 0.085 18135 12705 1 14 . 1 1 57 57 HIS N N 57 117.041 117.041 118.526 -1.485 18135 12706 1 14 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.033 -0.247 18135 12707 1 14 . 1 1 57 57 HIS C C 57 175.640 175.640 177.470 -1.830 18135 12708 1 14 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.865 0.666 18135 12709 1 14 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.129 -1.920 18135 12710 1 14 . 1 1 57 57 HIS H H 57 9.047 9.047 8.136 0.911 18135 12711 1 14 . 1 1 58 58 GLU N N 58 119.521 119.521 118.836 0.685 18135 12712 1 14 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.844 0.163 18135 12713 1 14 . 1 1 58 58 GLU C C 58 179.029 179.029 179.053 -0.024 18135 12714 1 14 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.489 -0.522 18135 12715 1 14 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.518 -1.228 18135 12716 1 14 . 1 1 58 58 GLU H H 58 7.860 7.860 8.155 -0.295 18135 12717 1 14 . 1 1 59 59 MET N N 59 119.512 119.512 118.892 0.620 18135 12718 1 14 . 1 1 59 59 MET HA H 59 4.074 4.074 4.350 -0.276 18135 12719 1 14 . 1 1 59 59 MET C C 59 177.031 177.031 179.291 -2.260 18135 12720 1 14 . 1 1 59 59 MET CA C 59 59.408 59.408 58.481 0.927 18135 12721 1 14 . 1 1 59 59 MET CB C 59 32.525 32.525 32.417 0.108 18135 12722 1 14 . 1 1 59 59 MET H H 59 8.442 8.442 7.956 0.486 18135 12723 1 14 . 1 1 60 60 ILE N N 60 117.183 117.183 118.290 -1.107 18135 12724 1 14 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.501 -0.084 18135 12725 1 14 . 1 1 60 60 ILE C C 60 177.524 177.524 178.238 -0.714 18135 12726 1 14 . 1 1 60 60 ILE CA C 60 65.326 65.326 65.086 0.240 18135 12727 1 14 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.132 -0.272 18135 12728 1 14 . 1 1 60 60 ILE H H 60 8.338 8.338 7.809 0.529 18135 12729 1 14 . 1 1 61 61 GLN N N 61 120.191 120.191 119.665 0.526 18135 12730 1 14 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.906 -0.204 18135 12731 1 14 . 1 1 61 61 GLN C C 61 178.270 178.270 177.758 0.512 18135 12732 1 14 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.433 -0.647 18135 12733 1 14 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.222 0.444 18135 12734 1 14 . 1 1 61 61 GLN H H 61 8.234 8.234 8.115 0.119 18135 12735 1 14 . 1 1 62 62 GLN N N 62 116.795 116.795 118.982 -2.187 18135 12736 1 14 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.341 0.286 18135 12737 1 14 . 1 1 62 62 GLN C C 62 179.685 179.685 178.393 1.292 18135 12738 1 14 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.429 -0.421 18135 12739 1 14 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.892 -3.550 18135 12740 1 14 . 1 1 62 62 GLN H H 62 8.421 8.421 7.988 0.433 18135 12741 1 14 . 1 1 63 63 ILE N N 63 122.797 122.797 120.046 2.751 18135 12742 1 14 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.888 -0.239 18135 12743 1 14 . 1 1 63 63 ILE C C 63 177.279 177.279 177.901 -0.622 18135 12744 1 14 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.689 2.276 18135 12745 1 14 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.817 -0.502 18135 12746 1 14 . 1 1 63 63 ILE H H 63 8.164 8.164 7.606 0.558 18135 12747 1 14 . 1 1 64 64 PHE N N 64 120.820 120.820 121.400 -0.580 18135 12748 1 14 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.533 -0.817 18135 12749 1 14 . 1 1 64 64 PHE C C 64 178.402 178.402 176.831 1.571 18135 12750 1 14 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.167 0.985 18135 12751 1 14 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.635 -0.125 18135 12752 1 14 . 1 1 64 64 PHE H H 64 8.405 8.405 7.994 0.411 18135 12753 1 14 . 1 1 65 65 ASN N N 65 119.981 119.981 117.857 2.124 18135 12754 1 14 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.469 0.594 18135 12755 1 14 . 1 1 65 65 ASN C C 65 177.944 177.944 176.902 1.042 18135 12756 1 14 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.643 0.225 18135 12757 1 14 . 1 1 65 65 ASN CB C 65 37.256 37.256 37.976 -0.720 18135 12758 1 14 . 1 1 65 65 ASN H H 65 8.812 8.812 7.744 1.068 18135 12759 1 14 . 1 1 66 66 LEU N N 66 121.533 121.533 119.574 1.959 18135 12760 1 14 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.220 0.003 18135 12761 1 14 . 1 1 66 66 LEU C C 66 177.777 177.777 179.034 -1.257 18135 12762 1 14 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.596 0.672 18135 12763 1 14 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.519 0.088 18135 12764 1 14 . 1 1 66 66 LEU H H 66 8.177 8.177 7.691 0.486 18135 12765 1 14 . 1 1 67 67 PHE N N 67 110.842 110.842 116.588 -5.746 18135 12766 1 14 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.571 0.309 18135 12767 1 14 . 1 1 67 67 PHE C C 67 177.965 177.965 177.354 0.611 18135 12768 1 14 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.763 0.771 18135 12769 1 14 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.609 0.007 18135 12770 1 14 . 1 1 67 67 PHE H H 67 8.160 8.160 8.676 -0.516 18135 12771 1 14 . 1 1 68 68 SER N N 68 119.131 119.131 114.171 4.960 18135 12772 1 14 . 1 1 68 68 SER HA H 68 4.580 4.580 4.339 0.241 18135 12773 1 14 . 1 1 68 68 SER C C 68 173.472 173.472 175.127 -1.655 18135 12774 1 14 . 1 1 68 68 SER CA C 68 59.191 59.191 59.178 0.013 18135 12775 1 14 . 1 1 68 68 SER CB C 68 63.123 63.123 63.208 -0.085 18135 12776 1 14 . 1 1 68 68 SER H H 68 8.016 8.016 7.718 0.298 18135 12777 1 14 . 1 1 69 69 THR N N 69 111.353 111.353 115.377 -4.024 18135 12778 1 14 . 1 1 69 69 THR HA H 69 4.345 4.345 4.465 -0.120 18135 12779 1 14 . 1 1 69 69 THR C C 69 175.661 175.661 174.959 0.702 18135 12780 1 14 . 1 1 69 69 THR CA C 69 61.411 61.411 60.690 0.721 18135 12781 1 14 . 1 1 69 69 THR CB C 69 72.209 72.209 70.671 1.538 18135 12782 1 14 . 1 1 69 69 THR H H 69 6.977 6.977 7.416 -0.439 18135 12783 1 14 . 1 1 70 70 LYS N N 70 121.120 121.120 122.446 -1.326 18135 12784 1 14 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.133 -0.044 18135 12785 1 14 . 1 1 70 70 LYS C C 70 179.259 179.259 177.407 1.852 18135 12786 1 14 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.941 -0.985 18135 12787 1 14 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.125 -0.375 18135 12788 1 14 . 1 1 70 70 LYS H H 70 9.065 9.065 8.595 0.470 18135 12789 1 14 . 1 1 71 71 ASP N N 71 116.374 116.374 119.525 -3.151 18135 12790 1 14 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.238 -0.063 18135 12791 1 14 . 1 1 71 71 ASP C C 71 178.372 178.372 177.221 1.151 18135 12792 1 14 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.152 -0.085 18135 12793 1 14 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.303 0.003 18135 12794 1 14 . 1 1 71 71 ASP H H 71 7.518 7.518 7.909 -0.391 18135 12795 1 14 . 1 1 72 72 SER N N 72 117.341 117.341 112.900 4.441 18135 12796 1 14 . 1 1 72 72 SER HA H 72 3.715 3.715 3.312 0.403 18135 12797 1 14 . 1 1 72 72 SER C C 72 176.897 176.897 176.071 0.826 18135 12798 1 14 . 1 1 72 72 SER CA C 72 60.267 60.267 60.743 -0.476 18135 12799 1 14 . 1 1 72 72 SER CB C 72 62.616 62.616 62.815 -0.199 18135 12800 1 14 . 1 1 72 72 SER H H 72 8.066 8.066 7.765 0.301 18135 12801 1 14 . 1 1 73 73 SER N N 73 113.398 113.398 116.977 -3.579 18135 12802 1 14 . 1 1 73 73 SER HA H 73 4.094 4.094 4.097 -0.003 18135 12803 1 14 . 1 1 73 73 SER C C 73 174.855 174.855 174.992 -0.137 18135 12804 1 14 . 1 1 73 73 SER CA C 73 61.385 61.385 60.437 0.948 18135 12805 1 14 . 1 1 73 73 SER CB C 73 62.798 62.798 62.635 0.163 18135 12806 1 14 . 1 1 73 73 SER H H 73 7.982 7.982 7.688 0.294 18135 12807 1 14 . 1 1 74 74 ALA N N 74 119.486 119.486 120.260 -0.774 18135 12808 1 14 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.174 -0.017 18135 12809 1 14 . 1 1 74 74 ALA C C 74 177.626 177.626 177.486 0.140 18135 12810 1 14 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.631 0.082 18135 12811 1 14 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.900 -0.153 18135 12812 1 14 . 1 1 74 74 ALA H H 74 7.095 7.095 7.563 -0.468 18135 12813 1 14 . 1 1 75 75 ALA N N 75 121.465 121.465 120.892 0.573 18135 12814 1 14 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.844 -0.148 18135 12815 1 14 . 1 1 75 75 ALA C C 75 177.197 177.197 176.127 1.070 18135 12816 1 14 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.977 1.028 18135 12817 1 14 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.795 -0.535 18135 12818 1 14 . 1 1 75 75 ALA H H 75 7.159 7.159 7.264 -0.105 18135 12819 1 14 . 1 1 76 76 TRP N N 76 116.791 116.791 116.556 0.235 18135 12820 1 14 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.720 0.330 18135 12821 1 14 . 1 1 76 76 TRP C C 76 177.617 177.617 174.978 2.639 18135 12822 1 14 . 1 1 76 76 TRP CA C 76 53.319 53.319 54.977 -1.658 18135 12823 1 14 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.996 2.080 18135 12824 1 14 . 1 1 76 76 TRP H H 76 7.080 7.080 7.153 -0.073 18135 12825 1 14 . 1 1 77 77 ASP N N 77 119.928 119.928 121.376 -1.448 18135 12826 1 14 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.547 -0.190 18135 12827 1 14 . 1 1 77 77 ASP C C 77 176.877 176.877 177.654 -0.777 18135 12828 1 14 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.950 -1.132 18135 12829 1 14 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.858 0.757 18135 12830 1 14 . 1 1 77 77 ASP H H 77 8.259 8.259 8.401 -0.142 18135 12831 1 14 . 1 1 78 78 GLU N N 78 127.277 127.277 124.976 2.301 18135 12832 1 14 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.988 -0.103 18135 12833 1 14 . 1 1 78 78 GLU C C 78 177.439 177.439 178.202 -0.763 18135 12834 1 14 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.778 -0.394 18135 12835 1 14 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.357 -0.715 18135 12836 1 14 . 1 1 78 78 GLU H H 78 8.920 8.920 8.914 0.006 18135 12837 1 14 . 1 1 79 79 THR N N 79 115.422 115.422 117.780 -2.358 18135 12838 1 14 . 1 1 79 79 THR HA H 79 3.907 3.907 4.033 -0.126 18135 12839 1 14 . 1 1 79 79 THR C C 79 177.330 177.330 176.732 0.598 18135 12840 1 14 . 1 1 79 79 THR CA C 79 66.263 66.263 65.774 0.489 18135 12841 1 14 . 1 1 79 79 THR CB C 79 68.002 68.002 68.481 -0.479 18135 12842 1 14 . 1 1 79 79 THR H H 79 8.124 8.124 8.215 -0.091 18135 12843 1 14 . 1 1 80 80 LEU N N 80 121.791 121.791 122.038 -0.247 18135 12844 1 14 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.114 -0.227 18135 12845 1 14 . 1 1 80 80 LEU C C 80 179.018 179.018 178.615 0.403 18135 12846 1 14 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.724 -0.485 18135 12847 1 14 . 1 1 80 80 LEU CB C 80 41.652 41.652 40.952 0.700 18135 12848 1 14 . 1 1 80 80 LEU H H 80 7.725 7.725 8.097 -0.372 18135 12849 1 14 . 1 1 81 81 LEU N N 81 119.280 119.280 120.732 -1.452 18135 12850 1 14 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.212 -0.723 18135 12851 1 14 . 1 1 81 81 LEU C C 81 177.062 177.062 178.852 -1.790 18135 12852 1 14 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.803 -1.094 18135 12853 1 14 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.161 -1.213 18135 12854 1 14 . 1 1 81 81 LEU H H 81 8.344 8.344 8.708 -0.364 18135 12855 1 14 . 1 1 82 82 ASP N N 82 115.357 115.357 120.036 -4.679 18135 12856 1 14 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.423 -0.149 18135 12857 1 14 . 1 1 82 82 ASP C C 82 179.018 179.018 178.497 0.521 18135 12858 1 14 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.999 -1.184 18135 12859 1 14 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.995 -2.773 18135 12860 1 14 . 1 1 82 82 ASP H H 82 8.001 8.001 8.616 -0.615 18135 12861 1 14 . 1 1 83 83 LYS N N 83 119.603 119.603 118.940 0.663 18135 12862 1 14 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.866 0.116 18135 12863 1 14 . 1 1 83 83 LYS C C 83 178.624 178.624 178.910 -0.286 18135 12864 1 14 . 1 1 83 83 LYS CA C 83 59.745 59.745 59.023 0.723 18135 12865 1 14 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.367 0.739 18135 12866 1 14 . 1 1 83 83 LYS H H 83 7.342 7.342 7.702 -0.360 18135 12867 1 14 . 1 1 84 84 PHE N N 84 123.933 123.933 121.758 2.175 18135 12868 1 14 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.001 0.034 18135 12869 1 14 . 1 1 84 84 PHE C C 84 177.210 177.210 176.890 0.320 18135 12870 1 14 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.624 -1.282 18135 12871 1 14 . 1 1 84 84 PHE CB C 84 39.316 39.316 39.104 0.212 18135 12872 1 14 . 1 1 84 84 PHE H H 84 8.471 8.471 8.382 0.089 18135 12873 1 14 . 1 1 85 85 TYR N N 85 118.387 118.387 117.823 0.564 18135 12874 1 14 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.802 0.266 18135 12875 1 14 . 1 1 85 85 TYR C C 85 178.104 178.104 177.298 0.806 18135 12876 1 14 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.824 -1.247 18135 12877 1 14 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.002 -0.025 18135 12878 1 14 . 1 1 85 85 TYR H H 85 9.011 9.011 9.014 -0.003 18135 12879 1 14 . 1 1 86 86 THR N N 86 114.035 114.035 116.511 -2.476 18135 12880 1 14 . 1 1 86 86 THR HA H 86 3.945 3.945 3.210 0.735 18135 12881 1 14 . 1 1 86 86 THR C C 86 176.708 176.708 176.441 0.267 18135 12882 1 14 . 1 1 86 86 THR CA C 86 66.759 66.759 66.957 -0.198 18135 12883 1 14 . 1 1 86 86 THR CB C 86 68.853 68.853 68.078 0.775 18135 12884 1 14 . 1 1 86 86 THR H H 86 7.609 7.609 7.283 0.326 18135 12885 1 14 . 1 1 87 87 GLU N N 87 120.790 120.790 121.262 -0.472 18135 12886 1 14 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.909 0.138 18135 12887 1 14 . 1 1 87 87 GLU C C 87 179.606 179.606 178.821 0.785 18135 12888 1 14 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.389 -0.991 18135 12889 1 14 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.201 -0.916 18135 12890 1 14 . 1 1 87 87 GLU H H 87 7.712 7.712 7.576 0.136 18135 12891 1 14 . 1 1 88 88 LEU N N 88 120.729 120.729 119.951 0.778 18135 12892 1 14 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.915 -0.187 18135 12893 1 14 . 1 1 88 88 LEU C C 88 178.695 178.695 179.247 -0.552 18135 12894 1 14 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.157 1.094 18135 12895 1 14 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.024 1.563 18135 12896 1 14 . 1 1 88 88 LEU H H 88 8.393 8.393 7.505 0.888 18135 12897 1 14 . 1 1 89 89 TYR N N 89 118.654 118.654 119.154 -0.500 18135 12898 1 14 . 1 1 89 89 TYR HA H 89 3.931 3.931 3.947 -0.016 18135 12899 1 14 . 1 1 89 89 TYR C C 89 178.438 178.438 178.624 -0.186 18135 12900 1 14 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.028 0.379 18135 12901 1 14 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.316 0.551 18135 12902 1 14 . 1 1 89 89 TYR H H 89 8.637 8.637 8.211 0.426 18135 12903 1 14 . 1 1 90 90 GLN N N 90 118.263 118.263 116.468 1.795 18135 12904 1 14 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.988 -0.002 18135 12905 1 14 . 1 1 90 90 GLN C C 90 178.411 178.411 178.765 -0.354 18135 12906 1 14 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.617 0.166 18135 12907 1 14 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.278 -0.131 18135 12908 1 14 . 1 1 90 90 GLN H H 90 7.796 7.796 7.807 -0.011 18135 12909 1 14 . 1 1 91 91 GLN N N 91 117.959 117.959 120.322 -2.363 18135 12910 1 14 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.046 0.036 18135 12911 1 14 . 1 1 91 91 GLN C C 91 178.705 178.705 178.485 0.220 18135 12912 1 14 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.882 -0.062 18135 12913 1 14 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.348 0.825 18135 12914 1 14 . 1 1 91 91 GLN H H 91 7.727 7.727 8.013 -0.286 18135 12915 1 14 . 1 1 92 92 LEU N N 92 119.965 119.965 118.300 1.665 18135 12916 1 14 . 1 1 92 92 LEU HA H 92 3.734 3.734 4.026 -0.292 18135 12917 1 14 . 1 1 92 92 LEU C C 92 178.984 178.984 178.672 0.312 18135 12918 1 14 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.937 -0.445 18135 12919 1 14 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.912 0.467 18135 12920 1 14 . 1 1 92 92 LEU H H 92 8.465 8.465 8.498 -0.033 18135 12921 1 14 . 1 1 93 93 ASN N N 93 117.793 117.793 118.470 -0.677 18135 12922 1 14 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.255 0.146 18135 12923 1 14 . 1 1 93 93 ASN C C 93 178.309 178.309 177.086 1.223 18135 12924 1 14 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.282 0.121 18135 12925 1 14 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.192 0.446 18135 12926 1 14 . 1 1 93 93 ASN H H 93 8.091 8.091 8.075 0.016 18135 12927 1 14 . 1 1 94 94 ASP N N 94 121.133 121.133 120.274 0.859 18135 12928 1 14 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.394 0.011 18135 12929 1 14 . 1 1 94 94 ASP C C 94 178.328 178.328 178.553 -0.225 18135 12930 1 14 . 1 1 94 94 ASP CA C 94 56.547 56.547 56.695 -0.148 18135 12931 1 14 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.882 -2.233 18135 12932 1 14 . 1 1 94 94 ASP H H 94 8.362 8.362 7.970 0.392 18135 12933 1 14 . 1 1 95 95 LEU N N 95 119.160 119.160 121.135 -1.975 18135 12934 1 14 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.892 0.147 18135 12935 1 14 . 1 1 95 95 LEU C C 95 178.826 178.826 178.368 0.458 18135 12936 1 14 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.253 -1.226 18135 12937 1 14 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.093 0.117 18135 12938 1 14 . 1 1 95 95 LEU H H 95 8.143 8.143 8.398 -0.255 18135 12939 1 14 . 1 1 96 96 GLU N N 96 118.813 118.813 118.968 -0.155 18135 12940 1 14 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.755 0.206 18135 12941 1 14 . 1 1 96 96 GLU C C 96 177.640 177.640 178.224 -0.584 18135 12942 1 14 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.419 -1.705 18135 12943 1 14 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.576 -1.438 18135 12944 1 14 . 1 1 96 96 GLU H H 96 8.111 8.111 8.326 -0.215 18135 12945 1 14 . 1 1 97 97 ALA N N 97 120.549 120.549 121.210 -0.661 18135 12946 1 14 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.988 0.134 18135 12947 1 14 . 1 1 97 97 ALA C C 97 179.126 179.126 180.330 -1.204 18135 12948 1 14 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.743 -0.710 18135 12949 1 14 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.899 0.081 18135 12950 1 14 . 1 1 97 97 ALA H H 97 7.798 7.798 7.800 -0.002 18135 12951 1 14 . 1 1 98 98 CYS N N 98 115.510 115.510 116.984 -1.474 18135 12952 1 14 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.154 0.296 18135 12953 1 14 . 1 1 98 98 CYS C C 98 175.363 175.363 176.041 -0.678 18135 12954 1 14 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.341 -5.175 18135 12955 1 14 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.161 15.718 18135 12956 1 14 . 1 1 98 98 CYS H H 98 7.597 7.597 7.964 -0.367 18135 12957 1 14 . 1 1 99 99 VAL N N 99 121.713 121.713 118.961 2.752 18135 12958 1 14 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.911 -0.117 18135 12959 1 14 . 1 1 99 99 VAL C C 99 177.357 177.357 177.712 -0.355 18135 12960 1 14 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.039 -0.456 18135 12961 1 14 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.197 -0.166 18135 12962 1 14 . 1 1 99 99 VAL H H 99 7.828 7.828 7.491 0.337 18135 12963 1 14 . 1 1 100 100 ILE N N 100 122.333 122.333 118.022 4.311 18135 12964 1 14 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.727 0.197 18135 12965 1 14 . 1 1 100 100 ILE C C 100 176.827 176.827 176.713 0.114 18135 12966 1 14 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.621 -1.383 18135 12967 1 14 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.581 0.697 18135 12968 1 14 . 1 1 100 100 ILE H H 100 8.067 8.067 8.169 -0.102 18135 12969 1 14 . 1 1 101 101 GLN N N 101 121.864 121.864 117.495 4.369 18135 12970 1 14 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.257 -0.031 18135 12971 1 14 . 1 1 101 101 GLN C C 101 176.438 176.438 178.040 -1.602 18135 12972 1 14 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.312 0.008 18135 12973 1 14 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.241 -0.230 18135 12974 1 14 . 1 1 101 101 GLN H H 101 8.062 8.062 7.405 0.657 18135 12975 1 14 . 1 1 102 102 GLY N N 102 109.288 109.288 108.685 0.603 18135 12976 1 14 . 1 1 102 102 GLY C C 102 173.855 173.855 175.444 -1.589 18135 12977 1 14 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.397 -1.238 18135 12978 1 14 . 1 1 102 102 GLY H H 102 8.087 8.087 8.806 -0.719 18135 12979 1 14 . 1 1 103 103 VAL N N 103 118.932 118.932 119.071 -0.139 18135 12980 1 14 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.796 0.278 18135 12981 1 14 . 1 1 103 103 VAL C C 103 176.299 176.299 175.992 0.307 18135 12982 1 14 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.990 -1.491 18135 12983 1 14 . 1 1 103 103 VAL CB C 103 32.854 32.854 32.014 0.840 18135 12984 1 14 . 1 1 103 103 VAL H H 103 8.079 8.079 7.545 0.534 18135 12985 1 14 . 1 1 104 104 GLY N N 104 112.028 112.028 107.086 4.942 18135 12986 1 14 . 1 1 104 104 GLY C C 104 173.694 173.694 173.144 0.550 18135 12987 1 14 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.209 0.194 18135 12988 1 14 . 1 1 104 104 GLY H H 104 8.446 8.446 7.634 0.812 18135 12989 1 14 . 1 1 105 105 VAL N N 105 120.439 120.439 119.985 0.454 18135 12990 1 14 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.373 -0.185 18135 12991 1 14 . 1 1 105 105 VAL C C 105 175.963 175.963 174.647 1.316 18135 12992 1 14 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.352 0.784 18135 12993 1 14 . 1 1 105 105 VAL CB C 105 32.814 32.814 35.567 -2.753 18135 12994 1 14 . 1 1 105 105 VAL H H 105 7.867 7.867 7.917 -0.050 18135 12995 1 14 . 1 1 106 106 THR N N 106 116.366 116.366 114.183 2.183 18135 12996 1 14 . 1 1 106 106 THR HA H 106 4.548 4.548 4.592 -0.044 18135 12997 1 14 . 1 1 106 106 THR C C 106 173.731 173.731 173.821 -0.090 18135 12998 1 14 . 1 1 106 106 THR CA C 106 59.419 59.419 60.902 -1.483 18135 12999 1 14 . 1 1 106 106 THR CB C 106 79.536 79.536 71.049 8.487 18135 13000 1 14 . 1 1 106 106 THR H H 106 8.565 8.565 8.032 0.533 18135 13001 1 14 . 1 1 107 107 GLU N N 107 119.743 119.743 121.530 -1.787 18135 13002 1 14 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.735 -0.273 18135 13003 1 14 . 1 1 107 107 GLU C C 107 175.639 175.639 175.945 -0.306 18135 13004 1 14 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.899 0.812 18135 13005 1 14 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.866 -1.367 18135 13006 1 14 . 1 1 107 107 GLU H H 107 8.410 8.410 8.685 -0.275 18135 13007 1 14 . 1 1 108 108 THR N N 108 114.402 114.402 113.073 1.329 18135 13008 1 14 . 1 1 108 108 THR HA H 108 4.448 4.448 4.746 -0.298 18135 13009 1 14 . 1 1 108 108 THR CA C 108 60.348 60.348 59.198 1.150 18135 13010 1 14 . 1 1 108 108 THR CB C 108 68.544 68.544 68.787 -0.243 18135 13011 1 14 . 1 1 108 108 THR H H 108 8.155 8.155 8.149 0.006 18135 13012 1 14 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.426 -0.188 18135 13013 1 14 . 1 1 109 109 PRO C C 109 178.666 178.666 177.654 1.012 18135 13014 1 14 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.335 1.041 18135 13015 1 14 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.874 -0.026 18135 13016 1 14 . 1 1 110 110 LEU N N 110 118.566 118.566 118.708 -0.142 18135 13017 1 14 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.115 0.001 18135 13018 1 14 . 1 1 110 110 LEU C C 110 178.293 178.293 179.611 -1.318 18135 13019 1 14 . 1 1 110 110 LEU CA C 110 56.686 56.686 58.186 -1.500 18135 13020 1 14 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.033 0.936 18135 13021 1 14 . 1 1 110 110 LEU H H 110 8.016 8.016 8.062 -0.046 18135 13022 1 14 . 1 1 111 111 MET N N 111 118.982 118.982 116.823 2.159 18135 13023 1 14 . 1 1 111 111 MET HA H 111 4.210 4.210 4.282 -0.072 18135 13024 1 14 . 1 1 111 111 MET C C 111 178.720 178.720 177.604 1.116 18135 13025 1 14 . 1 1 111 111 MET CA C 111 58.144 58.144 57.331 0.813 18135 13026 1 14 . 1 1 111 111 MET CB C 111 32.374 32.374 32.178 0.196 18135 13027 1 14 . 1 1 111 111 MET H H 111 7.705 7.705 7.886 -0.181 18135 13028 1 14 . 1 1 112 112 LYS N N 112 121.377 121.377 118.810 2.567 18135 13029 1 14 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.250 -0.142 18135 13030 1 14 . 1 1 112 112 LYS C C 112 178.000 178.000 178.707 -0.707 18135 13031 1 14 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.232 -1.927 18135 13032 1 14 . 1 1 112 112 LYS CB C 112 32.367 32.367 31.886 0.481 18135 13033 1 14 . 1 1 112 112 LYS H H 112 8.257 8.257 7.498 0.759 18135 13034 1 14 . 1 1 113 113 GLU N N 113 119.104 119.104 118.977 0.127 18135 13035 1 14 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.059 0.007 18135 13036 1 14 . 1 1 113 113 GLU C C 113 178.289 178.289 178.936 -0.647 18135 13037 1 14 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.077 -0.824 18135 13038 1 14 . 1 1 113 113 GLU CB C 113 28.138 28.138 28.978 -0.840 18135 13039 1 14 . 1 1 113 113 GLU H H 113 8.270 8.270 7.633 0.637 18135 13040 1 14 . 1 1 114 114 ASP N N 114 119.224 119.224 119.642 -0.418 18135 13041 1 14 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.550 -0.262 18135 13042 1 14 . 1 1 114 114 ASP C C 114 178.365 178.365 177.981 0.384 18135 13043 1 14 . 1 1 114 114 ASP CA C 114 56.108 56.108 56.696 -0.588 18135 13044 1 14 . 1 1 114 114 ASP CB C 114 38.235 38.235 41.147 -2.912 18135 13045 1 14 . 1 1 114 114 ASP H H 114 8.618 8.618 7.609 1.009 18135 13046 1 14 . 1 1 115 115 SER N N 115 118.195 118.195 116.774 1.421 18135 13047 1 14 . 1 1 115 115 SER HA H 115 4.200 4.200 4.118 0.082 18135 13048 1 14 . 1 1 115 115 SER C C 115 175.986 175.986 176.774 -0.788 18135 13049 1 14 . 1 1 115 115 SER CA C 115 61.588 61.588 61.851 -0.263 18135 13050 1 14 . 1 1 115 115 SER CB C 115 62.653 62.653 62.901 -0.248 18135 13051 1 14 . 1 1 115 115 SER H H 115 8.181 8.181 7.522 0.659 18135 13052 1 14 . 1 1 116 116 ILE N N 116 123.340 123.340 121.755 1.585 18135 13053 1 14 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.872 -0.246 18135 13054 1 14 . 1 1 116 116 ILE C C 116 178.367 178.367 178.142 0.225 18135 13055 1 14 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.100 1.716 18135 13056 1 14 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.588 0.830 18135 13057 1 14 . 1 1 116 116 ILE H H 116 7.773 7.773 8.354 -0.582 18135 13058 1 14 . 1 1 117 117 LEU N N 117 120.968 120.968 121.273 -0.305 18135 13059 1 14 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.892 0.013 18135 13060 1 14 . 1 1 117 117 LEU C C 117 178.746 178.746 178.323 0.423 18135 13061 1 14 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.309 -0.166 18135 13062 1 14 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.550 0.035 18135 13063 1 14 . 1 1 117 117 LEU H H 117 8.406 8.406 7.434 0.972 18135 13064 1 14 . 1 1 118 118 ALA N N 118 120.150 120.150 121.878 -1.728 18135 13065 1 14 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.659 0.453 18135 13066 1 14 . 1 1 118 118 ALA C C 118 181.633 181.633 178.730 2.903 18135 13067 1 14 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.031 0.282 18135 13068 1 14 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.417 -0.307 18135 13069 1 14 . 1 1 118 118 ALA H H 118 7.894 7.894 8.122 -0.228 18135 13070 1 14 . 1 1 119 119 VAL N N 119 118.873 118.873 114.928 3.945 18135 13071 1 14 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.319 0.436 18135 13072 1 14 . 1 1 119 119 VAL C C 119 177.896 177.896 177.554 0.342 18135 13073 1 14 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.582 1.599 18135 13074 1 14 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.979 0.915 18135 13075 1 14 . 1 1 119 119 VAL H H 119 7.572 7.572 7.800 -0.228 18135 13076 1 14 . 1 1 120 120 ARG N N 120 121.436 121.436 119.986 1.450 18135 13077 1 14 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.144 -0.117 18135 13078 1 14 . 1 1 120 120 ARG C C 120 179.848 179.848 179.007 0.841 18135 13079 1 14 . 1 1 120 120 ARG CA C 120 61.267 61.267 58.925 2.342 18135 13080 1 14 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.569 0.126 18135 13081 1 14 . 1 1 120 120 ARG H H 120 8.629 8.629 8.413 0.216 18135 13082 1 14 . 1 1 121 121 LYS N N 121 119.589 119.589 119.826 -0.237 18135 13083 1 14 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.973 0.101 18135 13084 1 14 . 1 1 121 121 LYS C C 121 178.331 178.331 179.549 -1.218 18135 13085 1 14 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.719 0.721 18135 13086 1 14 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.277 -0.170 18135 13087 1 14 . 1 1 121 121 LYS H H 121 9.015 9.015 8.012 1.003 18135 13088 1 14 . 1 1 122 122 TYR N N 122 121.546 121.546 118.940 2.606 18135 13089 1 14 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.197 0.135 18135 13090 1 14 . 1 1 122 122 TYR C C 122 176.527 176.527 177.953 -1.426 18135 13091 1 14 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.665 1.739 18135 13092 1 14 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.182 0.543 18135 13093 1 14 . 1 1 122 122 TYR H H 122 7.473 7.473 7.754 -0.281 18135 13094 1 14 . 1 1 123 123 PHE N N 123 116.026 116.026 120.225 -4.199 18135 13095 1 14 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.957 -0.217 18135 13096 1 14 . 1 1 123 123 PHE C C 123 179.005 179.005 177.498 1.507 18135 13097 1 14 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.424 3.104 18135 13098 1 14 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.782 0.549 18135 13099 1 14 . 1 1 123 123 PHE H H 123 7.932 7.932 8.375 -0.443 18135 13100 1 14 . 1 1 124 124 GLN N N 124 123.043 123.043 118.907 4.136 18135 13101 1 14 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.337 0.842 18135 13102 1 14 . 1 1 124 124 GLN C C 124 178.772 178.772 178.337 0.435 18135 13103 1 14 . 1 1 124 124 GLN CA C 124 59.316 59.316 58.998 0.318 18135 13104 1 14 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.153 -0.522 18135 13105 1 14 . 1 1 124 124 GLN H H 124 8.470 8.470 8.404 0.066 18135 13106 1 14 . 1 1 125 125 ARG N N 125 120.342 120.342 118.812 1.530 18135 13107 1 14 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.156 -0.078 18135 13108 1 14 . 1 1 125 125 ARG C C 125 180.340 180.340 179.207 1.133 18135 13109 1 14 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.788 2.509 18135 13110 1 14 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.100 0.225 18135 13111 1 14 . 1 1 125 125 ARG H H 125 8.137 8.137 7.978 0.159 18135 13112 1 14 . 1 1 126 126 ILE N N 126 121.876 121.876 121.090 0.786 18135 13113 1 14 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.672 -0.321 18135 13114 1 14 . 1 1 126 126 ILE C C 126 176.857 176.857 177.886 -1.029 18135 13115 1 14 . 1 1 126 126 ILE CA C 126 65.832 65.832 65.045 0.787 18135 13116 1 14 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.813 0.471 18135 13117 1 14 . 1 1 126 126 ILE H H 126 7.526 7.526 8.381 -0.855 18135 13118 1 14 . 1 1 127 127 THR N N 127 115.613 115.613 114.887 0.726 18135 13119 1 14 . 1 1 127 127 THR HA H 127 3.633 3.633 3.859 -0.226 18135 13120 1 14 . 1 1 127 127 THR C C 127 176.645 176.645 176.802 -0.157 18135 13121 1 14 . 1 1 127 127 THR CA C 127 67.294 67.294 66.530 0.764 18135 13122 1 14 . 1 1 127 127 THR CB C 127 68.871 68.871 68.901 -0.030 18135 13123 1 14 . 1 1 127 127 THR H H 127 8.288 8.288 8.213 0.075 18135 13124 1 14 . 1 1 128 128 LEU N N 128 122.627 122.627 122.132 0.495 18135 13125 1 14 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.950 0.006 18135 13126 1 14 . 1 1 128 128 LEU C C 128 178.331 178.331 177.436 0.895 18135 13127 1 14 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.908 0.180 18135 13128 1 14 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.243 0.331 18135 13129 1 14 . 1 1 128 128 LEU H H 128 8.263 8.263 7.940 0.323 18135 13130 1 14 . 1 1 129 129 TYR N N 129 120.955 120.955 120.195 0.760 18135 13131 1 14 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.025 -0.135 18135 13132 1 14 . 1 1 129 129 TYR C C 129 176.040 176.040 177.345 -1.305 18135 13133 1 14 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.691 -0.198 18135 13134 1 14 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.205 0.721 18135 13135 1 14 . 1 1 129 129 TYR H H 129 7.518 7.518 8.327 -0.809 18135 13136 1 14 . 1 1 130 130 LEU N N 130 119.155 119.155 116.371 2.784 18135 13137 1 14 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.330 -0.485 18135 13138 1 14 . 1 1 130 130 LEU C C 130 177.948 177.948 178.377 -0.429 18135 13139 1 14 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.877 0.236 18135 13140 1 14 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.539 1.047 18135 13141 1 14 . 1 1 130 130 LEU H H 130 7.717 7.717 7.989 -0.272 18135 13142 1 14 . 1 1 131 131 LYS N N 131 116.832 116.832 120.059 -3.227 18135 13143 1 14 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.922 -0.514 18135 13144 1 14 . 1 1 131 131 LYS C C 131 181.265 181.265 179.771 1.494 18135 13145 1 14 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.685 0.046 18135 13146 1 14 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.051 0.621 18135 13147 1 14 . 1 1 131 131 LYS H H 131 7.493 7.493 7.898 -0.405 18135 13148 1 14 . 1 1 132 132 GLU N N 132 121.918 121.918 119.399 2.519 18135 13149 1 14 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.121 -0.277 18135 13150 1 14 . 1 1 132 132 GLU C C 132 178.377 178.377 178.068 0.309 18135 13151 1 14 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.635 0.253 18135 13152 1 14 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.432 -0.765 18135 13153 1 14 . 1 1 132 132 GLU H H 132 8.430 8.430 8.020 0.410 18135 13154 1 14 . 1 1 133 133 LYS N N 133 116.079 116.079 116.565 -0.486 18135 13155 1 14 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.277 -0.311 18135 13156 1 14 . 1 1 133 133 LYS C C 133 175.282 175.282 175.667 -0.385 18135 13157 1 14 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.738 -0.440 18135 13158 1 14 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.918 0.080 18135 13159 1 14 . 1 1 133 133 LYS H H 133 7.390 7.390 7.333 0.057 18135 13160 1 14 . 1 1 134 134 LYS N N 134 117.759 117.759 115.925 1.834 18135 13161 1 14 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.069 -0.487 18135 13162 1 14 . 1 1 134 134 LYS C C 134 176.271 176.271 176.013 0.258 18135 13163 1 14 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.858 0.451 18135 13164 1 14 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.125 -0.323 18135 13165 1 14 . 1 1 134 134 LYS H H 134 7.716 7.716 7.582 0.134 18135 13166 1 14 . 1 1 135 135 TYR N N 135 110.598 110.598 113.007 -2.409 18135 13167 1 14 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.996 -1.119 18135 13168 1 14 . 1 1 135 135 TYR C C 135 174.148 174.148 175.199 -1.051 18135 13169 1 14 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.012 0.703 18135 13170 1 14 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.542 -0.836 18135 13171 1 14 . 1 1 135 135 TYR H H 135 8.428 8.428 8.848 -0.420 18135 13172 1 14 . 1 1 136 136 SER N N 136 113.712 113.712 115.311 -1.599 18135 13173 1 14 . 1 1 136 136 SER HA H 136 4.553 4.553 4.442 0.111 18135 13174 1 14 . 1 1 136 136 SER CA C 136 57.108 57.108 58.701 -1.593 18135 13175 1 14 . 1 1 136 136 SER CB C 136 62.500 62.500 63.727 -1.227 18135 13176 1 14 . 1 1 136 136 SER H H 136 6.744 6.744 7.400 -0.656 18135 13177 1 14 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.387 -0.222 18135 13178 1 14 . 1 1 137 137 PRO C C 137 180.675 180.675 177.817 2.858 18135 13179 1 14 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.875 0.782 18135 13180 1 14 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.748 0.235 18135 13181 1 14 . 1 1 138 138 CYS N N 138 113.914 113.914 116.107 -2.193 18135 13182 1 14 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.504 0.166 18135 13183 1 14 . 1 1 138 138 CYS C C 138 176.015 176.015 175.899 0.116 18135 13184 1 14 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.315 -3.220 18135 13185 1 14 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.058 10.720 18135 13186 1 14 . 1 1 138 138 CYS H H 138 8.580 8.580 8.477 0.103 18135 13187 1 14 . 1 1 139 139 ALA N N 139 125.290 125.290 124.566 0.724 18135 13188 1 14 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.121 0.328 18135 13189 1 14 . 1 1 139 139 ALA C C 139 180.149 180.149 179.229 0.920 18135 13190 1 14 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.981 -0.203 18135 13191 1 14 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.064 0.854 18135 13192 1 14 . 1 1 139 139 ALA H H 139 8.087 8.087 8.066 0.021 18135 13193 1 14 . 1 1 140 140 TRP N N 140 116.599 116.599 118.702 -2.103 18135 13194 1 14 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.282 0.320 18135 13195 1 14 . 1 1 140 140 TRP C C 140 179.137 179.137 178.393 0.744 18135 13196 1 14 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.695 -1.161 18135 13197 1 14 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.316 -0.058 18135 13198 1 14 . 1 1 140 140 TRP H H 140 8.505 8.505 7.745 0.760 18135 13199 1 14 . 1 1 141 141 GLU N N 141 121.578 121.578 118.981 2.597 18135 13200 1 14 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.205 1.018 18135 13201 1 14 . 1 1 141 141 GLU C C 141 177.886 177.886 178.963 -1.077 18135 13202 1 14 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.929 -2.022 18135 13203 1 14 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.244 -0.527 18135 13204 1 14 . 1 1 141 141 GLU H H 141 8.182 8.182 8.082 0.100 18135 13205 1 14 . 1 1 142 142 VAL N N 142 121.202 121.202 119.944 1.258 18135 13206 1 14 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.693 -0.063 18135 13207 1 14 . 1 1 142 142 VAL C C 142 180.246 180.246 178.539 1.707 18135 13208 1 14 . 1 1 142 142 VAL CA C 142 66.983 66.983 67.145 -0.162 18135 13209 1 14 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.512 0.310 18135 13210 1 14 . 1 1 142 142 VAL H H 142 8.623 8.623 8.037 0.586 18135 13211 1 14 . 1 1 143 143 VAL N N 143 120.119 120.119 120.443 -0.324 18135 13212 1 14 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.809 -0.512 18135 13213 1 14 . 1 1 143 143 VAL C C 143 176.407 176.407 178.301 -1.894 18135 13214 1 14 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.701 1.277 18135 13215 1 14 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.228 0.427 18135 13216 1 14 . 1 1 143 143 VAL H H 143 8.323 8.323 8.493 -0.170 18135 13217 1 14 . 1 1 144 144 ARG N N 144 124.102 124.102 118.871 5.231 18135 13218 1 14 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.003 -0.306 18135 13219 1 14 . 1 1 144 144 ARG C C 144 178.127 178.127 178.744 -0.617 18135 13220 1 14 . 1 1 144 144 ARG CA C 144 61.001 61.001 57.965 3.036 18135 13221 1 14 . 1 1 144 144 ARG CB C 144 29.936 29.936 28.749 1.187 18135 13222 1 14 . 1 1 144 144 ARG H H 144 9.619 9.619 8.770 0.849 18135 13223 1 14 . 1 1 145 145 ALA N N 145 119.431 119.431 122.124 -2.693 18135 13224 1 14 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.047 -0.196 18135 13225 1 14 . 1 1 145 145 ALA C C 145 180.763 180.763 179.977 0.786 18135 13226 1 14 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.305 0.070 18135 13227 1 14 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.030 0.154 18135 13228 1 14 . 1 1 145 145 ALA H H 145 8.867 8.867 8.374 0.493 18135 13229 1 14 . 1 1 146 146 GLU N N 146 121.815 121.815 119.046 2.769 18135 13230 1 14 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.254 -0.043 18135 13231 1 14 . 1 1 146 146 GLU C C 146 177.296 177.296 179.075 -1.779 18135 13232 1 14 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.206 -0.827 18135 13233 1 14 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.680 -1.546 18135 13234 1 14 . 1 1 146 146 GLU H H 146 8.136 8.136 7.938 0.198 18135 13235 1 14 . 1 1 147 147 ILE N N 147 119.542 119.542 120.407 -0.865 18135 13236 1 14 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.691 0.280 18135 13237 1 14 . 1 1 147 147 ILE C C 147 178.283 178.283 177.962 0.321 18135 13238 1 14 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.972 -3.719 18135 13239 1 14 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.584 -2.245 18135 13240 1 14 . 1 1 147 147 ILE H H 147 8.736 8.736 8.138 0.598 18135 13241 1 14 . 1 1 148 148 MET N N 148 119.501 119.501 118.348 1.153 18135 13242 1 14 . 1 1 148 148 MET HA H 148 3.801 3.801 4.199 -0.398 18135 13243 1 14 . 1 1 148 148 MET C C 148 178.210 178.210 178.658 -0.448 18135 13244 1 14 . 1 1 148 148 MET CA C 148 60.184 60.184 59.805 0.379 18135 13245 1 14 . 1 1 148 148 MET CB C 148 32.914 32.914 31.994 0.920 18135 13246 1 14 . 1 1 148 148 MET H H 148 8.440 8.440 8.370 0.070 18135 13247 1 14 . 1 1 149 149 ARG N N 149 119.734 119.734 119.719 0.015 18135 13248 1 14 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.118 -0.203 18135 13249 1 14 . 1 1 149 149 ARG C C 149 178.978 178.978 179.108 -0.130 18135 13250 1 14 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.503 0.360 18135 13251 1 14 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.681 0.599 18135 13252 1 14 . 1 1 149 149 ARG H H 149 7.648 7.648 8.298 -0.650 18135 13253 1 14 . 1 1 150 150 SER N N 150 118.109 118.109 114.314 3.795 18135 13254 1 14 . 1 1 150 150 SER HA H 150 3.339 3.339 3.763 -0.424 18135 13255 1 14 . 1 1 150 150 SER C C 150 177.292 177.292 176.272 1.020 18135 13256 1 14 . 1 1 150 150 SER CA C 150 61.316 61.316 61.574 -0.258 18135 13257 1 14 . 1 1 150 150 SER CB C 150 60.288 60.288 62.300 -2.012 18135 13258 1 14 . 1 1 150 150 SER H H 150 9.194 9.194 8.285 0.909 18135 13259 1 14 . 1 1 151 151 PHE N N 151 125.265 125.265 123.608 1.657 18135 13260 1 14 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.370 -0.334 18135 13261 1 14 . 1 1 151 151 PHE C C 151 178.696 178.696 177.483 1.213 18135 13262 1 14 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.652 1.768 18135 13263 1 14 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.747 0.139 18135 13264 1 14 . 1 1 151 151 PHE H H 151 9.455 9.455 8.308 1.147 18135 13265 1 14 . 1 1 152 152 SER N N 152 115.963 115.963 115.792 0.171 18135 13266 1 14 . 1 1 152 152 SER HA H 152 3.880 3.880 3.819 0.061 18135 13267 1 14 . 1 1 152 152 SER C C 152 175.858 175.858 176.745 -0.887 18135 13268 1 14 . 1 1 152 152 SER CA C 152 62.388 62.388 60.949 1.439 18135 13269 1 14 . 1 1 152 152 SER CB C 152 62.519 62.519 63.264 -0.745 18135 13270 1 14 . 1 1 152 152 SER H H 152 7.839 7.839 8.641 -0.802 18135 13271 1 14 . 1 1 153 153 LEU N N 153 121.365 121.365 121.913 -0.548 18135 13272 1 14 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.217 -0.136 18135 13273 1 14 . 1 1 153 153 LEU C C 153 179.515 179.515 178.585 0.930 18135 13274 1 14 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.672 0.211 18135 13275 1 14 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.517 0.825 18135 13276 1 14 . 1 1 153 153 LEU H H 153 7.775 7.775 8.066 -0.291 18135 13277 1 14 . 1 1 154 154 SER N N 154 113.950 113.950 114.020 -0.070 18135 13278 1 14 . 1 1 154 154 SER HA H 154 3.781 3.781 4.440 -0.659 18135 13279 1 14 . 1 1 154 154 SER C C 154 174.312 174.312 176.386 -2.074 18135 13280 1 14 . 1 1 154 154 SER CA C 154 61.366 61.366 61.109 0.257 18135 13281 1 14 . 1 1 154 154 SER CB C 154 63.242 63.242 63.685 -0.443 18135 13282 1 14 . 1 1 154 154 SER H H 154 7.874 7.874 8.400 -0.526 18135 13283 1 14 . 1 1 155 155 THR N N 155 109.346 109.346 110.926 -1.580 18135 13284 1 14 . 1 1 155 155 THR HA H 155 4.060 4.060 4.366 -0.306 18135 13285 1 14 . 1 1 155 155 THR C C 155 174.798 174.798 175.624 -0.826 18135 13286 1 14 . 1 1 155 155 THR CA C 155 62.275 62.275 64.166 -1.891 18135 13287 1 14 . 1 1 155 155 THR CB C 155 69.342 69.342 69.331 0.011 18135 13288 1 14 . 1 1 155 155 THR H H 155 7.176 7.176 7.864 -0.688 18135 13289 1 14 . 1 1 156 156 ASN N N 156 119.785 119.785 121.378 -1.593 18135 13290 1 14 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.737 -0.210 18135 13291 1 14 . 1 1 156 156 ASN C C 156 175.528 175.528 174.456 1.072 18135 13292 1 14 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.776 1.161 18135 13293 1 14 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.349 0.990 18135 13294 1 14 . 1 1 156 156 ASN H H 156 7.749 7.749 7.979 -0.230 18135 13295 1 14 . 1 1 157 157 LEU N N 157 120.552 120.552 121.672 -1.120 18135 13296 1 14 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.544 -0.289 18135 13297 1 14 . 1 1 157 157 LEU C C 157 174.702 174.702 178.359 -3.657 18135 13298 1 14 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.141 -0.467 18135 13299 1 14 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.163 0.189 18135 13300 1 14 . 1 1 157 157 LEU H H 157 8.097 8.097 7.791 0.306 18135 13301 1 14 . 1 1 158 158 GLN N N 158 119.860 119.860 117.728 2.132 18135 13302 1 14 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.091 0.089 18135 13303 1 14 . 1 1 158 158 GLN C C 158 176.434 176.434 175.585 0.849 18135 13304 1 14 . 1 1 158 158 GLN CA C 158 56.897 56.897 56.752 0.145 18135 13305 1 14 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.261 -0.251 18135 13306 1 14 . 1 1 158 158 GLN H H 158 8.230 8.230 8.256 -0.026 18135 13307 1 14 . 1 1 159 159 GLU N N 159 120.461 120.461 115.567 4.894 18135 13308 1 14 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.903 0.316 18135 13309 1 14 . 1 1 159 159 GLU C C 159 175.251 175.251 175.437 -0.186 18135 13310 1 14 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.675 -0.980 18135 13311 1 14 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.852 0.129 18135 13312 1 14 . 1 1 159 159 GLU H H 159 8.300 8.300 8.841 -0.541 18135 13313 1 14 . 1 1 160 160 SER N N 160 115.719 115.719 112.105 3.614 18135 13314 1 14 . 1 1 160 160 SER HA H 160 4.372 4.372 4.558 -0.186 18135 13315 1 14 . 1 1 160 160 SER C C 160 174.188 174.188 174.840 -0.652 18135 13316 1 14 . 1 1 160 160 SER CA C 160 58.481 58.481 58.312 0.169 18135 13317 1 14 . 1 1 160 160 SER CB C 160 63.731 63.731 63.325 0.406 18135 13318 1 14 . 1 1 160 160 SER H H 160 8.113 8.113 8.279 -0.166 18135 13319 1 14 . 1 1 161 161 LEU N N 161 123.794 123.794 121.472 2.322 18135 13320 1 14 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.334 -0.054 18135 13321 1 14 . 1 1 161 161 LEU C C 161 177.293 177.293 177.420 -0.127 18135 13322 1 14 . 1 1 161 161 LEU CA C 161 55.190 55.190 56.307 -1.117 18135 13323 1 14 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.468 -0.184 18135 13324 1 14 . 1 1 161 161 LEU H H 161 8.032 8.032 7.933 0.099 18135 13325 1 14 . 1 1 162 162 ARG N N 162 120.715 120.715 119.752 0.963 18135 13326 1 14 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.457 -0.288 18135 13327 1 14 . 1 1 162 162 ARG C C 162 176.288 176.288 175.848 0.440 18135 13328 1 14 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.879 1.167 18135 13329 1 14 . 1 1 162 162 ARG CB C 162 30.935 30.935 28.645 2.290 18135 13330 1 14 . 1 1 162 162 ARG H H 162 8.094 8.094 8.224 -0.130 18135 13331 1 14 . 1 1 163 163 SER N N 163 116.670 116.670 119.207 -2.537 18135 13332 1 14 . 1 1 163 163 SER HA H 163 4.372 4.372 4.763 -0.391 18135 13333 1 14 . 1 1 163 163 SER C C 163 174.184 174.184 173.978 0.206 18135 13334 1 14 . 1 1 163 163 SER CA C 163 58.481 58.481 58.038 0.443 18135 13335 1 14 . 1 1 163 163 SER CB C 163 63.745 63.745 64.828 -1.083 18135 13336 1 14 . 1 1 163 163 SER H H 163 8.191 8.191 7.998 0.193 18135 13337 1 14 . 1 1 164 164 LYS N N 164 123.100 123.100 119.723 3.377 18135 13338 1 14 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.229 0.048 18135 13339 1 14 . 1 1 164 164 LYS C C 164 175.617 175.617 176.948 -1.331 18135 13340 1 14 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.023 -0.710 18135 13341 1 14 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.461 0.504 18135 13342 1 14 . 1 1 164 164 LYS H H 164 8.251 8.251 8.541 -0.290 18135 13343 1 15 . 1 1 2 2 ASP N N 2 125.691 125.691 121.903 3.788 18135 13344 1 15 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.424 0.286 18135 13345 1 15 . 1 1 2 2 ASP C C 2 174.758 174.758 175.991 -1.233 18135 13346 1 15 . 1 1 2 2 ASP CA C 2 52.843 52.843 55.340 -2.497 18135 13347 1 15 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.219 -1.898 18135 13348 1 15 . 1 1 2 2 ASP H H 2 8.773 8.773 8.644 0.129 18135 13349 1 15 . 1 1 3 3 LEU N N 3 123.957 123.957 116.522 7.435 18135 13350 1 15 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.412 -0.011 18135 13351 1 15 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.483 0.170 18135 13352 1 15 . 1 1 3 3 LEU CB C 3 40.555 40.555 41.466 -0.911 18135 13353 1 15 . 1 1 3 3 LEU H H 3 8.164 8.164 7.562 0.602 18135 13354 1 15 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.584 -0.270 18135 13355 1 15 . 1 1 4 4 PRO C C 4 176.213 176.213 176.859 -0.646 18135 13356 1 15 . 1 1 4 4 PRO CA C 4 63.908 63.908 62.942 0.966 18135 13357 1 15 . 1 1 4 4 PRO CB C 4 31.894 31.894 31.317 0.577 18135 13358 1 15 . 1 1 5 5 GLN N N 5 121.621 121.621 123.981 -2.360 18135 13359 1 15 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.110 0.116 18135 13360 1 15 . 1 1 5 5 GLN C C 5 176.995 176.995 176.183 0.812 18135 13361 1 15 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.284 -1.574 18135 13362 1 15 . 1 1 5 5 GLN CB C 5 28.951 28.951 28.956 -0.005 18135 13363 1 15 . 1 1 5 5 GLN H H 5 8.767 8.767 8.337 0.430 18135 13364 1 15 . 1 1 6 6 THR N N 6 111.419 111.419 110.190 1.229 18135 13365 1 15 . 1 1 6 6 THR HA H 6 4.135 4.135 4.420 -0.285 18135 13366 1 15 . 1 1 6 6 THR C C 6 174.695 174.695 175.464 -0.769 18135 13367 1 15 . 1 1 6 6 THR CA C 6 62.661 62.661 63.193 -0.532 18135 13368 1 15 . 1 1 6 6 THR CB C 6 69.365 69.365 68.862 0.503 18135 13369 1 15 . 1 1 6 6 THR H H 6 7.865 7.865 8.440 -0.575 18135 13370 1 15 . 1 1 7 7 HIS N N 7 119.137 119.137 118.847 0.290 18135 13371 1 15 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.671 -0.086 18135 13372 1 15 . 1 1 7 7 HIS C C 7 174.980 174.980 175.106 -0.126 18135 13373 1 15 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.552 -2.548 18135 13374 1 15 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.953 -1.790 18135 13375 1 15 . 1 1 7 7 HIS H H 7 8.567 8.567 8.239 0.328 18135 13376 1 15 . 1 1 8 8 SER N N 8 115.796 115.796 113.108 2.688 18135 13377 1 15 . 1 1 8 8 SER HA H 8 4.363 4.363 4.483 -0.120 18135 13378 1 15 . 1 1 8 8 SER C C 8 175.312 175.312 175.994 -0.682 18135 13379 1 15 . 1 1 8 8 SER CA C 8 58.969 58.969 60.255 -1.286 18135 13380 1 15 . 1 1 8 8 SER CB C 8 63.439 63.439 64.048 -0.609 18135 13381 1 15 . 1 1 8 8 SER H H 8 8.180 8.180 7.804 0.376 18135 13382 1 15 . 1 1 9 9 LEU N N 9 123.844 123.844 118.182 5.662 18135 13383 1 15 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.824 -0.669 18135 13384 1 15 . 1 1 9 9 LEU C C 9 178.568 178.568 178.478 0.090 18135 13385 1 15 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.488 0.478 18135 13386 1 15 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.267 -0.471 18135 13387 1 15 . 1 1 9 9 LEU H H 9 8.404 8.404 7.636 0.768 18135 13388 1 15 . 1 1 10 10 GLY N N 10 107.582 107.582 107.255 0.327 18135 13389 1 15 . 1 1 10 10 GLY C C 10 174.586 174.586 176.199 -1.613 18135 13390 1 15 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.285 -0.380 18135 13391 1 15 . 1 1 10 10 GLY H H 10 8.438 8.438 8.510 -0.072 18135 13392 1 15 . 1 1 11 11 SER N N 11 118.806 118.806 116.267 2.539 18135 13393 1 15 . 1 1 11 11 SER HA H 11 4.156 4.156 3.994 0.162 18135 13394 1 15 . 1 1 11 11 SER C C 11 175.749 175.749 176.293 -0.544 18135 13395 1 15 . 1 1 11 11 SER CA C 11 61.299 61.299 61.681 -0.382 18135 13396 1 15 . 1 1 11 11 SER CB C 11 62.653 62.653 63.051 -0.398 18135 13397 1 15 . 1 1 11 11 SER H H 11 8.249 8.249 8.180 0.069 18135 13398 1 15 . 1 1 12 12 ARG N N 12 121.986 121.986 121.518 0.468 18135 13399 1 15 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.021 -0.067 18135 13400 1 15 . 1 1 12 12 ARG C C 12 178.283 178.283 178.350 -0.067 18135 13401 1 15 . 1 1 12 12 ARG CA C 12 59.830 59.830 59.276 0.554 18135 13402 1 15 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.085 -0.501 18135 13403 1 15 . 1 1 12 12 ARG H H 12 8.027 8.027 8.147 -0.120 18135 13404 1 15 . 1 1 13 13 ARG N N 13 119.432 119.432 118.962 0.470 18135 13405 1 15 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.088 -0.249 18135 13406 1 15 . 1 1 13 13 ARG C C 13 178.480 178.480 178.435 0.045 18135 13407 1 15 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.169 1.322 18135 13408 1 15 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.508 0.574 18135 13409 1 15 . 1 1 13 13 ARG H H 13 8.437 8.437 7.850 0.587 18135 13410 1 15 . 1 1 14 14 THR N N 14 116.879 116.879 116.625 0.254 18135 13411 1 15 . 1 1 14 14 THR HA H 14 3.532 3.532 4.182 -0.650 18135 13412 1 15 . 1 1 14 14 THR C C 14 175.584 175.584 177.171 -1.587 18135 13413 1 15 . 1 1 14 14 THR CA C 14 68.036 68.036 66.571 1.465 18135 13414 1 15 . 1 1 14 14 THR CB C 14 67.969 67.969 68.550 -0.581 18135 13415 1 15 . 1 1 14 14 THR H H 14 7.957 7.957 8.215 -0.258 18135 13416 1 15 . 1 1 15 15 LEU N N 15 120.252 120.252 122.448 -2.196 18135 13417 1 15 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.990 -0.044 18135 13418 1 15 . 1 1 15 15 LEU C C 15 178.652 178.652 178.927 -0.275 18135 13419 1 15 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.262 -0.174 18135 13420 1 15 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.772 -0.217 18135 13421 1 15 . 1 1 15 15 LEU H H 15 7.550 7.550 8.119 -0.569 18135 13422 1 15 . 1 1 16 16 MET N N 16 118.788 118.788 117.443 1.345 18135 13423 1 15 . 1 1 16 16 MET HA H 16 4.023 4.023 3.925 0.098 18135 13424 1 15 . 1 1 16 16 MET C C 16 178.718 178.718 178.696 0.022 18135 13425 1 15 . 1 1 16 16 MET CA C 16 58.513 58.513 59.232 -0.719 18135 13426 1 15 . 1 1 16 16 MET CB C 16 32.150 32.150 32.331 -0.181 18135 13427 1 15 . 1 1 16 16 MET H H 16 7.985 7.985 8.295 -0.310 18135 13428 1 15 . 1 1 17 17 LEU N N 17 120.644 120.644 119.561 1.083 18135 13429 1 15 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.988 -0.016 18135 13430 1 15 . 1 1 17 17 LEU C C 17 178.238 178.238 179.163 -0.925 18135 13431 1 15 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.375 -0.648 18135 13432 1 15 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.144 0.991 18135 13433 1 15 . 1 1 17 17 LEU H H 17 7.829 7.829 8.157 -0.328 18135 13434 1 15 . 1 1 18 18 LEU N N 18 118.280 118.280 117.699 0.581 18135 13435 1 15 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.749 -0.243 18135 13436 1 15 . 1 1 18 18 LEU C C 18 175.739 175.739 178.199 -2.460 18135 13437 1 15 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.222 0.434 18135 13438 1 15 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.329 0.913 18135 13439 1 15 . 1 1 18 18 LEU H H 18 7.499 7.499 8.387 -0.888 18135 13440 1 15 . 1 1 19 19 ALA N N 19 121.961 121.961 120.296 1.665 18135 13441 1 15 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.177 -0.340 18135 13442 1 15 . 1 1 19 19 ALA C C 19 180.736 180.736 178.265 2.471 18135 13443 1 15 . 1 1 19 19 ALA CA C 19 55.066 55.066 53.933 1.133 18135 13444 1 15 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.334 -1.258 18135 13445 1 15 . 1 1 19 19 ALA H H 19 7.950 7.950 7.487 0.463 18135 13446 1 15 . 1 1 20 20 GLN N N 20 118.605 118.605 116.178 2.427 18135 13447 1 15 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.190 -0.255 18135 13448 1 15 . 1 1 20 20 GLN C C 20 176.945 176.945 177.463 -0.518 18135 13449 1 15 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.151 0.864 18135 13450 1 15 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.292 -0.818 18135 13451 1 15 . 1 1 20 20 GLN H H 20 7.958 7.958 7.901 0.057 18135 13452 1 15 . 1 1 21 21 MET N N 21 116.693 116.693 118.660 -1.967 18135 13453 1 15 . 1 1 21 21 MET HA H 21 3.861 3.861 4.398 -0.537 18135 13454 1 15 . 1 1 21 21 MET C C 21 174.671 174.671 175.321 -0.650 18135 13455 1 15 . 1 1 21 21 MET CA C 21 57.111 57.111 57.115 -0.004 18135 13456 1 15 . 1 1 21 21 MET CB C 21 34.073 34.073 33.756 0.317 18135 13457 1 15 . 1 1 21 21 MET H H 21 7.420 7.420 7.980 -0.560 18135 13458 1 15 . 1 1 22 22 ARG N N 22 115.451 115.451 120.228 -4.777 18135 13459 1 15 . 1 1 22 22 ARG HA H 22 3.853 3.853 4.157 -0.304 18135 13460 1 15 . 1 1 22 22 ARG C C 22 175.950 175.950 175.170 0.780 18135 13461 1 15 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.530 2.922 18135 13462 1 15 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.406 1.108 18135 13463 1 15 . 1 1 22 22 ARG H H 22 6.484 6.484 7.231 -0.747 18135 13464 1 15 . 1 1 23 23 LYS N N 23 128.593 128.593 123.469 5.124 18135 13465 1 15 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.623 -0.138 18135 13466 1 15 . 1 1 23 23 LYS C C 23 176.643 176.643 175.439 1.204 18135 13467 1 15 . 1 1 23 23 LYS CA C 23 57.287 57.287 56.195 1.092 18135 13468 1 15 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.037 4.224 18135 13469 1 15 . 1 1 23 23 LYS H H 23 10.212 10.212 8.818 1.394 18135 13470 1 15 . 1 1 24 24 ILE N N 24 118.605 118.605 121.901 -3.296 18135 13471 1 15 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.370 0.114 18135 13472 1 15 . 1 1 24 24 ILE C C 24 173.878 173.878 174.293 -0.415 18135 13473 1 15 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.675 -1.078 18135 13474 1 15 . 1 1 24 24 ILE CB C 24 41.456 41.456 40.605 0.851 18135 13475 1 15 . 1 1 24 24 ILE H H 24 8.465 8.465 8.536 -0.071 18135 13476 1 15 . 1 1 25 25 SER N N 25 113.658 113.658 118.410 -4.752 18135 13477 1 15 . 1 1 25 25 SER HA H 25 4.481 4.481 4.968 -0.487 18135 13478 1 15 . 1 1 25 25 SER C C 25 176.359 176.359 175.798 0.561 18135 13479 1 15 . 1 1 25 25 SER CA C 25 56.975 56.975 57.233 -0.258 18135 13480 1 15 . 1 1 25 25 SER CB C 25 64.759 64.759 63.872 0.887 18135 13481 1 15 . 1 1 25 25 SER H H 25 8.104 8.104 8.548 -0.444 18135 13482 1 15 . 1 1 26 26 LEU N N 26 127.566 127.566 125.896 1.670 18135 13483 1 15 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.172 -0.295 18135 13484 1 15 . 1 1 26 26 LEU C C 26 178.946 178.946 176.786 2.160 18135 13485 1 15 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.098 0.580 18135 13486 1 15 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.672 0.047 18135 13487 1 15 . 1 1 26 26 LEU H H 26 8.802 8.802 8.981 -0.179 18135 13488 1 15 . 1 1 27 27 PHE N N 27 117.143 117.143 116.457 0.686 18135 13489 1 15 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.634 -0.396 18135 13490 1 15 . 1 1 27 27 PHE C C 27 177.067 177.067 176.829 0.238 18135 13491 1 15 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.408 1.682 18135 13492 1 15 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.375 -0.113 18135 13493 1 15 . 1 1 27 27 PHE H H 27 7.986 7.986 7.860 0.126 18135 13494 1 15 . 1 1 28 28 SER N N 28 115.200 115.200 116.534 -1.334 18135 13495 1 15 . 1 1 28 28 SER HA H 28 4.505 4.505 4.393 0.112 18135 13496 1 15 . 1 1 28 28 SER C C 28 174.533 174.533 174.892 -0.359 18135 13497 1 15 . 1 1 28 28 SER CA C 28 59.447 59.447 60.794 -1.347 18135 13498 1 15 . 1 1 28 28 SER CB C 28 63.790 63.790 63.619 0.171 18135 13499 1 15 . 1 1 28 28 SER H H 28 7.929 7.929 8.188 -0.259 18135 13500 1 15 . 1 1 29 29 CYS N N 29 119.870 119.870 120.117 -0.247 18135 13501 1 15 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.723 0.359 18135 13502 1 15 . 1 1 29 29 CYS C C 29 176.475 176.475 174.124 2.351 18135 13503 1 15 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.449 -5.019 18135 13504 1 15 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.110 10.132 18135 13505 1 15 . 1 1 29 29 CYS H H 29 7.865 7.865 7.870 -0.005 18135 13506 1 15 . 1 1 30 30 LEU N N 30 122.259 122.259 122.442 -0.183 18135 13507 1 15 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.438 -0.477 18135 13508 1 15 . 1 1 30 30 LEU C C 30 179.774 179.774 178.546 1.228 18135 13509 1 15 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.322 1.981 18135 13510 1 15 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.481 -0.905 18135 13511 1 15 . 1 1 30 30 LEU H H 30 7.812 7.812 8.495 -0.683 18135 13512 1 15 . 1 1 31 31 LYS N N 31 117.731 117.731 115.674 2.057 18135 13513 1 15 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.251 0.439 18135 13514 1 15 . 1 1 31 31 LYS C C 31 176.692 176.692 175.693 0.999 18135 13515 1 15 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.476 -3.399 18135 13516 1 15 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.520 0.067 18135 13517 1 15 . 1 1 31 31 LYS H H 31 8.597 8.597 8.034 0.563 18135 13518 1 15 . 1 1 32 32 ASP N N 32 117.841 117.841 118.447 -0.606 18135 13519 1 15 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.600 0.094 18135 13520 1 15 . 1 1 32 32 ASP C C 32 175.505 175.505 176.092 -0.587 18135 13521 1 15 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.004 0.084 18135 13522 1 15 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.567 -0.759 18135 13523 1 15 . 1 1 32 32 ASP H H 32 7.808 7.808 7.734 0.074 18135 13524 1 15 . 1 1 33 33 ARG N N 33 120.876 120.876 118.348 2.528 18135 13525 1 15 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.086 -0.045 18135 13526 1 15 . 1 1 33 33 ARG C C 33 175.286 175.286 175.990 -0.704 18135 13527 1 15 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.151 -0.068 18135 13528 1 15 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.487 -0.474 18135 13529 1 15 . 1 1 33 33 ARG H H 33 7.378 7.378 7.211 0.167 18135 13530 1 15 . 1 1 34 34 HIS N N 34 120.555 120.555 116.956 3.599 18135 13531 1 15 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.630 -0.418 18135 13532 1 15 . 1 1 34 34 HIS C C 34 170.494 170.494 173.607 -3.113 18135 13533 1 15 . 1 1 34 34 HIS CA C 34 54.607 54.607 55.169 -0.562 18135 13534 1 15 . 1 1 34 34 HIS CB C 34 31.488 31.488 30.328 1.160 18135 13535 1 15 . 1 1 34 34 HIS H H 34 7.974 7.974 7.573 0.401 18135 13536 1 15 . 1 1 35 35 ASP N N 35 125.061 125.061 123.835 1.226 18135 13537 1 15 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.393 0.245 18135 13538 1 15 . 1 1 35 35 ASP C C 35 175.943 175.943 176.339 -0.396 18135 13539 1 15 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.795 -2.426 18135 13540 1 15 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.532 -1.170 18135 13541 1 15 . 1 1 35 35 ASP H H 35 7.805 7.805 8.306 -0.501 18135 13542 1 15 . 1 1 36 36 PHE N N 36 122.860 122.860 120.442 2.418 18135 13543 1 15 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.438 -0.113 18135 13544 1 15 . 1 1 36 36 PHE C C 36 176.643 176.643 176.272 0.371 18135 13545 1 15 . 1 1 36 36 PHE CA C 36 59.639 59.639 59.389 0.250 18135 13546 1 15 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.257 1.434 18135 13547 1 15 . 1 1 36 36 PHE H H 36 8.973 8.973 7.626 1.347 18135 13548 1 15 . 1 1 37 37 GLY N N 37 111.856 111.856 107.879 3.977 18135 13549 1 15 . 1 1 37 37 GLY C C 37 175.185 175.185 174.404 0.781 18135 13550 1 15 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.690 3.453 18135 13551 1 15 . 1 1 37 37 GLY H H 37 8.727 8.727 8.192 0.535 18135 13552 1 15 . 1 1 38 38 PHE N N 38 123.178 123.178 119.367 3.811 18135 13553 1 15 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.830 -0.916 18135 13554 1 15 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.347 2.457 18135 13555 1 15 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.557 0.100 18135 13556 1 15 . 1 1 38 38 PHE H H 38 9.169 9.169 7.249 1.920 18135 13557 1 15 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.491 0.038 18135 13558 1 15 . 1 1 39 39 PRO C C 39 174.634 174.634 176.945 -2.311 18135 13559 1 15 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.724 -1.181 18135 13560 1 15 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.910 -2.206 18135 13561 1 15 . 1 1 40 40 GLN N N 40 123.608 123.608 124.567 -0.959 18135 13562 1 15 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.275 -0.656 18135 13563 1 15 . 1 1 40 40 GLN C C 40 176.958 176.958 177.604 -0.646 18135 13564 1 15 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.813 -0.740 18135 13565 1 15 . 1 1 40 40 GLN CB C 40 28.817 28.817 28.023 0.794 18135 13566 1 15 . 1 1 40 40 GLN H H 40 7.966 7.966 8.472 -0.506 18135 13567 1 15 . 1 1 41 41 GLU N N 41 119.446 119.446 118.053 1.393 18135 13568 1 15 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.195 -0.058 18135 13569 1 15 . 1 1 41 41 GLU C C 41 177.346 177.346 178.069 -0.723 18135 13570 1 15 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.091 -1.162 18135 13571 1 15 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.293 -1.460 18135 13572 1 15 . 1 1 41 41 GLU H H 41 9.044 9.044 8.764 0.280 18135 13573 1 15 . 1 1 42 42 GLU N N 42 117.196 117.196 117.681 -0.485 18135 13574 1 15 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.319 -0.256 18135 13575 1 15 . 1 1 42 42 GLU C C 42 174.886 174.886 177.788 -2.902 18135 13576 1 15 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.869 -1.485 18135 13577 1 15 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.089 -2.531 18135 13578 1 15 . 1 1 42 42 GLU H H 42 7.646 7.646 7.891 -0.245 18135 13579 1 15 . 1 1 43 43 PHE N N 43 115.527 115.527 121.477 -5.950 18135 13580 1 15 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.708 -0.222 18135 13581 1 15 . 1 1 43 43 PHE C C 43 175.615 175.615 175.893 -0.278 18135 13582 1 15 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.283 -0.735 18135 13583 1 15 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.666 -0.773 18135 13584 1 15 . 1 1 43 43 PHE H H 43 7.601 7.601 8.643 -1.042 18135 13585 1 15 . 1 1 44 44 GLY N N 44 107.243 107.243 108.676 -1.433 18135 13586 1 15 . 1 1 44 44 GLY C C 44 174.032 174.032 173.727 0.305 18135 13587 1 15 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.362 0.250 18135 13588 1 15 . 1 1 44 44 GLY H H 44 7.733 7.733 7.761 -0.028 18135 13589 1 15 . 1 1 45 45 ASN N N 45 117.599 117.599 121.141 -3.542 18135 13590 1 15 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.791 -0.240 18135 13591 1 15 . 1 1 45 45 ASN C C 45 175.894 175.894 175.703 0.191 18135 13592 1 15 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.147 1.702 18135 13593 1 15 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.316 -0.897 18135 13594 1 15 . 1 1 45 45 ASN H H 45 8.343 8.343 7.864 0.479 18135 13595 1 15 . 1 1 46 46 GLN N N 46 118.916 118.916 118.624 0.292 18135 13596 1 15 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.124 -0.042 18135 13597 1 15 . 1 1 46 46 GLN C C 46 175.851 175.851 175.801 0.050 18135 13598 1 15 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.693 0.953 18135 13599 1 15 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.483 0.961 18135 13600 1 15 . 1 1 46 46 GLN H H 46 8.652 8.652 8.611 0.041 18135 13601 1 15 . 1 1 47 47 PHE N N 47 119.511 119.511 113.777 5.734 18135 13602 1 15 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.556 0.006 18135 13603 1 15 . 1 1 47 47 PHE C C 47 176.258 176.258 175.101 1.157 18135 13604 1 15 . 1 1 47 47 PHE CA C 47 57.920 57.920 56.732 1.188 18135 13605 1 15 . 1 1 47 47 PHE CB C 47 39.858 39.858 38.192 1.666 18135 13606 1 15 . 1 1 47 47 PHE H H 47 7.904 7.904 7.345 0.559 18135 13607 1 15 . 1 1 48 48 GLN N N 48 120.127 120.127 120.253 -0.126 18135 13608 1 15 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.351 0.024 18135 13609 1 15 . 1 1 48 48 GLN C C 48 181.265 181.265 175.628 5.637 18135 13610 1 15 . 1 1 48 48 GLN CA C 48 55.576 55.576 53.927 1.649 18135 13611 1 15 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.542 -1.074 18135 13612 1 15 . 1 1 48 48 GLN H H 48 8.255 8.255 7.386 0.869 18135 13613 1 15 . 1 1 49 49 LYS N N 49 121.777 121.777 120.555 1.222 18135 13614 1 15 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.365 -0.262 18135 13615 1 15 . 1 1 49 49 LYS C C 49 177.968 177.968 177.197 0.771 18135 13616 1 15 . 1 1 49 49 LYS CA C 49 58.149 58.149 57.768 0.381 18135 13617 1 15 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.298 0.092 18135 13618 1 15 . 1 1 49 49 LYS H H 49 8.426 8.426 8.524 -0.098 18135 13619 1 15 . 1 1 50 50 ALA N N 50 120.573 120.573 120.414 0.159 18135 13620 1 15 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.355 -0.285 18135 13621 1 15 . 1 1 50 50 ALA C C 50 178.697 178.697 177.204 1.493 18135 13622 1 15 . 1 1 50 50 ALA CA C 50 54.768 54.768 52.793 1.975 18135 13623 1 15 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.366 0.508 18135 13624 1 15 . 1 1 50 50 ALA H H 50 8.578 8.578 8.144 0.434 18135 13625 1 15 . 1 1 51 51 GLU N N 51 115.015 115.015 116.892 -1.877 18135 13626 1 15 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.282 -0.016 18135 13627 1 15 . 1 1 51 51 GLU C C 51 176.995 176.995 176.719 0.276 18135 13628 1 15 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.244 -0.251 18135 13629 1 15 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.646 -0.741 18135 13630 1 15 . 1 1 51 51 GLU H H 51 7.907 7.907 8.330 -0.423 18135 13631 1 15 . 1 1 52 52 THR N N 52 111.210 111.210 113.876 -2.666 18135 13632 1 15 . 1 1 52 52 THR HA H 52 4.114 4.114 4.314 -0.200 18135 13633 1 15 . 1 1 52 52 THR C C 52 175.271 175.271 175.807 -0.536 18135 13634 1 15 . 1 1 52 52 THR CA C 52 63.611 63.611 64.385 -0.774 18135 13635 1 15 . 1 1 52 52 THR CB C 52 69.673 69.673 68.550 1.123 18135 13636 1 15 . 1 1 52 52 THR H H 52 7.863 7.863 7.975 -0.112 18135 13637 1 15 . 1 1 53 53 ILE N N 53 119.113 119.113 121.841 -2.728 18135 13638 1 15 . 1 1 53 53 ILE HA H 53 3.864 3.864 3.996 -0.132 18135 13639 1 15 . 1 1 53 53 ILE CA C 53 66.907 66.907 66.492 0.415 18135 13640 1 15 . 1 1 53 53 ILE CB C 53 34.953 34.953 35.973 -1.020 18135 13641 1 15 . 1 1 53 53 ILE H H 53 8.341 8.341 8.289 0.052 18135 13642 1 15 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.526 -0.240 18135 13643 1 15 . 1 1 54 54 PRO C C 54 179.655 179.655 178.990 0.665 18135 13644 1 15 . 1 1 54 54 PRO CA C 54 66.051 66.051 65.971 0.080 18135 13645 1 15 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.408 0.477 18135 13646 1 15 . 1 1 55 55 VAL N N 55 116.355 116.355 116.341 0.014 18135 13647 1 15 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.875 -0.194 18135 13648 1 15 . 1 1 55 55 VAL C C 55 177.649 177.649 178.063 -0.414 18135 13649 1 15 . 1 1 55 55 VAL CA C 55 65.837 65.837 66.249 -0.412 18135 13650 1 15 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.181 0.290 18135 13651 1 15 . 1 1 55 55 VAL H H 55 7.119 7.119 7.475 -0.356 18135 13652 1 15 . 1 1 56 56 LEU N N 56 123.038 123.038 120.918 2.120 18135 13653 1 15 . 1 1 56 56 LEU HA H 56 4.310 4.310 3.967 0.343 18135 13654 1 15 . 1 1 56 56 LEU C C 56 178.637 178.637 177.833 0.804 18135 13655 1 15 . 1 1 56 56 LEU CA C 56 58.086 58.086 59.018 -0.932 18135 13656 1 15 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.969 0.349 18135 13657 1 15 . 1 1 56 56 LEU H H 56 8.535 8.535 8.355 0.180 18135 13658 1 15 . 1 1 57 57 HIS N N 57 117.041 117.041 118.133 -1.092 18135 13659 1 15 . 1 1 57 57 HIS HA H 57 3.786 3.786 3.997 -0.211 18135 13660 1 15 . 1 1 57 57 HIS C C 57 175.640 175.640 177.219 -1.579 18135 13661 1 15 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.715 0.816 18135 13662 1 15 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.134 -1.925 18135 13663 1 15 . 1 1 57 57 HIS H H 57 9.047 9.047 8.137 0.910 18135 13664 1 15 . 1 1 58 58 GLU N N 58 119.521 119.521 118.650 0.871 18135 13665 1 15 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.827 0.180 18135 13666 1 15 . 1 1 58 58 GLU C C 58 179.029 179.029 178.985 0.044 18135 13667 1 15 . 1 1 58 58 GLU CA C 58 58.967 58.967 58.867 0.099 18135 13668 1 15 . 1 1 58 58 GLU CB C 58 28.290 28.290 28.903 -0.613 18135 13669 1 15 . 1 1 58 58 GLU H H 58 7.860 7.860 8.260 -0.400 18135 13670 1 15 . 1 1 59 59 MET N N 59 119.512 119.512 119.449 0.063 18135 13671 1 15 . 1 1 59 59 MET HA H 59 4.074 4.074 4.292 -0.218 18135 13672 1 15 . 1 1 59 59 MET C C 59 177.031 177.031 178.858 -1.827 18135 13673 1 15 . 1 1 59 59 MET CA C 59 59.408 59.408 59.317 0.091 18135 13674 1 15 . 1 1 59 59 MET CB C 59 32.525 32.525 32.706 -0.181 18135 13675 1 15 . 1 1 59 59 MET H H 59 8.442 8.442 7.916 0.526 18135 13676 1 15 . 1 1 60 60 ILE N N 60 117.183 117.183 117.608 -0.425 18135 13677 1 15 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.521 -0.104 18135 13678 1 15 . 1 1 60 60 ILE C C 60 177.524 177.524 178.178 -0.654 18135 13679 1 15 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.748 0.578 18135 13680 1 15 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.027 -0.167 18135 13681 1 15 . 1 1 60 60 ILE H H 60 8.338 8.338 7.749 0.589 18135 13682 1 15 . 1 1 61 61 GLN N N 61 120.191 120.191 120.211 -0.020 18135 13683 1 15 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.712 -0.010 18135 13684 1 15 . 1 1 61 61 GLN C C 61 178.270 178.270 177.776 0.494 18135 13685 1 15 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.220 -0.434 18135 13686 1 15 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.176 0.490 18135 13687 1 15 . 1 1 61 61 GLN H H 61 8.234 8.234 8.138 0.096 18135 13688 1 15 . 1 1 62 62 GLN N N 62 116.795 116.795 118.675 -1.880 18135 13689 1 15 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.168 0.459 18135 13690 1 15 . 1 1 62 62 GLN C C 62 179.685 179.685 178.420 1.265 18135 13691 1 15 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.191 -0.183 18135 13692 1 15 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.714 -3.372 18135 13693 1 15 . 1 1 62 62 GLN H H 62 8.421 8.421 8.104 0.317 18135 13694 1 15 . 1 1 63 63 ILE N N 63 122.797 122.797 120.062 2.735 18135 13695 1 15 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.877 -0.228 18135 13696 1 15 . 1 1 63 63 ILE C C 63 177.279 177.279 177.849 -0.570 18135 13697 1 15 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.510 2.455 18135 13698 1 15 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.770 -0.455 18135 13699 1 15 . 1 1 63 63 ILE H H 63 8.164 8.164 7.605 0.559 18135 13700 1 15 . 1 1 64 64 PHE N N 64 120.820 120.820 121.281 -0.461 18135 13701 1 15 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.404 -0.688 18135 13702 1 15 . 1 1 64 64 PHE C C 64 178.402 178.402 176.650 1.752 18135 13703 1 15 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.215 0.937 18135 13704 1 15 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.610 -0.100 18135 13705 1 15 . 1 1 64 64 PHE H H 64 8.405 8.405 7.924 0.481 18135 13706 1 15 . 1 1 65 65 ASN N N 65 119.981 119.981 118.515 1.466 18135 13707 1 15 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.786 0.277 18135 13708 1 15 . 1 1 65 65 ASN C C 65 177.944 177.944 177.514 0.430 18135 13709 1 15 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.327 -0.459 18135 13710 1 15 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.573 -1.317 18135 13711 1 15 . 1 1 65 65 ASN H H 65 8.812 8.812 7.980 0.832 18135 13712 1 15 . 1 1 66 66 LEU N N 66 121.533 121.533 120.841 0.692 18135 13713 1 15 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.230 -0.007 18135 13714 1 15 . 1 1 66 66 LEU C C 66 177.777 177.777 179.211 -1.434 18135 13715 1 15 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.863 0.405 18135 13716 1 15 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.062 0.545 18135 13717 1 15 . 1 1 66 66 LEU H H 66 8.177 8.177 7.940 0.237 18135 13718 1 15 . 1 1 67 67 PHE N N 67 110.842 110.842 113.647 -2.805 18135 13719 1 15 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.617 0.263 18135 13720 1 15 . 1 1 67 67 PHE C C 67 177.965 177.965 176.159 1.806 18135 13721 1 15 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.605 0.929 18135 13722 1 15 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.858 -0.242 18135 13723 1 15 . 1 1 67 67 PHE H H 67 8.160 8.160 8.363 -0.203 18135 13724 1 15 . 1 1 68 68 SER N N 68 119.131 119.131 113.144 5.987 18135 13725 1 15 . 1 1 68 68 SER HA H 68 4.580 4.580 4.250 0.330 18135 13726 1 15 . 1 1 68 68 SER C C 68 173.472 173.472 174.865 -1.393 18135 13727 1 15 . 1 1 68 68 SER CA C 68 59.191 59.191 58.674 0.517 18135 13728 1 15 . 1 1 68 68 SER CB C 68 63.123 63.123 63.640 -0.517 18135 13729 1 15 . 1 1 68 68 SER H H 68 8.016 8.016 7.523 0.493 18135 13730 1 15 . 1 1 69 69 THR N N 69 111.353 111.353 115.327 -3.974 18135 13731 1 15 . 1 1 69 69 THR HA H 69 4.345 4.345 4.381 -0.036 18135 13732 1 15 . 1 1 69 69 THR C C 69 175.661 175.661 174.810 0.851 18135 13733 1 15 . 1 1 69 69 THR CA C 69 61.411 61.411 60.655 0.756 18135 13734 1 15 . 1 1 69 69 THR CB C 69 72.209 72.209 70.453 1.756 18135 13735 1 15 . 1 1 69 69 THR H H 69 6.977 6.977 7.326 -0.349 18135 13736 1 15 . 1 1 70 70 LYS N N 70 121.120 121.120 122.994 -1.874 18135 13737 1 15 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.105 -0.016 18135 13738 1 15 . 1 1 70 70 LYS C C 70 179.259 179.259 177.500 1.759 18135 13739 1 15 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.952 -0.996 18135 13740 1 15 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.470 -0.720 18135 13741 1 15 . 1 1 70 70 LYS H H 70 9.065 9.065 8.614 0.451 18135 13742 1 15 . 1 1 71 71 ASP N N 71 116.374 116.374 119.927 -3.553 18135 13743 1 15 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.293 -0.118 18135 13744 1 15 . 1 1 71 71 ASP C C 71 178.372 178.372 177.800 0.572 18135 13745 1 15 . 1 1 71 71 ASP CA C 71 57.067 57.067 56.967 0.100 18135 13746 1 15 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.532 -0.226 18135 13747 1 15 . 1 1 71 71 ASP H H 71 7.518 7.518 7.737 -0.219 18135 13748 1 15 . 1 1 72 72 SER N N 72 117.341 117.341 115.340 2.001 18135 13749 1 15 . 1 1 72 72 SER HA H 72 3.715 3.715 3.172 0.543 18135 13750 1 15 . 1 1 72 72 SER C C 72 176.897 176.897 176.212 0.685 18135 13751 1 15 . 1 1 72 72 SER CA C 72 60.267 60.267 60.615 -0.348 18135 13752 1 15 . 1 1 72 72 SER CB C 72 62.616 62.616 62.802 -0.186 18135 13753 1 15 . 1 1 72 72 SER H H 72 8.066 8.066 8.397 -0.331 18135 13754 1 15 . 1 1 73 73 SER N N 73 113.398 113.398 118.367 -4.969 18135 13755 1 15 . 1 1 73 73 SER HA H 73 4.094 4.094 4.083 0.011 18135 13756 1 15 . 1 1 73 73 SER C C 73 174.855 174.855 174.405 0.450 18135 13757 1 15 . 1 1 73 73 SER CA C 73 61.385 61.385 60.930 0.455 18135 13758 1 15 . 1 1 73 73 SER CB C 73 62.798 62.798 63.153 -0.355 18135 13759 1 15 . 1 1 73 73 SER H H 73 7.982 7.982 7.707 0.275 18135 13760 1 15 . 1 1 74 74 ALA N N 74 119.486 119.486 119.073 0.413 18135 13761 1 15 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.255 -0.098 18135 13762 1 15 . 1 1 74 74 ALA C C 74 177.626 177.626 177.154 0.472 18135 13763 1 15 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.043 0.670 18135 13764 1 15 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.795 -0.048 18135 13765 1 15 . 1 1 74 74 ALA H H 74 7.095 7.095 7.201 -0.106 18135 13766 1 15 . 1 1 75 75 ALA N N 75 121.465 121.465 121.404 0.061 18135 13767 1 15 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.821 -0.125 18135 13768 1 15 . 1 1 75 75 ALA C C 75 177.197 177.197 175.380 1.817 18135 13769 1 15 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.871 1.133 18135 13770 1 15 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.364 -1.104 18135 13771 1 15 . 1 1 75 75 ALA H H 75 7.159 7.159 7.422 -0.263 18135 13772 1 15 . 1 1 76 76 TRP N N 76 116.791 116.791 116.160 0.631 18135 13773 1 15 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.693 0.357 18135 13774 1 15 . 1 1 76 76 TRP C C 76 177.617 177.617 174.889 2.728 18135 13775 1 15 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.236 -1.917 18135 13776 1 15 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.116 1.960 18135 13777 1 15 . 1 1 76 76 TRP H H 76 7.080 7.080 7.106 -0.026 18135 13778 1 15 . 1 1 77 77 ASP N N 77 119.928 119.928 121.568 -1.640 18135 13779 1 15 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.527 -0.170 18135 13780 1 15 . 1 1 77 77 ASP C C 77 176.877 176.877 177.716 -0.839 18135 13781 1 15 . 1 1 77 77 ASP CA C 77 54.818 54.818 56.135 -1.317 18135 13782 1 15 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.983 0.632 18135 13783 1 15 . 1 1 77 77 ASP H H 77 8.259 8.259 8.375 -0.116 18135 13784 1 15 . 1 1 78 78 GLU N N 78 127.277 127.277 125.279 1.998 18135 13785 1 15 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.948 -0.063 18135 13786 1 15 . 1 1 78 78 GLU C C 78 177.439 177.439 178.335 -0.896 18135 13787 1 15 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.905 -0.521 18135 13788 1 15 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.301 -0.659 18135 13789 1 15 . 1 1 78 78 GLU H H 78 8.920 8.920 8.956 -0.036 18135 13790 1 15 . 1 1 79 79 THR N N 79 115.422 115.422 117.310 -1.888 18135 13791 1 15 . 1 1 79 79 THR HA H 79 3.907 3.907 4.034 -0.127 18135 13792 1 15 . 1 1 79 79 THR C C 79 177.330 177.330 176.518 0.812 18135 13793 1 15 . 1 1 79 79 THR CA C 79 66.263 66.263 65.848 0.415 18135 13794 1 15 . 1 1 79 79 THR CB C 79 68.002 68.002 68.440 -0.438 18135 13795 1 15 . 1 1 79 79 THR H H 79 8.124 8.124 8.236 -0.112 18135 13796 1 15 . 1 1 80 80 LEU N N 80 121.791 121.791 122.339 -0.548 18135 13797 1 15 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.157 -0.270 18135 13798 1 15 . 1 1 80 80 LEU C C 80 179.018 179.018 178.945 0.073 18135 13799 1 15 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.671 -0.432 18135 13800 1 15 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.161 0.491 18135 13801 1 15 . 1 1 80 80 LEU H H 80 7.725 7.725 8.045 -0.320 18135 13802 1 15 . 1 1 81 81 LEU N N 81 119.280 119.280 120.649 -1.369 18135 13803 1 15 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.231 -0.742 18135 13804 1 15 . 1 1 81 81 LEU C C 81 177.062 177.062 178.891 -1.829 18135 13805 1 15 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.684 -0.975 18135 13806 1 15 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.044 -1.096 18135 13807 1 15 . 1 1 81 81 LEU H H 81 8.344 8.344 8.850 -0.506 18135 13808 1 15 . 1 1 82 82 ASP N N 82 115.357 115.357 119.825 -4.468 18135 13809 1 15 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.457 -0.183 18135 13810 1 15 . 1 1 82 82 ASP C C 82 179.018 179.018 178.688 0.330 18135 13811 1 15 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.367 -0.552 18135 13812 1 15 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.812 -2.591 18135 13813 1 15 . 1 1 82 82 ASP H H 82 8.001 8.001 8.579 -0.578 18135 13814 1 15 . 1 1 83 83 LYS N N 83 119.603 119.603 119.047 0.556 18135 13815 1 15 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.864 0.118 18135 13816 1 15 . 1 1 83 83 LYS C C 83 178.624 178.624 178.792 -0.168 18135 13817 1 15 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.934 0.811 18135 13818 1 15 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.235 0.871 18135 13819 1 15 . 1 1 83 83 LYS H H 83 7.342 7.342 7.673 -0.331 18135 13820 1 15 . 1 1 84 84 PHE N N 84 123.933 123.933 121.729 2.204 18135 13821 1 15 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.036 -0.001 18135 13822 1 15 . 1 1 84 84 PHE C C 84 177.210 177.210 177.092 0.118 18135 13823 1 15 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.828 -1.485 18135 13824 1 15 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.886 0.430 18135 13825 1 15 . 1 1 84 84 PHE H H 84 8.471 8.471 8.545 -0.074 18135 13826 1 15 . 1 1 85 85 TYR N N 85 118.387 118.387 117.505 0.882 18135 13827 1 15 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.735 0.333 18135 13828 1 15 . 1 1 85 85 TYR C C 85 178.104 178.104 177.368 0.736 18135 13829 1 15 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.904 -1.327 18135 13830 1 15 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.206 -0.229 18135 13831 1 15 . 1 1 85 85 TYR H H 85 9.011 9.011 8.992 0.019 18135 13832 1 15 . 1 1 86 86 THR N N 86 114.035 114.035 115.895 -1.860 18135 13833 1 15 . 1 1 86 86 THR HA H 86 3.945 3.945 3.252 0.693 18135 13834 1 15 . 1 1 86 86 THR C C 86 176.708 176.708 176.544 0.164 18135 13835 1 15 . 1 1 86 86 THR CA C 86 66.759 66.759 66.340 0.419 18135 13836 1 15 . 1 1 86 86 THR CB C 86 68.853 68.853 67.742 1.111 18135 13837 1 15 . 1 1 86 86 THR H H 86 7.609 7.609 7.277 0.332 18135 13838 1 15 . 1 1 87 87 GLU N N 87 120.790 120.790 121.355 -0.565 18135 13839 1 15 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.935 0.112 18135 13840 1 15 . 1 1 87 87 GLU C C 87 179.606 179.606 178.823 0.783 18135 13841 1 15 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.182 -0.784 18135 13842 1 15 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.097 -0.811 18135 13843 1 15 . 1 1 87 87 GLU H H 87 7.712 7.712 7.664 0.048 18135 13844 1 15 . 1 1 88 88 LEU N N 88 120.729 120.729 120.003 0.726 18135 13845 1 15 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.881 -0.153 18135 13846 1 15 . 1 1 88 88 LEU C C 88 178.695 178.695 179.260 -0.565 18135 13847 1 15 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.306 0.945 18135 13848 1 15 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.001 1.586 18135 13849 1 15 . 1 1 88 88 LEU H H 88 8.393 8.393 7.469 0.924 18135 13850 1 15 . 1 1 89 89 TYR N N 89 118.654 118.654 118.614 0.040 18135 13851 1 15 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.070 -0.139 18135 13852 1 15 . 1 1 89 89 TYR C C 89 178.438 178.438 178.593 -0.155 18135 13853 1 15 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.324 0.083 18135 13854 1 15 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.414 0.453 18135 13855 1 15 . 1 1 89 89 TYR H H 89 8.637 8.637 8.322 0.315 18135 13856 1 15 . 1 1 90 90 GLN N N 90 118.263 118.263 116.413 1.850 18135 13857 1 15 . 1 1 90 90 GLN HA H 90 3.986 3.986 4.000 -0.014 18135 13858 1 15 . 1 1 90 90 GLN C C 90 178.411 178.411 178.800 -0.389 18135 13859 1 15 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.597 0.185 18135 13860 1 15 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.296 -0.149 18135 13861 1 15 . 1 1 90 90 GLN H H 90 7.796 7.796 7.825 -0.029 18135 13862 1 15 . 1 1 91 91 GLN N N 91 117.959 117.959 120.328 -2.369 18135 13863 1 15 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.074 0.008 18135 13864 1 15 . 1 1 91 91 GLN C C 91 178.705 178.705 178.549 0.156 18135 13865 1 15 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.781 0.039 18135 13866 1 15 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.390 0.783 18135 13867 1 15 . 1 1 91 91 GLN H H 91 7.727 7.727 8.150 -0.423 18135 13868 1 15 . 1 1 92 92 LEU N N 92 119.965 119.965 118.416 1.549 18135 13869 1 15 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.972 -0.238 18135 13870 1 15 . 1 1 92 92 LEU C C 92 178.984 178.984 178.672 0.312 18135 13871 1 15 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.969 -0.477 18135 13872 1 15 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.834 0.546 18135 13873 1 15 . 1 1 92 92 LEU H H 92 8.465 8.465 8.467 -0.002 18135 13874 1 15 . 1 1 93 93 ASN N N 93 117.793 117.793 118.249 -0.456 18135 13875 1 15 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.278 0.123 18135 13876 1 15 . 1 1 93 93 ASN C C 93 178.309 178.309 177.142 1.167 18135 13877 1 15 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.244 0.159 18135 13878 1 15 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.247 0.391 18135 13879 1 15 . 1 1 93 93 ASN H H 93 8.091 8.091 8.014 0.077 18135 13880 1 15 . 1 1 94 94 ASP N N 94 121.133 121.133 120.821 0.312 18135 13881 1 15 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.356 0.049 18135 13882 1 15 . 1 1 94 94 ASP C C 94 178.328 178.328 178.671 -0.343 18135 13883 1 15 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.444 -0.897 18135 13884 1 15 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.989 -2.340 18135 13885 1 15 . 1 1 94 94 ASP H H 94 8.362 8.362 7.951 0.411 18135 13886 1 15 . 1 1 95 95 LEU N N 95 119.160 119.160 120.989 -1.829 18135 13887 1 15 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.844 0.195 18135 13888 1 15 . 1 1 95 95 LEU C C 95 178.826 178.826 178.294 0.532 18135 13889 1 15 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.085 -1.058 18135 13890 1 15 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.105 0.105 18135 13891 1 15 . 1 1 95 95 LEU H H 95 8.143 8.143 8.494 -0.351 18135 13892 1 15 . 1 1 96 96 GLU N N 96 118.813 118.813 118.832 -0.019 18135 13893 1 15 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.715 0.246 18135 13894 1 15 . 1 1 96 96 GLU C C 96 177.640 177.640 178.255 -0.615 18135 13895 1 15 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.453 -1.739 18135 13896 1 15 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.448 -1.310 18135 13897 1 15 . 1 1 96 96 GLU H H 96 8.111 8.111 8.278 -0.167 18135 13898 1 15 . 1 1 97 97 ALA N N 97 120.549 120.549 120.953 -0.404 18135 13899 1 15 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.973 0.149 18135 13900 1 15 . 1 1 97 97 ALA C C 97 179.126 179.126 180.272 -1.146 18135 13901 1 15 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.743 -0.710 18135 13902 1 15 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.886 0.094 18135 13903 1 15 . 1 1 97 97 ALA H H 97 7.798 7.798 7.777 0.021 18135 13904 1 15 . 1 1 98 98 CYS N N 98 115.510 115.510 117.362 -1.852 18135 13905 1 15 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.107 0.343 18135 13906 1 15 . 1 1 98 98 CYS C C 98 175.363 175.363 176.297 -0.934 18135 13907 1 15 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.356 -5.191 18135 13908 1 15 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.124 15.755 18135 13909 1 15 . 1 1 98 98 CYS H H 98 7.597 7.597 7.698 -0.101 18135 13910 1 15 . 1 1 99 99 VAL N N 99 121.713 121.713 118.768 2.945 18135 13911 1 15 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.810 -0.016 18135 13912 1 15 . 1 1 99 99 VAL C C 99 177.357 177.357 177.943 -0.586 18135 13913 1 15 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.490 -0.907 18135 13914 1 15 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.309 -0.278 18135 13915 1 15 . 1 1 99 99 VAL H H 99 7.828 7.828 7.482 0.346 18135 13916 1 15 . 1 1 100 100 ILE N N 100 122.333 122.333 118.211 4.122 18135 13917 1 15 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.697 0.227 18135 13918 1 15 . 1 1 100 100 ILE C C 100 176.827 176.827 176.517 0.310 18135 13919 1 15 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.691 -1.454 18135 13920 1 15 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.693 0.585 18135 13921 1 15 . 1 1 100 100 ILE H H 100 8.067 8.067 8.262 -0.195 18135 13922 1 15 . 1 1 101 101 GLN N N 101 121.864 121.864 117.450 4.414 18135 13923 1 15 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.198 0.028 18135 13924 1 15 . 1 1 101 101 GLN C C 101 176.438 176.438 178.079 -1.641 18135 13925 1 15 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.593 -0.273 18135 13926 1 15 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.138 -0.127 18135 13927 1 15 . 1 1 101 101 GLN H H 101 8.062 8.062 7.407 0.655 18135 13928 1 15 . 1 1 102 102 GLY N N 102 109.288 109.288 108.305 0.983 18135 13929 1 15 . 1 1 102 102 GLY C C 102 173.855 173.855 175.450 -1.595 18135 13930 1 15 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.238 -1.079 18135 13931 1 15 . 1 1 102 102 GLY H H 102 8.087 8.087 8.804 -0.717 18135 13932 1 15 . 1 1 103 103 VAL N N 103 118.932 118.932 115.121 3.811 18135 13933 1 15 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.795 0.279 18135 13934 1 15 . 1 1 103 103 VAL C C 103 176.299 176.299 175.929 0.370 18135 13935 1 15 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.801 -1.302 18135 13936 1 15 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.500 1.353 18135 13937 1 15 . 1 1 103 103 VAL H H 103 8.079 8.079 7.530 0.549 18135 13938 1 15 . 1 1 104 104 GLY N N 104 112.028 112.028 108.727 3.301 18135 13939 1 15 . 1 1 104 104 GLY C C 104 173.694 173.694 172.776 0.918 18135 13940 1 15 . 1 1 104 104 GLY CA C 104 45.402 45.402 44.877 0.525 18135 13941 1 15 . 1 1 104 104 GLY H H 104 8.446 8.446 7.698 0.748 18135 13942 1 15 . 1 1 105 105 VAL N N 105 120.439 120.439 121.166 -0.727 18135 13943 1 15 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.392 -0.204 18135 13944 1 15 . 1 1 105 105 VAL C C 105 175.963 175.963 173.917 2.046 18135 13945 1 15 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.933 1.203 18135 13946 1 15 . 1 1 105 105 VAL CB C 105 32.814 32.814 33.544 -0.730 18135 13947 1 15 . 1 1 105 105 VAL H H 105 7.867 7.867 7.896 -0.029 18135 13948 1 15 . 1 1 106 106 THR N N 106 116.366 116.366 116.959 -0.593 18135 13949 1 15 . 1 1 106 106 THR HA H 106 4.548 4.548 4.599 -0.051 18135 13950 1 15 . 1 1 106 106 THR C C 106 173.731 173.731 173.497 0.234 18135 13951 1 15 . 1 1 106 106 THR CA C 106 59.419 59.419 60.039 -0.620 18135 13952 1 15 . 1 1 106 106 THR CB C 106 79.536 79.536 71.186 8.350 18135 13953 1 15 . 1 1 106 106 THR H H 106 8.565 8.565 8.013 0.552 18135 13954 1 15 . 1 1 107 107 GLU N N 107 119.743 119.743 120.600 -0.857 18135 13955 1 15 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.642 -0.180 18135 13956 1 15 . 1 1 107 107 GLU C C 107 175.639 175.639 176.422 -0.783 18135 13957 1 15 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.959 0.752 18135 13958 1 15 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.162 -0.663 18135 13959 1 15 . 1 1 107 107 GLU H H 107 8.410 8.410 8.419 -0.009 18135 13960 1 15 . 1 1 108 108 THR N N 108 114.402 114.402 110.845 3.557 18135 13961 1 15 . 1 1 108 108 THR HA H 108 4.448 4.448 4.881 -0.433 18135 13962 1 15 . 1 1 108 108 THR CA C 108 60.348 60.348 58.279 2.070 18135 13963 1 15 . 1 1 108 108 THR CB C 108 68.544 68.544 69.512 -0.968 18135 13964 1 15 . 1 1 108 108 THR H H 108 8.155 8.155 8.498 -0.343 18135 13965 1 15 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.426 -0.188 18135 13966 1 15 . 1 1 109 109 PRO C C 109 178.666 178.666 177.732 0.934 18135 13967 1 15 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.127 1.249 18135 13968 1 15 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.949 -0.101 18135 13969 1 15 . 1 1 110 110 LEU N N 110 118.566 118.566 119.083 -0.517 18135 13970 1 15 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.117 -0.001 18135 13971 1 15 . 1 1 110 110 LEU C C 110 178.293 178.293 179.127 -0.834 18135 13972 1 15 . 1 1 110 110 LEU CA C 110 56.686 56.686 58.308 -1.622 18135 13973 1 15 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.662 0.307 18135 13974 1 15 . 1 1 110 110 LEU H H 110 8.016 8.016 7.880 0.136 18135 13975 1 15 . 1 1 111 111 MET N N 111 118.982 118.982 116.097 2.885 18135 13976 1 15 . 1 1 111 111 MET HA H 111 4.210 4.210 4.228 -0.018 18135 13977 1 15 . 1 1 111 111 MET C C 111 178.720 178.720 177.622 1.098 18135 13978 1 15 . 1 1 111 111 MET CA C 111 58.144 58.144 58.004 0.140 18135 13979 1 15 . 1 1 111 111 MET CB C 111 32.374 32.374 32.438 -0.064 18135 13980 1 15 . 1 1 111 111 MET H H 111 7.705 7.705 8.113 -0.408 18135 13981 1 15 . 1 1 112 112 LYS N N 112 121.377 121.377 120.128 1.249 18135 13982 1 15 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.189 -0.082 18135 13983 1 15 . 1 1 112 112 LYS C C 112 178.000 178.000 178.473 -0.473 18135 13984 1 15 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.506 -2.201 18135 13985 1 15 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.234 0.133 18135 13986 1 15 . 1 1 112 112 LYS H H 112 8.257 8.257 7.578 0.679 18135 13987 1 15 . 1 1 113 113 GLU N N 113 119.104 119.104 118.722 0.382 18135 13988 1 15 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.979 0.087 18135 13989 1 15 . 1 1 113 113 GLU C C 113 178.289 178.289 178.205 0.084 18135 13990 1 15 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.335 -1.082 18135 13991 1 15 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.460 -1.322 18135 13992 1 15 . 1 1 113 113 GLU H H 113 8.270 8.270 7.736 0.534 18135 13993 1 15 . 1 1 114 114 ASP N N 114 119.224 119.224 119.023 0.201 18135 13994 1 15 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.540 -0.252 18135 13995 1 15 . 1 1 114 114 ASP C C 114 178.365 178.365 178.535 -0.170 18135 13996 1 15 . 1 1 114 114 ASP CA C 114 56.108 56.108 56.554 -0.446 18135 13997 1 15 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.842 -2.607 18135 13998 1 15 . 1 1 114 114 ASP H H 114 8.618 8.618 7.575 1.043 18135 13999 1 15 . 1 1 115 115 SER N N 115 118.195 118.195 116.978 1.217 18135 14000 1 15 . 1 1 115 115 SER HA H 115 4.200 4.200 4.155 0.044 18135 14001 1 15 . 1 1 115 115 SER C C 115 175.986 175.986 176.666 -0.680 18135 14002 1 15 . 1 1 115 115 SER CA C 115 61.588 61.588 61.956 -0.368 18135 14003 1 15 . 1 1 115 115 SER CB C 115 62.653 62.653 62.911 -0.258 18135 14004 1 15 . 1 1 115 115 SER H H 115 8.181 8.181 7.510 0.671 18135 14005 1 15 . 1 1 116 116 ILE N N 116 123.340 123.340 121.644 1.696 18135 14006 1 15 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.880 -0.254 18135 14007 1 15 . 1 1 116 116 ILE C C 116 178.367 178.367 178.257 0.110 18135 14008 1 15 . 1 1 116 116 ILE CA C 116 64.817 64.817 62.788 2.030 18135 14009 1 15 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.489 0.929 18135 14010 1 15 . 1 1 116 116 ILE H H 116 7.773 7.773 8.244 -0.471 18135 14011 1 15 . 1 1 117 117 LEU N N 117 120.968 120.968 121.474 -0.506 18135 14012 1 15 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.916 -0.011 18135 14013 1 15 . 1 1 117 117 LEU C C 117 178.746 178.746 178.149 0.597 18135 14014 1 15 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.361 -0.218 18135 14015 1 15 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.592 -0.006 18135 14016 1 15 . 1 1 117 117 LEU H H 117 8.406 8.406 7.300 1.106 18135 14017 1 15 . 1 1 118 118 ALA N N 118 120.150 120.150 122.161 -2.011 18135 14018 1 15 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.591 0.521 18135 14019 1 15 . 1 1 118 118 ALA C C 118 181.633 181.633 178.548 3.085 18135 14020 1 15 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.064 0.249 18135 14021 1 15 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.322 -0.212 18135 14022 1 15 . 1 1 118 118 ALA H H 118 7.894 7.894 8.202 -0.308 18135 14023 1 15 . 1 1 119 119 VAL N N 119 118.873 118.873 115.749 3.124 18135 14024 1 15 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.221 0.533 18135 14025 1 15 . 1 1 119 119 VAL C C 119 177.896 177.896 177.702 0.194 18135 14026 1 15 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.983 1.198 18135 14027 1 15 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.144 0.750 18135 14028 1 15 . 1 1 119 119 VAL H H 119 7.572 7.572 7.727 -0.155 18135 14029 1 15 . 1 1 120 120 ARG N N 120 121.436 121.436 120.089 1.347 18135 14030 1 15 . 1 1 120 120 ARG HA H 120 4.027 4.027 3.954 0.073 18135 14031 1 15 . 1 1 120 120 ARG C C 120 179.848 179.848 178.318 1.530 18135 14032 1 15 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.860 1.407 18135 14033 1 15 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.892 -0.197 18135 14034 1 15 . 1 1 120 120 ARG H H 120 8.629 8.629 7.945 0.684 18135 14035 1 15 . 1 1 121 121 LYS N N 121 119.589 119.589 119.726 -0.137 18135 14036 1 15 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.909 0.165 18135 14037 1 15 . 1 1 121 121 LYS C C 121 178.331 178.331 179.438 -1.107 18135 14038 1 15 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.744 0.696 18135 14039 1 15 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.244 -0.137 18135 14040 1 15 . 1 1 121 121 LYS H H 121 9.015 9.015 8.089 0.926 18135 14041 1 15 . 1 1 122 122 TYR N N 122 121.546 121.546 118.657 2.889 18135 14042 1 15 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.192 0.140 18135 14043 1 15 . 1 1 122 122 TYR C C 122 176.527 176.527 178.382 -1.855 18135 14044 1 15 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.382 2.022 18135 14045 1 15 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.230 0.495 18135 14046 1 15 . 1 1 122 122 TYR H H 122 7.473 7.473 7.654 -0.181 18135 14047 1 15 . 1 1 123 123 PHE N N 123 116.026 116.026 120.061 -4.035 18135 14048 1 15 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.969 -0.229 18135 14049 1 15 . 1 1 123 123 PHE C C 123 179.005 179.005 177.388 1.617 18135 14050 1 15 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.320 3.208 18135 14051 1 15 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.626 0.705 18135 14052 1 15 . 1 1 123 123 PHE H H 123 7.932 7.932 8.288 -0.356 18135 14053 1 15 . 1 1 124 124 GLN N N 124 123.043 123.043 118.242 4.801 18135 14054 1 15 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.429 0.750 18135 14055 1 15 . 1 1 124 124 GLN C C 124 178.772 178.772 178.703 0.069 18135 14056 1 15 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.417 -0.101 18135 14057 1 15 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.245 -0.614 18135 14058 1 15 . 1 1 124 124 GLN H H 124 8.470 8.470 8.661 -0.191 18135 14059 1 15 . 1 1 125 125 ARG N N 125 120.342 120.342 118.947 1.395 18135 14060 1 15 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.139 -0.061 18135 14061 1 15 . 1 1 125 125 ARG C C 125 180.340 180.340 179.332 1.008 18135 14062 1 15 . 1 1 125 125 ARG CA C 125 61.297 61.297 59.359 1.938 18135 14063 1 15 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.315 0.010 18135 14064 1 15 . 1 1 125 125 ARG H H 125 8.137 8.137 8.039 0.098 18135 14065 1 15 . 1 1 126 126 ILE N N 126 121.876 121.876 121.159 0.717 18135 14066 1 15 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.792 -0.441 18135 14067 1 15 . 1 1 126 126 ILE C C 126 176.857 176.857 177.916 -1.059 18135 14068 1 15 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.828 1.004 18135 14069 1 15 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.948 0.336 18135 14070 1 15 . 1 1 126 126 ILE H H 126 7.526 7.526 8.367 -0.841 18135 14071 1 15 . 1 1 127 127 THR N N 127 115.613 115.613 114.983 0.630 18135 14072 1 15 . 1 1 127 127 THR HA H 127 3.633 3.633 3.871 -0.238 18135 14073 1 15 . 1 1 127 127 THR C C 127 176.645 176.645 176.818 -0.173 18135 14074 1 15 . 1 1 127 127 THR CA C 127 67.294 67.294 66.497 0.797 18135 14075 1 15 . 1 1 127 127 THR CB C 127 68.871 68.871 68.865 0.006 18135 14076 1 15 . 1 1 127 127 THR H H 127 8.288 8.288 8.128 0.160 18135 14077 1 15 . 1 1 128 128 LEU N N 128 122.627 122.627 122.172 0.455 18135 14078 1 15 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.943 0.013 18135 14079 1 15 . 1 1 128 128 LEU C C 128 178.331 178.331 177.435 0.896 18135 14080 1 15 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.997 0.091 18135 14081 1 15 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.325 0.249 18135 14082 1 15 . 1 1 128 128 LEU H H 128 8.263 8.263 8.054 0.209 18135 14083 1 15 . 1 1 129 129 TYR N N 129 120.955 120.955 120.484 0.471 18135 14084 1 15 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.020 -0.130 18135 14085 1 15 . 1 1 129 129 TYR C C 129 176.040 176.040 177.045 -1.005 18135 14086 1 15 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.876 -0.383 18135 14087 1 15 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.266 0.659 18135 14088 1 15 . 1 1 129 129 TYR H H 129 7.518 7.518 8.224 -0.706 18135 14089 1 15 . 1 1 130 130 LEU N N 130 119.155 119.155 116.395 2.760 18135 14090 1 15 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.317 -0.472 18135 14091 1 15 . 1 1 130 130 LEU C C 130 177.948 177.948 178.373 -0.425 18135 14092 1 15 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.900 0.213 18135 14093 1 15 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.531 1.055 18135 14094 1 15 . 1 1 130 130 LEU H H 130 7.717 7.717 7.957 -0.240 18135 14095 1 15 . 1 1 131 131 LYS N N 131 116.832 116.832 119.952 -3.120 18135 14096 1 15 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.837 -0.429 18135 14097 1 15 . 1 1 131 131 LYS C C 131 181.265 181.265 179.750 1.515 18135 14098 1 15 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.633 0.098 18135 14099 1 15 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.022 0.650 18135 14100 1 15 . 1 1 131 131 LYS H H 131 7.493 7.493 7.852 -0.359 18135 14101 1 15 . 1 1 132 132 GLU N N 132 121.918 121.918 119.041 2.877 18135 14102 1 15 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.073 -0.229 18135 14103 1 15 . 1 1 132 132 GLU C C 132 178.377 178.377 177.713 0.664 18135 14104 1 15 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.607 0.280 18135 14105 1 15 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.505 -0.838 18135 14106 1 15 . 1 1 132 132 GLU H H 132 8.430 8.430 8.053 0.377 18135 14107 1 15 . 1 1 133 133 LYS N N 133 116.079 116.079 116.135 -0.056 18135 14108 1 15 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.278 -0.312 18135 14109 1 15 . 1 1 133 133 LYS C C 133 175.282 175.282 176.207 -0.925 18135 14110 1 15 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.510 -0.211 18135 14111 1 15 . 1 1 133 133 LYS CB C 133 31.998 31.998 32.001 -0.003 18135 14112 1 15 . 1 1 133 133 LYS H H 133 7.390 7.390 7.368 0.022 18135 14113 1 15 . 1 1 134 134 LYS N N 134 117.759 117.759 115.937 1.822 18135 14114 1 15 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.067 -0.485 18135 14115 1 15 . 1 1 134 134 LYS C C 134 176.271 176.271 175.973 0.298 18135 14116 1 15 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.826 0.482 18135 14117 1 15 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.083 -0.281 18135 14118 1 15 . 1 1 134 134 LYS H H 134 7.716 7.716 7.591 0.125 18135 14119 1 15 . 1 1 135 135 TYR N N 135 110.598 110.598 113.732 -3.134 18135 14120 1 15 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.943 -1.066 18135 14121 1 15 . 1 1 135 135 TYR C C 135 174.148 174.148 175.215 -1.067 18135 14122 1 15 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.015 0.700 18135 14123 1 15 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.002 -0.296 18135 14124 1 15 . 1 1 135 135 TYR H H 135 8.428 8.428 8.814 -0.386 18135 14125 1 15 . 1 1 136 136 SER N N 136 113.712 113.712 115.416 -1.704 18135 14126 1 15 . 1 1 136 136 SER HA H 136 4.553 4.553 4.380 0.173 18135 14127 1 15 . 1 1 136 136 SER CA C 136 57.108 57.108 58.742 -1.633 18135 14128 1 15 . 1 1 136 136 SER CB C 136 62.500 62.500 64.076 -1.576 18135 14129 1 15 . 1 1 136 136 SER H H 136 6.744 6.744 7.378 -0.634 18135 14130 1 15 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.399 -0.234 18135 14131 1 15 . 1 1 137 137 PRO C C 137 180.675 180.675 177.340 3.335 18135 14132 1 15 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.771 0.886 18135 14133 1 15 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.826 0.157 18135 14134 1 15 . 1 1 138 138 CYS N N 138 113.914 113.914 115.568 -1.654 18135 14135 1 15 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.524 0.146 18135 14136 1 15 . 1 1 138 138 CYS C C 138 176.015 176.015 176.211 -0.196 18135 14137 1 15 . 1 1 138 138 CYS CA C 138 57.095 57.095 61.107 -4.012 18135 14138 1 15 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.233 10.546 18135 14139 1 15 . 1 1 138 138 CYS H H 138 8.580 8.580 8.533 0.047 18135 14140 1 15 . 1 1 139 139 ALA N N 139 125.290 125.290 124.023 1.267 18135 14141 1 15 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.160 0.289 18135 14142 1 15 . 1 1 139 139 ALA C C 139 180.149 180.149 179.291 0.858 18135 14143 1 15 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.945 -0.167 18135 14144 1 15 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.159 0.759 18135 14145 1 15 . 1 1 139 139 ALA H H 139 8.087 8.087 8.051 0.036 18135 14146 1 15 . 1 1 140 140 TRP N N 140 116.599 116.599 118.588 -1.989 18135 14147 1 15 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.342 0.260 18135 14148 1 15 . 1 1 140 140 TRP C C 140 179.137 179.137 178.677 0.460 18135 14149 1 15 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.379 -0.845 18135 14150 1 15 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.292 -0.034 18135 14151 1 15 . 1 1 140 140 TRP H H 140 8.505 8.505 7.758 0.747 18135 14152 1 15 . 1 1 141 141 GLU N N 141 121.578 121.578 119.496 2.082 18135 14153 1 15 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.387 0.836 18135 14154 1 15 . 1 1 141 141 GLU C C 141 177.886 177.886 178.973 -1.087 18135 14155 1 15 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.772 -1.865 18135 14156 1 15 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.339 -0.622 18135 14157 1 15 . 1 1 141 141 GLU H H 141 8.182 8.182 8.062 0.120 18135 14158 1 15 . 1 1 142 142 VAL N N 142 121.202 121.202 120.411 0.791 18135 14159 1 15 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.639 -0.009 18135 14160 1 15 . 1 1 142 142 VAL C C 142 180.246 180.246 178.408 1.838 18135 14161 1 15 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.782 0.201 18135 14162 1 15 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.733 0.089 18135 14163 1 15 . 1 1 142 142 VAL H H 142 8.623 8.623 8.196 0.427 18135 14164 1 15 . 1 1 143 143 VAL N N 143 120.119 120.119 119.260 0.859 18135 14165 1 15 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.772 -0.475 18135 14166 1 15 . 1 1 143 143 VAL C C 143 176.407 176.407 178.357 -1.950 18135 14167 1 15 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.882 1.096 18135 14168 1 15 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.141 0.514 18135 14169 1 15 . 1 1 143 143 VAL H H 143 8.323 8.323 8.493 -0.170 18135 14170 1 15 . 1 1 144 144 ARG N N 144 124.102 124.102 120.032 4.070 18135 14171 1 15 . 1 1 144 144 ARG HA H 144 3.697 3.697 3.979 -0.282 18135 14172 1 15 . 1 1 144 144 ARG C C 144 178.127 178.127 178.373 -0.246 18135 14173 1 15 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.459 1.542 18135 14174 1 15 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.859 0.077 18135 14175 1 15 . 1 1 144 144 ARG H H 144 9.619 9.619 8.488 1.131 18135 14176 1 15 . 1 1 145 145 ALA N N 145 119.431 119.431 121.421 -1.990 18135 14177 1 15 . 1 1 145 145 ALA HA H 145 3.851 3.851 3.997 -0.146 18135 14178 1 15 . 1 1 145 145 ALA C C 145 180.763 180.763 179.619 1.144 18135 14179 1 15 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.407 -0.032 18135 14180 1 15 . 1 1 145 145 ALA CB C 145 18.185 18.185 17.881 0.304 18135 14181 1 15 . 1 1 145 145 ALA H H 145 8.867 8.867 8.243 0.624 18135 14182 1 15 . 1 1 146 146 GLU N N 146 121.815 121.815 119.248 2.567 18135 14183 1 15 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.244 -0.033 18135 14184 1 15 . 1 1 146 146 GLU C C 146 177.296 177.296 179.074 -1.778 18135 14185 1 15 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.504 -1.125 18135 14186 1 15 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.969 -1.835 18135 14187 1 15 . 1 1 146 146 GLU H H 146 8.136 8.136 8.070 0.066 18135 14188 1 15 . 1 1 147 147 ILE N N 147 119.542 119.542 120.404 -0.862 18135 14189 1 15 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.706 0.264 18135 14190 1 15 . 1 1 147 147 ILE C C 147 178.283 178.283 178.317 -0.034 18135 14191 1 15 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.671 -3.418 18135 14192 1 15 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.419 -2.080 18135 14193 1 15 . 1 1 147 147 ILE H H 147 8.736 8.736 8.154 0.582 18135 14194 1 15 . 1 1 148 148 MET N N 148 119.501 119.501 118.793 0.708 18135 14195 1 15 . 1 1 148 148 MET HA H 148 3.801 3.801 4.207 -0.406 18135 14196 1 15 . 1 1 148 148 MET C C 148 178.210 178.210 178.655 -0.445 18135 14197 1 15 . 1 1 148 148 MET CA C 148 60.184 60.184 59.806 0.378 18135 14198 1 15 . 1 1 148 148 MET CB C 148 32.914 32.914 32.041 0.873 18135 14199 1 15 . 1 1 148 148 MET H H 148 8.440 8.440 8.415 0.025 18135 14200 1 15 . 1 1 149 149 ARG N N 149 119.734 119.734 119.605 0.129 18135 14201 1 15 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.113 -0.198 18135 14202 1 15 . 1 1 149 149 ARG C C 149 178.978 178.978 179.051 -0.073 18135 14203 1 15 . 1 1 149 149 ARG CA C 149 59.863 59.863 58.811 1.052 18135 14204 1 15 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.384 0.896 18135 14205 1 15 . 1 1 149 149 ARG H H 149 7.648 7.648 8.422 -0.774 18135 14206 1 15 . 1 1 150 150 SER N N 150 118.109 118.109 114.808 3.301 18135 14207 1 15 . 1 1 150 150 SER HA H 150 3.339 3.339 3.958 -0.619 18135 14208 1 15 . 1 1 150 150 SER C C 150 177.292 177.292 176.240 1.052 18135 14209 1 15 . 1 1 150 150 SER CA C 150 61.316 61.316 61.592 -0.276 18135 14210 1 15 . 1 1 150 150 SER CB C 150 60.288 60.288 62.400 -2.112 18135 14211 1 15 . 1 1 150 150 SER H H 150 9.194 9.194 8.498 0.696 18135 14212 1 15 . 1 1 151 151 PHE N N 151 125.265 125.265 123.340 1.925 18135 14213 1 15 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.338 -0.302 18135 14214 1 15 . 1 1 151 151 PHE C C 151 178.696 178.696 177.518 1.178 18135 14215 1 15 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.744 1.676 18135 14216 1 15 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.605 0.281 18135 14217 1 15 . 1 1 151 151 PHE H H 151 9.455 9.455 8.282 1.173 18135 14218 1 15 . 1 1 152 152 SER N N 152 115.963 115.963 114.832 1.131 18135 14219 1 15 . 1 1 152 152 SER HA H 152 3.880 3.880 3.713 0.167 18135 14220 1 15 . 1 1 152 152 SER C C 152 175.858 175.858 176.882 -1.024 18135 14221 1 15 . 1 1 152 152 SER CA C 152 62.388 62.388 61.688 0.700 18135 14222 1 15 . 1 1 152 152 SER CB C 152 62.519 62.519 63.066 -0.548 18135 14223 1 15 . 1 1 152 152 SER H H 152 7.839 7.839 8.495 -0.656 18135 14224 1 15 . 1 1 153 153 LEU N N 153 121.365 121.365 122.794 -1.429 18135 14225 1 15 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.157 -0.076 18135 14226 1 15 . 1 1 153 153 LEU C C 153 179.515 179.515 177.551 1.964 18135 14227 1 15 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.471 0.412 18135 14228 1 15 . 1 1 153 153 LEU CB C 153 42.342 42.342 42.115 0.227 18135 14229 1 15 . 1 1 153 153 LEU H H 153 7.775 7.775 8.173 -0.398 18135 14230 1 15 . 1 1 154 154 SER N N 154 113.950 113.950 112.735 1.215 18135 14231 1 15 . 1 1 154 154 SER HA H 154 3.781 3.781 4.180 -0.399 18135 14232 1 15 . 1 1 154 154 SER C C 154 174.312 174.312 176.988 -2.676 18135 14233 1 15 . 1 1 154 154 SER CA C 154 61.366 61.366 61.597 -0.231 18135 14234 1 15 . 1 1 154 154 SER CB C 154 63.242 63.242 63.570 -0.328 18135 14235 1 15 . 1 1 154 154 SER H H 154 7.874 7.874 8.383 -0.509 18135 14236 1 15 . 1 1 155 155 THR N N 155 109.346 109.346 116.497 -7.151 18135 14237 1 15 . 1 1 155 155 THR HA H 155 4.060 4.060 4.134 -0.074 18135 14238 1 15 . 1 1 155 155 THR C C 155 174.798 174.798 175.966 -1.168 18135 14239 1 15 . 1 1 155 155 THR CA C 155 62.275 62.275 64.847 -2.572 18135 14240 1 15 . 1 1 155 155 THR CB C 155 69.342 69.342 69.006 0.336 18135 14241 1 15 . 1 1 155 155 THR H H 155 7.176 7.176 8.050 -0.874 18135 14242 1 15 . 1 1 156 156 ASN N N 156 119.785 119.785 120.214 -0.429 18135 14243 1 15 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.802 -0.275 18135 14244 1 15 . 1 1 156 156 ASN C C 156 175.528 175.528 174.836 0.692 18135 14245 1 15 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.337 1.599 18135 14246 1 15 . 1 1 156 156 ASN CB C 156 38.338 38.338 38.178 0.160 18135 14247 1 15 . 1 1 156 156 ASN H H 156 7.749 7.749 7.844 -0.095 18135 14248 1 15 . 1 1 157 157 LEU N N 157 120.552 120.552 120.906 -0.354 18135 14249 1 15 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.416 -0.161 18135 14250 1 15 . 1 1 157 157 LEU C C 157 174.702 174.702 178.180 -3.478 18135 14251 1 15 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.895 -1.220 18135 14252 1 15 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.123 0.228 18135 14253 1 15 . 1 1 157 157 LEU H H 157 8.097 8.097 7.594 0.503 18135 14254 1 15 . 1 1 158 158 GLN N N 158 119.860 119.860 116.645 3.215 18135 14255 1 15 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.186 -0.006 18135 14256 1 15 . 1 1 158 158 GLN C C 158 176.434 176.434 175.063 1.371 18135 14257 1 15 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.624 1.273 18135 14258 1 15 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.360 -0.350 18135 14259 1 15 . 1 1 158 158 GLN H H 158 8.230 8.230 8.127 0.103 18135 14260 1 15 . 1 1 159 159 GLU N N 159 120.461 120.461 117.005 3.456 18135 14261 1 15 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.078 0.141 18135 14262 1 15 . 1 1 159 159 GLU C C 159 175.251 175.251 175.491 -0.240 18135 14263 1 15 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.052 -0.357 18135 14264 1 15 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.423 0.558 18135 14265 1 15 . 1 1 159 159 GLU H H 159 8.300 8.300 8.493 -0.193 18135 14266 1 15 . 1 1 160 160 SER N N 160 115.719 115.719 112.876 2.843 18135 14267 1 15 . 1 1 160 160 SER HA H 160 4.372 4.372 4.599 -0.227 18135 14268 1 15 . 1 1 160 160 SER C C 160 174.188 174.188 174.717 -0.529 18135 14269 1 15 . 1 1 160 160 SER CA C 160 58.481 58.481 58.650 -0.169 18135 14270 1 15 . 1 1 160 160 SER CB C 160 63.731 63.731 62.941 0.790 18135 14271 1 15 . 1 1 160 160 SER H H 160 8.113 8.113 8.487 -0.374 18135 14272 1 15 . 1 1 161 161 LEU N N 161 123.794 123.794 120.999 2.795 18135 14273 1 15 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.416 -0.136 18135 14274 1 15 . 1 1 161 161 LEU C C 161 177.293 177.293 176.568 0.725 18135 14275 1 15 . 1 1 161 161 LEU CA C 161 55.190 55.190 55.352 -0.162 18135 14276 1 15 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.397 -0.113 18135 14277 1 15 . 1 1 161 161 LEU H H 161 8.032 8.032 7.611 0.421 18135 14278 1 15 . 1 1 162 162 ARG N N 162 120.715 120.715 119.792 0.923 18135 14279 1 15 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.527 -0.358 18135 14280 1 15 . 1 1 162 162 ARG C C 162 176.288 176.288 174.916 1.372 18135 14281 1 15 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.847 1.199 18135 14282 1 15 . 1 1 162 162 ARG CB C 162 30.935 30.935 32.170 -1.235 18135 14283 1 15 . 1 1 162 162 ARG H H 162 8.094 8.094 7.858 0.236 18135 14284 1 15 . 1 1 163 163 SER N N 163 116.670 116.670 117.278 -0.608 18135 14285 1 15 . 1 1 163 163 SER HA H 163 4.372 4.372 4.793 -0.421 18135 14286 1 15 . 1 1 163 163 SER C C 163 174.184 174.184 174.993 -0.809 18135 14287 1 15 . 1 1 163 163 SER CA C 163 58.481 58.481 57.692 0.789 18135 14288 1 15 . 1 1 163 163 SER CB C 163 63.745 63.745 64.158 -0.413 18135 14289 1 15 . 1 1 163 163 SER H H 163 8.191 8.191 8.521 -0.330 18135 14290 1 15 . 1 1 164 164 LYS N N 164 123.100 123.100 123.653 -0.553 18135 14291 1 15 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.237 0.040 18135 14292 1 15 . 1 1 164 164 LYS C C 164 175.617 175.617 177.137 -1.520 18135 14293 1 15 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.349 -1.036 18135 14294 1 15 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.555 0.410 18135 14295 1 15 . 1 1 164 164 LYS H H 164 8.251 8.251 8.687 -0.436 18135 14296 1 16 . 1 1 2 2 ASP N N 2 125.691 125.691 122.576 3.115 18135 14297 1 16 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.685 0.025 18135 14298 1 16 . 1 1 2 2 ASP C C 2 174.758 174.758 175.367 -0.609 18135 14299 1 16 . 1 1 2 2 ASP CA C 2 52.843 52.843 53.633 -0.790 18135 14300 1 16 . 1 1 2 2 ASP CB C 2 39.321 39.321 39.329 -0.008 18135 14301 1 16 . 1 1 2 2 ASP H H 2 8.773 8.773 8.615 0.158 18135 14302 1 16 . 1 1 3 3 LEU N N 3 123.957 123.957 120.341 3.616 18135 14303 1 16 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.757 -0.356 18135 14304 1 16 . 1 1 3 3 LEU CA C 3 53.653 53.653 51.754 1.899 18135 14305 1 16 . 1 1 3 3 LEU CB C 3 40.555 40.555 41.520 -0.965 18135 14306 1 16 . 1 1 3 3 LEU H H 3 8.164 8.164 7.492 0.672 18135 14307 1 16 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.595 -0.281 18135 14308 1 16 . 1 1 4 4 PRO C C 4 176.213 176.213 176.276 -0.063 18135 14309 1 16 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.046 0.862 18135 14310 1 16 . 1 1 4 4 PRO CB C 4 31.894 31.894 29.982 1.913 18135 14311 1 16 . 1 1 5 5 GLN N N 5 121.621 121.621 121.172 0.449 18135 14312 1 16 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.178 0.048 18135 14313 1 16 . 1 1 5 5 GLN C C 5 176.995 176.995 176.834 0.161 18135 14314 1 16 . 1 1 5 5 GLN CA C 5 57.710 57.710 58.891 -1.181 18135 14315 1 16 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.419 -0.468 18135 14316 1 16 . 1 1 5 5 GLN H H 5 8.767 8.767 8.693 0.074 18135 14317 1 16 . 1 1 6 6 THR N N 6 111.419 111.419 111.297 0.122 18135 14318 1 16 . 1 1 6 6 THR HA H 6 4.135 4.135 4.472 -0.337 18135 14319 1 16 . 1 1 6 6 THR C C 6 174.695 174.695 175.014 -0.319 18135 14320 1 16 . 1 1 6 6 THR CA C 6 62.661 62.661 62.777 -0.116 18135 14321 1 16 . 1 1 6 6 THR CB C 6 69.365 69.365 68.906 0.459 18135 14322 1 16 . 1 1 6 6 THR H H 6 7.865 7.865 8.451 -0.586 18135 14323 1 16 . 1 1 7 7 HIS N N 7 119.137 119.137 119.985 -0.848 18135 14324 1 16 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.743 -0.158 18135 14325 1 16 . 1 1 7 7 HIS C C 7 174.980 174.980 175.771 -0.791 18135 14326 1 16 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.962 -2.958 18135 14327 1 16 . 1 1 7 7 HIS CB C 7 28.163 28.163 30.051 -1.888 18135 14328 1 16 . 1 1 7 7 HIS H H 7 8.567 8.567 8.362 0.205 18135 14329 1 16 . 1 1 8 8 SER N N 8 115.796 115.796 114.444 1.352 18135 14330 1 16 . 1 1 8 8 SER HA H 8 4.363 4.363 4.315 0.048 18135 14331 1 16 . 1 1 8 8 SER C C 8 175.312 175.312 176.226 -0.914 18135 14332 1 16 . 1 1 8 8 SER CA C 8 58.969 58.969 61.993 -3.024 18135 14333 1 16 . 1 1 8 8 SER CB C 8 63.439 63.439 63.768 -0.329 18135 14334 1 16 . 1 1 8 8 SER H H 8 8.180 8.180 7.969 0.211 18135 14335 1 16 . 1 1 9 9 LEU N N 9 123.844 123.844 118.055 5.789 18135 14336 1 16 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.708 -0.553 18135 14337 1 16 . 1 1 9 9 LEU C C 9 178.568 178.568 178.354 0.214 18135 14338 1 16 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.590 0.376 18135 14339 1 16 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.195 -0.399 18135 14340 1 16 . 1 1 9 9 LEU H H 9 8.404 8.404 7.896 0.508 18135 14341 1 16 . 1 1 10 10 GLY N N 10 107.582 107.582 108.498 -0.916 18135 14342 1 16 . 1 1 10 10 GLY C C 10 174.586 174.586 175.974 -1.388 18135 14343 1 16 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.540 -0.635 18135 14344 1 16 . 1 1 10 10 GLY H H 10 8.438 8.438 8.560 -0.122 18135 14345 1 16 . 1 1 11 11 SER N N 11 118.806 118.806 117.724 1.082 18135 14346 1 16 . 1 1 11 11 SER HA H 11 4.156 4.156 4.173 -0.017 18135 14347 1 16 . 1 1 11 11 SER C C 11 175.749 175.749 176.716 -0.967 18135 14348 1 16 . 1 1 11 11 SER CA C 11 61.299 61.299 62.323 -1.024 18135 14349 1 16 . 1 1 11 11 SER CB C 11 62.653 62.653 63.154 -0.501 18135 14350 1 16 . 1 1 11 11 SER H H 11 8.249 8.249 8.347 -0.098 18135 14351 1 16 . 1 1 12 12 ARG N N 12 121.986 121.986 120.786 1.200 18135 14352 1 16 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.162 -0.208 18135 14353 1 16 . 1 1 12 12 ARG C C 12 178.283 178.283 178.106 0.177 18135 14354 1 16 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.676 1.154 18135 14355 1 16 . 1 1 12 12 ARG CB C 12 29.584 29.584 29.971 -0.387 18135 14356 1 16 . 1 1 12 12 ARG H H 12 8.027 8.027 8.078 -0.051 18135 14357 1 16 . 1 1 13 13 ARG N N 13 119.432 119.432 118.821 0.611 18135 14358 1 16 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.021 -0.182 18135 14359 1 16 . 1 1 13 13 ARG C C 13 178.480 178.480 178.152 0.328 18135 14360 1 16 . 1 1 13 13 ARG CA C 13 60.491 60.491 60.025 0.466 18135 14361 1 16 . 1 1 13 13 ARG CB C 13 30.082 30.082 30.110 -0.028 18135 14362 1 16 . 1 1 13 13 ARG H H 13 8.437 8.437 8.400 0.037 18135 14363 1 16 . 1 1 14 14 THR N N 14 116.879 116.879 116.459 0.420 18135 14364 1 16 . 1 1 14 14 THR HA H 14 3.532 3.532 4.183 -0.651 18135 14365 1 16 . 1 1 14 14 THR C C 14 175.584 175.584 177.074 -1.490 18135 14366 1 16 . 1 1 14 14 THR CA C 14 68.036 68.036 66.552 1.484 18135 14367 1 16 . 1 1 14 14 THR CB C 14 67.969 67.969 68.353 -0.384 18135 14368 1 16 . 1 1 14 14 THR H H 14 7.957 7.957 8.241 -0.284 18135 14369 1 16 . 1 1 15 15 LEU N N 15 120.252 120.252 122.194 -1.942 18135 14370 1 16 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.001 -0.055 18135 14371 1 16 . 1 1 15 15 LEU C C 15 178.652 178.652 178.961 -0.309 18135 14372 1 16 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.301 -0.213 18135 14373 1 16 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.816 -0.261 18135 14374 1 16 . 1 1 15 15 LEU H H 15 7.550 7.550 8.165 -0.615 18135 14375 1 16 . 1 1 16 16 MET N N 16 118.788 118.788 117.849 0.939 18135 14376 1 16 . 1 1 16 16 MET HA H 16 4.023 4.023 3.957 0.066 18135 14377 1 16 . 1 1 16 16 MET C C 16 178.718 178.718 178.592 0.126 18135 14378 1 16 . 1 1 16 16 MET CA C 16 58.513 58.513 59.546 -1.033 18135 14379 1 16 . 1 1 16 16 MET CB C 16 32.150 32.150 32.452 -0.302 18135 14380 1 16 . 1 1 16 16 MET H H 16 7.985 7.985 8.310 -0.325 18135 14381 1 16 . 1 1 17 17 LEU N N 17 120.644 120.644 119.422 1.222 18135 14382 1 16 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.930 0.042 18135 14383 1 16 . 1 1 17 17 LEU C C 17 178.238 178.238 179.311 -1.073 18135 14384 1 16 . 1 1 17 17 LEU CA C 17 57.727 57.727 57.639 0.088 18135 14385 1 16 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.557 0.578 18135 14386 1 16 . 1 1 17 17 LEU H H 17 7.829 7.829 8.114 -0.285 18135 14387 1 16 . 1 1 18 18 LEU N N 18 118.280 118.280 118.837 -0.557 18135 14388 1 16 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.810 -0.304 18135 14389 1 16 . 1 1 18 18 LEU C C 18 175.739 175.739 178.575 -2.836 18135 14390 1 16 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.483 0.173 18135 14391 1 16 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.561 0.681 18135 14392 1 16 . 1 1 18 18 LEU H H 18 7.499 7.499 8.400 -0.901 18135 14393 1 16 . 1 1 19 19 ALA N N 19 121.961 121.961 120.619 1.342 18135 14394 1 16 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.133 -0.296 18135 14395 1 16 . 1 1 19 19 ALA C C 19 180.736 180.736 179.075 1.661 18135 14396 1 16 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.332 0.734 18135 14397 1 16 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.170 -1.093 18135 14398 1 16 . 1 1 19 19 ALA H H 19 7.950 7.950 7.770 0.180 18135 14399 1 16 . 1 1 20 20 GLN N N 20 118.605 118.605 115.879 2.726 18135 14400 1 16 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.188 -0.253 18135 14401 1 16 . 1 1 20 20 GLN C C 20 176.945 176.945 177.167 -0.222 18135 14402 1 16 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.549 0.466 18135 14403 1 16 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.044 -0.570 18135 14404 1 16 . 1 1 20 20 GLN H H 20 7.958 7.958 7.965 -0.007 18135 14405 1 16 . 1 1 21 21 MET N N 21 116.693 116.693 117.149 -0.456 18135 14406 1 16 . 1 1 21 21 MET HA H 21 3.861 3.861 4.420 -0.559 18135 14407 1 16 . 1 1 21 21 MET C C 21 174.671 174.671 176.028 -1.357 18135 14408 1 16 . 1 1 21 21 MET CA C 21 57.111 57.111 56.886 0.225 18135 14409 1 16 . 1 1 21 21 MET CB C 21 34.073 34.073 33.560 0.513 18135 14410 1 16 . 1 1 21 21 MET H H 21 7.420 7.420 7.685 -0.265 18135 14411 1 16 . 1 1 22 22 ARG N N 22 115.451 115.451 121.667 -6.216 18135 14412 1 16 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.437 0.416 18135 14413 1 16 . 1 1 22 22 ARG C C 22 175.950 175.950 174.731 1.219 18135 14414 1 16 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.182 3.270 18135 14415 1 16 . 1 1 22 22 ARG CB C 22 31.514 31.514 29.841 1.673 18135 14416 1 16 . 1 1 22 22 ARG H H 22 6.484 6.484 7.306 -0.822 18135 14417 1 16 . 1 1 23 23 LYS N N 23 128.593 128.593 127.376 1.217 18135 14418 1 16 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.585 -0.100 18135 14419 1 16 . 1 1 23 23 LYS C C 23 176.643 176.643 174.966 1.677 18135 14420 1 16 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.617 1.671 18135 14421 1 16 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.785 4.476 18135 14422 1 16 . 1 1 23 23 LYS H H 23 10.212 10.212 8.622 1.590 18135 14423 1 16 . 1 1 24 24 ILE N N 24 118.605 118.605 123.092 -4.487 18135 14424 1 16 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.482 0.002 18135 14425 1 16 . 1 1 24 24 ILE C C 24 173.878 173.878 174.743 -0.865 18135 14426 1 16 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.976 -1.379 18135 14427 1 16 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.458 -0.002 18135 14428 1 16 . 1 1 24 24 ILE H H 24 8.465 8.465 8.331 0.134 18135 14429 1 16 . 1 1 25 25 SER N N 25 113.658 113.658 117.839 -4.181 18135 14430 1 16 . 1 1 25 25 SER HA H 25 4.481 4.481 5.004 -0.523 18135 14431 1 16 . 1 1 25 25 SER C C 25 176.359 176.359 175.526 0.833 18135 14432 1 16 . 1 1 25 25 SER CA C 25 56.975 56.975 56.655 0.320 18135 14433 1 16 . 1 1 25 25 SER CB C 25 64.759 64.759 64.101 0.658 18135 14434 1 16 . 1 1 25 25 SER H H 25 8.104 8.104 8.653 -0.549 18135 14435 1 16 . 1 1 26 26 LEU N N 26 127.566 127.566 125.433 2.133 18135 14436 1 16 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.615 -0.738 18135 14437 1 16 . 1 1 26 26 LEU C C 26 178.946 178.946 177.788 1.158 18135 14438 1 16 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.235 0.443 18135 14439 1 16 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.070 -0.351 18135 14440 1 16 . 1 1 26 26 LEU H H 26 8.802 8.802 8.949 -0.147 18135 14441 1 16 . 1 1 27 27 PHE N N 27 117.143 117.143 117.078 0.065 18135 14442 1 16 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.618 -0.380 18135 14443 1 16 . 1 1 27 27 PHE C C 27 177.067 177.067 176.537 0.530 18135 14444 1 16 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.535 1.555 18135 14445 1 16 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.522 -0.260 18135 14446 1 16 . 1 1 27 27 PHE H H 27 7.986 7.986 8.030 -0.044 18135 14447 1 16 . 1 1 28 28 SER N N 28 115.200 115.200 114.680 0.520 18135 14448 1 16 . 1 1 28 28 SER HA H 28 4.505 4.505 4.556 -0.051 18135 14449 1 16 . 1 1 28 28 SER C C 28 174.533 174.533 174.345 0.188 18135 14450 1 16 . 1 1 28 28 SER CA C 28 59.447 59.447 59.355 0.092 18135 14451 1 16 . 1 1 28 28 SER CB C 28 63.790 63.790 63.951 -0.161 18135 14452 1 16 . 1 1 28 28 SER H H 28 7.929 7.929 8.118 -0.189 18135 14453 1 16 . 1 1 29 29 CYS N N 29 119.870 119.870 119.940 -0.070 18135 14454 1 16 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.752 0.330 18135 14455 1 16 . 1 1 29 29 CYS C C 29 176.475 176.475 174.471 2.004 18135 14456 1 16 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.223 -4.793 18135 14457 1 16 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.211 10.031 18135 14458 1 16 . 1 1 29 29 CYS H H 29 7.865 7.865 7.489 0.376 18135 14459 1 16 . 1 1 30 30 LEU N N 30 122.259 122.259 122.038 0.221 18135 14460 1 16 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.320 -0.359 18135 14461 1 16 . 1 1 30 30 LEU C C 30 179.774 179.774 178.450 1.324 18135 14462 1 16 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.176 2.127 18135 14463 1 16 . 1 1 30 30 LEU CB C 30 41.576 41.576 41.983 -0.407 18135 14464 1 16 . 1 1 30 30 LEU H H 30 7.812 7.812 8.404 -0.592 18135 14465 1 16 . 1 1 31 31 LYS N N 31 117.731 117.731 114.862 2.869 18135 14466 1 16 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.137 0.553 18135 14467 1 16 . 1 1 31 31 LYS C C 31 176.692 176.692 176.176 0.516 18135 14468 1 16 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.772 -3.695 18135 14469 1 16 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.124 -0.537 18135 14470 1 16 . 1 1 31 31 LYS H H 31 8.597 8.597 8.355 0.242 18135 14471 1 16 . 1 1 32 32 ASP N N 32 117.841 117.841 118.350 -0.509 18135 14472 1 16 . 1 1 32 32 ASP HA H 32 4.694 4.694 5.008 -0.314 18135 14473 1 16 . 1 1 32 32 ASP C C 32 175.505 175.505 175.991 -0.486 18135 14474 1 16 . 1 1 32 32 ASP CA C 32 54.088 54.088 53.634 0.454 18135 14475 1 16 . 1 1 32 32 ASP CB C 32 41.808 41.808 41.243 0.565 18135 14476 1 16 . 1 1 32 32 ASP H H 32 7.808 7.808 8.390 -0.582 18135 14477 1 16 . 1 1 33 33 ARG N N 33 120.876 120.876 119.910 0.966 18135 14478 1 16 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.245 -0.204 18135 14479 1 16 . 1 1 33 33 ARG C C 33 175.286 175.286 175.214 0.072 18135 14480 1 16 . 1 1 33 33 ARG CA C 33 58.083 58.083 56.878 1.205 18135 14481 1 16 . 1 1 33 33 ARG CB C 33 30.013 30.013 29.967 0.046 18135 14482 1 16 . 1 1 33 33 ARG H H 33 7.378 7.378 7.207 0.171 18135 14483 1 16 . 1 1 34 34 HIS N N 34 120.555 120.555 122.593 -2.038 18135 14484 1 16 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.532 -0.320 18135 14485 1 16 . 1 1 34 34 HIS C C 34 170.494 170.494 172.897 -2.403 18135 14486 1 16 . 1 1 34 34 HIS CA C 34 54.607 54.607 55.439 -0.832 18135 14487 1 16 . 1 1 34 34 HIS CB C 34 31.488 31.488 33.387 -1.899 18135 14488 1 16 . 1 1 34 34 HIS H H 34 7.974 7.974 8.447 -0.473 18135 14489 1 16 . 1 1 35 35 ASP N N 35 125.061 125.061 119.175 5.886 18135 14490 1 16 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.570 0.068 18135 14491 1 16 . 1 1 35 35 ASP C C 35 175.943 175.943 175.362 0.581 18135 14492 1 16 . 1 1 35 35 ASP CA C 35 52.369 52.369 53.094 -0.725 18135 14493 1 16 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.351 -0.989 18135 14494 1 16 . 1 1 35 35 ASP H H 35 7.805 7.805 8.124 -0.319 18135 14495 1 16 . 1 1 36 36 PHE N N 36 122.860 122.860 121.918 0.942 18135 14496 1 16 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.522 -0.197 18135 14497 1 16 . 1 1 36 36 PHE C C 36 176.643 176.643 176.822 -0.179 18135 14498 1 16 . 1 1 36 36 PHE CA C 36 59.639 59.639 56.636 3.003 18135 14499 1 16 . 1 1 36 36 PHE CB C 36 40.691 40.691 37.755 2.936 18135 14500 1 16 . 1 1 36 36 PHE H H 36 8.973 8.973 8.208 0.765 18135 14501 1 16 . 1 1 37 37 GLY N N 37 111.856 111.856 109.797 2.059 18135 14502 1 16 . 1 1 37 37 GLY C C 37 175.185 175.185 174.331 0.854 18135 14503 1 16 . 1 1 37 37 GLY CA C 37 48.143 48.143 45.104 3.039 18135 14504 1 16 . 1 1 37 37 GLY H H 37 8.727 8.727 7.632 1.095 18135 14505 1 16 . 1 1 38 38 PHE N N 38 123.178 123.178 123.646 -0.468 18135 14506 1 16 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.911 -0.997 18135 14507 1 16 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.878 1.926 18135 14508 1 16 . 1 1 38 38 PHE CB C 38 38.657 38.657 39.168 -0.511 18135 14509 1 16 . 1 1 38 38 PHE H H 38 9.169 9.169 7.980 1.189 18135 14510 1 16 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.566 -0.037 18135 14511 1 16 . 1 1 39 39 PRO C C 39 174.634 174.634 176.948 -2.314 18135 14512 1 16 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.803 -1.260 18135 14513 1 16 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.346 -1.642 18135 14514 1 16 . 1 1 40 40 GLN N N 40 123.608 123.608 123.394 0.214 18135 14515 1 16 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.403 -0.784 18135 14516 1 16 . 1 1 40 40 GLN C C 40 176.958 176.958 177.789 -0.831 18135 14517 1 16 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.295 -1.222 18135 14518 1 16 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.586 1.231 18135 14519 1 16 . 1 1 40 40 GLN H H 40 7.966 7.966 8.287 -0.321 18135 14520 1 16 . 1 1 41 41 GLU N N 41 119.446 119.446 119.465 -0.019 18135 14521 1 16 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.103 0.034 18135 14522 1 16 . 1 1 41 41 GLU C C 41 177.346 177.346 178.186 -0.840 18135 14523 1 16 . 1 1 41 41 GLU CA C 41 57.929 57.929 59.055 -1.126 18135 14524 1 16 . 1 1 41 41 GLU CB C 41 27.833 27.833 28.833 -1.000 18135 14525 1 16 . 1 1 41 41 GLU H H 41 9.044 9.044 8.797 0.247 18135 14526 1 16 . 1 1 42 42 GLU N N 42 117.196 117.196 117.126 0.070 18135 14527 1 16 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.330 -0.267 18135 14528 1 16 . 1 1 42 42 GLU C C 42 174.886 174.886 178.225 -3.339 18135 14529 1 16 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.325 -0.941 18135 14530 1 16 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.219 -2.661 18135 14531 1 16 . 1 1 42 42 GLU H H 42 7.646 7.646 7.982 -0.336 18135 14532 1 16 . 1 1 43 43 PHE N N 43 115.527 115.527 121.028 -5.501 18135 14533 1 16 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.463 0.023 18135 14534 1 16 . 1 1 43 43 PHE C C 43 175.615 175.615 175.772 -0.157 18135 14535 1 16 . 1 1 43 43 PHE CA C 43 57.548 57.548 59.516 -1.968 18135 14536 1 16 . 1 1 43 43 PHE CB C 43 39.893 39.893 39.670 0.223 18135 14537 1 16 . 1 1 43 43 PHE H H 43 7.601 7.601 8.399 -0.798 18135 14538 1 16 . 1 1 44 44 GLY N N 44 107.243 107.243 107.412 -0.169 18135 14539 1 16 . 1 1 44 44 GLY C C 44 174.032 174.032 173.339 0.693 18135 14540 1 16 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.319 0.293 18135 14541 1 16 . 1 1 44 44 GLY H H 44 7.733 7.733 7.925 -0.192 18135 14542 1 16 . 1 1 45 45 ASN N N 45 117.599 117.599 113.859 3.740 18135 14543 1 16 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.369 0.182 18135 14544 1 16 . 1 1 45 45 ASN C C 45 175.894 175.894 175.492 0.402 18135 14545 1 16 . 1 1 45 45 ASN CA C 45 53.849 53.849 53.776 0.072 18135 14546 1 16 . 1 1 45 45 ASN CB C 45 38.419 38.419 37.354 1.065 18135 14547 1 16 . 1 1 45 45 ASN H H 45 8.343 8.343 8.524 -0.181 18135 14548 1 16 . 1 1 46 46 GLN N N 46 118.916 118.916 115.403 3.513 18135 14549 1 16 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.284 -0.202 18135 14550 1 16 . 1 1 46 46 GLN C C 46 175.851 175.851 174.815 1.036 18135 14551 1 16 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.352 1.294 18135 14552 1 16 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.222 1.222 18135 14553 1 16 . 1 1 46 46 GLN H H 46 8.652 8.652 8.188 0.464 18135 14554 1 16 . 1 1 47 47 PHE N N 47 119.511 119.511 118.791 0.720 18135 14555 1 16 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.477 0.085 18135 14556 1 16 . 1 1 47 47 PHE C C 47 176.258 176.258 175.263 0.995 18135 14557 1 16 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.452 -0.532 18135 14558 1 16 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.690 0.168 18135 14559 1 16 . 1 1 47 47 PHE H H 47 7.904 7.904 8.397 -0.493 18135 14560 1 16 . 1 1 48 48 GLN N N 48 120.127 120.127 117.724 2.403 18135 14561 1 16 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.562 -0.187 18135 14562 1 16 . 1 1 48 48 GLN C C 48 181.265 181.265 176.097 5.168 18135 14563 1 16 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.115 1.461 18135 14564 1 16 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.844 -0.376 18135 14565 1 16 . 1 1 48 48 GLN H H 48 8.255 8.255 7.746 0.509 18135 14566 1 16 . 1 1 49 49 LYS N N 49 121.777 121.777 122.768 -0.991 18135 14567 1 16 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.304 -0.201 18135 14568 1 16 . 1 1 49 49 LYS C C 49 177.968 177.968 178.095 -0.127 18135 14569 1 16 . 1 1 49 49 LYS CA C 49 58.149 58.149 59.564 -1.415 18135 14570 1 16 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.115 0.274 18135 14571 1 16 . 1 1 49 49 LYS H H 49 8.426 8.426 8.632 -0.206 18135 14572 1 16 . 1 1 50 50 ALA N N 50 120.573 120.573 119.621 0.952 18135 14573 1 16 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.204 -0.134 18135 14574 1 16 . 1 1 50 50 ALA C C 50 178.697 178.697 177.392 1.305 18135 14575 1 16 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.548 1.220 18135 14576 1 16 . 1 1 50 50 ALA CB C 50 18.874 18.874 17.962 0.912 18135 14577 1 16 . 1 1 50 50 ALA H H 50 8.578 8.578 8.213 0.365 18135 14578 1 16 . 1 1 51 51 GLU N N 51 115.015 115.015 115.337 -0.322 18135 14579 1 16 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.257 0.009 18135 14580 1 16 . 1 1 51 51 GLU C C 51 176.995 176.995 176.224 0.771 18135 14581 1 16 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.006 -0.013 18135 14582 1 16 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.203 -1.298 18135 14583 1 16 . 1 1 51 51 GLU H H 51 7.907 7.907 8.469 -0.562 18135 14584 1 16 . 1 1 52 52 THR N N 52 111.210 111.210 115.544 -4.334 18135 14585 1 16 . 1 1 52 52 THR HA H 52 4.114 4.114 4.270 -0.156 18135 14586 1 16 . 1 1 52 52 THR C C 52 175.271 175.271 175.559 -0.288 18135 14587 1 16 . 1 1 52 52 THR CA C 52 63.611 63.611 65.145 -1.534 18135 14588 1 16 . 1 1 52 52 THR CB C 52 69.673 69.673 68.965 0.708 18135 14589 1 16 . 1 1 52 52 THR H H 52 7.863 7.863 7.338 0.525 18135 14590 1 16 . 1 1 53 53 ILE N N 53 119.113 119.113 121.815 -2.702 18135 14591 1 16 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.026 -0.162 18135 14592 1 16 . 1 1 53 53 ILE CA C 53 66.907 66.907 66.381 0.526 18135 14593 1 16 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.137 -1.184 18135 14594 1 16 . 1 1 53 53 ILE H H 53 8.341 8.341 7.995 0.346 18135 14595 1 16 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.372 -0.086 18135 14596 1 16 . 1 1 54 54 PRO C C 54 179.655 179.655 178.858 0.797 18135 14597 1 16 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.158 -0.107 18135 14598 1 16 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.406 0.479 18135 14599 1 16 . 1 1 55 55 VAL N N 55 116.355 116.355 116.494 -0.139 18135 14600 1 16 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.784 -0.103 18135 14601 1 16 . 1 1 55 55 VAL C C 55 177.649 177.649 178.140 -0.491 18135 14602 1 16 . 1 1 55 55 VAL CA C 55 65.837 65.837 66.028 -0.191 18135 14603 1 16 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.930 0.541 18135 14604 1 16 . 1 1 55 55 VAL H H 55 7.119 7.119 7.408 -0.289 18135 14605 1 16 . 1 1 56 56 LEU N N 56 123.038 123.038 121.022 2.016 18135 14606 1 16 . 1 1 56 56 LEU HA H 56 4.310 4.310 3.989 0.321 18135 14607 1 16 . 1 1 56 56 LEU C C 56 178.637 178.637 177.917 0.720 18135 14608 1 16 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.550 -0.464 18135 14609 1 16 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.356 0.962 18135 14610 1 16 . 1 1 56 56 LEU H H 56 8.535 8.535 8.413 0.122 18135 14611 1 16 . 1 1 57 57 HIS N N 57 117.041 117.041 118.485 -1.444 18135 14612 1 16 . 1 1 57 57 HIS HA H 57 3.786 3.786 3.983 -0.197 18135 14613 1 16 . 1 1 57 57 HIS C C 57 175.640 175.640 177.392 -1.752 18135 14614 1 16 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.659 0.872 18135 14615 1 16 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.085 -1.876 18135 14616 1 16 . 1 1 57 57 HIS H H 57 9.047 9.047 8.071 0.976 18135 14617 1 16 . 1 1 58 58 GLU N N 58 119.521 119.521 118.333 1.188 18135 14618 1 16 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.766 0.241 18135 14619 1 16 . 1 1 58 58 GLU C C 58 179.029 179.029 178.643 0.386 18135 14620 1 16 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.312 -0.345 18135 14621 1 16 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.396 -1.106 18135 14622 1 16 . 1 1 58 58 GLU H H 58 7.860 7.860 8.081 -0.221 18135 14623 1 16 . 1 1 59 59 MET N N 59 119.512 119.512 120.384 -0.872 18135 14624 1 16 . 1 1 59 59 MET HA H 59 4.074 4.074 4.231 -0.157 18135 14625 1 16 . 1 1 59 59 MET C C 59 177.031 177.031 178.553 -1.522 18135 14626 1 16 . 1 1 59 59 MET CA C 59 59.408 59.408 59.353 0.055 18135 14627 1 16 . 1 1 59 59 MET CB C 59 32.525 32.525 32.876 -0.351 18135 14628 1 16 . 1 1 59 59 MET H H 59 8.442 8.442 7.922 0.520 18135 14629 1 16 . 1 1 60 60 ILE N N 60 117.183 117.183 118.047 -0.864 18135 14630 1 16 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.522 -0.105 18135 14631 1 16 . 1 1 60 60 ILE C C 60 177.524 177.524 178.133 -0.609 18135 14632 1 16 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.722 0.604 18135 14633 1 16 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.058 -0.198 18135 14634 1 16 . 1 1 60 60 ILE H H 60 8.338 8.338 7.796 0.542 18135 14635 1 16 . 1 1 61 61 GLN N N 61 120.191 120.191 120.152 0.039 18135 14636 1 16 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.744 -0.042 18135 14637 1 16 . 1 1 61 61 GLN C C 61 178.270 178.270 177.793 0.477 18135 14638 1 16 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.257 -0.471 18135 14639 1 16 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.205 0.461 18135 14640 1 16 . 1 1 61 61 GLN H H 61 8.234 8.234 8.134 0.100 18135 14641 1 16 . 1 1 62 62 GLN N N 62 116.795 116.795 118.720 -1.925 18135 14642 1 16 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.177 0.450 18135 14643 1 16 . 1 1 62 62 GLN C C 62 179.685 179.685 178.477 1.208 18135 14644 1 16 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.199 -0.191 18135 14645 1 16 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.730 -3.388 18135 14646 1 16 . 1 1 62 62 GLN H H 62 8.421 8.421 7.957 0.464 18135 14647 1 16 . 1 1 63 63 ILE N N 63 122.797 122.797 120.123 2.674 18135 14648 1 16 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.915 -0.266 18135 14649 1 16 . 1 1 63 63 ILE C C 63 177.279 177.279 177.881 -0.602 18135 14650 1 16 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.615 2.350 18135 14651 1 16 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.810 -0.495 18135 14652 1 16 . 1 1 63 63 ILE H H 63 8.164 8.164 7.670 0.494 18135 14653 1 16 . 1 1 64 64 PHE N N 64 120.820 120.820 121.212 -0.392 18135 14654 1 16 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.443 -0.727 18135 14655 1 16 . 1 1 64 64 PHE C C 64 178.402 178.402 176.555 1.847 18135 14656 1 16 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.127 1.024 18135 14657 1 16 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.822 -0.312 18135 14658 1 16 . 1 1 64 64 PHE H H 64 8.405 8.405 7.957 0.448 18135 14659 1 16 . 1 1 65 65 ASN N N 65 119.981 119.981 118.277 1.704 18135 14660 1 16 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.714 0.349 18135 14661 1 16 . 1 1 65 65 ASN C C 65 177.944 177.944 177.791 0.153 18135 14662 1 16 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.286 -0.418 18135 14663 1 16 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.637 -1.381 18135 14664 1 16 . 1 1 65 65 ASN H H 65 8.812 8.812 7.950 0.862 18135 14665 1 16 . 1 1 66 66 LEU N N 66 121.533 121.533 121.031 0.502 18135 14666 1 16 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.170 0.053 18135 14667 1 16 . 1 1 66 66 LEU C C 66 177.777 177.777 179.515 -1.738 18135 14668 1 16 . 1 1 66 66 LEU CA C 66 58.268 58.268 58.257 0.011 18135 14669 1 16 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.478 0.129 18135 14670 1 16 . 1 1 66 66 LEU H H 66 8.177 8.177 7.978 0.199 18135 14671 1 16 . 1 1 67 67 PHE N N 67 110.842 110.842 115.930 -5.088 18135 14672 1 16 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.517 0.363 18135 14673 1 16 . 1 1 67 67 PHE C C 67 177.965 177.965 177.339 0.626 18135 14674 1 16 . 1 1 67 67 PHE CA C 67 59.534 59.534 59.125 0.409 18135 14675 1 16 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.653 -0.037 18135 14676 1 16 . 1 1 67 67 PHE H H 67 8.160 8.160 8.514 -0.354 18135 14677 1 16 . 1 1 68 68 SER N N 68 119.131 119.131 113.652 5.479 18135 14678 1 16 . 1 1 68 68 SER HA H 68 4.580 4.580 4.223 0.357 18135 14679 1 16 . 1 1 68 68 SER C C 68 173.472 173.472 175.376 -1.904 18135 14680 1 16 . 1 1 68 68 SER CA C 68 59.191 59.191 59.458 -0.267 18135 14681 1 16 . 1 1 68 68 SER CB C 68 63.123 63.123 63.134 -0.011 18135 14682 1 16 . 1 1 68 68 SER H H 68 8.016 8.016 7.338 0.678 18135 14683 1 16 . 1 1 69 69 THR N N 69 111.353 111.353 116.385 -5.032 18135 14684 1 16 . 1 1 69 69 THR HA H 69 4.345 4.345 4.407 -0.062 18135 14685 1 16 . 1 1 69 69 THR C C 69 175.661 175.661 173.995 1.666 18135 14686 1 16 . 1 1 69 69 THR CA C 69 61.411 61.411 60.722 0.689 18135 14687 1 16 . 1 1 69 69 THR CB C 69 72.209 72.209 70.387 1.822 18135 14688 1 16 . 1 1 69 69 THR H H 69 6.977 6.977 7.372 -0.395 18135 14689 1 16 . 1 1 70 70 LYS N N 70 121.120 121.120 123.325 -2.205 18135 14690 1 16 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.096 -0.007 18135 14691 1 16 . 1 1 70 70 LYS C C 70 179.259 179.259 176.958 2.301 18135 14692 1 16 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.602 -0.645 18135 14693 1 16 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.375 -0.625 18135 14694 1 16 . 1 1 70 70 LYS H H 70 9.065 9.065 8.631 0.434 18135 14695 1 16 . 1 1 71 71 ASP N N 71 116.374 116.374 117.979 -1.605 18135 14696 1 16 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.319 -0.144 18135 14697 1 16 . 1 1 71 71 ASP C C 71 178.372 178.372 176.564 1.808 18135 14698 1 16 . 1 1 71 71 ASP CA C 71 57.067 57.067 56.578 0.489 18135 14699 1 16 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.428 -0.122 18135 14700 1 16 . 1 1 71 71 ASP H H 71 7.518 7.518 7.818 -0.300 18135 14701 1 16 . 1 1 72 72 SER N N 72 117.341 117.341 112.895 4.446 18135 14702 1 16 . 1 1 72 72 SER HA H 72 3.715 3.715 3.168 0.547 18135 14703 1 16 . 1 1 72 72 SER C C 72 176.897 176.897 176.106 0.791 18135 14704 1 16 . 1 1 72 72 SER CA C 72 60.267 60.267 59.554 0.713 18135 14705 1 16 . 1 1 72 72 SER CB C 72 62.616 62.616 63.969 -1.353 18135 14706 1 16 . 1 1 72 72 SER H H 72 8.066 8.066 7.416 0.650 18135 14707 1 16 . 1 1 73 73 SER N N 73 113.398 113.398 117.174 -3.776 18135 14708 1 16 . 1 1 73 73 SER HA H 73 4.094 4.094 4.093 0.001 18135 14709 1 16 . 1 1 73 73 SER C C 73 174.855 174.855 174.902 -0.047 18135 14710 1 16 . 1 1 73 73 SER CA C 73 61.385 61.385 59.933 1.452 18135 14711 1 16 . 1 1 73 73 SER CB C 73 62.798 62.798 62.750 0.048 18135 14712 1 16 . 1 1 73 73 SER H H 73 7.982 7.982 7.615 0.367 18135 14713 1 16 . 1 1 74 74 ALA N N 74 119.486 119.486 119.853 -0.367 18135 14714 1 16 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.154 0.003 18135 14715 1 16 . 1 1 74 74 ALA C C 74 177.626 177.626 177.499 0.127 18135 14716 1 16 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.782 -0.069 18135 14717 1 16 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.895 -0.148 18135 14718 1 16 . 1 1 74 74 ALA H H 74 7.095 7.095 7.617 -0.522 18135 14719 1 16 . 1 1 75 75 ALA N N 75 121.465 121.465 120.631 0.834 18135 14720 1 16 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.898 -0.202 18135 14721 1 16 . 1 1 75 75 ALA C C 75 177.197 177.197 176.139 1.058 18135 14722 1 16 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.070 0.934 18135 14723 1 16 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.003 -0.743 18135 14724 1 16 . 1 1 75 75 ALA H H 75 7.159 7.159 7.266 -0.107 18135 14725 1 16 . 1 1 76 76 TRP N N 76 116.791 116.791 116.589 0.202 18135 14726 1 16 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.733 0.317 18135 14727 1 16 . 1 1 76 76 TRP C C 76 177.617 177.617 174.761 2.856 18135 14728 1 16 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.174 -1.855 18135 14729 1 16 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.970 2.106 18135 14730 1 16 . 1 1 76 76 TRP H H 76 7.080 7.080 7.043 0.037 18135 14731 1 16 . 1 1 77 77 ASP N N 77 119.928 119.928 121.274 -1.346 18135 14732 1 16 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.518 -0.161 18135 14733 1 16 . 1 1 77 77 ASP C C 77 176.877 176.877 177.728 -0.851 18135 14734 1 16 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.212 -0.395 18135 14735 1 16 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.194 0.422 18135 14736 1 16 . 1 1 77 77 ASP H H 77 8.259 8.259 8.925 -0.666 18135 14737 1 16 . 1 1 78 78 GLU N N 78 127.277 127.277 126.134 1.143 18135 14738 1 16 . 1 1 78 78 GLU HA H 78 3.885 3.885 4.081 -0.196 18135 14739 1 16 . 1 1 78 78 GLU C C 78 177.439 177.439 178.148 -0.709 18135 14740 1 16 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.358 0.026 18135 14741 1 16 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.530 -0.888 18135 14742 1 16 . 1 1 78 78 GLU H H 78 8.920 8.920 8.868 0.052 18135 14743 1 16 . 1 1 79 79 THR N N 79 115.422 115.422 117.952 -2.530 18135 14744 1 16 . 1 1 79 79 THR HA H 79 3.907 3.907 4.023 -0.116 18135 14745 1 16 . 1 1 79 79 THR C C 79 177.330 177.330 176.529 0.801 18135 14746 1 16 . 1 1 79 79 THR CA C 79 66.263 66.263 66.528 -0.265 18135 14747 1 16 . 1 1 79 79 THR CB C 79 68.002 68.002 68.654 -0.652 18135 14748 1 16 . 1 1 79 79 THR H H 79 8.124 8.124 7.661 0.463 18135 14749 1 16 . 1 1 80 80 LEU N N 80 121.791 121.791 121.852 -0.061 18135 14750 1 16 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.115 -0.228 18135 14751 1 16 . 1 1 80 80 LEU C C 80 179.018 179.018 178.374 0.644 18135 14752 1 16 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.935 -0.697 18135 14753 1 16 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.098 0.554 18135 14754 1 16 . 1 1 80 80 LEU H H 80 7.725 7.725 8.089 -0.364 18135 14755 1 16 . 1 1 81 81 LEU N N 81 119.280 119.280 120.227 -0.947 18135 14756 1 16 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.211 -0.722 18135 14757 1 16 . 1 1 81 81 LEU C C 81 177.062 177.062 178.760 -1.698 18135 14758 1 16 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.849 -1.140 18135 14759 1 16 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.052 -1.104 18135 14760 1 16 . 1 1 81 81 LEU H H 81 8.344 8.344 8.610 -0.266 18135 14761 1 16 . 1 1 82 82 ASP N N 82 115.357 115.357 119.678 -4.321 18135 14762 1 16 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.422 -0.148 18135 14763 1 16 . 1 1 82 82 ASP C C 82 179.018 179.018 178.426 0.592 18135 14764 1 16 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.644 -0.829 18135 14765 1 16 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.873 -2.652 18135 14766 1 16 . 1 1 82 82 ASP H H 82 8.001 8.001 8.460 -0.459 18135 14767 1 16 . 1 1 83 83 LYS N N 83 119.603 119.603 119.073 0.530 18135 14768 1 16 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.835 0.147 18135 14769 1 16 . 1 1 83 83 LYS C C 83 178.624 178.624 178.844 -0.220 18135 14770 1 16 . 1 1 83 83 LYS CA C 83 59.745 59.745 59.417 0.328 18135 14771 1 16 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.413 0.693 18135 14772 1 16 . 1 1 83 83 LYS H H 83 7.342 7.342 7.609 -0.267 18135 14773 1 16 . 1 1 84 84 PHE N N 84 123.933 123.933 121.879 2.054 18135 14774 1 16 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.018 0.017 18135 14775 1 16 . 1 1 84 84 PHE C C 84 177.210 177.210 176.943 0.267 18135 14776 1 16 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.712 -1.369 18135 14777 1 16 . 1 1 84 84 PHE CB C 84 39.316 39.316 39.021 0.295 18135 14778 1 16 . 1 1 84 84 PHE H H 84 8.471 8.471 8.402 0.069 18135 14779 1 16 . 1 1 85 85 TYR N N 85 118.387 118.387 117.511 0.876 18135 14780 1 16 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.768 0.300 18135 14781 1 16 . 1 1 85 85 TYR C C 85 178.104 178.104 177.609 0.495 18135 14782 1 16 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.664 -1.087 18135 14783 1 16 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.520 -0.542 18135 14784 1 16 . 1 1 85 85 TYR H H 85 9.011 9.011 8.954 0.057 18135 14785 1 16 . 1 1 86 86 THR N N 86 114.035 114.035 116.097 -2.062 18135 14786 1 16 . 1 1 86 86 THR HA H 86 3.945 3.945 3.264 0.681 18135 14787 1 16 . 1 1 86 86 THR C C 86 176.708 176.708 176.305 0.403 18135 14788 1 16 . 1 1 86 86 THR CA C 86 66.759 66.759 66.952 -0.193 18135 14789 1 16 . 1 1 86 86 THR CB C 86 68.853 68.853 67.871 0.982 18135 14790 1 16 . 1 1 86 86 THR H H 86 7.609 7.609 7.341 0.268 18135 14791 1 16 . 1 1 87 87 GLU N N 87 120.790 120.790 121.357 -0.567 18135 14792 1 16 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.960 0.087 18135 14793 1 16 . 1 1 87 87 GLU C C 87 179.606 179.606 179.038 0.568 18135 14794 1 16 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.035 -0.638 18135 14795 1 16 . 1 1 87 87 GLU CB C 87 28.286 28.286 28.986 -0.700 18135 14796 1 16 . 1 1 87 87 GLU H H 87 7.712 7.712 7.596 0.116 18135 14797 1 16 . 1 1 88 88 LEU N N 88 120.729 120.729 120.084 0.645 18135 14798 1 16 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.898 -0.170 18135 14799 1 16 . 1 1 88 88 LEU C C 88 178.695 178.695 179.266 -0.571 18135 14800 1 16 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.289 0.962 18135 14801 1 16 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.033 1.554 18135 14802 1 16 . 1 1 88 88 LEU H H 88 8.393 8.393 7.483 0.910 18135 14803 1 16 . 1 1 89 89 TYR N N 89 118.654 118.654 118.746 -0.092 18135 14804 1 16 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.063 -0.132 18135 14805 1 16 . 1 1 89 89 TYR C C 89 178.438 178.438 178.586 -0.148 18135 14806 1 16 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.289 0.117 18135 14807 1 16 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.404 0.463 18135 14808 1 16 . 1 1 89 89 TYR H H 89 8.637 8.637 8.336 0.301 18135 14809 1 16 . 1 1 90 90 GLN N N 90 118.263 118.263 116.441 1.822 18135 14810 1 16 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.986 -0.000 18135 14811 1 16 . 1 1 90 90 GLN C C 90 178.411 178.411 178.773 -0.362 18135 14812 1 16 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.657 0.126 18135 14813 1 16 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.307 -0.160 18135 14814 1 16 . 1 1 90 90 GLN H H 90 7.796 7.796 7.828 -0.032 18135 14815 1 16 . 1 1 91 91 GLN N N 91 117.959 117.959 120.228 -2.269 18135 14816 1 16 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.060 0.022 18135 14817 1 16 . 1 1 91 91 GLN C C 91 178.705 178.705 178.525 0.180 18135 14818 1 16 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.816 0.004 18135 14819 1 16 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.359 0.814 18135 14820 1 16 . 1 1 91 91 GLN H H 91 7.727 7.727 8.146 -0.419 18135 14821 1 16 . 1 1 92 92 LEU N N 92 119.965 119.965 118.439 1.526 18135 14822 1 16 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.961 -0.227 18135 14823 1 16 . 1 1 92 92 LEU C C 92 178.984 178.984 178.664 0.320 18135 14824 1 16 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.928 -0.436 18135 14825 1 16 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.850 0.529 18135 14826 1 16 . 1 1 92 92 LEU H H 92 8.465 8.465 8.440 0.025 18135 14827 1 16 . 1 1 93 93 ASN N N 93 117.793 117.793 118.298 -0.505 18135 14828 1 16 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.261 0.140 18135 14829 1 16 . 1 1 93 93 ASN C C 93 178.309 178.309 177.163 1.146 18135 14830 1 16 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.228 0.175 18135 14831 1 16 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.216 0.422 18135 14832 1 16 . 1 1 93 93 ASN H H 93 8.091 8.091 8.029 0.062 18135 14833 1 16 . 1 1 94 94 ASP N N 94 121.133 121.133 120.754 0.379 18135 14834 1 16 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.362 0.043 18135 14835 1 16 . 1 1 94 94 ASP C C 94 178.328 178.328 178.669 -0.341 18135 14836 1 16 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.269 -0.722 18135 14837 1 16 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.947 -2.298 18135 14838 1 16 . 1 1 94 94 ASP H H 94 8.362 8.362 7.964 0.398 18135 14839 1 16 . 1 1 95 95 LEU N N 95 119.160 119.160 121.262 -2.102 18135 14840 1 16 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.809 0.230 18135 14841 1 16 . 1 1 95 95 LEU C C 95 178.826 178.826 178.404 0.422 18135 14842 1 16 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.158 -1.131 18135 14843 1 16 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.056 0.154 18135 14844 1 16 . 1 1 95 95 LEU H H 95 8.143 8.143 8.547 -0.404 18135 14845 1 16 . 1 1 96 96 GLU N N 96 118.813 118.813 118.741 0.072 18135 14846 1 16 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.694 0.267 18135 14847 1 16 . 1 1 96 96 GLU C C 96 177.640 177.640 178.287 -0.647 18135 14848 1 16 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.519 -1.805 18135 14849 1 16 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.377 -1.239 18135 14850 1 16 . 1 1 96 96 GLU H H 96 8.111 8.111 8.280 -0.169 18135 14851 1 16 . 1 1 97 97 ALA N N 97 120.549 120.549 120.846 -0.297 18135 14852 1 16 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.986 0.136 18135 14853 1 16 . 1 1 97 97 ALA C C 97 179.126 179.126 180.290 -1.164 18135 14854 1 16 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.680 -0.647 18135 14855 1 16 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.902 0.078 18135 14856 1 16 . 1 1 97 97 ALA H H 97 7.798 7.798 7.764 0.034 18135 14857 1 16 . 1 1 98 98 CYS N N 98 115.510 115.510 117.128 -1.618 18135 14858 1 16 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.180 0.270 18135 14859 1 16 . 1 1 98 98 CYS C C 98 175.363 175.363 175.886 -0.523 18135 14860 1 16 . 1 1 98 98 CYS CA C 98 57.166 57.166 61.864 -4.698 18135 14861 1 16 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.353 15.526 18135 14862 1 16 . 1 1 98 98 CYS H H 98 7.597 7.597 7.819 -0.222 18135 14863 1 16 . 1 1 99 99 VAL N N 99 121.713 121.713 119.168 2.545 18135 14864 1 16 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.901 -0.107 18135 14865 1 16 . 1 1 99 99 VAL C C 99 177.357 177.357 177.689 -0.332 18135 14866 1 16 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.504 -0.921 18135 14867 1 16 . 1 1 99 99 VAL CB C 99 32.031 32.031 31.969 0.062 18135 14868 1 16 . 1 1 99 99 VAL H H 99 7.828 7.828 7.648 0.180 18135 14869 1 16 . 1 1 100 100 ILE N N 100 122.333 122.333 117.810 4.523 18135 14870 1 16 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.722 0.202 18135 14871 1 16 . 1 1 100 100 ILE C C 100 176.827 176.827 176.648 0.179 18135 14872 1 16 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.688 -1.450 18135 14873 1 16 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.781 0.497 18135 14874 1 16 . 1 1 100 100 ILE H H 100 8.067 8.067 8.223 -0.156 18135 14875 1 16 . 1 1 101 101 GLN N N 101 121.864 121.864 117.300 4.564 18135 14876 1 16 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.214 0.012 18135 14877 1 16 . 1 1 101 101 GLN C C 101 176.438 176.438 177.979 -1.541 18135 14878 1 16 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.518 -0.198 18135 14879 1 16 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.098 -0.087 18135 14880 1 16 . 1 1 101 101 GLN H H 101 8.062 8.062 7.424 0.638 18135 14881 1 16 . 1 1 102 102 GLY N N 102 109.288 109.288 106.778 2.510 18135 14882 1 16 . 1 1 102 102 GLY C C 102 173.855 173.855 175.290 -1.435 18135 14883 1 16 . 1 1 102 102 GLY CA C 102 45.159 45.159 45.677 -0.518 18135 14884 1 16 . 1 1 102 102 GLY H H 102 8.087 8.087 8.733 -0.646 18135 14885 1 16 . 1 1 103 103 VAL N N 103 118.932 118.932 114.555 4.377 18135 14886 1 16 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.851 0.223 18135 14887 1 16 . 1 1 103 103 VAL C C 103 176.299 176.299 175.739 0.560 18135 14888 1 16 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.750 -1.251 18135 14889 1 16 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.422 1.432 18135 14890 1 16 . 1 1 103 103 VAL H H 103 8.079 8.079 7.629 0.450 18135 14891 1 16 . 1 1 104 104 GLY N N 104 112.028 112.028 108.108 3.920 18135 14892 1 16 . 1 1 104 104 GLY C C 104 173.694 173.694 173.575 0.119 18135 14893 1 16 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.054 0.347 18135 14894 1 16 . 1 1 104 104 GLY H H 104 8.446 8.446 7.577 0.869 18135 14895 1 16 . 1 1 105 105 VAL N N 105 120.439 120.439 121.334 -0.895 18135 14896 1 16 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.387 -0.199 18135 14897 1 16 . 1 1 105 105 VAL C C 105 175.963 175.963 174.808 1.155 18135 14898 1 16 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.278 0.858 18135 14899 1 16 . 1 1 105 105 VAL CB C 105 32.814 32.814 35.274 -2.460 18135 14900 1 16 . 1 1 105 105 VAL H H 105 7.867 7.867 7.978 -0.111 18135 14901 1 16 . 1 1 106 106 THR N N 106 116.366 116.366 115.613 0.753 18135 14902 1 16 . 1 1 106 106 THR HA H 106 4.548 4.548 4.574 -0.026 18135 14903 1 16 . 1 1 106 106 THR C C 106 173.731 173.731 173.553 0.178 18135 14904 1 16 . 1 1 106 106 THR CA C 106 59.419 59.419 60.076 -0.657 18135 14905 1 16 . 1 1 106 106 THR CB C 106 79.536 79.536 70.956 8.580 18135 14906 1 16 . 1 1 106 106 THR H H 106 8.565 8.565 7.979 0.586 18135 14907 1 16 . 1 1 107 107 GLU N N 107 119.743 119.743 120.132 -0.389 18135 14908 1 16 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.573 -0.111 18135 14909 1 16 . 1 1 107 107 GLU C C 107 175.639 175.639 176.661 -1.022 18135 14910 1 16 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.806 0.905 18135 14911 1 16 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.242 -0.744 18135 14912 1 16 . 1 1 107 107 GLU H H 107 8.410 8.410 8.397 0.013 18135 14913 1 16 . 1 1 108 108 THR N N 108 114.402 114.402 112.015 2.387 18135 14914 1 16 . 1 1 108 108 THR HA H 108 4.448 4.448 4.612 -0.164 18135 14915 1 16 . 1 1 108 108 THR CA C 108 60.348 60.348 58.701 1.647 18135 14916 1 16 . 1 1 108 108 THR CB C 108 68.544 68.544 69.199 -0.655 18135 14917 1 16 . 1 1 108 108 THR H H 108 8.155 8.155 8.505 -0.350 18135 14918 1 16 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.483 -0.245 18135 14919 1 16 . 1 1 109 109 PRO C C 109 178.666 178.666 176.558 2.108 18135 14920 1 16 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.222 1.154 18135 14921 1 16 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.726 0.122 18135 14922 1 16 . 1 1 110 110 LEU N N 110 118.566 118.566 116.261 2.305 18135 14923 1 16 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.276 -0.160 18135 14924 1 16 . 1 1 110 110 LEU C C 110 178.293 178.293 178.961 -0.668 18135 14925 1 16 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.113 -0.427 18135 14926 1 16 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.986 -0.017 18135 14927 1 16 . 1 1 110 110 LEU H H 110 8.016 8.016 7.213 0.803 18135 14928 1 16 . 1 1 111 111 MET N N 111 118.982 118.982 115.553 3.429 18135 14929 1 16 . 1 1 111 111 MET HA H 111 4.210 4.210 4.448 -0.238 18135 14930 1 16 . 1 1 111 111 MET C C 111 178.720 178.720 177.755 0.965 18135 14931 1 16 . 1 1 111 111 MET CA C 111 58.144 58.144 58.062 0.082 18135 14932 1 16 . 1 1 111 111 MET CB C 111 32.374 32.374 33.023 -0.649 18135 14933 1 16 . 1 1 111 111 MET H H 111 7.705 7.705 7.500 0.205 18135 14934 1 16 . 1 1 112 112 LYS N N 112 121.377 121.377 118.887 2.490 18135 14935 1 16 . 1 1 112 112 LYS HA H 112 4.108 4.108 3.992 0.116 18135 14936 1 16 . 1 1 112 112 LYS C C 112 178.000 178.000 177.681 0.319 18135 14937 1 16 . 1 1 112 112 LYS CA C 112 56.305 56.305 59.257 -2.952 18135 14938 1 16 . 1 1 112 112 LYS CB C 112 32.367 32.367 31.867 0.500 18135 14939 1 16 . 1 1 112 112 LYS H H 112 8.257 8.257 7.787 0.470 18135 14940 1 16 . 1 1 113 113 GLU N N 113 119.104 119.104 119.836 -0.732 18135 14941 1 16 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.983 0.083 18135 14942 1 16 . 1 1 113 113 GLU C C 113 178.289 178.289 178.938 -0.649 18135 14943 1 16 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.300 -1.047 18135 14944 1 16 . 1 1 113 113 GLU CB C 113 28.138 28.138 28.763 -0.625 18135 14945 1 16 . 1 1 113 113 GLU H H 113 8.270 8.270 7.589 0.681 18135 14946 1 16 . 1 1 114 114 ASP N N 114 119.224 119.224 119.970 -0.746 18135 14947 1 16 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.457 -0.169 18135 14948 1 16 . 1 1 114 114 ASP C C 114 178.365 178.365 178.887 -0.522 18135 14949 1 16 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.320 -1.212 18135 14950 1 16 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.383 -2.148 18135 14951 1 16 . 1 1 114 114 ASP H H 114 8.618 8.618 7.726 0.892 18135 14952 1 16 . 1 1 115 115 SER N N 115 118.195 118.195 116.144 2.051 18135 14953 1 16 . 1 1 115 115 SER HA H 115 4.200 4.200 4.148 0.052 18135 14954 1 16 . 1 1 115 115 SER C C 115 175.986 175.986 176.684 -0.698 18135 14955 1 16 . 1 1 115 115 SER CA C 115 61.588 61.588 62.018 -0.430 18135 14956 1 16 . 1 1 115 115 SER CB C 115 62.653 62.653 62.882 -0.229 18135 14957 1 16 . 1 1 115 115 SER H H 115 8.181 8.181 7.622 0.559 18135 14958 1 16 . 1 1 116 116 ILE N N 116 123.340 123.340 121.686 1.654 18135 14959 1 16 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.826 -0.200 18135 14960 1 16 . 1 1 116 116 ILE C C 116 178.367 178.367 178.218 0.149 18135 14961 1 16 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.949 0.868 18135 14962 1 16 . 1 1 116 116 ILE CB C 116 37.418 37.418 37.004 0.414 18135 14963 1 16 . 1 1 116 116 ILE H H 116 7.773 7.773 8.458 -0.685 18135 14964 1 16 . 1 1 117 117 LEU N N 117 120.968 120.968 121.486 -0.518 18135 14965 1 16 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.944 -0.039 18135 14966 1 16 . 1 1 117 117 LEU C C 117 178.746 178.746 178.435 0.311 18135 14967 1 16 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.603 -0.460 18135 14968 1 16 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.594 -0.008 18135 14969 1 16 . 1 1 117 117 LEU H H 117 8.406 8.406 8.145 0.261 18135 14970 1 16 . 1 1 118 118 ALA N N 118 120.150 120.150 121.953 -1.803 18135 14971 1 16 . 1 1 118 118 ALA HA H 118 4.112 4.112 4.089 0.023 18135 14972 1 16 . 1 1 118 118 ALA C C 118 181.633 181.633 179.493 2.140 18135 14973 1 16 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.415 -0.102 18135 14974 1 16 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.592 -0.482 18135 14975 1 16 . 1 1 118 118 ALA H H 118 7.894 7.894 8.110 -0.216 18135 14976 1 16 . 1 1 119 119 VAL N N 119 118.873 118.873 116.605 2.268 18135 14977 1 16 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.549 0.206 18135 14978 1 16 . 1 1 119 119 VAL C C 119 177.896 177.896 178.037 -0.141 18135 14979 1 16 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.212 0.969 18135 14980 1 16 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.108 0.785 18135 14981 1 16 . 1 1 119 119 VAL H H 119 7.572 7.572 7.988 -0.416 18135 14982 1 16 . 1 1 120 120 ARG N N 120 121.436 121.436 120.277 1.159 18135 14983 1 16 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.082 -0.055 18135 14984 1 16 . 1 1 120 120 ARG C C 120 179.848 179.848 178.754 1.094 18135 14985 1 16 . 1 1 120 120 ARG CA C 120 61.267 61.267 60.138 1.129 18135 14986 1 16 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.998 -0.303 18135 14987 1 16 . 1 1 120 120 ARG H H 120 8.629 8.629 8.496 0.133 18135 14988 1 16 . 1 1 121 121 LYS N N 121 119.589 119.589 119.956 -0.367 18135 14989 1 16 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.018 0.056 18135 14990 1 16 . 1 1 121 121 LYS C C 121 178.331 178.331 178.794 -0.463 18135 14991 1 16 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.867 0.573 18135 14992 1 16 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.456 -0.349 18135 14993 1 16 . 1 1 121 121 LYS H H 121 9.015 9.015 8.130 0.885 18135 14994 1 16 . 1 1 122 122 TYR N N 122 121.546 121.546 120.972 0.574 18135 14995 1 16 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.146 0.186 18135 14996 1 16 . 1 1 122 122 TYR C C 122 176.527 176.527 177.845 -1.318 18135 14997 1 16 . 1 1 122 122 TYR CA C 122 60.404 60.404 62.000 -1.596 18135 14998 1 16 . 1 1 122 122 TYR CB C 122 37.725 37.725 38.494 -0.769 18135 14999 1 16 . 1 1 122 122 TYR H H 122 7.473 7.473 8.220 -0.747 18135 15000 1 16 . 1 1 123 123 PHE N N 123 116.026 116.026 118.834 -2.808 18135 15001 1 16 . 1 1 123 123 PHE HA H 123 3.740 3.740 4.024 -0.284 18135 15002 1 16 . 1 1 123 123 PHE C C 123 179.005 179.005 177.561 1.444 18135 15003 1 16 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.362 3.166 18135 15004 1 16 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.804 0.527 18135 15005 1 16 . 1 1 123 123 PHE H H 123 7.932 7.932 8.546 -0.614 18135 15006 1 16 . 1 1 124 124 GLN N N 124 123.043 123.043 119.270 3.773 18135 15007 1 16 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.473 0.706 18135 15008 1 16 . 1 1 124 124 GLN C C 124 178.772 178.772 178.325 0.447 18135 15009 1 16 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.492 -0.176 18135 15010 1 16 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.466 -0.835 18135 15011 1 16 . 1 1 124 124 GLN H H 124 8.470 8.470 8.523 -0.053 18135 15012 1 16 . 1 1 125 125 ARG N N 125 120.342 120.342 118.589 1.753 18135 15013 1 16 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.073 0.005 18135 15014 1 16 . 1 1 125 125 ARG C C 125 180.340 180.340 179.047 1.293 18135 15015 1 16 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.497 2.800 18135 15016 1 16 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.024 0.301 18135 15017 1 16 . 1 1 125 125 ARG H H 125 8.137 8.137 8.363 -0.226 18135 15018 1 16 . 1 1 126 126 ILE N N 126 121.876 121.876 121.144 0.732 18135 15019 1 16 . 1 1 126 126 ILE HA H 126 3.351 3.351 2.999 0.352 18135 15020 1 16 . 1 1 126 126 ILE C C 126 176.857 176.857 177.620 -0.763 18135 15021 1 16 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.483 1.349 18135 15022 1 16 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.602 0.682 18135 15023 1 16 . 1 1 126 126 ILE H H 126 7.526 7.526 8.223 -0.697 18135 15024 1 16 . 1 1 127 127 THR N N 127 115.613 115.613 115.217 0.396 18135 15025 1 16 . 1 1 127 127 THR HA H 127 3.633 3.633 3.785 -0.152 18135 15026 1 16 . 1 1 127 127 THR C C 127 176.645 176.645 177.002 -0.357 18135 15027 1 16 . 1 1 127 127 THR CA C 127 67.294 67.294 66.556 0.738 18135 15028 1 16 . 1 1 127 127 THR CB C 127 68.871 68.871 68.857 0.014 18135 15029 1 16 . 1 1 127 127 THR H H 127 8.288 8.288 8.041 0.247 18135 15030 1 16 . 1 1 128 128 LEU N N 128 122.627 122.627 122.101 0.526 18135 15031 1 16 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.925 0.031 18135 15032 1 16 . 1 1 128 128 LEU C C 128 178.331 178.331 177.417 0.914 18135 15033 1 16 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.527 0.561 18135 15034 1 16 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.105 0.469 18135 15035 1 16 . 1 1 128 128 LEU H H 128 8.263 8.263 8.012 0.251 18135 15036 1 16 . 1 1 129 129 TYR N N 129 120.955 120.955 120.167 0.788 18135 15037 1 16 . 1 1 129 129 TYR HA H 129 3.890 3.890 3.963 -0.073 18135 15038 1 16 . 1 1 129 129 TYR C C 129 176.040 176.040 177.225 -1.185 18135 15039 1 16 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.706 -0.213 18135 15040 1 16 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.206 0.719 18135 15041 1 16 . 1 1 129 129 TYR H H 129 7.518 7.518 7.955 -0.437 18135 15042 1 16 . 1 1 130 130 LEU N N 130 119.155 119.155 116.378 2.777 18135 15043 1 16 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.284 -0.439 18135 15044 1 16 . 1 1 130 130 LEU C C 130 177.948 177.948 178.300 -0.352 18135 15045 1 16 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.839 0.274 18135 15046 1 16 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.507 1.079 18135 15047 1 16 . 1 1 130 130 LEU H H 130 7.717 7.717 7.896 -0.179 18135 15048 1 16 . 1 1 131 131 LYS N N 131 116.832 116.832 119.914 -3.082 18135 15049 1 16 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.778 -0.370 18135 15050 1 16 . 1 1 131 131 LYS C C 131 181.265 181.265 179.667 1.598 18135 15051 1 16 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.597 0.134 18135 15052 1 16 . 1 1 131 131 LYS CB C 131 32.672 32.672 31.990 0.682 18135 15053 1 16 . 1 1 131 131 LYS H H 131 7.493 7.493 7.776 -0.283 18135 15054 1 16 . 1 1 132 132 GLU N N 132 121.918 121.918 118.672 3.246 18135 15055 1 16 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.037 -0.193 18135 15056 1 16 . 1 1 132 132 GLU C C 132 178.377 178.377 177.564 0.813 18135 15057 1 16 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.545 0.342 18135 15058 1 16 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.469 -0.802 18135 15059 1 16 . 1 1 132 132 GLU H H 132 8.430 8.430 7.907 0.523 18135 15060 1 16 . 1 1 133 133 LYS N N 133 116.079 116.079 115.988 0.091 18135 15061 1 16 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.291 -0.325 18135 15062 1 16 . 1 1 133 133 LYS C C 133 175.282 175.282 176.207 -0.925 18135 15063 1 16 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.296 0.002 18135 15064 1 16 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.738 0.260 18135 15065 1 16 . 1 1 133 133 LYS H H 133 7.390 7.390 7.305 0.085 18135 15066 1 16 . 1 1 134 134 LYS N N 134 117.759 117.759 116.921 0.838 18135 15067 1 16 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.022 -0.440 18135 15068 1 16 . 1 1 134 134 LYS C C 134 176.271 176.271 175.895 0.376 18135 15069 1 16 . 1 1 134 134 LYS CA C 134 57.308 57.308 57.174 0.134 18135 15070 1 16 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.493 -0.691 18135 15071 1 16 . 1 1 134 134 LYS H H 134 7.716 7.716 7.597 0.119 18135 15072 1 16 . 1 1 135 135 TYR N N 135 110.598 110.598 112.789 -2.191 18135 15073 1 16 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.912 -1.035 18135 15074 1 16 . 1 1 135 135 TYR C C 135 174.148 174.148 175.710 -1.562 18135 15075 1 16 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.279 0.436 18135 15076 1 16 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.391 -0.685 18135 15077 1 16 . 1 1 135 135 TYR H H 135 8.428 8.428 8.666 -0.238 18135 15078 1 16 . 1 1 136 136 SER N N 136 113.712 113.712 115.624 -1.912 18135 15079 1 16 . 1 1 136 136 SER HA H 136 4.553 4.553 4.391 0.162 18135 15080 1 16 . 1 1 136 136 SER CA C 136 57.108 57.108 59.144 -2.036 18135 15081 1 16 . 1 1 136 136 SER CB C 136 62.500 62.500 63.924 -1.424 18135 15082 1 16 . 1 1 136 136 SER H H 136 6.744 6.744 7.550 -0.806 18135 15083 1 16 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.411 -0.246 18135 15084 1 16 . 1 1 137 137 PRO C C 137 180.675 180.675 177.194 3.481 18135 15085 1 16 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.750 0.907 18135 15086 1 16 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.690 0.293 18135 15087 1 16 . 1 1 138 138 CYS N N 138 113.914 113.914 116.835 -2.921 18135 15088 1 16 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.660 0.010 18135 15089 1 16 . 1 1 138 138 CYS C C 138 176.015 176.015 176.798 -0.783 18135 15090 1 16 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.973 -3.878 18135 15091 1 16 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.398 10.381 18135 15092 1 16 . 1 1 138 138 CYS H H 138 8.580 8.580 8.413 0.167 18135 15093 1 16 . 1 1 139 139 ALA N N 139 125.290 125.290 124.644 0.646 18135 15094 1 16 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.224 0.225 18135 15095 1 16 . 1 1 139 139 ALA C C 139 180.149 180.149 179.406 0.743 18135 15096 1 16 . 1 1 139 139 ALA CA C 139 54.778 54.778 55.073 -0.295 18135 15097 1 16 . 1 1 139 139 ALA CB C 139 18.918 18.918 17.913 1.005 18135 15098 1 16 . 1 1 139 139 ALA H H 139 8.087 8.087 8.229 -0.142 18135 15099 1 16 . 1 1 140 140 TRP N N 140 116.599 116.599 118.586 -1.987 18135 15100 1 16 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.289 0.313 18135 15101 1 16 . 1 1 140 140 TRP C C 140 179.137 179.137 178.592 0.545 18135 15102 1 16 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.469 -0.935 18135 15103 1 16 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.370 -0.112 18135 15104 1 16 . 1 1 140 140 TRP H H 140 8.505 8.505 7.802 0.703 18135 15105 1 16 . 1 1 141 141 GLU N N 141 121.578 121.578 119.521 2.057 18135 15106 1 16 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.352 0.871 18135 15107 1 16 . 1 1 141 141 GLU C C 141 177.886 177.886 178.842 -0.956 18135 15108 1 16 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.972 -2.065 18135 15109 1 16 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.410 -0.693 18135 15110 1 16 . 1 1 141 141 GLU H H 141 8.182 8.182 8.080 0.102 18135 15111 1 16 . 1 1 142 142 VAL N N 142 121.202 121.202 120.597 0.605 18135 15112 1 16 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.808 -0.177 18135 15113 1 16 . 1 1 142 142 VAL C C 142 180.246 180.246 178.767 1.479 18135 15114 1 16 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.887 0.096 18135 15115 1 16 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.533 0.289 18135 15116 1 16 . 1 1 142 142 VAL H H 142 8.623 8.623 8.216 0.407 18135 15117 1 16 . 1 1 143 143 VAL N N 143 120.119 120.119 119.939 0.180 18135 15118 1 16 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.773 -0.476 18135 15119 1 16 . 1 1 143 143 VAL C C 143 176.407 176.407 178.401 -1.994 18135 15120 1 16 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.624 1.354 18135 15121 1 16 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.044 0.611 18135 15122 1 16 . 1 1 143 143 VAL H H 143 8.323 8.323 8.797 -0.474 18135 15123 1 16 . 1 1 144 144 ARG N N 144 124.102 124.102 119.507 4.595 18135 15124 1 16 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.014 -0.317 18135 15125 1 16 . 1 1 144 144 ARG C C 144 178.127 178.127 178.615 -0.488 18135 15126 1 16 . 1 1 144 144 ARG CA C 144 61.001 61.001 58.745 2.256 18135 15127 1 16 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.445 0.491 18135 15128 1 16 . 1 1 144 144 ARG H H 144 9.619 9.619 8.320 1.299 18135 15129 1 16 . 1 1 145 145 ALA N N 145 119.431 119.431 121.984 -2.553 18135 15130 1 16 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.042 -0.191 18135 15131 1 16 . 1 1 145 145 ALA C C 145 180.763 180.763 180.235 0.528 18135 15132 1 16 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.384 -0.009 18135 15133 1 16 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.090 0.095 18135 15134 1 16 . 1 1 145 145 ALA H H 145 8.867 8.867 8.214 0.653 18135 15135 1 16 . 1 1 146 146 GLU N N 146 121.815 121.815 118.467 3.348 18135 15136 1 16 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.191 0.020 18135 15137 1 16 . 1 1 146 146 GLU C C 146 177.296 177.296 179.278 -1.982 18135 15138 1 16 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.147 -0.768 18135 15139 1 16 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.313 -1.179 18135 15140 1 16 . 1 1 146 146 GLU H H 146 8.136 8.136 8.037 0.099 18135 15141 1 16 . 1 1 147 147 ILE N N 147 119.542 119.542 121.234 -1.692 18135 15142 1 16 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.978 -0.008 18135 15143 1 16 . 1 1 147 147 ILE C C 147 178.283 178.283 178.326 -0.043 18135 15144 1 16 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.921 -3.668 18135 15145 1 16 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.578 -2.240 18135 15146 1 16 . 1 1 147 147 ILE H H 147 8.736 8.736 8.237 0.499 18135 15147 1 16 . 1 1 148 148 MET N N 148 119.501 119.501 118.344 1.157 18135 15148 1 16 . 1 1 148 148 MET HA H 148 3.801 3.801 4.219 -0.418 18135 15149 1 16 . 1 1 148 148 MET C C 148 178.210 178.210 178.695 -0.485 18135 15150 1 16 . 1 1 148 148 MET CA C 148 60.184 60.184 59.744 0.440 18135 15151 1 16 . 1 1 148 148 MET CB C 148 32.914 32.914 32.021 0.893 18135 15152 1 16 . 1 1 148 148 MET H H 148 8.440 8.440 8.219 0.221 18135 15153 1 16 . 1 1 149 149 ARG N N 149 119.734 119.734 119.527 0.207 18135 15154 1 16 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.051 -0.136 18135 15155 1 16 . 1 1 149 149 ARG C C 149 178.978 178.978 178.904 0.074 18135 15156 1 16 . 1 1 149 149 ARG CA C 149 59.863 59.863 58.749 1.114 18135 15157 1 16 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.321 0.959 18135 15158 1 16 . 1 1 149 149 ARG H H 149 7.648 7.648 8.215 -0.567 18135 15159 1 16 . 1 1 150 150 SER N N 150 118.109 118.109 115.090 3.019 18135 15160 1 16 . 1 1 150 150 SER HA H 150 3.339 3.339 4.417 -1.078 18135 15161 1 16 . 1 1 150 150 SER C C 150 177.292 177.292 176.837 0.455 18135 15162 1 16 . 1 1 150 150 SER CA C 150 61.316 61.316 61.626 -0.310 18135 15163 1 16 . 1 1 150 150 SER CB C 150 60.288 60.288 63.105 -2.817 18135 15164 1 16 . 1 1 150 150 SER H H 150 9.194 9.194 8.464 0.730 18135 15165 1 16 . 1 1 151 151 PHE N N 151 125.265 125.265 123.853 1.412 18135 15166 1 16 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.305 -0.269 18135 15167 1 16 . 1 1 151 151 PHE C C 151 178.696 178.696 177.630 1.066 18135 15168 1 16 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.387 2.033 18135 15169 1 16 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.440 0.446 18135 15170 1 16 . 1 1 151 151 PHE H H 151 9.455 9.455 8.531 0.924 18135 15171 1 16 . 1 1 152 152 SER N N 152 115.963 115.963 116.501 -0.538 18135 15172 1 16 . 1 1 152 152 SER HA H 152 3.880 3.880 3.978 -0.098 18135 15173 1 16 . 1 1 152 152 SER C C 152 175.858 175.858 176.921 -1.063 18135 15174 1 16 . 1 1 152 152 SER CA C 152 62.388 62.388 61.589 0.799 18135 15175 1 16 . 1 1 152 152 SER CB C 152 62.519 62.519 63.323 -0.804 18135 15176 1 16 . 1 1 152 152 SER H H 152 7.839 7.839 8.228 -0.389 18135 15177 1 16 . 1 1 153 153 LEU N N 153 121.365 121.365 122.642 -1.277 18135 15178 1 16 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.006 0.075 18135 15179 1 16 . 1 1 153 153 LEU C C 153 179.515 179.515 178.477 1.038 18135 15180 1 16 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.844 0.039 18135 15181 1 16 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.940 0.402 18135 15182 1 16 . 1 1 153 153 LEU H H 153 7.775 7.775 8.039 -0.264 18135 15183 1 16 . 1 1 154 154 SER N N 154 113.950 113.950 113.417 0.533 18135 15184 1 16 . 1 1 154 154 SER HA H 154 3.781 3.781 4.511 -0.730 18135 15185 1 16 . 1 1 154 154 SER C C 154 174.312 174.312 177.148 -2.836 18135 15186 1 16 . 1 1 154 154 SER CA C 154 61.366 61.366 61.798 -0.432 18135 15187 1 16 . 1 1 154 154 SER CB C 154 63.242 63.242 63.598 -0.356 18135 15188 1 16 . 1 1 154 154 SER H H 154 7.874 7.874 8.565 -0.691 18135 15189 1 16 . 1 1 155 155 THR N N 155 109.346 109.346 114.875 -5.529 18135 15190 1 16 . 1 1 155 155 THR HA H 155 4.060 4.060 4.209 -0.149 18135 15191 1 16 . 1 1 155 155 THR C C 155 174.798 174.798 177.186 -2.388 18135 15192 1 16 . 1 1 155 155 THR CA C 155 62.275 62.275 65.043 -2.768 18135 15193 1 16 . 1 1 155 155 THR CB C 155 69.342 69.342 68.578 0.764 18135 15194 1 16 . 1 1 155 155 THR H H 155 7.176 7.176 8.163 -0.987 18135 15195 1 16 . 1 1 156 156 ASN N N 156 119.785 119.785 121.715 -1.930 18135 15196 1 16 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.456 0.071 18135 15197 1 16 . 1 1 156 156 ASN C C 156 175.528 175.528 177.336 -1.808 18135 15198 1 16 . 1 1 156 156 ASN CA C 156 53.937 53.937 56.145 -2.208 18135 15199 1 16 . 1 1 156 156 ASN CB C 156 38.338 38.338 38.155 0.183 18135 15200 1 16 . 1 1 156 156 ASN H H 156 7.749 7.749 8.061 -0.312 18135 15201 1 16 . 1 1 157 157 LEU N N 157 120.552 120.552 118.301 2.251 18135 15202 1 16 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.231 0.024 18135 15203 1 16 . 1 1 157 157 LEU C C 157 174.702 174.702 178.226 -3.524 18135 15204 1 16 . 1 1 157 157 LEU CA C 157 55.674 55.674 57.176 -1.502 18135 15205 1 16 . 1 1 157 157 LEU CB C 157 42.351 42.351 40.942 1.409 18135 15206 1 16 . 1 1 157 157 LEU H H 157 8.097 8.097 7.967 0.130 18135 15207 1 16 . 1 1 158 158 GLN N N 158 119.860 119.860 114.627 5.233 18135 15208 1 16 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.334 -0.154 18135 15209 1 16 . 1 1 158 158 GLN C C 158 176.434 176.434 176.486 -0.052 18135 15210 1 16 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.422 1.475 18135 15211 1 16 . 1 1 158 158 GLN CB C 158 29.010 29.010 28.954 0.056 18135 15212 1 16 . 1 1 158 158 GLN H H 158 8.230 8.230 7.548 0.682 18135 15213 1 16 . 1 1 159 159 GLU N N 159 120.461 120.461 118.332 2.129 18135 15214 1 16 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.007 0.212 18135 15215 1 16 . 1 1 159 159 GLU C C 159 175.251 175.251 176.815 -1.564 18135 15216 1 16 . 1 1 159 159 GLU CA C 159 56.695 56.695 58.723 -2.028 18135 15217 1 16 . 1 1 159 159 GLU CB C 159 28.981 28.981 29.923 -0.942 18135 15218 1 16 . 1 1 159 159 GLU H H 159 8.300 8.300 7.986 0.314 18135 15219 1 16 . 1 1 160 160 SER N N 160 115.719 115.719 113.526 2.193 18135 15220 1 16 . 1 1 160 160 SER HA H 160 4.372 4.372 4.241 0.131 18135 15221 1 16 . 1 1 160 160 SER C C 160 174.188 174.188 174.501 -0.313 18135 15222 1 16 . 1 1 160 160 SER CA C 160 58.481 58.481 59.055 -0.574 18135 15223 1 16 . 1 1 160 160 SER CB C 160 63.731 63.731 62.410 1.321 18135 15224 1 16 . 1 1 160 160 SER H H 160 8.113 8.113 8.188 -0.075 18135 15225 1 16 . 1 1 161 161 LEU N N 161 123.794 123.794 123.523 0.271 18135 15226 1 16 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.516 -0.236 18135 15227 1 16 . 1 1 161 161 LEU C C 161 177.293 177.293 177.078 0.215 18135 15228 1 16 . 1 1 161 161 LEU CA C 161 55.190 55.190 54.917 0.272 18135 15229 1 16 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.242 0.042 18135 15230 1 16 . 1 1 161 161 LEU H H 161 8.032 8.032 7.866 0.166 18135 15231 1 16 . 1 1 162 162 ARG N N 162 120.715 120.715 121.596 -0.881 18135 15232 1 16 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.476 -0.307 18135 15233 1 16 . 1 1 162 162 ARG C C 162 176.288 176.288 176.275 0.013 18135 15234 1 16 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.505 1.541 18135 15235 1 16 . 1 1 162 162 ARG CB C 162 30.935 30.935 31.180 -0.245 18135 15236 1 16 . 1 1 162 162 ARG H H 162 8.094 8.094 8.217 -0.123 18135 15237 1 16 . 1 1 163 163 SER N N 163 116.670 116.670 118.794 -2.124 18135 15238 1 16 . 1 1 163 163 SER HA H 163 4.372 4.372 4.432 -0.060 18135 15239 1 16 . 1 1 163 163 SER C C 163 174.184 174.184 174.361 -0.177 18135 15240 1 16 . 1 1 163 163 SER CA C 163 58.481 58.481 58.926 -0.445 18135 15241 1 16 . 1 1 163 163 SER CB C 163 63.745 63.745 63.723 0.022 18135 15242 1 16 . 1 1 163 163 SER H H 163 8.191 8.191 8.527 -0.336 18135 15243 1 16 . 1 1 164 164 LYS N N 164 123.100 123.100 121.406 1.694 18135 15244 1 16 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.493 -0.216 18135 15245 1 16 . 1 1 164 164 LYS C C 164 175.617 175.617 175.283 0.334 18135 15246 1 16 . 1 1 164 164 LYS CA C 164 56.313 56.313 55.615 0.698 18135 15247 1 16 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.587 0.378 18135 15248 1 16 . 1 1 164 164 LYS H H 164 8.251 8.251 8.245 0.006 18135 15249 1 17 . 1 1 2 2 ASP N N 2 125.691 125.691 120.881 4.810 18135 15250 1 17 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.449 0.261 18135 15251 1 17 . 1 1 2 2 ASP C C 2 174.758 174.758 175.895 -1.137 18135 15252 1 17 . 1 1 2 2 ASP CA C 2 52.843 52.843 55.189 -2.346 18135 15253 1 17 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.078 -1.757 18135 15254 1 17 . 1 1 2 2 ASP H H 2 8.773 8.773 8.313 0.460 18135 15255 1 17 . 1 1 3 3 LEU N N 3 123.957 123.957 115.266 8.691 18135 15256 1 17 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.332 0.069 18135 15257 1 17 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.032 0.621 18135 15258 1 17 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.923 -0.368 18135 15259 1 17 . 1 1 3 3 LEU H H 3 8.164 8.164 7.495 0.669 18135 15260 1 17 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.542 -0.228 18135 15261 1 17 . 1 1 4 4 PRO C C 4 176.213 176.213 176.087 0.126 18135 15262 1 17 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.263 0.645 18135 15263 1 17 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.184 1.710 18135 15264 1 17 . 1 1 5 5 GLN N N 5 121.621 121.621 121.347 0.274 18135 15265 1 17 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.172 0.054 18135 15266 1 17 . 1 1 5 5 GLN C C 5 176.995 176.995 176.907 0.088 18135 15267 1 17 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.115 -1.405 18135 15268 1 17 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.389 -0.438 18135 15269 1 17 . 1 1 5 5 GLN H H 5 8.767 8.767 8.694 0.073 18135 15270 1 17 . 1 1 6 6 THR N N 6 111.419 111.419 110.291 1.128 18135 15271 1 17 . 1 1 6 6 THR HA H 6 4.135 4.135 4.424 -0.289 18135 15272 1 17 . 1 1 6 6 THR C C 6 174.695 174.695 174.804 -0.109 18135 15273 1 17 . 1 1 6 6 THR CA C 6 62.661 62.661 62.771 -0.110 18135 15274 1 17 . 1 1 6 6 THR CB C 6 69.365 69.365 68.552 0.812 18135 15275 1 17 . 1 1 6 6 THR H H 6 7.865 7.865 8.448 -0.583 18135 15276 1 17 . 1 1 7 7 HIS N N 7 119.137 119.137 119.422 -0.285 18135 15277 1 17 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.754 -0.169 18135 15278 1 17 . 1 1 7 7 HIS C C 7 174.980 174.980 175.717 -0.737 18135 15279 1 17 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.362 -2.358 18135 15280 1 17 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.599 -1.437 18135 15281 1 17 . 1 1 7 7 HIS H H 7 8.567 8.567 8.514 0.053 18135 15282 1 17 . 1 1 8 8 SER N N 8 115.796 115.796 113.858 1.938 18135 15283 1 17 . 1 1 8 8 SER HA H 8 4.363 4.363 4.485 -0.122 18135 15284 1 17 . 1 1 8 8 SER C C 8 175.312 175.312 175.536 -0.224 18135 15285 1 17 . 1 1 8 8 SER CA C 8 58.969 58.969 60.665 -1.696 18135 15286 1 17 . 1 1 8 8 SER CB C 8 63.439 63.439 63.999 -0.560 18135 15287 1 17 . 1 1 8 8 SER H H 8 8.180 8.180 8.146 0.034 18135 15288 1 17 . 1 1 9 9 LEU N N 9 123.844 123.844 117.654 6.190 18135 15289 1 17 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.707 -0.552 18135 15290 1 17 . 1 1 9 9 LEU C C 9 178.568 178.568 178.307 0.261 18135 15291 1 17 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.642 0.324 18135 15292 1 17 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.266 -0.470 18135 15293 1 17 . 1 1 9 9 LEU H H 9 8.404 8.404 7.934 0.470 18135 15294 1 17 . 1 1 10 10 GLY N N 10 107.582 107.582 107.527 0.055 18135 15295 1 17 . 1 1 10 10 GLY C C 10 174.586 174.586 176.458 -1.872 18135 15296 1 17 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.094 -0.189 18135 15297 1 17 . 1 1 10 10 GLY H H 10 8.438 8.438 8.732 -0.294 18135 15298 1 17 . 1 1 11 11 SER N N 11 118.806 118.806 117.457 1.349 18135 15299 1 17 . 1 1 11 11 SER HA H 11 4.156 4.156 4.323 -0.167 18135 15300 1 17 . 1 1 11 11 SER C C 11 175.749 175.749 176.427 -0.678 18135 15301 1 17 . 1 1 11 11 SER CA C 11 61.299 61.299 62.192 -0.893 18135 15302 1 17 . 1 1 11 11 SER CB C 11 62.653 62.653 62.975 -0.322 18135 15303 1 17 . 1 1 11 11 SER H H 11 8.249 8.249 8.043 0.206 18135 15304 1 17 . 1 1 12 12 ARG N N 12 121.986 121.986 121.299 0.687 18135 15305 1 17 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.113 -0.159 18135 15306 1 17 . 1 1 12 12 ARG C C 12 178.283 178.283 178.386 -0.103 18135 15307 1 17 . 1 1 12 12 ARG CA C 12 59.830 59.830 59.264 0.566 18135 15308 1 17 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.171 -0.587 18135 15309 1 17 . 1 1 12 12 ARG H H 12 8.027 8.027 8.151 -0.124 18135 15310 1 17 . 1 1 13 13 ARG N N 13 119.432 119.432 119.100 0.332 18135 15311 1 17 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.102 -0.263 18135 15312 1 17 . 1 1 13 13 ARG C C 13 178.480 178.480 178.405 0.075 18135 15313 1 17 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.394 1.097 18135 15314 1 17 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.762 0.320 18135 15315 1 17 . 1 1 13 13 ARG H H 13 8.437 8.437 7.913 0.524 18135 15316 1 17 . 1 1 14 14 THR N N 14 116.879 116.879 117.531 -0.652 18135 15317 1 17 . 1 1 14 14 THR HA H 14 3.532 3.532 4.070 -0.538 18135 15318 1 17 . 1 1 14 14 THR C C 14 175.584 175.584 176.634 -1.050 18135 15319 1 17 . 1 1 14 14 THR CA C 14 68.036 68.036 67.451 0.585 18135 15320 1 17 . 1 1 14 14 THR CB C 14 67.969 67.969 68.784 -0.815 18135 15321 1 17 . 1 1 14 14 THR H H 14 7.957 7.957 8.196 -0.239 18135 15322 1 17 . 1 1 15 15 LEU N N 15 120.252 120.252 122.163 -1.911 18135 15323 1 17 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.994 -0.048 18135 15324 1 17 . 1 1 15 15 LEU C C 15 178.652 178.652 178.957 -0.305 18135 15325 1 17 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.243 -0.155 18135 15326 1 17 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.788 -0.233 18135 15327 1 17 . 1 1 15 15 LEU H H 15 7.550 7.550 8.264 -0.714 18135 15328 1 17 . 1 1 16 16 MET N N 16 118.788 118.788 117.666 1.122 18135 15329 1 17 . 1 1 16 16 MET HA H 16 4.023 4.023 3.935 0.088 18135 15330 1 17 . 1 1 16 16 MET C C 16 178.718 178.718 178.690 0.028 18135 15331 1 17 . 1 1 16 16 MET CA C 16 58.513 58.513 59.244 -0.731 18135 15332 1 17 . 1 1 16 16 MET CB C 16 32.150 32.150 32.410 -0.260 18135 15333 1 17 . 1 1 16 16 MET H H 16 7.985 7.985 8.225 -0.240 18135 15334 1 17 . 1 1 17 17 LEU N N 17 120.644 120.644 119.525 1.119 18135 15335 1 17 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.993 -0.021 18135 15336 1 17 . 1 1 17 17 LEU C C 17 178.238 178.238 179.181 -0.943 18135 15337 1 17 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.387 -0.660 18135 15338 1 17 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.185 0.950 18135 15339 1 17 . 1 1 17 17 LEU H H 17 7.829 7.829 8.218 -0.389 18135 15340 1 17 . 1 1 18 18 LEU N N 18 118.280 118.280 118.967 -0.687 18135 15341 1 17 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.772 -0.266 18135 15342 1 17 . 1 1 18 18 LEU C C 18 175.739 175.739 178.624 -2.885 18135 15343 1 17 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.452 0.204 18135 15344 1 17 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.423 0.819 18135 15345 1 17 . 1 1 18 18 LEU H H 18 7.499 7.499 8.383 -0.883 18135 15346 1 17 . 1 1 19 19 ALA N N 19 121.961 121.961 120.548 1.413 18135 15347 1 17 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.136 -0.299 18135 15348 1 17 . 1 1 19 19 ALA C C 19 180.736 180.736 178.202 2.534 18135 15349 1 17 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.165 0.901 18135 15350 1 17 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.275 -1.198 18135 15351 1 17 . 1 1 19 19 ALA H H 19 7.950 7.950 7.789 0.161 18135 15352 1 17 . 1 1 20 20 GLN N N 20 118.605 118.605 115.907 2.698 18135 15353 1 17 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.177 -0.242 18135 15354 1 17 . 1 1 20 20 GLN C C 20 176.945 176.945 177.474 -0.529 18135 15355 1 17 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.533 0.482 18135 15356 1 17 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.316 -0.842 18135 15357 1 17 . 1 1 20 20 GLN H H 20 7.958 7.958 7.988 -0.030 18135 15358 1 17 . 1 1 21 21 MET N N 21 116.693 116.693 117.877 -1.184 18135 15359 1 17 . 1 1 21 21 MET HA H 21 3.861 3.861 4.353 -0.492 18135 15360 1 17 . 1 1 21 21 MET C C 21 174.671 174.671 175.945 -1.274 18135 15361 1 17 . 1 1 21 21 MET CA C 21 57.111 57.111 57.123 -0.012 18135 15362 1 17 . 1 1 21 21 MET CB C 21 34.073 34.073 33.269 0.804 18135 15363 1 17 . 1 1 21 21 MET H H 21 7.420 7.420 7.773 -0.353 18135 15364 1 17 . 1 1 22 22 ARG N N 22 115.451 115.451 121.698 -6.247 18135 15365 1 17 . 1 1 22 22 ARG HA H 22 3.853 3.853 2.980 0.873 18135 15366 1 17 . 1 1 22 22 ARG C C 22 175.950 175.950 174.609 1.341 18135 15367 1 17 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.096 3.357 18135 15368 1 17 . 1 1 22 22 ARG CB C 22 31.514 31.514 29.749 1.765 18135 15369 1 17 . 1 1 22 22 ARG H H 22 6.484 6.484 7.228 -0.744 18135 15370 1 17 . 1 1 23 23 LYS N N 23 128.593 128.593 126.992 1.601 18135 15371 1 17 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.491 -0.006 18135 15372 1 17 . 1 1 23 23 LYS C C 23 176.643 176.643 174.901 1.742 18135 15373 1 17 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.566 1.721 18135 15374 1 17 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.839 4.422 18135 15375 1 17 . 1 1 23 23 LYS H H 23 10.212 10.212 8.094 2.118 18135 15376 1 17 . 1 1 24 24 ILE N N 24 118.605 118.605 122.754 -4.149 18135 15377 1 17 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.398 0.086 18135 15378 1 17 . 1 1 24 24 ILE C C 24 173.878 173.878 174.664 -0.786 18135 15379 1 17 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.846 -1.249 18135 15380 1 17 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.694 -0.238 18135 15381 1 17 . 1 1 24 24 ILE H H 24 8.465 8.465 8.194 0.271 18135 15382 1 17 . 1 1 25 25 SER N N 25 113.658 113.658 118.009 -4.351 18135 15383 1 17 . 1 1 25 25 SER HA H 25 4.481 4.481 4.948 -0.467 18135 15384 1 17 . 1 1 25 25 SER C C 25 176.359 176.359 175.572 0.787 18135 15385 1 17 . 1 1 25 25 SER CA C 25 56.975 56.975 57.413 -0.438 18135 15386 1 17 . 1 1 25 25 SER CB C 25 64.759 64.759 63.805 0.954 18135 15387 1 17 . 1 1 25 25 SER H H 25 8.104 8.104 8.528 -0.424 18135 15388 1 17 . 1 1 26 26 LEU N N 26 127.566 127.566 126.375 1.191 18135 15389 1 17 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.092 -0.215 18135 15390 1 17 . 1 1 26 26 LEU C C 26 178.946 178.946 177.933 1.013 18135 15391 1 17 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.550 0.128 18135 15392 1 17 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.003 -0.284 18135 15393 1 17 . 1 1 26 26 LEU H H 26 8.802 8.802 9.127 -0.325 18135 15394 1 17 . 1 1 27 27 PHE N N 27 117.143 117.143 116.136 1.007 18135 15395 1 17 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.542 -0.304 18135 15396 1 17 . 1 1 27 27 PHE C C 27 177.067 177.067 176.913 0.154 18135 15397 1 17 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.270 1.819 18135 15398 1 17 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.319 -0.057 18135 15399 1 17 . 1 1 27 27 PHE H H 27 7.986 7.986 8.102 -0.116 18135 15400 1 17 . 1 1 28 28 SER N N 28 115.200 115.200 115.989 -0.789 18135 15401 1 17 . 1 1 28 28 SER HA H 28 4.505 4.505 4.373 0.132 18135 15402 1 17 . 1 1 28 28 SER C C 28 174.533 174.533 174.590 -0.057 18135 15403 1 17 . 1 1 28 28 SER CA C 28 59.447 59.447 60.938 -1.491 18135 15404 1 17 . 1 1 28 28 SER CB C 28 63.790 63.790 63.750 0.040 18135 15405 1 17 . 1 1 28 28 SER H H 28 7.929 7.929 8.284 -0.355 18135 15406 1 17 . 1 1 29 29 CYS N N 29 119.870 119.870 118.678 1.192 18135 15407 1 17 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.630 0.452 18135 15408 1 17 . 1 1 29 29 CYS C C 29 176.475 176.475 173.454 3.021 18135 15409 1 17 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.707 -5.277 18135 15410 1 17 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.756 9.486 18135 15411 1 17 . 1 1 29 29 CYS H H 29 7.865 7.865 7.997 -0.132 18135 15412 1 17 . 1 1 30 30 LEU N N 30 122.259 122.259 123.192 -0.933 18135 15413 1 17 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.182 -0.221 18135 15414 1 17 . 1 1 30 30 LEU C C 30 179.774 179.774 178.987 0.787 18135 15415 1 17 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.427 1.876 18135 15416 1 17 . 1 1 30 30 LEU CB C 30 41.576 41.576 41.910 -0.334 18135 15417 1 17 . 1 1 30 30 LEU H H 30 7.812 7.812 8.485 -0.673 18135 15418 1 17 . 1 1 31 31 LYS N N 31 117.731 117.731 118.991 -1.260 18135 15419 1 17 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.037 0.653 18135 15420 1 17 . 1 1 31 31 LYS C C 31 176.692 176.692 176.558 0.134 18135 15421 1 17 . 1 1 31 31 LYS CA C 31 54.077 54.077 58.081 -4.003 18135 15422 1 17 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.211 -0.624 18135 15423 1 17 . 1 1 31 31 LYS H H 31 8.597 8.597 8.200 0.397 18135 15424 1 17 . 1 1 32 32 ASP N N 32 117.841 117.841 115.005 2.836 18135 15425 1 17 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.616 0.078 18135 15426 1 17 . 1 1 32 32 ASP C C 32 175.505 175.505 176.149 -0.644 18135 15427 1 17 . 1 1 32 32 ASP CA C 32 54.088 54.088 53.883 0.205 18135 15428 1 17 . 1 1 32 32 ASP CB C 32 41.808 41.808 40.826 0.982 18135 15429 1 17 . 1 1 32 32 ASP H H 32 7.808 7.808 8.194 -0.386 18135 15430 1 17 . 1 1 33 33 ARG N N 33 120.876 120.876 118.899 1.977 18135 15431 1 17 . 1 1 33 33 ARG HA H 33 4.041 4.041 3.873 0.168 18135 15432 1 17 . 1 1 33 33 ARG C C 33 175.286 175.286 176.229 -0.943 18135 15433 1 17 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.621 -0.538 18135 15434 1 17 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.304 -0.291 18135 15435 1 17 . 1 1 33 33 ARG H H 33 7.378 7.378 7.179 0.199 18135 15436 1 17 . 1 1 34 34 HIS N N 34 120.555 120.555 113.742 6.813 18135 15437 1 17 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.673 -0.461 18135 15438 1 17 . 1 1 34 34 HIS C C 34 170.494 170.494 174.023 -3.529 18135 15439 1 17 . 1 1 34 34 HIS CA C 34 54.607 54.607 55.983 -1.376 18135 15440 1 17 . 1 1 34 34 HIS CB C 34 31.488 31.488 31.428 0.060 18135 15441 1 17 . 1 1 34 34 HIS H H 34 7.974 7.974 8.119 -0.145 18135 15442 1 17 . 1 1 35 35 ASP N N 35 125.061 125.061 123.095 1.966 18135 15443 1 17 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.411 0.227 18135 15444 1 17 . 1 1 35 35 ASP C C 35 175.943 175.943 176.842 -0.899 18135 15445 1 17 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.252 -1.883 18135 15446 1 17 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.661 -1.299 18135 15447 1 17 . 1 1 35 35 ASP H H 35 7.805 7.805 8.565 -0.760 18135 15448 1 17 . 1 1 36 36 PHE N N 36 122.860 122.860 120.310 2.550 18135 15449 1 17 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.438 -0.113 18135 15450 1 17 . 1 1 36 36 PHE C C 36 176.643 176.643 177.029 -0.386 18135 15451 1 17 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.990 0.649 18135 15452 1 17 . 1 1 36 36 PHE CB C 36 40.691 40.691 38.998 1.693 18135 15453 1 17 . 1 1 36 36 PHE H H 36 8.973 8.973 7.494 1.479 18135 15454 1 17 . 1 1 37 37 GLY N N 37 111.856 111.856 108.462 3.394 18135 15455 1 17 . 1 1 37 37 GLY C C 37 175.185 175.185 174.910 0.275 18135 15456 1 17 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.793 3.350 18135 15457 1 17 . 1 1 37 37 GLY H H 37 8.727 8.727 8.267 0.460 18135 15458 1 17 . 1 1 38 38 PHE N N 38 123.178 123.178 119.352 3.826 18135 15459 1 17 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.566 -0.651 18135 15460 1 17 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.556 2.248 18135 15461 1 17 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.261 0.396 18135 15462 1 17 . 1 1 38 38 PHE H H 38 9.169 9.169 7.843 1.326 18135 15463 1 17 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.409 0.120 18135 15464 1 17 . 1 1 39 39 PRO C C 39 174.634 174.634 177.387 -2.753 18135 15465 1 17 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.743 -1.200 18135 15466 1 17 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.365 -1.661 18135 15467 1 17 . 1 1 40 40 GLN N N 40 123.608 123.608 123.423 0.185 18135 15468 1 17 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.293 -0.674 18135 15469 1 17 . 1 1 40 40 GLN C C 40 176.958 176.958 177.427 -0.469 18135 15470 1 17 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.182 -1.109 18135 15471 1 17 . 1 1 40 40 GLN CB C 40 28.817 28.817 28.096 0.721 18135 15472 1 17 . 1 1 40 40 GLN H H 40 7.966 7.966 8.209 -0.243 18135 15473 1 17 . 1 1 41 41 GLU N N 41 119.446 119.446 119.366 0.080 18135 15474 1 17 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.097 0.040 18135 15475 1 17 . 1 1 41 41 GLU C C 41 177.346 177.346 177.621 -0.275 18135 15476 1 17 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.733 -0.804 18135 15477 1 17 . 1 1 41 41 GLU CB C 41 27.833 27.833 28.727 -0.894 18135 15478 1 17 . 1 1 41 41 GLU H H 41 9.044 9.044 8.734 0.310 18135 15479 1 17 . 1 1 42 42 GLU N N 42 117.196 117.196 117.975 -0.779 18135 15480 1 17 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.364 -0.301 18135 15481 1 17 . 1 1 42 42 GLU C C 42 174.886 174.886 177.979 -3.093 18135 15482 1 17 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.477 -1.093 18135 15483 1 17 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.150 -2.592 18135 15484 1 17 . 1 1 42 42 GLU H H 42 7.646 7.646 7.791 -0.145 18135 15485 1 17 . 1 1 43 43 PHE N N 43 115.527 115.527 122.993 -7.466 18135 15486 1 17 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.660 -0.174 18135 15487 1 17 . 1 1 43 43 PHE C C 43 175.615 175.615 176.103 -0.488 18135 15488 1 17 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.261 -0.713 18135 15489 1 17 . 1 1 43 43 PHE CB C 43 39.893 39.893 39.870 0.023 18135 15490 1 17 . 1 1 43 43 PHE H H 43 7.601 7.601 8.762 -1.161 18135 15491 1 17 . 1 1 44 44 GLY N N 44 107.243 107.243 108.733 -1.490 18135 15492 1 17 . 1 1 44 44 GLY C C 44 174.032 174.032 174.279 -0.247 18135 15493 1 17 . 1 1 44 44 GLY CA C 44 45.612 45.612 46.011 -0.400 18135 15494 1 17 . 1 1 44 44 GLY H H 44 7.733 7.733 7.810 -0.077 18135 15495 1 17 . 1 1 45 45 ASN N N 45 117.599 117.599 121.694 -4.095 18135 15496 1 17 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.784 -0.233 18135 15497 1 17 . 1 1 45 45 ASN C C 45 175.894 175.894 174.713 1.181 18135 15498 1 17 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.852 0.997 18135 15499 1 17 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.660 -1.240 18135 15500 1 17 . 1 1 45 45 ASN H H 45 8.343 8.343 7.868 0.475 18135 15501 1 17 . 1 1 46 46 GLN N N 46 118.916 118.916 118.361 0.555 18135 15502 1 17 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.229 -0.147 18135 15503 1 17 . 1 1 46 46 GLN C C 46 175.851 175.851 176.103 -0.252 18135 15504 1 17 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.637 1.009 18135 15505 1 17 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.756 0.688 18135 15506 1 17 . 1 1 46 46 GLN H H 46 8.652 8.652 8.487 0.165 18135 15507 1 17 . 1 1 47 47 PHE N N 47 119.511 119.511 114.857 4.654 18135 15508 1 17 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.638 -0.076 18135 15509 1 17 . 1 1 47 47 PHE C C 47 176.258 176.258 174.618 1.640 18135 15510 1 17 . 1 1 47 47 PHE CA C 47 57.920 57.920 56.357 1.563 18135 15511 1 17 . 1 1 47 47 PHE CB C 47 39.858 39.858 37.877 1.981 18135 15512 1 17 . 1 1 47 47 PHE H H 47 7.904 7.904 7.285 0.619 18135 15513 1 17 . 1 1 48 48 GLN N N 48 120.127 120.127 120.210 -0.083 18135 15514 1 17 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.383 -0.008 18135 15515 1 17 . 1 1 48 48 GLN C C 48 181.265 181.265 175.313 5.952 18135 15516 1 17 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.494 1.082 18135 15517 1 17 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.944 -0.476 18135 15518 1 17 . 1 1 48 48 GLN H H 48 8.255 8.255 7.307 0.948 18135 15519 1 17 . 1 1 49 49 LYS N N 49 121.777 121.777 122.383 -0.606 18135 15520 1 17 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.150 -0.047 18135 15521 1 17 . 1 1 49 49 LYS C C 49 177.968 177.968 177.660 0.308 18135 15522 1 17 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.913 -0.765 18135 15523 1 17 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.533 -0.143 18135 15524 1 17 . 1 1 49 49 LYS H H 49 8.426 8.426 8.568 -0.142 18135 15525 1 17 . 1 1 50 50 ALA N N 50 120.573 120.573 118.816 1.757 18135 15526 1 17 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.357 -0.287 18135 15527 1 17 . 1 1 50 50 ALA C C 50 178.697 178.697 177.109 1.588 18135 15528 1 17 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.079 1.689 18135 15529 1 17 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.535 0.339 18135 15530 1 17 . 1 1 50 50 ALA H H 50 8.578 8.578 8.228 0.350 18135 15531 1 17 . 1 1 51 51 GLU N N 51 115.015 115.015 116.838 -1.823 18135 15532 1 17 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.230 0.036 18135 15533 1 17 . 1 1 51 51 GLU C C 51 176.995 176.995 176.645 0.350 18135 15534 1 17 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.398 -0.405 18135 15535 1 17 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.736 -0.831 18135 15536 1 17 . 1 1 51 51 GLU H H 51 7.907 7.907 8.419 -0.512 18135 15537 1 17 . 1 1 52 52 THR N N 52 111.210 111.210 113.804 -2.594 18135 15538 1 17 . 1 1 52 52 THR HA H 52 4.114 4.114 4.261 -0.147 18135 15539 1 17 . 1 1 52 52 THR C C 52 175.271 175.271 175.723 -0.452 18135 15540 1 17 . 1 1 52 52 THR CA C 52 63.611 63.611 64.322 -0.711 18135 15541 1 17 . 1 1 52 52 THR CB C 52 69.673 69.673 68.710 0.963 18135 15542 1 17 . 1 1 52 52 THR H H 52 7.863 7.863 7.897 -0.034 18135 15543 1 17 . 1 1 53 53 ILE N N 53 119.113 119.113 122.292 -3.179 18135 15544 1 17 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.050 -0.186 18135 15545 1 17 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.735 1.172 18135 15546 1 17 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.330 -1.377 18135 15547 1 17 . 1 1 53 53 ILE H H 53 8.341 8.341 8.161 0.180 18135 15548 1 17 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.361 -0.075 18135 15549 1 17 . 1 1 54 54 PRO C C 54 179.655 179.655 178.998 0.657 18135 15550 1 17 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.123 -0.072 18135 15551 1 17 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.338 0.547 18135 15552 1 17 . 1 1 55 55 VAL N N 55 116.355 116.355 116.191 0.164 18135 15553 1 17 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.847 -0.166 18135 15554 1 17 . 1 1 55 55 VAL C C 55 177.649 177.649 178.007 -0.358 18135 15555 1 17 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.785 0.052 18135 15556 1 17 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.893 0.578 18135 15557 1 17 . 1 1 55 55 VAL H H 55 7.119 7.119 7.579 -0.460 18135 15558 1 17 . 1 1 56 56 LEU N N 56 123.038 123.038 121.623 1.415 18135 15559 1 17 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.069 0.241 18135 15560 1 17 . 1 1 56 56 LEU C C 56 178.637 178.637 177.930 0.707 18135 15561 1 17 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.261 -0.175 18135 15562 1 17 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.505 0.812 18135 15563 1 17 . 1 1 56 56 LEU H H 56 8.535 8.535 8.561 -0.026 18135 15564 1 17 . 1 1 57 57 HIS N N 57 117.041 117.041 118.270 -1.229 18135 15565 1 17 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.024 -0.238 18135 15566 1 17 . 1 1 57 57 HIS C C 57 175.640 175.640 177.667 -2.027 18135 15567 1 17 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.801 0.730 18135 15568 1 17 . 1 1 57 57 HIS CB C 57 28.209 28.209 29.988 -1.779 18135 15569 1 17 . 1 1 57 57 HIS H H 57 9.047 9.047 8.005 1.042 18135 15570 1 17 . 1 1 58 58 GLU N N 58 119.521 119.521 118.561 0.960 18135 15571 1 17 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.823 0.184 18135 15572 1 17 . 1 1 58 58 GLU C C 58 179.029 179.029 179.007 0.022 18135 15573 1 17 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.403 -0.436 18135 15574 1 17 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.337 -1.047 18135 15575 1 17 . 1 1 58 58 GLU H H 58 7.860 7.860 8.222 -0.362 18135 15576 1 17 . 1 1 59 59 MET N N 59 119.512 119.512 119.170 0.342 18135 15577 1 17 . 1 1 59 59 MET HA H 59 4.074 4.074 4.254 -0.180 18135 15578 1 17 . 1 1 59 59 MET C C 59 177.031 177.031 179.123 -2.092 18135 15579 1 17 . 1 1 59 59 MET CA C 59 59.408 59.408 59.818 -0.410 18135 15580 1 17 . 1 1 59 59 MET CB C 59 32.525 32.525 32.893 -0.368 18135 15581 1 17 . 1 1 59 59 MET H H 59 8.442 8.442 7.913 0.529 18135 15582 1 17 . 1 1 60 60 ILE N N 60 117.183 117.183 118.305 -1.122 18135 15583 1 17 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.493 -0.076 18135 15584 1 17 . 1 1 60 60 ILE C C 60 177.524 177.524 178.150 -0.626 18135 15585 1 17 . 1 1 60 60 ILE CA C 60 65.326 65.326 65.086 0.240 18135 15586 1 17 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.248 -0.388 18135 15587 1 17 . 1 1 60 60 ILE H H 60 8.338 8.338 7.785 0.553 18135 15588 1 17 . 1 1 61 61 GLN N N 61 120.191 120.191 119.599 0.592 18135 15589 1 17 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.904 -0.202 18135 15590 1 17 . 1 1 61 61 GLN C C 61 178.270 178.270 177.798 0.472 18135 15591 1 17 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.481 -0.695 18135 15592 1 17 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.252 0.414 18135 15593 1 17 . 1 1 61 61 GLN H H 61 8.234 8.234 8.323 -0.089 18135 15594 1 17 . 1 1 62 62 GLN N N 62 116.795 116.795 118.884 -2.089 18135 15595 1 17 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.386 0.241 18135 15596 1 17 . 1 1 62 62 GLN C C 62 179.685 179.685 178.335 1.350 18135 15597 1 17 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.439 -0.431 18135 15598 1 17 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.809 -3.467 18135 15599 1 17 . 1 1 62 62 GLN H H 62 8.421 8.421 8.066 0.355 18135 15600 1 17 . 1 1 63 63 ILE N N 63 122.797 122.797 120.100 2.697 18135 15601 1 17 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.883 -0.234 18135 15602 1 17 . 1 1 63 63 ILE C C 63 177.279 177.279 177.846 -0.567 18135 15603 1 17 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.863 2.102 18135 15604 1 17 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.806 -0.491 18135 15605 1 17 . 1 1 63 63 ILE H H 63 8.164 8.164 7.563 0.601 18135 15606 1 17 . 1 1 64 64 PHE N N 64 120.820 120.820 121.175 -0.355 18135 15607 1 17 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.493 -0.777 18135 15608 1 17 . 1 1 64 64 PHE C C 64 178.402 178.402 176.938 1.464 18135 15609 1 17 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.099 1.053 18135 15610 1 17 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.578 -0.068 18135 15611 1 17 . 1 1 64 64 PHE H H 64 8.405 8.405 7.895 0.510 18135 15612 1 17 . 1 1 65 65 ASN N N 65 119.981 119.981 117.766 2.215 18135 15613 1 17 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.473 0.590 18135 15614 1 17 . 1 1 65 65 ASN C C 65 177.944 177.944 177.223 0.721 18135 15615 1 17 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.887 -0.019 18135 15616 1 17 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.105 -0.849 18135 15617 1 17 . 1 1 65 65 ASN H H 65 8.812 8.812 7.588 1.224 18135 15618 1 17 . 1 1 66 66 LEU N N 66 121.533 121.533 119.703 1.830 18135 15619 1 17 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.188 0.035 18135 15620 1 17 . 1 1 66 66 LEU C C 66 177.777 177.777 179.456 -1.679 18135 15621 1 17 . 1 1 66 66 LEU CA C 66 58.268 58.268 58.082 0.186 18135 15622 1 17 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.581 0.026 18135 15623 1 17 . 1 1 66 66 LEU H H 66 8.177 8.177 7.767 0.410 18135 15624 1 17 . 1 1 67 67 PHE N N 67 110.842 110.842 114.688 -3.846 18135 15625 1 17 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.556 0.324 18135 15626 1 17 . 1 1 67 67 PHE C C 67 177.965 177.965 176.694 1.271 18135 15627 1 17 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.856 0.678 18135 15628 1 17 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.750 -0.134 18135 15629 1 17 . 1 1 67 67 PHE H H 67 8.160 8.160 8.682 -0.522 18135 15630 1 17 . 1 1 68 68 SER N N 68 119.131 119.131 112.981 6.150 18135 15631 1 17 . 1 1 68 68 SER HA H 68 4.580 4.580 4.450 0.130 18135 15632 1 17 . 1 1 68 68 SER C C 68 173.472 173.472 174.853 -1.381 18135 15633 1 17 . 1 1 68 68 SER CA C 68 59.191 59.191 58.919 0.272 18135 15634 1 17 . 1 1 68 68 SER CB C 68 63.123 63.123 63.914 -0.791 18135 15635 1 17 . 1 1 68 68 SER H H 68 8.016 8.016 7.790 0.226 18135 15636 1 17 . 1 1 69 69 THR N N 69 111.353 111.353 115.637 -4.284 18135 15637 1 17 . 1 1 69 69 THR HA H 69 4.345 4.345 4.479 -0.134 18135 15638 1 17 . 1 1 69 69 THR C C 69 175.661 175.661 174.423 1.238 18135 15639 1 17 . 1 1 69 69 THR CA C 69 61.411 61.411 60.696 0.715 18135 15640 1 17 . 1 1 69 69 THR CB C 69 72.209 72.209 70.705 1.504 18135 15641 1 17 . 1 1 69 69 THR H H 69 6.977 6.977 7.499 -0.522 18135 15642 1 17 . 1 1 70 70 LYS N N 70 121.120 121.120 122.927 -1.807 18135 15643 1 17 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.154 -0.065 18135 15644 1 17 . 1 1 70 70 LYS C C 70 179.259 179.259 177.647 1.612 18135 15645 1 17 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.992 -1.036 18135 15646 1 17 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.161 -0.411 18135 15647 1 17 . 1 1 70 70 LYS H H 70 9.065 9.065 8.604 0.461 18135 15648 1 17 . 1 1 71 71 ASP N N 71 116.374 116.374 119.652 -3.278 18135 15649 1 17 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.248 -0.073 18135 15650 1 17 . 1 1 71 71 ASP C C 71 178.372 178.372 177.572 0.800 18135 15651 1 17 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.374 -0.307 18135 15652 1 17 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.422 -0.116 18135 15653 1 17 . 1 1 71 71 ASP H H 71 7.518 7.518 7.852 -0.334 18135 15654 1 17 . 1 1 72 72 SER N N 72 117.341 117.341 113.958 3.383 18135 15655 1 17 . 1 1 72 72 SER HA H 72 3.715 3.715 3.443 0.272 18135 15656 1 17 . 1 1 72 72 SER C C 72 176.897 176.897 176.034 0.863 18135 15657 1 17 . 1 1 72 72 SER CA C 72 60.267 60.267 60.821 -0.554 18135 15658 1 17 . 1 1 72 72 SER CB C 72 62.616 62.616 62.751 -0.135 18135 15659 1 17 . 1 1 72 72 SER H H 72 8.066 8.066 7.738 0.328 18135 15660 1 17 . 1 1 73 73 SER N N 73 113.398 113.398 117.290 -3.892 18135 15661 1 17 . 1 1 73 73 SER HA H 73 4.094 4.094 4.113 -0.019 18135 15662 1 17 . 1 1 73 73 SER C C 73 174.855 174.855 175.107 -0.252 18135 15663 1 17 . 1 1 73 73 SER CA C 73 61.385 61.385 60.695 0.690 18135 15664 1 17 . 1 1 73 73 SER CB C 73 62.798 62.798 62.931 -0.133 18135 15665 1 17 . 1 1 73 73 SER H H 73 7.982 7.982 7.565 0.417 18135 15666 1 17 . 1 1 74 74 ALA N N 74 119.486 119.486 119.558 -0.072 18135 15667 1 17 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.255 -0.098 18135 15668 1 17 . 1 1 74 74 ALA C C 74 177.626 177.626 177.593 0.033 18135 15669 1 17 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.548 0.165 18135 15670 1 17 . 1 1 74 74 ALA CB C 74 18.747 18.747 19.105 -0.358 18135 15671 1 17 . 1 1 74 74 ALA H H 74 7.095 7.095 7.704 -0.609 18135 15672 1 17 . 1 1 75 75 ALA N N 75 121.465 121.465 121.261 0.204 18135 15673 1 17 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.816 -0.120 18135 15674 1 17 . 1 1 75 75 ALA C C 75 177.197 177.197 176.381 0.816 18135 15675 1 17 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.453 0.551 18135 15676 1 17 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.769 -0.509 18135 15677 1 17 . 1 1 75 75 ALA H H 75 7.159 7.159 7.323 -0.164 18135 15678 1 17 . 1 1 76 76 TRP N N 76 116.791 116.791 116.304 0.487 18135 15679 1 17 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.712 0.338 18135 15680 1 17 . 1 1 76 76 TRP C C 76 177.617 177.617 174.728 2.889 18135 15681 1 17 . 1 1 76 76 TRP CA C 76 53.319 53.319 54.999 -1.680 18135 15682 1 17 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.072 2.004 18135 15683 1 17 . 1 1 76 76 TRP H H 76 7.080 7.080 7.297 -0.217 18135 15684 1 17 . 1 1 77 77 ASP N N 77 119.928 119.928 121.241 -1.313 18135 15685 1 17 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.525 -0.168 18135 15686 1 17 . 1 1 77 77 ASP C C 77 176.877 176.877 177.731 -0.854 18135 15687 1 17 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.155 -0.337 18135 15688 1 17 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.169 0.446 18135 15689 1 17 . 1 1 77 77 ASP H H 77 8.259 8.259 8.990 -0.731 18135 15690 1 17 . 1 1 78 78 GLU N N 78 127.277 127.277 126.167 1.110 18135 15691 1 17 . 1 1 78 78 GLU HA H 78 3.885 3.885 4.025 -0.140 18135 15692 1 17 . 1 1 78 78 GLU C C 78 177.439 177.439 178.033 -0.594 18135 15693 1 17 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.539 -0.155 18135 15694 1 17 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.520 -0.878 18135 15695 1 17 . 1 1 78 78 GLU H H 78 8.920 8.920 8.925 -0.005 18135 15696 1 17 . 1 1 79 79 THR N N 79 115.422 115.422 117.604 -2.182 18135 15697 1 17 . 1 1 79 79 THR HA H 79 3.907 3.907 4.086 -0.179 18135 15698 1 17 . 1 1 79 79 THR C C 79 177.330 177.330 176.463 0.867 18135 15699 1 17 . 1 1 79 79 THR CA C 79 66.263 66.263 66.238 0.025 18135 15700 1 17 . 1 1 79 79 THR CB C 79 68.002 68.002 68.401 -0.399 18135 15701 1 17 . 1 1 79 79 THR H H 79 8.124 8.124 7.901 0.223 18135 15702 1 17 . 1 1 80 80 LEU N N 80 121.791 121.791 122.347 -0.556 18135 15703 1 17 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.176 -0.289 18135 15704 1 17 . 1 1 80 80 LEU C C 80 179.018 179.018 179.232 -0.214 18135 15705 1 17 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.841 -0.602 18135 15706 1 17 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.233 0.419 18135 15707 1 17 . 1 1 80 80 LEU H H 80 7.725 7.725 8.037 -0.312 18135 15708 1 17 . 1 1 81 81 LEU N N 81 119.280 119.280 120.213 -0.933 18135 15709 1 17 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.237 -0.748 18135 15710 1 17 . 1 1 81 81 LEU C C 81 177.062 177.062 178.768 -1.706 18135 15711 1 17 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.801 -1.093 18135 15712 1 17 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.055 -1.107 18135 15713 1 17 . 1 1 81 81 LEU H H 81 8.344 8.344 8.713 -0.369 18135 15714 1 17 . 1 1 82 82 ASP N N 82 115.357 115.357 119.878 -4.521 18135 15715 1 17 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.409 -0.135 18135 15716 1 17 . 1 1 82 82 ASP C C 82 179.018 179.018 178.452 0.566 18135 15717 1 17 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.438 -0.623 18135 15718 1 17 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.727 -2.506 18135 15719 1 17 . 1 1 82 82 ASP H H 82 8.001 8.001 8.468 -0.467 18135 15720 1 17 . 1 1 83 83 LYS N N 83 119.603 119.603 118.763 0.840 18135 15721 1 17 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.873 0.109 18135 15722 1 17 . 1 1 83 83 LYS C C 83 178.624 178.624 178.967 -0.343 18135 15723 1 17 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.939 0.806 18135 15724 1 17 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.210 0.896 18135 15725 1 17 . 1 1 83 83 LYS H H 83 7.342 7.342 7.723 -0.381 18135 15726 1 17 . 1 1 84 84 PHE N N 84 123.933 123.933 121.911 2.022 18135 15727 1 17 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.040 -0.005 18135 15728 1 17 . 1 1 84 84 PHE C C 84 177.210 177.210 177.020 0.190 18135 15729 1 17 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.799 -1.456 18135 15730 1 17 . 1 1 84 84 PHE CB C 84 39.316 39.316 39.029 0.287 18135 15731 1 17 . 1 1 84 84 PHE H H 84 8.471 8.471 8.289 0.182 18135 15732 1 17 . 1 1 85 85 TYR N N 85 118.387 118.387 117.818 0.569 18135 15733 1 17 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.797 0.271 18135 15734 1 17 . 1 1 85 85 TYR C C 85 178.104 178.104 177.337 0.767 18135 15735 1 17 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.716 -1.139 18135 15736 1 17 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.032 -0.055 18135 15737 1 17 . 1 1 85 85 TYR H H 85 9.011 9.011 9.047 -0.036 18135 15738 1 17 . 1 1 86 86 THR N N 86 114.035 114.035 116.816 -2.781 18135 15739 1 17 . 1 1 86 86 THR HA H 86 3.945 3.945 3.183 0.762 18135 15740 1 17 . 1 1 86 86 THR C C 86 176.708 176.708 176.317 0.391 18135 15741 1 17 . 1 1 86 86 THR CA C 86 66.759 66.759 66.993 -0.234 18135 15742 1 17 . 1 1 86 86 THR CB C 86 68.853 68.853 67.987 0.866 18135 15743 1 17 . 1 1 86 86 THR H H 86 7.609 7.609 7.462 0.147 18135 15744 1 17 . 1 1 87 87 GLU N N 87 120.790 120.790 121.810 -1.020 18135 15745 1 17 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.859 0.188 18135 15746 1 17 . 1 1 87 87 GLU C C 87 179.606 179.606 178.539 1.067 18135 15747 1 17 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.702 -1.304 18135 15748 1 17 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.532 -1.246 18135 15749 1 17 . 1 1 87 87 GLU H H 87 7.712 7.712 7.508 0.204 18135 15750 1 17 . 1 1 88 88 LEU N N 88 120.729 120.729 118.961 1.768 18135 15751 1 17 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.895 -0.167 18135 15752 1 17 . 1 1 88 88 LEU C C 88 178.695 178.695 179.433 -0.738 18135 15753 1 17 . 1 1 88 88 LEU CA C 88 58.251 58.251 56.947 1.304 18135 15754 1 17 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.048 1.539 18135 15755 1 17 . 1 1 88 88 LEU H H 88 8.393 8.393 7.459 0.934 18135 15756 1 17 . 1 1 89 89 TYR N N 89 118.654 118.654 119.276 -0.622 18135 15757 1 17 . 1 1 89 89 TYR HA H 89 3.931 3.931 3.948 -0.017 18135 15758 1 17 . 1 1 89 89 TYR C C 89 178.438 178.438 178.601 -0.163 18135 15759 1 17 . 1 1 89 89 TYR CA C 89 61.407 61.407 60.879 0.528 18135 15760 1 17 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.330 0.537 18135 15761 1 17 . 1 1 89 89 TYR H H 89 8.637 8.637 8.131 0.506 18135 15762 1 17 . 1 1 90 90 GLN N N 90 118.263 118.263 116.746 1.517 18135 15763 1 17 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.892 0.094 18135 15764 1 17 . 1 1 90 90 GLN C C 90 178.411 178.411 178.599 -0.188 18135 15765 1 17 . 1 1 90 90 GLN CA C 90 58.782 58.782 59.177 -0.395 18135 15766 1 17 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.351 -0.204 18135 15767 1 17 . 1 1 90 90 GLN H H 90 7.796 7.796 7.748 0.048 18135 15768 1 17 . 1 1 91 91 GLN N N 91 117.959 117.959 119.042 -1.083 18135 15769 1 17 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.028 0.054 18135 15770 1 17 . 1 1 91 91 GLN C C 91 178.705 178.705 178.768 -0.063 18135 15771 1 17 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.507 0.313 18135 15772 1 17 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.185 0.988 18135 15773 1 17 . 1 1 91 91 GLN H H 91 7.727 7.727 8.516 -0.789 18135 15774 1 17 . 1 1 92 92 LEU N N 92 119.965 119.965 118.282 1.683 18135 15775 1 17 . 1 1 92 92 LEU HA H 92 3.734 3.734 4.016 -0.282 18135 15776 1 17 . 1 1 92 92 LEU C C 92 178.984 178.984 178.639 0.345 18135 15777 1 17 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.647 -0.155 18135 15778 1 17 . 1 1 92 92 LEU CB C 92 41.379 41.379 41.069 0.310 18135 15779 1 17 . 1 1 92 92 LEU H H 92 8.465 8.465 8.480 -0.015 18135 15780 1 17 . 1 1 93 93 ASN N N 93 117.793 117.793 118.671 -0.878 18135 15781 1 17 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.332 0.070 18135 15782 1 17 . 1 1 93 93 ASN C C 93 178.309 178.309 177.216 1.093 18135 15783 1 17 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.095 0.308 18135 15784 1 17 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.259 0.379 18135 15785 1 17 . 1 1 93 93 ASN H H 93 8.091 8.091 7.948 0.143 18135 15786 1 17 . 1 1 94 94 ASP N N 94 121.133 121.133 120.935 0.198 18135 15787 1 17 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.384 0.021 18135 15788 1 17 . 1 1 94 94 ASP C C 94 178.328 178.328 178.755 -0.427 18135 15789 1 17 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.779 -1.232 18135 15790 1 17 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.944 -2.295 18135 15791 1 17 . 1 1 94 94 ASP H H 94 8.362 8.362 8.400 -0.038 18135 15792 1 17 . 1 1 95 95 LEU N N 95 119.160 119.160 120.455 -1.295 18135 15793 1 17 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.903 0.136 18135 15794 1 17 . 1 1 95 95 LEU C C 95 178.826 178.826 178.272 0.554 18135 15795 1 17 . 1 1 95 95 LEU CA C 95 57.027 57.027 57.957 -0.930 18135 15796 1 17 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.046 0.164 18135 15797 1 17 . 1 1 95 95 LEU H H 95 8.143 8.143 8.492 -0.349 18135 15798 1 17 . 1 1 96 96 GLU N N 96 118.813 118.813 119.131 -0.318 18135 15799 1 17 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.748 0.213 18135 15800 1 17 . 1 1 96 96 GLU C C 96 177.640 177.640 178.108 -0.468 18135 15801 1 17 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.315 -1.601 18135 15802 1 17 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.439 -1.301 18135 15803 1 17 . 1 1 96 96 GLU H H 96 8.111 8.111 7.805 0.306 18135 15804 1 17 . 1 1 97 97 ALA N N 97 120.549 120.549 121.296 -0.747 18135 15805 1 17 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.966 0.156 18135 15806 1 17 . 1 1 97 97 ALA C C 97 179.126 179.126 180.186 -1.060 18135 15807 1 17 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.761 -0.728 18135 15808 1 17 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.890 0.090 18135 15809 1 17 . 1 1 97 97 ALA H H 97 7.798 7.798 7.864 -0.066 18135 15810 1 17 . 1 1 98 98 CYS N N 98 115.510 115.510 117.496 -1.986 18135 15811 1 17 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.195 0.255 18135 15812 1 17 . 1 1 98 98 CYS C C 98 175.363 175.363 176.351 -0.988 18135 15813 1 17 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.610 -5.444 18135 15814 1 17 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.239 15.640 18135 15815 1 17 . 1 1 98 98 CYS H H 98 7.597 7.597 8.058 -0.461 18135 15816 1 17 . 1 1 99 99 VAL N N 99 121.713 121.713 119.927 1.786 18135 15817 1 17 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.900 -0.106 18135 15818 1 17 . 1 1 99 99 VAL C C 99 177.357 177.357 177.581 -0.224 18135 15819 1 17 . 1 1 99 99 VAL CA C 99 64.583 64.583 64.940 -0.357 18135 15820 1 17 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.116 -0.085 18135 15821 1 17 . 1 1 99 99 VAL H H 99 7.828 7.828 7.402 0.426 18135 15822 1 17 . 1 1 100 100 ILE N N 100 122.333 122.333 118.457 3.876 18135 15823 1 17 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.711 0.213 18135 15824 1 17 . 1 1 100 100 ILE C C 100 176.827 176.827 176.631 0.196 18135 15825 1 17 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.624 -1.386 18135 15826 1 17 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.635 0.643 18135 15827 1 17 . 1 1 100 100 ILE H H 100 8.067 8.067 8.145 -0.078 18135 15828 1 17 . 1 1 101 101 GLN N N 101 121.864 121.864 117.617 4.247 18135 15829 1 17 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.199 0.027 18135 15830 1 17 . 1 1 101 101 GLN C C 101 176.438 176.438 178.109 -1.671 18135 15831 1 17 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.597 -0.277 18135 15832 1 17 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.104 -0.093 18135 15833 1 17 . 1 1 101 101 GLN H H 101 8.062 8.062 7.416 0.646 18135 15834 1 17 . 1 1 102 102 GLY N N 102 109.288 109.288 109.917 -0.629 18135 15835 1 17 . 1 1 102 102 GLY C C 102 173.855 173.855 175.411 -1.556 18135 15836 1 17 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.414 -1.255 18135 15837 1 17 . 1 1 102 102 GLY H H 102 8.087 8.087 8.857 -0.770 18135 15838 1 17 . 1 1 103 103 VAL N N 103 118.932 118.932 115.869 3.063 18135 15839 1 17 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.810 0.264 18135 15840 1 17 . 1 1 103 103 VAL C C 103 176.299 176.299 175.898 0.401 18135 15841 1 17 . 1 1 103 103 VAL CA C 103 62.499 62.499 64.012 -1.513 18135 15842 1 17 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.039 1.815 18135 15843 1 17 . 1 1 103 103 VAL H H 103 8.079 8.079 7.568 0.511 18135 15844 1 17 . 1 1 104 104 GLY N N 104 112.028 112.028 108.939 3.089 18135 15845 1 17 . 1 1 104 104 GLY C C 104 173.694 173.694 173.415 0.279 18135 15846 1 17 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.106 0.296 18135 15847 1 17 . 1 1 104 104 GLY H H 104 8.446 8.446 7.835 0.611 18135 15848 1 17 . 1 1 105 105 VAL N N 105 120.439 120.439 120.943 -0.504 18135 15849 1 17 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.390 -0.202 18135 15850 1 17 . 1 1 105 105 VAL C C 105 175.963 175.963 174.564 1.399 18135 15851 1 17 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.101 1.035 18135 15852 1 17 . 1 1 105 105 VAL CB C 105 32.814 32.814 35.013 -2.199 18135 15853 1 17 . 1 1 105 105 VAL H H 105 7.867 7.867 8.008 -0.141 18135 15854 1 17 . 1 1 106 106 THR N N 106 116.366 116.366 113.594 2.772 18135 15855 1 17 . 1 1 106 106 THR HA H 106 4.548 4.548 4.562 -0.014 18135 15856 1 17 . 1 1 106 106 THR C C 106 173.731 173.731 173.398 0.333 18135 15857 1 17 . 1 1 106 106 THR CA C 106 59.419 59.419 60.575 -1.155 18135 15858 1 17 . 1 1 106 106 THR CB C 106 79.536 79.536 71.269 8.267 18135 15859 1 17 . 1 1 106 106 THR H H 106 8.565 8.565 8.012 0.553 18135 15860 1 17 . 1 1 107 107 GLU N N 107 119.743 119.743 122.404 -2.661 18135 15861 1 17 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.747 -0.285 18135 15862 1 17 . 1 1 107 107 GLU C C 107 175.639 175.639 176.106 -0.467 18135 15863 1 17 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.448 1.263 18135 15864 1 17 . 1 1 107 107 GLU CB C 107 30.499 30.499 33.244 -2.745 18135 15865 1 17 . 1 1 107 107 GLU H H 107 8.410 8.410 8.578 -0.168 18135 15866 1 17 . 1 1 108 108 THR N N 108 114.402 114.402 112.253 2.149 18135 15867 1 17 . 1 1 108 108 THR HA H 108 4.448 4.448 4.727 -0.279 18135 15868 1 17 . 1 1 108 108 THR CA C 108 60.348 60.348 58.861 1.487 18135 15869 1 17 . 1 1 108 108 THR CB C 108 68.544 68.544 68.539 0.005 18135 15870 1 17 . 1 1 108 108 THR H H 108 8.155 8.155 8.418 -0.263 18135 15871 1 17 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.422 -0.184 18135 15872 1 17 . 1 1 109 109 PRO C C 109 178.666 178.666 177.514 1.152 18135 15873 1 17 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.176 1.200 18135 15874 1 17 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.943 -0.095 18135 15875 1 17 . 1 1 110 110 LEU N N 110 118.566 118.566 118.620 -0.054 18135 15876 1 17 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.061 0.055 18135 15877 1 17 . 1 1 110 110 LEU C C 110 178.293 178.293 179.397 -1.104 18135 15878 1 17 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.780 -1.094 18135 15879 1 17 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.471 0.498 18135 15880 1 17 . 1 1 110 110 LEU H H 110 8.016 8.016 7.820 0.196 18135 15881 1 17 . 1 1 111 111 MET N N 111 118.982 118.982 115.787 3.195 18135 15882 1 17 . 1 1 111 111 MET HA H 111 4.210 4.210 4.251 -0.041 18135 15883 1 17 . 1 1 111 111 MET C C 111 178.720 178.720 177.851 0.869 18135 15884 1 17 . 1 1 111 111 MET CA C 111 58.144 58.144 58.069 0.075 18135 15885 1 17 . 1 1 111 111 MET CB C 111 32.374 32.374 32.486 -0.112 18135 15886 1 17 . 1 1 111 111 MET H H 111 7.705 7.705 7.855 -0.150 18135 15887 1 17 . 1 1 112 112 LYS N N 112 121.377 121.377 119.302 2.075 18135 15888 1 17 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.244 -0.136 18135 15889 1 17 . 1 1 112 112 LYS C C 112 178.000 178.000 178.453 -0.453 18135 15890 1 17 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.284 -1.979 18135 15891 1 17 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.252 0.116 18135 15892 1 17 . 1 1 112 112 LYS H H 112 8.257 8.257 7.617 0.640 18135 15893 1 17 . 1 1 113 113 GLU N N 113 119.104 119.104 118.814 0.290 18135 15894 1 17 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.019 0.047 18135 15895 1 17 . 1 1 113 113 GLU C C 113 178.289 178.289 178.867 -0.578 18135 15896 1 17 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.226 -0.973 18135 15897 1 17 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.069 -0.931 18135 15898 1 17 . 1 1 113 113 GLU H H 113 8.270 8.270 7.715 0.555 18135 15899 1 17 . 1 1 114 114 ASP N N 114 119.224 119.224 119.445 -0.221 18135 15900 1 17 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.489 -0.201 18135 15901 1 17 . 1 1 114 114 ASP C C 114 178.365 178.365 178.162 0.203 18135 15902 1 17 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.360 -1.252 18135 15903 1 17 . 1 1 114 114 ASP CB C 114 38.235 38.235 41.026 -2.791 18135 15904 1 17 . 1 1 114 114 ASP H H 114 8.618 8.618 7.648 0.970 18135 15905 1 17 . 1 1 115 115 SER N N 115 118.195 118.195 116.944 1.251 18135 15906 1 17 . 1 1 115 115 SER HA H 115 4.200 4.200 4.129 0.071 18135 15907 1 17 . 1 1 115 115 SER C C 115 175.986 175.986 176.521 -0.535 18135 15908 1 17 . 1 1 115 115 SER CA C 115 61.588 61.588 61.828 -0.240 18135 15909 1 17 . 1 1 115 115 SER CB C 115 62.653 62.653 62.957 -0.304 18135 15910 1 17 . 1 1 115 115 SER H H 115 8.181 8.181 7.568 0.613 18135 15911 1 17 . 1 1 116 116 ILE N N 116 123.340 123.340 121.731 1.609 18135 15912 1 17 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.830 -0.204 18135 15913 1 17 . 1 1 116 116 ILE C C 116 178.367 178.367 177.965 0.402 18135 15914 1 17 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.786 1.031 18135 15915 1 17 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.488 0.930 18135 15916 1 17 . 1 1 116 116 ILE H H 116 7.773 7.773 8.525 -0.752 18135 15917 1 17 . 1 1 117 117 LEU N N 117 120.968 120.968 121.689 -0.721 18135 15918 1 17 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.862 0.043 18135 15919 1 17 . 1 1 117 117 LEU C C 117 178.746 178.746 178.539 0.207 18135 15920 1 17 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.368 -0.225 18135 15921 1 17 . 1 1 117 117 LEU CB C 117 41.586 41.586 40.849 0.737 18135 15922 1 17 . 1 1 117 117 LEU H H 117 8.406 8.406 7.425 0.981 18135 15923 1 17 . 1 1 118 118 ALA N N 118 120.150 120.150 122.029 -1.879 18135 15924 1 17 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.605 0.507 18135 15925 1 17 . 1 1 118 118 ALA C C 118 181.633 181.633 178.790 2.843 18135 15926 1 17 . 1 1 118 118 ALA CA C 118 55.313 55.313 54.863 0.450 18135 15927 1 17 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.390 -0.280 18135 15928 1 17 . 1 1 118 118 ALA H H 118 7.894 7.894 7.958 -0.064 18135 15929 1 17 . 1 1 119 119 VAL N N 119 118.873 118.873 118.497 0.376 18135 15930 1 17 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.014 0.741 18135 15931 1 17 . 1 1 119 119 VAL C C 119 177.896 177.896 178.007 -0.111 18135 15932 1 17 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.778 0.403 18135 15933 1 17 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.355 0.539 18135 15934 1 17 . 1 1 119 119 VAL H H 119 7.572 7.572 7.810 -0.238 18135 15935 1 17 . 1 1 120 120 ARG N N 120 121.436 121.436 118.458 2.978 18135 15936 1 17 . 1 1 120 120 ARG HA H 120 4.027 4.027 3.938 0.089 18135 15937 1 17 . 1 1 120 120 ARG C C 120 179.848 179.848 178.505 1.343 18135 15938 1 17 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.776 1.491 18135 15939 1 17 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.786 -0.091 18135 15940 1 17 . 1 1 120 120 ARG H H 120 8.629 8.629 8.343 0.286 18135 15941 1 17 . 1 1 121 121 LYS N N 121 119.589 119.589 119.494 0.095 18135 15942 1 17 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.908 0.166 18135 15943 1 17 . 1 1 121 121 LYS C C 121 178.331 178.331 179.277 -0.946 18135 15944 1 17 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.639 0.800 18135 15945 1 17 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.238 -0.131 18135 15946 1 17 . 1 1 121 121 LYS H H 121 9.015 9.015 8.021 0.994 18135 15947 1 17 . 1 1 122 122 TYR N N 122 121.546 121.546 118.438 3.108 18135 15948 1 17 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.137 0.195 18135 15949 1 17 . 1 1 122 122 TYR C C 122 176.527 176.527 178.306 -1.779 18135 15950 1 17 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.935 1.469 18135 15951 1 17 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.300 0.425 18135 15952 1 17 . 1 1 122 122 TYR H H 122 7.473 7.473 7.474 -0.001 18135 15953 1 17 . 1 1 123 123 PHE N N 123 116.026 116.026 120.418 -4.392 18135 15954 1 17 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.943 -0.203 18135 15955 1 17 . 1 1 123 123 PHE C C 123 179.005 179.005 177.060 1.945 18135 15956 1 17 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.420 3.108 18135 15957 1 17 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.520 0.811 18135 15958 1 17 . 1 1 123 123 PHE H H 123 7.932 7.932 8.230 -0.298 18135 15959 1 17 . 1 1 124 124 GLN N N 124 123.043 123.043 118.910 4.133 18135 15960 1 17 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.350 0.829 18135 15961 1 17 . 1 1 124 124 GLN C C 124 178.772 178.772 178.284 0.488 18135 15962 1 17 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.010 0.306 18135 15963 1 17 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.168 -0.537 18135 15964 1 17 . 1 1 124 124 GLN H H 124 8.470 8.470 8.503 -0.033 18135 15965 1 17 . 1 1 125 125 ARG N N 125 120.342 120.342 118.856 1.486 18135 15966 1 17 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.147 -0.069 18135 15967 1 17 . 1 1 125 125 ARG C C 125 180.340 180.340 179.310 1.030 18135 15968 1 17 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.590 2.707 18135 15969 1 17 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.941 0.384 18135 15970 1 17 . 1 1 125 125 ARG H H 125 8.137 8.137 7.955 0.182 18135 15971 1 17 . 1 1 126 126 ILE N N 126 121.876 121.876 121.586 0.290 18135 15972 1 17 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.744 -0.393 18135 15973 1 17 . 1 1 126 126 ILE C C 126 176.857 176.857 177.872 -1.015 18135 15974 1 17 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.969 0.864 18135 15975 1 17 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.803 0.481 18135 15976 1 17 . 1 1 126 126 ILE H H 126 7.526 7.526 8.407 -0.881 18135 15977 1 17 . 1 1 127 127 THR N N 127 115.613 115.613 115.316 0.297 18135 15978 1 17 . 1 1 127 127 THR HA H 127 3.633 3.633 3.844 -0.211 18135 15979 1 17 . 1 1 127 127 THR C C 127 176.645 176.645 177.074 -0.429 18135 15980 1 17 . 1 1 127 127 THR CA C 127 67.294 67.294 66.674 0.620 18135 15981 1 17 . 1 1 127 127 THR CB C 127 68.871 68.871 68.927 -0.056 18135 15982 1 17 . 1 1 127 127 THR H H 127 8.288 8.288 8.202 0.086 18135 15983 1 17 . 1 1 128 128 LEU N N 128 122.627 122.627 122.038 0.589 18135 15984 1 17 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.962 -0.006 18135 15985 1 17 . 1 1 128 128 LEU C C 128 178.331 178.331 177.528 0.803 18135 15986 1 17 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.758 0.330 18135 15987 1 17 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.330 0.244 18135 15988 1 17 . 1 1 128 128 LEU H H 128 8.263 8.263 8.099 0.164 18135 15989 1 17 . 1 1 129 129 TYR N N 129 120.955 120.955 120.206 0.749 18135 15990 1 17 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.030 -0.140 18135 15991 1 17 . 1 1 129 129 TYR C C 129 176.040 176.040 177.299 -1.259 18135 15992 1 17 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.689 -0.196 18135 15993 1 17 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.239 0.686 18135 15994 1 17 . 1 1 129 129 TYR H H 129 7.518 7.518 8.195 -0.677 18135 15995 1 17 . 1 1 130 130 LEU N N 130 119.155 119.155 116.479 2.676 18135 15996 1 17 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.308 -0.463 18135 15997 1 17 . 1 1 130 130 LEU C C 130 177.948 177.948 178.417 -0.469 18135 15998 1 17 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.890 0.223 18135 15999 1 17 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.520 1.066 18135 16000 1 17 . 1 1 130 130 LEU H H 130 7.717 7.717 7.974 -0.257 18135 16001 1 17 . 1 1 131 131 LYS N N 131 116.832 116.832 119.949 -3.117 18135 16002 1 17 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.934 -0.526 18135 16003 1 17 . 1 1 131 131 LYS C C 131 181.265 181.265 179.739 1.526 18135 16004 1 17 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.683 0.048 18135 16005 1 17 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.031 0.641 18135 16006 1 17 . 1 1 131 131 LYS H H 131 7.493 7.493 7.911 -0.418 18135 16007 1 17 . 1 1 132 132 GLU N N 132 121.918 121.918 119.379 2.539 18135 16008 1 17 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.108 -0.264 18135 16009 1 17 . 1 1 132 132 GLU C C 132 178.377 178.377 177.995 0.382 18135 16010 1 17 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.648 0.239 18135 16011 1 17 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.479 -0.812 18135 16012 1 17 . 1 1 132 132 GLU H H 132 8.430 8.430 7.916 0.514 18135 16013 1 17 . 1 1 133 133 LYS N N 133 116.079 116.079 116.675 -0.596 18135 16014 1 17 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.318 -0.352 18135 16015 1 17 . 1 1 133 133 LYS C C 133 175.282 175.282 175.519 -0.237 18135 16016 1 17 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.304 -0.006 18135 16017 1 17 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.524 0.474 18135 16018 1 17 . 1 1 133 133 LYS H H 133 7.390 7.390 7.319 0.071 18135 16019 1 17 . 1 1 134 134 LYS N N 134 117.759 117.759 116.913 0.846 18135 16020 1 17 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.027 -0.445 18135 16021 1 17 . 1 1 134 134 LYS C C 134 176.271 176.271 175.877 0.394 18135 16022 1 17 . 1 1 134 134 LYS CA C 134 57.308 57.308 57.098 0.210 18135 16023 1 17 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.427 -0.625 18135 16024 1 17 . 1 1 134 134 LYS H H 134 7.716 7.716 7.510 0.206 18135 16025 1 17 . 1 1 135 135 TYR N N 135 110.598 110.598 113.011 -2.413 18135 16026 1 17 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.877 -1.000 18135 16027 1 17 . 1 1 135 135 TYR C C 135 174.148 174.148 175.416 -1.268 18135 16028 1 17 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.046 0.669 18135 16029 1 17 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.177 -0.471 18135 16030 1 17 . 1 1 135 135 TYR H H 135 8.428 8.428 8.693 -0.265 18135 16031 1 17 . 1 1 136 136 SER N N 136 113.712 113.712 115.527 -1.815 18135 16032 1 17 . 1 1 136 136 SER HA H 136 4.553 4.553 4.366 0.187 18135 16033 1 17 . 1 1 136 136 SER CA C 136 57.108 57.108 59.057 -1.949 18135 16034 1 17 . 1 1 136 136 SER CB C 136 62.500 62.500 64.039 -1.539 18135 16035 1 17 . 1 1 136 136 SER H H 136 6.744 6.744 7.483 -0.739 18135 16036 1 17 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.430 -0.265 18135 16037 1 17 . 1 1 137 137 PRO C C 137 180.675 180.675 177.141 3.534 18135 16038 1 17 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.722 0.935 18135 16039 1 17 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.996 -0.013 18135 16040 1 17 . 1 1 138 138 CYS N N 138 113.914 113.914 115.464 -1.550 18135 16041 1 17 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.546 0.124 18135 16042 1 17 . 1 1 138 138 CYS C C 138 176.015 176.015 176.233 -0.218 18135 16043 1 17 . 1 1 138 138 CYS CA C 138 57.095 57.095 61.287 -4.192 18135 16044 1 17 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.348 10.431 18135 16045 1 17 . 1 1 138 138 CYS H H 138 8.580 8.580 8.537 0.043 18135 16046 1 17 . 1 1 139 139 ALA N N 139 125.290 125.290 123.987 1.303 18135 16047 1 17 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.160 0.289 18135 16048 1 17 . 1 1 139 139 ALA C C 139 180.149 180.149 179.279 0.870 18135 16049 1 17 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.930 -0.152 18135 16050 1 17 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.129 0.789 18135 16051 1 17 . 1 1 139 139 ALA H H 139 8.087 8.087 8.083 0.004 18135 16052 1 17 . 1 1 140 140 TRP N N 140 116.599 116.599 118.462 -1.863 18135 16053 1 17 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.322 0.280 18135 16054 1 17 . 1 1 140 140 TRP C C 140 179.137 179.137 178.732 0.405 18135 16055 1 17 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.454 -0.920 18135 16056 1 17 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.350 -0.092 18135 16057 1 17 . 1 1 140 140 TRP H H 140 8.505 8.505 7.834 0.671 18135 16058 1 17 . 1 1 141 141 GLU N N 141 121.578 121.578 118.611 2.967 18135 16059 1 17 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.213 1.010 18135 16060 1 17 . 1 1 141 141 GLU C C 141 177.886 177.886 179.154 -1.268 18135 16061 1 17 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.213 -1.306 18135 16062 1 17 . 1 1 141 141 GLU CB C 141 28.717 28.717 28.705 0.012 18135 16063 1 17 . 1 1 141 141 GLU H H 141 8.182 8.182 8.168 0.014 18135 16064 1 17 . 1 1 142 142 VAL N N 142 121.202 121.202 120.521 0.681 18135 16065 1 17 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.700 -0.070 18135 16066 1 17 . 1 1 142 142 VAL C C 142 180.246 180.246 178.679 1.567 18135 16067 1 17 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.583 0.400 18135 16068 1 17 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.529 0.294 18135 16069 1 17 . 1 1 142 142 VAL H H 142 8.623 8.623 7.933 0.690 18135 16070 1 17 . 1 1 143 143 VAL N N 143 120.119 120.119 119.769 0.350 18135 16071 1 17 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.755 -0.458 18135 16072 1 17 . 1 1 143 143 VAL C C 143 176.407 176.407 178.318 -1.911 18135 16073 1 17 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.910 1.068 18135 16074 1 17 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.587 0.068 18135 16075 1 17 . 1 1 143 143 VAL H H 143 8.323 8.323 8.347 -0.024 18135 16076 1 17 . 1 1 144 144 ARG N N 144 124.102 124.102 119.298 4.804 18135 16077 1 17 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.032 -0.335 18135 16078 1 17 . 1 1 144 144 ARG C C 144 178.127 178.127 178.806 -0.679 18135 16079 1 17 . 1 1 144 144 ARG CA C 144 61.001 61.001 59.310 1.691 18135 16080 1 17 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.549 0.387 18135 16081 1 17 . 1 1 144 144 ARG H H 144 9.619 9.619 8.467 1.152 18135 16082 1 17 . 1 1 145 145 ALA N N 145 119.431 119.431 121.985 -2.554 18135 16083 1 17 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.096 -0.245 18135 16084 1 17 . 1 1 145 145 ALA C C 145 180.763 180.763 179.758 1.005 18135 16085 1 17 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.536 -0.161 18135 16086 1 17 . 1 1 145 145 ALA CB C 145 18.185 18.185 17.861 0.324 18135 16087 1 17 . 1 1 145 145 ALA H H 145 8.867 8.867 8.515 0.352 18135 16088 1 17 . 1 1 146 146 GLU N N 146 121.815 121.815 119.185 2.630 18135 16089 1 17 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.267 -0.056 18135 16090 1 17 . 1 1 146 146 GLU C C 146 177.296 177.296 179.043 -1.747 18135 16091 1 17 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.312 -0.933 18135 16092 1 17 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.828 -1.694 18135 16093 1 17 . 1 1 146 146 GLU H H 146 8.136 8.136 7.950 0.186 18135 16094 1 17 . 1 1 147 147 ILE N N 147 119.542 119.542 120.803 -1.261 18135 16095 1 17 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.767 0.203 18135 16096 1 17 . 1 1 147 147 ILE C C 147 178.283 178.283 178.109 0.174 18135 16097 1 17 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.364 -3.111 18135 16098 1 17 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.541 -2.202 18135 16099 1 17 . 1 1 147 147 ILE H H 147 8.736 8.736 8.202 0.534 18135 16100 1 17 . 1 1 148 148 MET N N 148 119.501 119.501 118.847 0.654 18135 16101 1 17 . 1 1 148 148 MET HA H 148 3.801 3.801 4.201 -0.400 18135 16102 1 17 . 1 1 148 148 MET C C 148 178.210 178.210 178.834 -0.624 18135 16103 1 17 . 1 1 148 148 MET CA C 148 60.184 60.184 59.827 0.357 18135 16104 1 17 . 1 1 148 148 MET CB C 148 32.914 32.914 32.030 0.884 18135 16105 1 17 . 1 1 148 148 MET H H 148 8.440 8.440 8.610 -0.170 18135 16106 1 17 . 1 1 149 149 ARG N N 149 119.734 119.734 119.954 -0.220 18135 16107 1 17 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.318 -0.403 18135 16108 1 17 . 1 1 149 149 ARG C C 149 178.978 178.978 179.367 -0.389 18135 16109 1 17 . 1 1 149 149 ARG CA C 149 59.863 59.863 58.187 1.676 18135 16110 1 17 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.398 0.882 18135 16111 1 17 . 1 1 149 149 ARG H H 149 7.648 7.648 8.443 -0.795 18135 16112 1 17 . 1 1 150 150 SER N N 150 118.109 118.109 114.870 3.239 18135 16113 1 17 . 1 1 150 150 SER HA H 150 3.339 3.339 3.448 -0.109 18135 16114 1 17 . 1 1 150 150 SER C C 150 177.292 177.292 176.263 1.029 18135 16115 1 17 . 1 1 150 150 SER CA C 150 61.316 61.316 61.152 0.164 18135 16116 1 17 . 1 1 150 150 SER CB C 150 60.288 60.288 62.286 -1.998 18135 16117 1 17 . 1 1 150 150 SER H H 150 9.194 9.194 8.069 1.125 18135 16118 1 17 . 1 1 151 151 PHE N N 151 125.265 125.265 122.466 2.799 18135 16119 1 17 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.427 -0.391 18135 16120 1 17 . 1 1 151 151 PHE C C 151 178.696 178.696 177.319 1.377 18135 16121 1 17 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.602 1.818 18135 16122 1 17 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.663 0.223 18135 16123 1 17 . 1 1 151 151 PHE H H 151 9.455 9.455 8.388 1.067 18135 16124 1 17 . 1 1 152 152 SER N N 152 115.963 115.963 115.519 0.444 18135 16125 1 17 . 1 1 152 152 SER HA H 152 3.880 3.880 3.560 0.320 18135 16126 1 17 . 1 1 152 152 SER C C 152 175.858 175.858 176.751 -0.893 18135 16127 1 17 . 1 1 152 152 SER CA C 152 62.388 62.388 61.378 1.010 18135 16128 1 17 . 1 1 152 152 SER CB C 152 62.519 62.519 63.097 -0.578 18135 16129 1 17 . 1 1 152 152 SER H H 152 7.839 7.839 8.358 -0.519 18135 16130 1 17 . 1 1 153 153 LEU N N 153 121.365 121.365 122.570 -1.205 18135 16131 1 17 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.209 -0.128 18135 16132 1 17 . 1 1 153 153 LEU C C 153 179.515 179.515 177.817 1.698 18135 16133 1 17 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.210 0.673 18135 16134 1 17 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.567 0.775 18135 16135 1 17 . 1 1 153 153 LEU H H 153 7.775 7.775 8.159 -0.384 18135 16136 1 17 . 1 1 154 154 SER N N 154 113.950 113.950 112.250 1.700 18135 16137 1 17 . 1 1 154 154 SER HA H 154 3.781 3.781 4.241 -0.460 18135 16138 1 17 . 1 1 154 154 SER C C 154 174.312 174.312 176.243 -1.931 18135 16139 1 17 . 1 1 154 154 SER CA C 154 61.366 61.366 61.137 0.229 18135 16140 1 17 . 1 1 154 154 SER CB C 154 63.242 63.242 63.694 -0.452 18135 16141 1 17 . 1 1 154 154 SER H H 154 7.874 7.874 8.401 -0.527 18135 16142 1 17 . 1 1 155 155 THR N N 155 109.346 109.346 113.292 -3.946 18135 16143 1 17 . 1 1 155 155 THR HA H 155 4.060 4.060 4.325 -0.265 18135 16144 1 17 . 1 1 155 155 THR C C 155 174.798 174.798 175.671 -0.873 18135 16145 1 17 . 1 1 155 155 THR CA C 155 62.275 62.275 64.083 -1.808 18135 16146 1 17 . 1 1 155 155 THR CB C 155 69.342 69.342 69.368 -0.026 18135 16147 1 17 . 1 1 155 155 THR H H 155 7.176 7.176 7.884 -0.708 18135 16148 1 17 . 1 1 156 156 ASN N N 156 119.785 119.785 121.937 -2.152 18135 16149 1 17 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.724 -0.197 18135 16150 1 17 . 1 1 156 156 ASN C C 156 175.528 175.528 175.623 -0.095 18135 16151 1 17 . 1 1 156 156 ASN CA C 156 53.937 53.937 53.556 0.381 18135 16152 1 17 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.049 1.289 18135 16153 1 17 . 1 1 156 156 ASN H H 156 7.749 7.749 7.968 -0.219 18135 16154 1 17 . 1 1 157 157 LEU N N 157 120.552 120.552 120.480 0.072 18135 16155 1 17 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.430 -0.175 18135 16156 1 17 . 1 1 157 157 LEU C C 157 174.702 174.702 178.403 -3.701 18135 16157 1 17 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.921 -1.247 18135 16158 1 17 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.203 0.148 18135 16159 1 17 . 1 1 157 157 LEU H H 157 8.097 8.097 8.229 -0.132 18135 16160 1 17 . 1 1 158 158 GLN N N 158 119.860 119.860 117.864 1.996 18135 16161 1 17 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.310 -0.130 18135 16162 1 17 . 1 1 158 158 GLN C C 158 176.434 176.434 175.792 0.642 18135 16163 1 17 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.831 1.066 18135 16164 1 17 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.507 -0.497 18135 16165 1 17 . 1 1 158 158 GLN H H 158 8.230 8.230 8.149 0.081 18135 16166 1 17 . 1 1 159 159 GLU N N 159 120.461 120.461 116.142 4.319 18135 16167 1 17 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.909 0.310 18135 16168 1 17 . 1 1 159 159 GLU C C 159 175.251 175.251 175.841 -0.590 18135 16169 1 17 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.737 -1.042 18135 16170 1 17 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.461 0.520 18135 16171 1 17 . 1 1 159 159 GLU H H 159 8.300 8.300 8.748 -0.448 18135 16172 1 17 . 1 1 160 160 SER N N 160 115.719 115.719 111.883 3.836 18135 16173 1 17 . 1 1 160 160 SER HA H 160 4.372 4.372 4.490 -0.118 18135 16174 1 17 . 1 1 160 160 SER C C 160 174.188 174.188 173.910 0.278 18135 16175 1 17 . 1 1 160 160 SER CA C 160 58.481 58.481 58.105 0.376 18135 16176 1 17 . 1 1 160 160 SER CB C 160 63.731 63.731 63.674 0.057 18135 16177 1 17 . 1 1 160 160 SER H H 160 8.113 8.113 8.278 -0.165 18135 16178 1 17 . 1 1 161 161 LEU N N 161 123.794 123.794 120.705 3.089 18135 16179 1 17 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.269 0.011 18135 16180 1 17 . 1 1 161 161 LEU C C 161 177.293 177.293 177.301 -0.008 18135 16181 1 17 . 1 1 161 161 LEU CA C 161 55.190 55.190 55.078 0.112 18135 16182 1 17 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.650 -0.366 18135 16183 1 17 . 1 1 161 161 LEU H H 161 8.032 8.032 7.607 0.425 18135 16184 1 17 . 1 1 162 162 ARG N N 162 120.715 120.715 117.667 3.048 18135 16185 1 17 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.041 0.128 18135 16186 1 17 . 1 1 162 162 ARG C C 162 176.288 176.288 176.131 0.157 18135 16187 1 17 . 1 1 162 162 ARG CA C 162 57.046 57.046 57.232 -0.186 18135 16188 1 17 . 1 1 162 162 ARG CB C 162 30.935 30.935 28.848 2.087 18135 16189 1 17 . 1 1 162 162 ARG H H 162 8.094 8.094 8.843 -0.749 18135 16190 1 17 . 1 1 163 163 SER N N 163 116.670 116.670 111.639 5.031 18135 16191 1 17 . 1 1 163 163 SER HA H 163 4.372 4.372 4.410 -0.038 18135 16192 1 17 . 1 1 163 163 SER C C 163 174.184 174.184 175.498 -1.314 18135 16193 1 17 . 1 1 163 163 SER CA C 163 58.481 58.481 59.349 -0.868 18135 16194 1 17 . 1 1 163 163 SER CB C 163 63.745 63.745 63.446 0.299 18135 16195 1 17 . 1 1 163 163 SER H H 163 8.191 8.191 8.393 -0.202 18135 16196 1 17 . 1 1 164 164 LYS N N 164 123.100 123.100 121.703 1.397 18135 16197 1 17 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.120 0.157 18135 16198 1 17 . 1 1 164 164 LYS C C 164 175.617 175.617 177.256 -1.639 18135 16199 1 17 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.898 -1.585 18135 16200 1 17 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.414 0.551 18135 16201 1 17 . 1 1 164 164 LYS H H 164 8.251 8.251 8.318 -0.067 18135 16202 1 18 . 1 1 2 2 ASP N N 2 125.691 125.691 120.705 4.986 18135 16203 1 18 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.631 0.079 18135 16204 1 18 . 1 1 2 2 ASP C C 2 174.758 174.758 176.199 -1.441 18135 16205 1 18 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.902 -2.059 18135 16206 1 18 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.322 -2.001 18135 16207 1 18 . 1 1 2 2 ASP H H 2 8.773 8.773 8.570 0.203 18135 16208 1 18 . 1 1 3 3 LEU N N 3 123.957 123.957 117.406 6.551 18135 16209 1 18 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.321 0.080 18135 16210 1 18 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.868 0.785 18135 16211 1 18 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.620 -0.064 18135 16212 1 18 . 1 1 3 3 LEU H H 3 8.164 8.164 7.395 0.769 18135 16213 1 18 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.562 -0.248 18135 16214 1 18 . 1 1 4 4 PRO C C 4 176.213 176.213 176.760 -0.547 18135 16215 1 18 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.130 0.778 18135 16216 1 18 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.587 1.307 18135 16217 1 18 . 1 1 5 5 GLN N N 5 121.621 121.621 122.443 -0.822 18135 16218 1 18 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.140 0.086 18135 16219 1 18 . 1 1 5 5 GLN C C 5 176.995 176.995 176.484 0.511 18135 16220 1 18 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.259 -1.549 18135 16221 1 18 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.252 -0.301 18135 16222 1 18 . 1 1 5 5 GLN H H 5 8.767 8.767 8.614 0.153 18135 16223 1 18 . 1 1 6 6 THR N N 6 111.419 111.419 111.210 0.209 18135 16224 1 18 . 1 1 6 6 THR HA H 6 4.135 4.135 4.429 -0.294 18135 16225 1 18 . 1 1 6 6 THR C C 6 174.695 174.695 175.738 -1.043 18135 16226 1 18 . 1 1 6 6 THR CA C 6 62.661 62.661 62.713 -0.052 18135 16227 1 18 . 1 1 6 6 THR CB C 6 69.365 69.365 68.765 0.600 18135 16228 1 18 . 1 1 6 6 THR H H 6 7.865 7.865 8.425 -0.560 18135 16229 1 18 . 1 1 7 7 HIS N N 7 119.137 119.137 119.513 -0.376 18135 16230 1 18 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.684 -0.099 18135 16231 1 18 . 1 1 7 7 HIS C C 7 174.980 174.980 175.611 -0.631 18135 16232 1 18 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.611 -2.607 18135 16233 1 18 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.753 -1.591 18135 16234 1 18 . 1 1 7 7 HIS H H 7 8.567 8.567 8.393 0.174 18135 16235 1 18 . 1 1 8 8 SER N N 8 115.796 115.796 113.703 2.093 18135 16236 1 18 . 1 1 8 8 SER HA H 8 4.363 4.363 4.498 -0.135 18135 16237 1 18 . 1 1 8 8 SER C C 8 175.312 175.312 175.773 -0.461 18135 16238 1 18 . 1 1 8 8 SER CA C 8 58.969 58.969 60.710 -1.741 18135 16239 1 18 . 1 1 8 8 SER CB C 8 63.439 63.439 63.960 -0.521 18135 16240 1 18 . 1 1 8 8 SER H H 8 8.180 8.180 7.967 0.213 18135 16241 1 18 . 1 1 9 9 LEU N N 9 123.844 123.844 117.405 6.439 18135 16242 1 18 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.917 -0.762 18135 16243 1 18 . 1 1 9 9 LEU C C 9 178.568 178.568 178.356 0.212 18135 16244 1 18 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.436 0.530 18135 16245 1 18 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.617 -0.821 18135 16246 1 18 . 1 1 9 9 LEU H H 9 8.404 8.404 7.705 0.699 18135 16247 1 18 . 1 1 10 10 GLY N N 10 107.582 107.582 108.009 -0.427 18135 16248 1 18 . 1 1 10 10 GLY C C 10 174.586 174.586 176.099 -1.513 18135 16249 1 18 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.477 -0.572 18135 16250 1 18 . 1 1 10 10 GLY H H 10 8.438 8.438 8.573 -0.135 18135 16251 1 18 . 1 1 11 11 SER N N 11 118.806 118.806 117.368 1.438 18135 16252 1 18 . 1 1 11 11 SER HA H 11 4.156 4.156 4.219 -0.063 18135 16253 1 18 . 1 1 11 11 SER C C 11 175.749 175.749 176.754 -1.005 18135 16254 1 18 . 1 1 11 11 SER CA C 11 61.299 61.299 62.415 -1.116 18135 16255 1 18 . 1 1 11 11 SER CB C 11 62.653 62.653 62.885 -0.232 18135 16256 1 18 . 1 1 11 11 SER H H 11 8.249 8.249 8.331 -0.082 18135 16257 1 18 . 1 1 12 12 ARG N N 12 121.986 121.986 121.323 0.663 18135 16258 1 18 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.146 -0.192 18135 16259 1 18 . 1 1 12 12 ARG C C 12 178.283 178.283 178.489 -0.206 18135 16260 1 18 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.481 1.349 18135 16261 1 18 . 1 1 12 12 ARG CB C 12 29.584 29.584 29.928 -0.344 18135 16262 1 18 . 1 1 12 12 ARG H H 12 8.027 8.027 8.055 -0.028 18135 16263 1 18 . 1 1 13 13 ARG N N 13 119.432 119.432 118.954 0.478 18135 16264 1 18 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.010 -0.171 18135 16265 1 18 . 1 1 13 13 ARG C C 13 178.480 178.480 178.693 -0.213 18135 16266 1 18 . 1 1 13 13 ARG CA C 13 60.491 60.491 60.157 0.334 18135 16267 1 18 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.979 0.103 18135 16268 1 18 . 1 1 13 13 ARG H H 13 8.437 8.437 7.979 0.458 18135 16269 1 18 . 1 1 14 14 THR N N 14 116.879 116.879 116.832 0.047 18135 16270 1 18 . 1 1 14 14 THR HA H 14 3.532 3.532 4.138 -0.606 18135 16271 1 18 . 1 1 14 14 THR C C 14 175.584 175.584 176.971 -1.387 18135 16272 1 18 . 1 1 14 14 THR CA C 14 68.036 68.036 67.080 0.956 18135 16273 1 18 . 1 1 14 14 THR CB C 14 67.969 67.969 68.777 -0.808 18135 16274 1 18 . 1 1 14 14 THR H H 14 7.957 7.957 8.287 -0.330 18135 16275 1 18 . 1 1 15 15 LEU N N 15 120.252 120.252 122.653 -2.401 18135 16276 1 18 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.054 -0.108 18135 16277 1 18 . 1 1 15 15 LEU C C 15 178.652 178.652 178.980 -0.328 18135 16278 1 18 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.297 -0.209 18135 16279 1 18 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.875 -0.321 18135 16280 1 18 . 1 1 15 15 LEU H H 15 7.550 7.550 8.250 -0.700 18135 16281 1 18 . 1 1 16 16 MET N N 16 118.788 118.788 117.503 1.285 18135 16282 1 18 . 1 1 16 16 MET HA H 16 4.023 4.023 3.951 0.072 18135 16283 1 18 . 1 1 16 16 MET C C 16 178.718 178.718 178.723 -0.005 18135 16284 1 18 . 1 1 16 16 MET CA C 16 58.513 58.513 59.293 -0.780 18135 16285 1 18 . 1 1 16 16 MET CB C 16 32.150 32.150 32.372 -0.222 18135 16286 1 18 . 1 1 16 16 MET H H 16 7.985 7.985 8.388 -0.403 18135 16287 1 18 . 1 1 17 17 LEU N N 17 120.644 120.644 119.462 1.182 18135 16288 1 18 . 1 1 17 17 LEU HA H 17 3.972 3.972 4.013 -0.041 18135 16289 1 18 . 1 1 17 17 LEU C C 17 178.238 178.238 179.455 -1.217 18135 16290 1 18 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.061 -0.334 18135 16291 1 18 . 1 1 17 17 LEU CB C 17 42.135 42.135 40.760 1.375 18135 16292 1 18 . 1 1 17 17 LEU H H 17 7.829 7.829 8.222 -0.393 18135 16293 1 18 . 1 1 18 18 LEU N N 18 118.280 118.280 118.898 -0.618 18135 16294 1 18 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.796 -0.290 18135 16295 1 18 . 1 1 18 18 LEU C C 18 175.739 175.739 178.704 -2.965 18135 16296 1 18 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.231 0.425 18135 16297 1 18 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.184 1.058 18135 16298 1 18 . 1 1 18 18 LEU H H 18 7.499 7.499 8.389 -0.890 18135 16299 1 18 . 1 1 19 19 ALA N N 19 121.961 121.961 121.028 0.933 18135 16300 1 18 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.184 -0.347 18135 16301 1 18 . 1 1 19 19 ALA C C 19 180.736 180.736 178.998 1.738 18135 16302 1 18 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.226 0.840 18135 16303 1 18 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.253 -1.176 18135 16304 1 18 . 1 1 19 19 ALA H H 19 7.950 7.950 7.809 0.141 18135 16305 1 18 . 1 1 20 20 GLN N N 20 118.605 118.605 116.144 2.461 18135 16306 1 18 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.161 -0.226 18135 16307 1 18 . 1 1 20 20 GLN C C 20 176.945 176.945 177.197 -0.252 18135 16308 1 18 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.655 0.360 18135 16309 1 18 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.109 -0.635 18135 16310 1 18 . 1 1 20 20 GLN H H 20 7.958 7.958 8.106 -0.148 18135 16311 1 18 . 1 1 21 21 MET N N 21 116.693 116.693 116.252 0.441 18135 16312 1 18 . 1 1 21 21 MET HA H 21 3.861 3.861 4.527 -0.666 18135 16313 1 18 . 1 1 21 21 MET C C 21 174.671 174.671 175.480 -0.809 18135 16314 1 18 . 1 1 21 21 MET CA C 21 57.111 57.111 57.076 0.035 18135 16315 1 18 . 1 1 21 21 MET CB C 21 34.073 34.073 33.855 0.218 18135 16316 1 18 . 1 1 21 21 MET H H 21 7.420 7.420 7.558 -0.138 18135 16317 1 18 . 1 1 22 22 ARG N N 22 115.451 115.451 121.529 -6.078 18135 16318 1 18 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.533 0.320 18135 16319 1 18 . 1 1 22 22 ARG C C 22 175.950 175.950 174.515 1.435 18135 16320 1 18 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.586 2.866 18135 16321 1 18 . 1 1 22 22 ARG CB C 22 31.514 31.514 29.975 1.539 18135 16322 1 18 . 1 1 22 22 ARG H H 22 6.484 6.484 7.263 -0.779 18135 16323 1 18 . 1 1 23 23 LYS N N 23 128.593 128.593 127.488 1.105 18135 16324 1 18 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.606 -0.121 18135 16325 1 18 . 1 1 23 23 LYS C C 23 176.643 176.643 175.578 1.065 18135 16326 1 18 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.986 1.301 18135 16327 1 18 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.319 3.942 18135 16328 1 18 . 1 1 23 23 LYS H H 23 10.212 10.212 8.716 1.496 18135 16329 1 18 . 1 1 24 24 ILE N N 24 118.605 118.605 122.051 -3.446 18135 16330 1 18 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.459 0.025 18135 16331 1 18 . 1 1 24 24 ILE C C 24 173.878 173.878 174.849 -0.971 18135 16332 1 18 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.629 -1.032 18135 16333 1 18 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.844 -0.388 18135 16334 1 18 . 1 1 24 24 ILE H H 24 8.465 8.465 8.424 0.041 18135 16335 1 18 . 1 1 25 25 SER N N 25 113.658 113.658 118.021 -4.363 18135 16336 1 18 . 1 1 25 25 SER HA H 25 4.481 4.481 4.968 -0.487 18135 16337 1 18 . 1 1 25 25 SER C C 25 176.359 176.359 175.811 0.548 18135 16338 1 18 . 1 1 25 25 SER CA C 25 56.975 56.975 56.694 0.281 18135 16339 1 18 . 1 1 25 25 SER CB C 25 64.759 64.759 63.817 0.942 18135 16340 1 18 . 1 1 25 25 SER H H 25 8.104 8.104 8.652 -0.548 18135 16341 1 18 . 1 1 26 26 LEU N N 26 127.566 127.566 125.718 1.848 18135 16342 1 18 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.391 -0.514 18135 16343 1 18 . 1 1 26 26 LEU C C 26 178.946 178.946 177.376 1.570 18135 16344 1 18 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.343 0.335 18135 16345 1 18 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.007 -0.288 18135 16346 1 18 . 1 1 26 26 LEU H H 26 8.802 8.802 8.974 -0.172 18135 16347 1 18 . 1 1 27 27 PHE N N 27 117.143 117.143 116.709 0.434 18135 16348 1 18 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.625 -0.387 18135 16349 1 18 . 1 1 27 27 PHE C C 27 177.067 177.067 176.885 0.182 18135 16350 1 18 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.428 1.662 18135 16351 1 18 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.301 -0.039 18135 16352 1 18 . 1 1 27 27 PHE H H 27 7.986 7.986 7.966 0.020 18135 16353 1 18 . 1 1 28 28 SER N N 28 115.200 115.200 115.877 -0.677 18135 16354 1 18 . 1 1 28 28 SER HA H 28 4.505 4.505 4.395 0.110 18135 16355 1 18 . 1 1 28 28 SER C C 28 174.533 174.533 174.497 0.036 18135 16356 1 18 . 1 1 28 28 SER CA C 28 59.447 59.447 60.793 -1.346 18135 16357 1 18 . 1 1 28 28 SER CB C 28 63.790 63.790 63.517 0.273 18135 16358 1 18 . 1 1 28 28 SER H H 28 7.929 7.929 8.047 -0.118 18135 16359 1 18 . 1 1 29 29 CYS N N 29 119.870 119.870 118.240 1.630 18135 16360 1 18 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.648 0.434 18135 16361 1 18 . 1 1 29 29 CYS C C 29 176.475 176.475 174.029 2.446 18135 16362 1 18 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.814 -5.384 18135 16363 1 18 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.312 9.930 18135 16364 1 18 . 1 1 29 29 CYS H H 29 7.865 7.865 8.439 -0.574 18135 16365 1 18 . 1 1 30 30 LEU N N 30 122.259 122.259 124.440 -2.181 18135 16366 1 18 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.370 -0.409 18135 16367 1 18 . 1 1 30 30 LEU C C 30 179.774 179.774 177.649 2.125 18135 16368 1 18 . 1 1 30 30 LEU CA C 30 58.303 58.303 55.857 2.446 18135 16369 1 18 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.304 -0.728 18135 16370 1 18 . 1 1 30 30 LEU H H 30 7.812 7.812 8.482 -0.670 18135 16371 1 18 . 1 1 31 31 LYS N N 31 117.731 117.731 112.786 4.945 18135 16372 1 18 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.274 0.416 18135 16373 1 18 . 1 1 31 31 LYS C C 31 176.692 176.692 175.792 0.900 18135 16374 1 18 . 1 1 31 31 LYS CA C 31 54.077 54.077 56.200 -2.123 18135 16375 1 18 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.330 0.257 18135 16376 1 18 . 1 1 31 31 LYS H H 31 8.597 8.597 8.196 0.401 18135 16377 1 18 . 1 1 32 32 ASP N N 32 117.841 117.841 119.925 -2.084 18135 16378 1 18 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.754 -0.060 18135 16379 1 18 . 1 1 32 32 ASP C C 32 175.505 175.505 176.425 -0.920 18135 16380 1 18 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.151 -0.062 18135 16381 1 18 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.979 -1.171 18135 16382 1 18 . 1 1 32 32 ASP H H 32 7.808 7.808 7.747 0.061 18135 16383 1 18 . 1 1 33 33 ARG N N 33 120.876 120.876 120.548 0.328 18135 16384 1 18 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.067 -0.026 18135 16385 1 18 . 1 1 33 33 ARG C C 33 175.286 175.286 176.286 -1.000 18135 16386 1 18 . 1 1 33 33 ARG CA C 33 58.083 58.083 56.114 1.969 18135 16387 1 18 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.844 -0.831 18135 16388 1 18 . 1 1 33 33 ARG H H 33 7.378 7.378 7.447 -0.069 18135 16389 1 18 . 1 1 34 34 HIS N N 34 120.555 120.555 117.297 3.258 18135 16390 1 18 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.434 -0.222 18135 16391 1 18 . 1 1 34 34 HIS C C 34 170.494 170.494 173.193 -2.699 18135 16392 1 18 . 1 1 34 34 HIS CA C 34 54.607 54.607 57.551 -2.944 18135 16393 1 18 . 1 1 34 34 HIS CB C 34 31.488 31.488 27.980 3.508 18135 16394 1 18 . 1 1 34 34 HIS H H 34 7.974 7.974 8.562 -0.588 18135 16395 1 18 . 1 1 35 35 ASP N N 35 125.061 125.061 120.598 4.463 18135 16396 1 18 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.472 0.166 18135 16397 1 18 . 1 1 35 35 ASP C C 35 175.943 175.943 175.140 0.803 18135 16398 1 18 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.589 -2.220 18135 16399 1 18 . 1 1 35 35 ASP CB C 35 40.362 40.362 42.767 -2.405 18135 16400 1 18 . 1 1 35 35 ASP H H 35 7.805 7.805 8.636 -0.831 18135 16401 1 18 . 1 1 36 36 PHE N N 36 122.860 122.860 121.428 1.432 18135 16402 1 18 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.670 -0.345 18135 16403 1 18 . 1 1 36 36 PHE C C 36 176.643 176.643 175.491 1.152 18135 16404 1 18 . 1 1 36 36 PHE CA C 36 59.639 59.639 56.161 3.478 18135 16405 1 18 . 1 1 36 36 PHE CB C 36 40.691 40.691 37.920 2.771 18135 16406 1 18 . 1 1 36 36 PHE H H 36 8.973 8.973 7.409 1.564 18135 16407 1 18 . 1 1 37 37 GLY N N 37 111.856 111.856 112.080 -0.224 18135 16408 1 18 . 1 1 37 37 GLY C C 37 175.185 175.185 173.839 1.346 18135 16409 1 18 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.365 3.778 18135 16410 1 18 . 1 1 37 37 GLY H H 37 8.727 8.727 8.111 0.616 18135 16411 1 18 . 1 1 38 38 PHE N N 38 123.178 123.178 123.763 -0.585 18135 16412 1 18 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.882 -0.968 18135 16413 1 18 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.786 2.018 18135 16414 1 18 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.642 0.015 18135 16415 1 18 . 1 1 38 38 PHE H H 38 9.169 9.169 8.075 1.094 18135 16416 1 18 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.467 0.062 18135 16417 1 18 . 1 1 39 39 PRO C C 39 174.634 174.634 176.930 -2.296 18135 16418 1 18 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.616 -1.073 18135 16419 1 18 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.258 -1.554 18135 16420 1 18 . 1 1 40 40 GLN N N 40 123.608 123.608 123.029 0.579 18135 16421 1 18 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.213 -0.594 18135 16422 1 18 . 1 1 40 40 GLN C C 40 176.958 176.958 177.844 -0.886 18135 16423 1 18 . 1 1 40 40 GLN CA C 40 58.073 58.073 59.181 -1.108 18135 16424 1 18 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.397 1.420 18135 16425 1 18 . 1 1 40 40 GLN H H 40 7.966 7.966 8.092 -0.126 18135 16426 1 18 . 1 1 41 41 GLU N N 41 119.446 119.446 120.116 -0.670 18135 16427 1 18 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.068 0.069 18135 16428 1 18 . 1 1 41 41 GLU C C 41 177.346 177.346 177.948 -0.602 18135 16429 1 18 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.939 -1.010 18135 16430 1 18 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.118 -1.285 18135 16431 1 18 . 1 1 41 41 GLU H H 41 9.044 9.044 8.656 0.388 18135 16432 1 18 . 1 1 42 42 GLU N N 42 117.196 117.196 117.169 0.027 18135 16433 1 18 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.311 -0.248 18135 16434 1 18 . 1 1 42 42 GLU C C 42 174.886 174.886 178.112 -3.226 18135 16435 1 18 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.227 -0.843 18135 16436 1 18 . 1 1 42 42 GLU CB C 42 27.558 27.558 30.048 -2.490 18135 16437 1 18 . 1 1 42 42 GLU H H 42 7.646 7.646 8.042 -0.396 18135 16438 1 18 . 1 1 43 43 PHE N N 43 115.527 115.527 122.679 -7.152 18135 16439 1 18 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.805 -0.319 18135 16440 1 18 . 1 1 43 43 PHE C C 43 175.615 175.615 176.811 -1.196 18135 16441 1 18 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.883 -1.335 18135 16442 1 18 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.214 -0.321 18135 16443 1 18 . 1 1 43 43 PHE H H 43 7.601 7.601 8.713 -1.112 18135 16444 1 18 . 1 1 44 44 GLY N N 44 107.243 107.243 110.706 -3.463 18135 16445 1 18 . 1 1 44 44 GLY C C 44 174.032 174.032 173.819 0.213 18135 16446 1 18 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.045 0.567 18135 16447 1 18 . 1 1 44 44 GLY H H 44 7.733 7.733 8.159 -0.426 18135 16448 1 18 . 1 1 45 45 ASN N N 45 117.599 117.599 119.024 -1.425 18135 16449 1 18 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.689 -0.138 18135 16450 1 18 . 1 1 45 45 ASN C C 45 175.894 175.894 175.521 0.373 18135 16451 1 18 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.130 1.718 18135 16452 1 18 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.397 -0.978 18135 16453 1 18 . 1 1 45 45 ASN H H 45 8.343 8.343 8.065 0.278 18135 16454 1 18 . 1 1 46 46 GLN N N 46 118.916 118.916 118.282 0.634 18135 16455 1 18 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.052 0.030 18135 16456 1 18 . 1 1 46 46 GLN C C 46 175.851 175.851 176.452 -0.601 18135 16457 1 18 . 1 1 46 46 GLN CA C 46 56.646 56.646 57.004 -0.358 18135 16458 1 18 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.564 0.880 18135 16459 1 18 . 1 1 46 46 GLN H H 46 8.652 8.652 8.380 0.272 18135 16460 1 18 . 1 1 47 47 PHE N N 47 119.511 119.511 115.424 4.087 18135 16461 1 18 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.514 0.048 18135 16462 1 18 . 1 1 47 47 PHE C C 47 176.258 176.258 174.717 1.541 18135 16463 1 18 . 1 1 47 47 PHE CA C 47 57.920 57.920 56.434 1.486 18135 16464 1 18 . 1 1 47 47 PHE CB C 47 39.858 39.858 37.977 1.881 18135 16465 1 18 . 1 1 47 47 PHE H H 47 7.904 7.904 7.630 0.274 18135 16466 1 18 . 1 1 48 48 GLN N N 48 120.127 120.127 119.721 0.406 18135 16467 1 18 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.300 0.075 18135 16468 1 18 . 1 1 48 48 GLN C C 48 181.265 181.265 176.186 5.079 18135 16469 1 18 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.049 1.527 18135 16470 1 18 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.716 -1.248 18135 16471 1 18 . 1 1 48 48 GLN H H 48 8.255 8.255 7.215 1.040 18135 16472 1 18 . 1 1 49 49 LYS N N 49 121.777 121.777 121.086 0.691 18135 16473 1 18 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.129 -0.026 18135 16474 1 18 . 1 1 49 49 LYS C C 49 177.968 177.968 177.243 0.725 18135 16475 1 18 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.093 0.056 18135 16476 1 18 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.037 0.353 18135 16477 1 18 . 1 1 49 49 LYS H H 49 8.426 8.426 8.558 -0.132 18135 16478 1 18 . 1 1 50 50 ALA N N 50 120.573 120.573 121.108 -0.535 18135 16479 1 18 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.387 -0.317 18135 16480 1 18 . 1 1 50 50 ALA C C 50 178.697 178.697 177.095 1.602 18135 16481 1 18 . 1 1 50 50 ALA CA C 50 54.768 54.768 52.882 1.886 18135 16482 1 18 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.669 0.205 18135 16483 1 18 . 1 1 50 50 ALA H H 50 8.578 8.578 8.242 0.336 18135 16484 1 18 . 1 1 51 51 GLU N N 51 115.015 115.015 116.134 -1.119 18135 16485 1 18 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.219 0.047 18135 16486 1 18 . 1 1 51 51 GLU C C 51 176.995 176.995 176.793 0.202 18135 16487 1 18 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.705 -0.712 18135 16488 1 18 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.408 -0.503 18135 16489 1 18 . 1 1 51 51 GLU H H 51 7.907 7.907 8.395 -0.488 18135 16490 1 18 . 1 1 52 52 THR N N 52 111.210 111.210 114.030 -2.820 18135 16491 1 18 . 1 1 52 52 THR HA H 52 4.114 4.114 4.271 -0.157 18135 16492 1 18 . 1 1 52 52 THR C C 52 175.271 175.271 175.766 -0.495 18135 16493 1 18 . 1 1 52 52 THR CA C 52 63.611 63.611 64.616 -1.005 18135 16494 1 18 . 1 1 52 52 THR CB C 52 69.673 69.673 68.647 1.026 18135 16495 1 18 . 1 1 52 52 THR H H 52 7.863 7.863 8.186 -0.323 18135 16496 1 18 . 1 1 53 53 ILE N N 53 119.113 119.113 122.577 -3.464 18135 16497 1 18 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.257 -0.393 18135 16498 1 18 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.546 1.361 18135 16499 1 18 . 1 1 53 53 ILE CB C 53 34.953 34.953 35.993 -1.040 18135 16500 1 18 . 1 1 53 53 ILE H H 53 8.341 8.341 8.221 0.120 18135 16501 1 18 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.369 -0.083 18135 16502 1 18 . 1 1 54 54 PRO C C 54 179.655 179.655 178.928 0.727 18135 16503 1 18 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.065 -0.014 18135 16504 1 18 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.346 0.539 18135 16505 1 18 . 1 1 55 55 VAL N N 55 116.355 116.355 116.632 -0.277 18135 16506 1 18 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.877 -0.196 18135 16507 1 18 . 1 1 55 55 VAL C C 55 177.649 177.649 177.805 -0.156 18135 16508 1 18 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.323 0.514 18135 16509 1 18 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.432 1.039 18135 16510 1 18 . 1 1 55 55 VAL H H 55 7.119 7.119 7.606 -0.487 18135 16511 1 18 . 1 1 56 56 LEU N N 56 123.038 123.038 121.785 1.253 18135 16512 1 18 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.030 0.280 18135 16513 1 18 . 1 1 56 56 LEU C C 56 178.637 178.637 178.560 0.077 18135 16514 1 18 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.555 -0.469 18135 16515 1 18 . 1 1 56 56 LEU CB C 56 42.318 42.318 40.861 1.457 18135 16516 1 18 . 1 1 56 56 LEU H H 56 8.535 8.535 8.514 0.021 18135 16517 1 18 . 1 1 57 57 HIS N N 57 117.041 117.041 118.618 -1.577 18135 16518 1 18 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.022 -0.236 18135 16519 1 18 . 1 1 57 57 HIS C C 57 175.640 175.640 177.667 -2.027 18135 16520 1 18 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.835 0.696 18135 16521 1 18 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.048 -1.839 18135 16522 1 18 . 1 1 57 57 HIS H H 57 9.047 9.047 7.989 1.058 18135 16523 1 18 . 1 1 58 58 GLU N N 58 119.521 119.521 118.633 0.888 18135 16524 1 18 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.780 0.227 18135 16525 1 18 . 1 1 58 58 GLU C C 58 179.029 179.029 178.772 0.257 18135 16526 1 18 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.428 -0.461 18135 16527 1 18 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.409 -1.119 18135 16528 1 18 . 1 1 58 58 GLU H H 58 7.860 7.860 8.244 -0.384 18135 16529 1 18 . 1 1 59 59 MET N N 59 119.512 119.512 120.305 -0.793 18135 16530 1 18 . 1 1 59 59 MET HA H 59 4.074 4.074 4.292 -0.218 18135 16531 1 18 . 1 1 59 59 MET C C 59 177.031 177.031 178.712 -1.681 18135 16532 1 18 . 1 1 59 59 MET CA C 59 59.408 59.408 58.318 1.090 18135 16533 1 18 . 1 1 59 59 MET CB C 59 32.525 32.525 32.583 -0.058 18135 16534 1 18 . 1 1 59 59 MET H H 59 8.442 8.442 7.857 0.585 18135 16535 1 18 . 1 1 60 60 ILE N N 60 117.183 117.183 118.318 -1.135 18135 16536 1 18 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.462 -0.045 18135 16537 1 18 . 1 1 60 60 ILE C C 60 177.524 177.524 178.138 -0.614 18135 16538 1 18 . 1 1 60 60 ILE CA C 60 65.326 65.326 65.019 0.307 18135 16539 1 18 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.283 -0.423 18135 16540 1 18 . 1 1 60 60 ILE H H 60 8.338 8.338 7.630 0.708 18135 16541 1 18 . 1 1 61 61 GLN N N 61 120.191 120.191 119.559 0.632 18135 16542 1 18 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.690 0.012 18135 16543 1 18 . 1 1 61 61 GLN C C 61 178.270 178.270 177.741 0.529 18135 16544 1 18 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.253 -0.467 18135 16545 1 18 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.116 0.550 18135 16546 1 18 . 1 1 61 61 GLN H H 61 8.234 8.234 8.302 -0.068 18135 16547 1 18 . 1 1 62 62 GLN N N 62 116.795 116.795 118.877 -2.082 18135 16548 1 18 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.216 0.411 18135 16549 1 18 . 1 1 62 62 GLN C C 62 179.685 179.685 178.297 1.388 18135 16550 1 18 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.423 -0.416 18135 16551 1 18 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.946 -3.604 18135 16552 1 18 . 1 1 62 62 GLN H H 62 8.421 8.421 8.079 0.341 18135 16553 1 18 . 1 1 63 63 ILE N N 63 122.797 122.797 120.017 2.780 18135 16554 1 18 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.933 -0.284 18135 16555 1 18 . 1 1 63 63 ILE C C 63 177.279 177.279 177.868 -0.589 18135 16556 1 18 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.799 2.166 18135 16557 1 18 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.810 -0.495 18135 16558 1 18 . 1 1 63 63 ILE H H 63 8.164 8.164 7.545 0.619 18135 16559 1 18 . 1 1 64 64 PHE N N 64 120.820 120.820 121.384 -0.564 18135 16560 1 18 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.447 -0.731 18135 16561 1 18 . 1 1 64 64 PHE C C 64 178.402 178.402 176.741 1.661 18135 16562 1 18 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.479 0.673 18135 16563 1 18 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.619 -0.109 18135 16564 1 18 . 1 1 64 64 PHE H H 64 8.405 8.405 7.939 0.466 18135 16565 1 18 . 1 1 65 65 ASN N N 65 119.981 119.981 118.738 1.243 18135 16566 1 18 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.783 0.280 18135 16567 1 18 . 1 1 65 65 ASN C C 65 177.944 177.944 177.478 0.466 18135 16568 1 18 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.364 -0.496 18135 16569 1 18 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.512 -1.256 18135 16570 1 18 . 1 1 65 65 ASN H H 65 8.812 8.812 8.022 0.790 18135 16571 1 18 . 1 1 66 66 LEU N N 66 121.533 121.533 120.913 0.620 18135 16572 1 18 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.236 -0.013 18135 16573 1 18 . 1 1 66 66 LEU C C 66 177.777 177.777 178.494 -0.717 18135 16574 1 18 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.822 0.446 18135 16575 1 18 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.138 0.469 18135 16576 1 18 . 1 1 66 66 LEU H H 66 8.177 8.177 7.975 0.202 18135 16577 1 18 . 1 1 67 67 PHE N N 67 110.842 110.842 112.374 -1.532 18135 16578 1 18 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.661 0.219 18135 16579 1 18 . 1 1 67 67 PHE C C 67 177.965 177.965 176.259 1.706 18135 16580 1 18 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.352 1.182 18135 16581 1 18 . 1 1 67 67 PHE CB C 67 38.616 38.616 39.038 -0.422 18135 16582 1 18 . 1 1 67 67 PHE H H 67 8.160 8.160 8.427 -0.267 18135 16583 1 18 . 1 1 68 68 SER N N 68 119.131 119.131 113.302 5.829 18135 16584 1 18 . 1 1 68 68 SER HA H 68 4.580 4.580 4.289 0.291 18135 16585 1 18 . 1 1 68 68 SER C C 68 173.472 173.472 174.880 -1.408 18135 16586 1 18 . 1 1 68 68 SER CA C 68 59.191 59.191 59.340 -0.149 18135 16587 1 18 . 1 1 68 68 SER CB C 68 63.123 63.123 63.691 -0.567 18135 16588 1 18 . 1 1 68 68 SER H H 68 8.016 8.016 7.534 0.482 18135 16589 1 18 . 1 1 69 69 THR N N 69 111.353 111.353 115.704 -4.351 18135 16590 1 18 . 1 1 69 69 THR HA H 69 4.345 4.345 4.463 -0.118 18135 16591 1 18 . 1 1 69 69 THR C C 69 175.661 175.661 174.402 1.259 18135 16592 1 18 . 1 1 69 69 THR CA C 69 61.411 61.411 60.690 0.721 18135 16593 1 18 . 1 1 69 69 THR CB C 69 72.209 72.209 70.956 1.253 18135 16594 1 18 . 1 1 69 69 THR H H 69 6.977 6.977 7.317 -0.340 18135 16595 1 18 . 1 1 70 70 LYS N N 70 121.120 121.120 123.239 -2.119 18135 16596 1 18 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.135 -0.046 18135 16597 1 18 . 1 1 70 70 LYS C C 70 179.259 179.259 177.427 1.832 18135 16598 1 18 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.828 -0.872 18135 16599 1 18 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.340 -0.590 18135 16600 1 18 . 1 1 70 70 LYS H H 70 9.065 9.065 8.593 0.472 18135 16601 1 18 . 1 1 71 71 ASP N N 71 116.374 116.374 120.105 -3.731 18135 16602 1 18 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.327 -0.152 18135 16603 1 18 . 1 1 71 71 ASP C C 71 178.372 178.372 176.928 1.444 18135 16604 1 18 . 1 1 71 71 ASP CA C 71 57.067 57.067 56.884 0.183 18135 16605 1 18 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.649 -0.343 18135 16606 1 18 . 1 1 71 71 ASP H H 71 7.518 7.518 7.745 -0.227 18135 16607 1 18 . 1 1 72 72 SER N N 72 117.341 117.341 114.956 2.385 18135 16608 1 18 . 1 1 72 72 SER HA H 72 3.715 3.715 3.050 0.665 18135 16609 1 18 . 1 1 72 72 SER C C 72 176.897 176.897 175.990 0.907 18135 16610 1 18 . 1 1 72 72 SER CA C 72 60.267 60.267 60.331 -0.065 18135 16611 1 18 . 1 1 72 72 SER CB C 72 62.616 62.616 63.366 -0.750 18135 16612 1 18 . 1 1 72 72 SER H H 72 8.066 8.066 7.642 0.424 18135 16613 1 18 . 1 1 73 73 SER N N 73 113.398 113.398 118.657 -5.259 18135 16614 1 18 . 1 1 73 73 SER HA H 73 4.094 4.094 4.107 -0.013 18135 16615 1 18 . 1 1 73 73 SER C C 73 174.855 174.855 175.260 -0.405 18135 16616 1 18 . 1 1 73 73 SER CA C 73 61.385 61.385 60.487 0.898 18135 16617 1 18 . 1 1 73 73 SER CB C 73 62.798 62.798 62.836 -0.038 18135 16618 1 18 . 1 1 73 73 SER H H 73 7.982 7.982 7.681 0.301 18135 16619 1 18 . 1 1 74 74 ALA N N 74 119.486 119.486 119.946 -0.460 18135 16620 1 18 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.226 -0.069 18135 16621 1 18 . 1 1 74 74 ALA C C 74 177.626 177.626 177.128 0.498 18135 16622 1 18 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.695 0.018 18135 16623 1 18 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.765 -0.017 18135 16624 1 18 . 1 1 74 74 ALA H H 74 7.095 7.095 7.351 -0.256 18135 16625 1 18 . 1 1 75 75 ALA N N 75 121.465 121.465 120.821 0.644 18135 16626 1 18 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.941 -0.245 18135 16627 1 18 . 1 1 75 75 ALA C C 75 177.197 177.197 176.142 1.055 18135 16628 1 18 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.821 1.183 18135 16629 1 18 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.030 -0.770 18135 16630 1 18 . 1 1 75 75 ALA H H 75 7.159 7.159 7.412 -0.253 18135 16631 1 18 . 1 1 76 76 TRP N N 76 116.791 116.791 116.506 0.285 18135 16632 1 18 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.728 0.322 18135 16633 1 18 . 1 1 76 76 TRP C C 76 177.617 177.617 174.902 2.715 18135 16634 1 18 . 1 1 76 76 TRP CA C 76 53.319 53.319 54.869 -1.550 18135 16635 1 18 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.122 1.954 18135 16636 1 18 . 1 1 76 76 TRP H H 76 7.080 7.080 6.996 0.084 18135 16637 1 18 . 1 1 77 77 ASP N N 77 119.928 119.928 121.129 -1.201 18135 16638 1 18 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.533 -0.176 18135 16639 1 18 . 1 1 77 77 ASP C C 77 176.877 176.877 177.752 -0.875 18135 16640 1 18 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.534 -0.716 18135 16641 1 18 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.829 0.786 18135 16642 1 18 . 1 1 77 77 ASP H H 77 8.259 8.259 8.513 -0.254 18135 16643 1 18 . 1 1 78 78 GLU N N 78 127.277 127.277 125.442 1.835 18135 16644 1 18 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.984 -0.099 18135 16645 1 18 . 1 1 78 78 GLU C C 78 177.439 177.439 178.251 -0.812 18135 16646 1 18 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.749 -0.365 18135 16647 1 18 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.412 -0.770 18135 16648 1 18 . 1 1 78 78 GLU H H 78 8.920 8.920 8.878 0.042 18135 16649 1 18 . 1 1 79 79 THR N N 79 115.422 115.422 117.632 -2.210 18135 16650 1 18 . 1 1 79 79 THR HA H 79 3.907 3.907 4.035 -0.128 18135 16651 1 18 . 1 1 79 79 THR C C 79 177.330 177.330 176.741 0.589 18135 16652 1 18 . 1 1 79 79 THR CA C 79 66.263 66.263 65.697 0.566 18135 16653 1 18 . 1 1 79 79 THR CB C 79 68.002 68.002 68.501 -0.499 18135 16654 1 18 . 1 1 79 79 THR H H 79 8.124 8.124 8.256 -0.132 18135 16655 1 18 . 1 1 80 80 LEU N N 80 121.791 121.791 122.289 -0.498 18135 16656 1 18 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.148 -0.261 18135 16657 1 18 . 1 1 80 80 LEU C C 80 179.018 179.018 178.947 0.071 18135 16658 1 18 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.749 -0.510 18135 16659 1 18 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.215 0.437 18135 16660 1 18 . 1 1 80 80 LEU H H 80 7.725 7.725 8.035 -0.310 18135 16661 1 18 . 1 1 81 81 LEU N N 81 119.280 119.280 120.818 -1.538 18135 16662 1 18 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.227 -0.738 18135 16663 1 18 . 1 1 81 81 LEU C C 81 177.062 177.062 178.894 -1.832 18135 16664 1 18 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.776 -1.067 18135 16665 1 18 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.125 -1.177 18135 16666 1 18 . 1 1 81 81 LEU H H 81 8.344 8.344 8.873 -0.529 18135 16667 1 18 . 1 1 82 82 ASP N N 82 115.357 115.357 119.935 -4.578 18135 16668 1 18 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.426 -0.152 18135 16669 1 18 . 1 1 82 82 ASP C C 82 179.018 179.018 178.658 0.360 18135 16670 1 18 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.659 -0.844 18135 16671 1 18 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.788 -2.567 18135 16672 1 18 . 1 1 82 82 ASP H H 82 8.001 8.001 8.579 -0.578 18135 16673 1 18 . 1 1 83 83 LYS N N 83 119.603 119.603 118.423 1.180 18135 16674 1 18 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.887 0.095 18135 16675 1 18 . 1 1 83 83 LYS C C 83 178.624 178.624 178.938 -0.314 18135 16676 1 18 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.923 0.822 18135 16677 1 18 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.153 0.953 18135 16678 1 18 . 1 1 83 83 LYS H H 83 7.342 7.342 7.737 -0.395 18135 16679 1 18 . 1 1 84 84 PHE N N 84 123.933 123.933 121.754 2.179 18135 16680 1 18 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.026 0.009 18135 16681 1 18 . 1 1 84 84 PHE C C 84 177.210 177.210 177.067 0.143 18135 16682 1 18 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.837 -1.494 18135 16683 1 18 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.903 0.413 18135 16684 1 18 . 1 1 84 84 PHE H H 84 8.471 8.471 8.529 -0.058 18135 16685 1 18 . 1 1 85 85 TYR N N 85 118.387 118.387 117.386 1.001 18135 16686 1 18 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.697 0.371 18135 16687 1 18 . 1 1 85 85 TYR C C 85 178.104 178.104 177.507 0.597 18135 16688 1 18 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.536 -0.959 18135 16689 1 18 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.142 -0.165 18135 16690 1 18 . 1 1 85 85 TYR H H 85 9.011 9.011 8.965 0.046 18135 16691 1 18 . 1 1 86 86 THR N N 86 114.035 114.035 116.064 -2.029 18135 16692 1 18 . 1 1 86 86 THR HA H 86 3.945 3.945 3.233 0.712 18135 16693 1 18 . 1 1 86 86 THR C C 86 176.708 176.708 176.586 0.122 18135 16694 1 18 . 1 1 86 86 THR CA C 86 66.759 66.759 66.894 -0.135 18135 16695 1 18 . 1 1 86 86 THR CB C 86 68.853 68.853 67.935 0.918 18135 16696 1 18 . 1 1 86 86 THR H H 86 7.609 7.609 7.329 0.280 18135 16697 1 18 . 1 1 87 87 GLU N N 87 120.790 120.790 121.549 -0.759 18135 16698 1 18 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.957 0.090 18135 16699 1 18 . 1 1 87 87 GLU C C 87 179.606 179.606 178.841 0.765 18135 16700 1 18 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.753 -1.355 18135 16701 1 18 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.077 -0.791 18135 16702 1 18 . 1 1 87 87 GLU H H 87 7.712 7.712 7.655 0.057 18135 16703 1 18 . 1 1 88 88 LEU N N 88 120.729 120.729 120.159 0.570 18135 16704 1 18 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.920 -0.192 18135 16705 1 18 . 1 1 88 88 LEU C C 88 178.695 178.695 179.392 -0.697 18135 16706 1 18 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.499 0.751 18135 16707 1 18 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.101 1.486 18135 16708 1 18 . 1 1 88 88 LEU H H 88 8.393 8.393 7.411 0.982 18135 16709 1 18 . 1 1 89 89 TYR N N 89 118.654 118.654 119.207 -0.553 18135 16710 1 18 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.043 -0.112 18135 16711 1 18 . 1 1 89 89 TYR C C 89 178.438 178.438 178.623 -0.185 18135 16712 1 18 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.192 0.215 18135 16713 1 18 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.460 0.407 18135 16714 1 18 . 1 1 89 89 TYR H H 89 8.637 8.637 8.178 0.459 18135 16715 1 18 . 1 1 90 90 GLN N N 90 118.263 118.263 117.040 1.223 18135 16716 1 18 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.971 0.015 18135 16717 1 18 . 1 1 90 90 GLN C C 90 178.411 178.411 178.591 -0.180 18135 16718 1 18 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.961 -0.179 18135 16719 1 18 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.487 -0.340 18135 16720 1 18 . 1 1 90 90 GLN H H 90 7.796 7.796 7.764 0.032 18135 16721 1 18 . 1 1 91 91 GLN N N 91 117.959 117.959 118.915 -0.956 18135 16722 1 18 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.030 0.052 18135 16723 1 18 . 1 1 91 91 GLN C C 91 178.705 178.705 178.696 0.009 18135 16724 1 18 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.598 0.222 18135 16725 1 18 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.245 0.928 18135 16726 1 18 . 1 1 91 91 GLN H H 91 7.727 7.727 8.627 -0.900 18135 16727 1 18 . 1 1 92 92 LEU N N 92 119.965 119.965 118.360 1.605 18135 16728 1 18 . 1 1 92 92 LEU HA H 92 3.734 3.734 4.002 -0.268 18135 16729 1 18 . 1 1 92 92 LEU C C 92 178.984 178.984 178.638 0.346 18135 16730 1 18 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.614 -0.121 18135 16731 1 18 . 1 1 92 92 LEU CB C 92 41.379 41.379 41.053 0.326 18135 16732 1 18 . 1 1 92 92 LEU H H 92 8.465 8.465 8.480 -0.015 18135 16733 1 18 . 1 1 93 93 ASN N N 93 117.793 117.793 118.585 -0.792 18135 16734 1 18 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.295 0.106 18135 16735 1 18 . 1 1 93 93 ASN C C 93 178.309 178.309 177.152 1.157 18135 16736 1 18 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.148 0.256 18135 16737 1 18 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.227 0.411 18135 16738 1 18 . 1 1 93 93 ASN H H 93 8.091 8.091 7.938 0.153 18135 16739 1 18 . 1 1 94 94 ASP N N 94 121.133 121.133 120.994 0.139 18135 16740 1 18 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.398 0.007 18135 16741 1 18 . 1 1 94 94 ASP C C 94 178.328 178.328 178.686 -0.358 18135 16742 1 18 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.590 -1.043 18135 16743 1 18 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.948 -2.299 18135 16744 1 18 . 1 1 94 94 ASP H H 94 8.362 8.362 8.244 0.118 18135 16745 1 18 . 1 1 95 95 LEU N N 95 119.160 119.160 120.377 -1.217 18135 16746 1 18 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.956 0.083 18135 16747 1 18 . 1 1 95 95 LEU C C 95 178.826 178.826 178.454 0.372 18135 16748 1 18 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.024 -0.997 18135 16749 1 18 . 1 1 95 95 LEU CB C 95 42.210 42.210 41.999 0.211 18135 16750 1 18 . 1 1 95 95 LEU H H 95 8.143 8.143 8.565 -0.422 18135 16751 1 18 . 1 1 96 96 GLU N N 96 118.813 118.813 119.034 -0.221 18135 16752 1 18 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.770 0.191 18135 16753 1 18 . 1 1 96 96 GLU C C 96 177.640 177.640 177.947 -0.307 18135 16754 1 18 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.138 -1.424 18135 16755 1 18 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.565 -1.427 18135 16756 1 18 . 1 1 96 96 GLU H H 96 8.111 8.111 7.856 0.255 18135 16757 1 18 . 1 1 97 97 ALA N N 97 120.549 120.549 122.035 -1.486 18135 16758 1 18 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.926 0.196 18135 16759 1 18 . 1 1 97 97 ALA C C 97 179.126 179.126 180.170 -1.044 18135 16760 1 18 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.785 -0.752 18135 16761 1 18 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.899 0.081 18135 16762 1 18 . 1 1 97 97 ALA H H 97 7.798 7.798 7.818 -0.020 18135 16763 1 18 . 1 1 98 98 CYS N N 98 115.510 115.510 117.167 -1.657 18135 16764 1 18 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.091 0.359 18135 16765 1 18 . 1 1 98 98 CYS C C 98 175.363 175.363 176.524 -1.161 18135 16766 1 18 . 1 1 98 98 CYS CA C 98 57.166 57.166 63.294 -6.128 18135 16767 1 18 . 1 1 98 98 CYS CB C 98 41.879 41.879 25.724 16.155 18135 16768 1 18 . 1 1 98 98 CYS H H 98 7.597 7.597 8.317 -0.720 18135 16769 1 18 . 1 1 99 99 VAL N N 99 121.713 121.713 119.519 2.194 18135 16770 1 18 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.893 -0.099 18135 16771 1 18 . 1 1 99 99 VAL C C 99 177.357 177.357 177.666 -0.309 18135 16772 1 18 . 1 1 99 99 VAL CA C 99 64.583 64.583 64.987 -0.404 18135 16773 1 18 . 1 1 99 99 VAL CB C 99 32.031 32.031 31.993 0.038 18135 16774 1 18 . 1 1 99 99 VAL H H 99 7.828 7.828 7.484 0.344 18135 16775 1 18 . 1 1 100 100 ILE N N 100 122.333 122.333 122.039 0.294 18135 16776 1 18 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.693 0.231 18135 16777 1 18 . 1 1 100 100 ILE C C 100 176.827 176.827 177.234 -0.407 18135 16778 1 18 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.902 -1.664 18135 16779 1 18 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.637 0.641 18135 16780 1 18 . 1 1 100 100 ILE H H 100 8.067 8.067 8.512 -0.445 18135 16781 1 18 . 1 1 101 101 GLN N N 101 121.864 121.864 117.112 4.752 18135 16782 1 18 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.379 -0.153 18135 16783 1 18 . 1 1 101 101 GLN C C 101 176.438 176.438 176.774 -0.336 18135 16784 1 18 . 1 1 101 101 GLN CA C 101 56.320 56.320 54.660 1.660 18135 16785 1 18 . 1 1 101 101 GLN CB C 101 29.011 29.011 28.377 0.634 18135 16786 1 18 . 1 1 101 101 GLN H H 101 8.062 8.062 7.592 0.470 18135 16787 1 18 . 1 1 102 102 GLY N N 102 109.288 109.288 107.635 1.653 18135 16788 1 18 . 1 1 102 102 GLY C C 102 173.855 173.855 175.070 -1.215 18135 16789 1 18 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.458 -1.299 18135 16790 1 18 . 1 1 102 102 GLY H H 102 8.087 8.087 8.191 -0.104 18135 16791 1 18 . 1 1 103 103 VAL N N 103 118.932 118.932 118.056 0.876 18135 16792 1 18 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.668 0.406 18135 16793 1 18 . 1 1 103 103 VAL C C 103 176.299 176.299 177.170 -0.871 18135 16794 1 18 . 1 1 103 103 VAL CA C 103 62.499 62.499 64.746 -2.247 18135 16795 1 18 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.660 1.194 18135 16796 1 18 . 1 1 103 103 VAL H H 103 8.079 8.079 7.506 0.573 18135 16797 1 18 . 1 1 104 104 GLY N N 104 112.028 112.028 105.656 6.372 18135 16798 1 18 . 1 1 104 104 GLY C C 104 173.694 173.694 173.268 0.426 18135 16799 1 18 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.174 0.228 18135 16800 1 18 . 1 1 104 104 GLY H H 104 8.446 8.446 8.607 -0.161 18135 16801 1 18 . 1 1 105 105 VAL N N 105 120.439 120.439 120.185 0.254 18135 16802 1 18 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.230 -0.042 18135 16803 1 18 . 1 1 105 105 VAL C C 105 175.963 175.963 173.516 2.447 18135 16804 1 18 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.409 0.727 18135 16805 1 18 . 1 1 105 105 VAL CB C 105 32.814 32.814 32.999 -0.185 18135 16806 1 18 . 1 1 105 105 VAL H H 105 7.867 7.867 7.543 0.324 18135 16807 1 18 . 1 1 106 106 THR N N 106 116.366 116.366 115.651 0.715 18135 16808 1 18 . 1 1 106 106 THR HA H 106 4.548 4.548 4.595 -0.047 18135 16809 1 18 . 1 1 106 106 THR C C 106 173.731 173.731 173.538 0.193 18135 16810 1 18 . 1 1 106 106 THR CA C 106 59.419 59.419 60.639 -1.220 18135 16811 1 18 . 1 1 106 106 THR CB C 106 79.536 79.536 71.379 8.157 18135 16812 1 18 . 1 1 106 106 THR H H 106 8.565 8.565 8.068 0.497 18135 16813 1 18 . 1 1 107 107 GLU N N 107 119.743 119.743 120.082 -0.339 18135 16814 1 18 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.757 -0.295 18135 16815 1 18 . 1 1 107 107 GLU C C 107 175.639 175.639 175.518 0.121 18135 16816 1 18 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.785 0.926 18135 16817 1 18 . 1 1 107 107 GLU CB C 107 30.499 30.499 33.478 -2.979 18135 16818 1 18 . 1 1 107 107 GLU H H 107 8.410 8.410 8.708 -0.298 18135 16819 1 18 . 1 1 108 108 THR N N 108 114.402 114.402 112.403 1.999 18135 16820 1 18 . 1 1 108 108 THR HA H 108 4.448 4.448 4.807 -0.359 18135 16821 1 18 . 1 1 108 108 THR CA C 108 60.348 60.348 58.744 1.604 18135 16822 1 18 . 1 1 108 108 THR CB C 108 68.544 68.544 68.590 -0.046 18135 16823 1 18 . 1 1 108 108 THR H H 108 8.155 8.155 8.347 -0.192 18135 16824 1 18 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.517 -0.279 18135 16825 1 18 . 1 1 109 109 PRO C C 109 178.666 178.666 177.985 0.681 18135 16826 1 18 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.428 0.948 18135 16827 1 18 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.788 0.060 18135 16828 1 18 . 1 1 110 110 LEU N N 110 118.566 118.566 118.194 0.372 18135 16829 1 18 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.053 0.063 18135 16830 1 18 . 1 1 110 110 LEU C C 110 178.293 178.293 179.448 -1.155 18135 16831 1 18 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.671 -0.985 18135 16832 1 18 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.471 0.499 18135 16833 1 18 . 1 1 110 110 LEU H H 110 8.016 8.016 7.826 0.190 18135 16834 1 18 . 1 1 111 111 MET N N 111 118.982 118.982 117.130 1.852 18135 16835 1 18 . 1 1 111 111 MET HA H 111 4.210 4.210 4.312 -0.102 18135 16836 1 18 . 1 1 111 111 MET C C 111 178.720 178.720 178.277 0.443 18135 16837 1 18 . 1 1 111 111 MET CA C 111 58.144 58.144 57.313 0.831 18135 16838 1 18 . 1 1 111 111 MET CB C 111 32.374 32.374 32.246 0.128 18135 16839 1 18 . 1 1 111 111 MET H H 111 7.705 7.705 7.954 -0.249 18135 16840 1 18 . 1 1 112 112 LYS N N 112 121.377 121.377 119.714 1.663 18135 16841 1 18 . 1 1 112 112 LYS HA H 112 4.108 4.108 3.960 0.148 18135 16842 1 18 . 1 1 112 112 LYS C C 112 178.000 178.000 178.068 -0.068 18135 16843 1 18 . 1 1 112 112 LYS CA C 112 56.305 56.305 59.457 -3.152 18135 16844 1 18 . 1 1 112 112 LYS CB C 112 32.367 32.367 31.960 0.407 18135 16845 1 18 . 1 1 112 112 LYS H H 112 8.257 8.257 7.678 0.579 18135 16846 1 18 . 1 1 113 113 GLU N N 113 119.104 119.104 118.852 0.252 18135 16847 1 18 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.023 0.043 18135 16848 1 18 . 1 1 113 113 GLU C C 113 178.289 178.289 179.173 -0.884 18135 16849 1 18 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.252 -0.999 18135 16850 1 18 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.136 -0.998 18135 16851 1 18 . 1 1 113 113 GLU H H 113 8.270 8.270 7.631 0.639 18135 16852 1 18 . 1 1 114 114 ASP N N 114 119.224 119.224 119.939 -0.715 18135 16853 1 18 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.575 -0.287 18135 16854 1 18 . 1 1 114 114 ASP C C 114 178.365 178.365 178.427 -0.062 18135 16855 1 18 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.364 -1.256 18135 16856 1 18 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.859 -2.624 18135 16857 1 18 . 1 1 114 114 ASP H H 114 8.618 8.618 7.814 0.804 18135 16858 1 18 . 1 1 115 115 SER N N 115 118.195 118.195 116.370 1.825 18135 16859 1 18 . 1 1 115 115 SER HA H 115 4.200 4.200 4.242 -0.042 18135 16860 1 18 . 1 1 115 115 SER C C 115 175.986 175.986 176.454 -0.468 18135 16861 1 18 . 1 1 115 115 SER CA C 115 61.588 61.588 62.000 -0.412 18135 16862 1 18 . 1 1 115 115 SER CB C 115 62.653 62.653 62.992 -0.339 18135 16863 1 18 . 1 1 115 115 SER H H 115 8.181 8.181 7.697 0.484 18135 16864 1 18 . 1 1 116 116 ILE N N 116 123.340 123.340 120.536 2.804 18135 16865 1 18 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.859 -0.233 18135 16866 1 18 . 1 1 116 116 ILE C C 116 178.367 178.367 177.890 0.477 18135 16867 1 18 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.988 0.829 18135 16868 1 18 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.947 0.471 18135 16869 1 18 . 1 1 116 116 ILE H H 116 7.773 7.773 8.425 -0.652 18135 16870 1 18 . 1 1 117 117 LEU N N 117 120.968 120.968 121.414 -0.446 18135 16871 1 18 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.975 -0.070 18135 16872 1 18 . 1 1 117 117 LEU C C 117 178.746 178.746 178.436 0.310 18135 16873 1 18 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.470 -0.327 18135 16874 1 18 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.563 0.023 18135 16875 1 18 . 1 1 117 117 LEU H H 117 8.406 8.406 7.482 0.924 18135 16876 1 18 . 1 1 118 118 ALA N N 118 120.150 120.150 122.431 -2.281 18135 16877 1 18 . 1 1 118 118 ALA HA H 118 4.112 4.112 4.031 0.081 18135 16878 1 18 . 1 1 118 118 ALA C C 118 181.633 181.633 179.511 2.122 18135 16879 1 18 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.528 -0.215 18135 16880 1 18 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.566 -0.456 18135 16881 1 18 . 1 1 118 118 ALA H H 118 7.894 7.894 8.175 -0.281 18135 16882 1 18 . 1 1 119 119 VAL N N 119 118.873 118.873 116.313 2.560 18135 16883 1 18 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.532 0.223 18135 16884 1 18 . 1 1 119 119 VAL C C 119 177.896 177.896 177.913 -0.017 18135 16885 1 18 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.877 1.304 18135 16886 1 18 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.193 0.701 18135 16887 1 18 . 1 1 119 119 VAL H H 119 7.572 7.572 7.894 -0.322 18135 16888 1 18 . 1 1 120 120 ARG N N 120 121.436 121.436 120.140 1.296 18135 16889 1 18 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.123 -0.096 18135 16890 1 18 . 1 1 120 120 ARG C C 120 179.848 179.848 178.739 1.109 18135 16891 1 18 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.040 2.227 18135 16892 1 18 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.420 0.275 18135 16893 1 18 . 1 1 120 120 ARG H H 120 8.629 8.629 8.604 0.025 18135 16894 1 18 . 1 1 121 121 LYS N N 121 119.589 119.589 119.802 -0.213 18135 16895 1 18 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.005 0.069 18135 16896 1 18 . 1 1 121 121 LYS C C 121 178.331 178.331 179.096 -0.765 18135 16897 1 18 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.825 0.615 18135 16898 1 18 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.361 -0.254 18135 16899 1 18 . 1 1 121 121 LYS H H 121 9.015 9.015 8.166 0.849 18135 16900 1 18 . 1 1 122 122 TYR N N 122 121.546 121.546 120.341 1.205 18135 16901 1 18 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.132 0.200 18135 16902 1 18 . 1 1 122 122 TYR C C 122 176.527 176.527 177.862 -1.335 18135 16903 1 18 . 1 1 122 122 TYR CA C 122 60.404 60.404 62.049 -1.645 18135 16904 1 18 . 1 1 122 122 TYR CB C 122 37.725 37.725 38.478 -0.753 18135 16905 1 18 . 1 1 122 122 TYR H H 122 7.473 7.473 7.919 -0.446 18135 16906 1 18 . 1 1 123 123 PHE N N 123 116.026 116.026 119.195 -3.169 18135 16907 1 18 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.972 -0.232 18135 16908 1 18 . 1 1 123 123 PHE C C 123 179.005 179.005 177.643 1.362 18135 16909 1 18 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.679 2.849 18135 16910 1 18 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.834 0.497 18135 16911 1 18 . 1 1 123 123 PHE H H 123 7.932 7.932 8.496 -0.564 18135 16912 1 18 . 1 1 124 124 GLN N N 124 123.043 123.043 118.727 4.316 18135 16913 1 18 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.434 0.745 18135 16914 1 18 . 1 1 124 124 GLN C C 124 178.772 178.772 178.410 0.362 18135 16915 1 18 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.208 0.109 18135 16916 1 18 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.236 -0.605 18135 16917 1 18 . 1 1 124 124 GLN H H 124 8.470 8.470 8.666 -0.196 18135 16918 1 18 . 1 1 125 125 ARG N N 125 120.342 120.342 119.692 0.650 18135 16919 1 18 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.117 -0.039 18135 16920 1 18 . 1 1 125 125 ARG C C 125 180.340 180.340 179.176 1.164 18135 16921 1 18 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.626 2.671 18135 16922 1 18 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.782 0.543 18135 16923 1 18 . 1 1 125 125 ARG H H 125 8.137 8.137 8.048 0.089 18135 16924 1 18 . 1 1 126 126 ILE N N 126 121.876 121.876 120.272 1.604 18135 16925 1 18 . 1 1 126 126 ILE HA H 126 3.351 3.351 2.993 0.358 18135 16926 1 18 . 1 1 126 126 ILE C C 126 176.857 176.857 177.520 -0.663 18135 16927 1 18 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.808 1.024 18135 16928 1 18 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.623 0.661 18135 16929 1 18 . 1 1 126 126 ILE H H 126 7.526 7.526 8.168 -0.642 18135 16930 1 18 . 1 1 127 127 THR N N 127 115.613 115.613 115.111 0.502 18135 16931 1 18 . 1 1 127 127 THR HA H 127 3.633 3.633 3.755 -0.122 18135 16932 1 18 . 1 1 127 127 THR C C 127 176.645 176.645 176.980 -0.335 18135 16933 1 18 . 1 1 127 127 THR CA C 127 67.294 67.294 66.529 0.765 18135 16934 1 18 . 1 1 127 127 THR CB C 127 68.871 68.871 68.804 0.067 18135 16935 1 18 . 1 1 127 127 THR H H 127 8.288 8.288 7.961 0.327 18135 16936 1 18 . 1 1 128 128 LEU N N 128 122.627 122.627 122.185 0.442 18135 16937 1 18 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.879 0.077 18135 16938 1 18 . 1 1 128 128 LEU C C 128 178.331 178.331 177.561 0.770 18135 16939 1 18 . 1 1 128 128 LEU CA C 128 58.088 58.088 58.074 0.014 18135 16940 1 18 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.428 0.145 18135 16941 1 18 . 1 1 128 128 LEU H H 128 8.263 8.263 8.217 0.046 18135 16942 1 18 . 1 1 129 129 TYR N N 129 120.955 120.955 119.991 0.964 18135 16943 1 18 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.003 -0.113 18135 16944 1 18 . 1 1 129 129 TYR C C 129 176.040 176.040 177.251 -1.211 18135 16945 1 18 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.766 -0.273 18135 16946 1 18 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.319 0.606 18135 16947 1 18 . 1 1 129 129 TYR H H 129 7.518 7.518 8.165 -0.647 18135 16948 1 18 . 1 1 130 130 LEU N N 130 119.155 119.155 116.382 2.773 18135 16949 1 18 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.307 -0.462 18135 16950 1 18 . 1 1 130 130 LEU C C 130 177.948 177.948 178.288 -0.340 18135 16951 1 18 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.823 0.290 18135 16952 1 18 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.479 1.107 18135 16953 1 18 . 1 1 130 130 LEU H H 130 7.717 7.717 7.917 -0.200 18135 16954 1 18 . 1 1 131 131 LYS N N 131 116.832 116.832 119.766 -2.934 18135 16955 1 18 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.784 -0.376 18135 16956 1 18 . 1 1 131 131 LYS C C 131 181.265 181.265 179.723 1.542 18135 16957 1 18 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.572 0.159 18135 16958 1 18 . 1 1 131 131 LYS CB C 131 32.672 32.672 31.983 0.689 18135 16959 1 18 . 1 1 131 131 LYS H H 131 7.493 7.493 7.884 -0.391 18135 16960 1 18 . 1 1 132 132 GLU N N 132 121.918 121.918 119.512 2.406 18135 16961 1 18 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.090 -0.246 18135 16962 1 18 . 1 1 132 132 GLU C C 132 178.377 178.377 177.979 0.398 18135 16963 1 18 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.619 0.268 18135 16964 1 18 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.448 -0.780 18135 16965 1 18 . 1 1 132 132 GLU H H 132 8.430 8.430 7.901 0.529 18135 16966 1 18 . 1 1 133 133 LYS N N 133 116.079 116.079 116.478 -0.399 18135 16967 1 18 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.262 -0.296 18135 16968 1 18 . 1 1 133 133 LYS C C 133 175.282 175.282 175.604 -0.322 18135 16969 1 18 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.571 -0.273 18135 16970 1 18 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.794 0.204 18135 16971 1 18 . 1 1 133 133 LYS H H 133 7.390 7.390 7.296 0.094 18135 16972 1 18 . 1 1 134 134 LYS N N 134 117.759 117.759 115.920 1.839 18135 16973 1 18 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.046 -0.464 18135 16974 1 18 . 1 1 134 134 LYS C C 134 176.271 176.271 175.982 0.289 18135 16975 1 18 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.846 0.462 18135 16976 1 18 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.091 -0.289 18135 16977 1 18 . 1 1 134 134 LYS H H 134 7.716 7.716 7.513 0.203 18135 16978 1 18 . 1 1 135 135 TYR N N 135 110.598 110.598 113.196 -2.598 18135 16979 1 18 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.901 -1.024 18135 16980 1 18 . 1 1 135 135 TYR C C 135 174.148 174.148 175.432 -1.284 18135 16981 1 18 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.183 0.532 18135 16982 1 18 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.179 -0.473 18135 16983 1 18 . 1 1 135 135 TYR H H 135 8.428 8.428 8.873 -0.445 18135 16984 1 18 . 1 1 136 136 SER N N 136 113.712 113.712 115.422 -1.710 18135 16985 1 18 . 1 1 136 136 SER HA H 136 4.553 4.553 4.365 0.188 18135 16986 1 18 . 1 1 136 136 SER CA C 136 57.108 57.108 59.179 -2.071 18135 16987 1 18 . 1 1 136 136 SER CB C 136 62.500 62.500 64.070 -1.570 18135 16988 1 18 . 1 1 136 136 SER H H 136 6.744 6.744 7.365 -0.621 18135 16989 1 18 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.391 -0.226 18135 16990 1 18 . 1 1 137 137 PRO C C 137 180.675 180.675 177.293 3.382 18135 16991 1 18 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.693 0.964 18135 16992 1 18 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.846 0.137 18135 16993 1 18 . 1 1 138 138 CYS N N 138 113.914 113.914 115.477 -1.563 18135 16994 1 18 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.658 0.012 18135 16995 1 18 . 1 1 138 138 CYS C C 138 176.015 176.015 176.450 -0.435 18135 16996 1 18 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.551 -3.456 18135 16997 1 18 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.236 10.543 18135 16998 1 18 . 1 1 138 138 CYS H H 138 8.580 8.580 8.476 0.104 18135 16999 1 18 . 1 1 139 139 ALA N N 139 125.290 125.290 124.047 1.243 18135 17000 1 18 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.187 0.262 18135 17001 1 18 . 1 1 139 139 ALA C C 139 180.149 180.149 179.279 0.870 18135 17002 1 18 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.940 -0.161 18135 17003 1 18 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.188 0.730 18135 17004 1 18 . 1 1 139 139 ALA H H 139 8.087 8.087 8.050 0.036 18135 17005 1 18 . 1 1 140 140 TRP N N 140 116.599 116.599 118.521 -1.922 18135 17006 1 18 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.282 0.320 18135 17007 1 18 . 1 1 140 140 TRP C C 140 179.137 179.137 178.569 0.568 18135 17008 1 18 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.401 -0.867 18135 17009 1 18 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.277 -0.020 18135 17010 1 18 . 1 1 140 140 TRP H H 140 8.505 8.505 7.779 0.726 18135 17011 1 18 . 1 1 141 141 GLU N N 141 121.578 121.578 119.897 1.681 18135 17012 1 18 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.296 0.927 18135 17013 1 18 . 1 1 141 141 GLU C C 141 177.886 177.886 179.017 -1.131 18135 17014 1 18 . 1 1 141 141 GLU CA C 141 57.907 57.907 60.057 -2.150 18135 17015 1 18 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.495 -0.778 18135 17016 1 18 . 1 1 141 141 GLU H H 141 8.182 8.182 8.033 0.149 18135 17017 1 18 . 1 1 142 142 VAL N N 142 121.202 121.202 119.673 1.529 18135 17018 1 18 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.695 -0.065 18135 17019 1 18 . 1 1 142 142 VAL C C 142 180.246 180.246 178.499 1.747 18135 17020 1 18 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.737 0.246 18135 17021 1 18 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.124 0.698 18135 17022 1 18 . 1 1 142 142 VAL H H 142 8.623 8.623 8.064 0.559 18135 17023 1 18 . 1 1 143 143 VAL N N 143 120.119 120.119 120.314 -0.195 18135 17024 1 18 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.717 -0.420 18135 17025 1 18 . 1 1 143 143 VAL C C 143 176.407 176.407 178.333 -1.926 18135 17026 1 18 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.830 1.148 18135 17027 1 18 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.099 0.556 18135 17028 1 18 . 1 1 143 143 VAL H H 143 8.323 8.323 8.505 -0.182 18135 17029 1 18 . 1 1 144 144 ARG N N 144 124.102 124.102 120.123 3.979 18135 17030 1 18 . 1 1 144 144 ARG HA H 144 3.697 3.697 3.997 -0.300 18135 17031 1 18 . 1 1 144 144 ARG C C 144 178.127 178.127 177.962 0.165 18135 17032 1 18 . 1 1 144 144 ARG CA C 144 61.001 61.001 58.583 2.418 18135 17033 1 18 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.532 0.404 18135 17034 1 18 . 1 1 144 144 ARG H H 144 9.619 9.619 8.640 0.979 18135 17035 1 18 . 1 1 145 145 ALA N N 145 119.431 119.431 121.443 -2.012 18135 17036 1 18 . 1 1 145 145 ALA HA H 145 3.851 3.851 3.984 -0.133 18135 17037 1 18 . 1 1 145 145 ALA C C 145 180.763 180.763 179.985 0.778 18135 17038 1 18 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.372 0.003 18135 17039 1 18 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.000 0.185 18135 17040 1 18 . 1 1 145 145 ALA H H 145 8.867 8.867 8.369 0.498 18135 17041 1 18 . 1 1 146 146 GLU N N 146 121.815 121.815 118.740 3.075 18135 17042 1 18 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.169 0.042 18135 17043 1 18 . 1 1 146 146 GLU C C 146 177.296 177.296 179.276 -1.980 18135 17044 1 18 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.890 -1.511 18135 17045 1 18 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.741 -1.607 18135 17046 1 18 . 1 1 146 146 GLU H H 146 8.136 8.136 7.913 0.223 18135 17047 1 18 . 1 1 147 147 ILE N N 147 119.542 119.542 121.151 -1.609 18135 17048 1 18 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.966 0.004 18135 17049 1 18 . 1 1 147 147 ILE C C 147 178.283 178.283 178.579 -0.296 18135 17050 1 18 . 1 1 147 147 ILE CA C 147 61.253 61.253 65.229 -3.976 18135 17051 1 18 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.654 -2.315 18135 17052 1 18 . 1 1 147 147 ILE H H 147 8.736 8.736 8.243 0.493 18135 17053 1 18 . 1 1 148 148 MET N N 148 119.501 119.501 118.357 1.144 18135 17054 1 18 . 1 1 148 148 MET HA H 148 3.801 3.801 4.225 -0.424 18135 17055 1 18 . 1 1 148 148 MET C C 148 178.210 178.210 178.633 -0.423 18135 17056 1 18 . 1 1 148 148 MET CA C 148 60.184 60.184 59.878 0.306 18135 17057 1 18 . 1 1 148 148 MET CB C 148 32.914 32.914 31.954 0.960 18135 17058 1 18 . 1 1 148 148 MET H H 148 8.440 8.440 8.285 0.155 18135 17059 1 18 . 1 1 149 149 ARG N N 149 119.734 119.734 120.389 -0.655 18135 17060 1 18 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.069 -0.154 18135 17061 1 18 . 1 1 149 149 ARG C C 149 178.978 178.978 178.866 0.112 18135 17062 1 18 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.554 0.309 18135 17063 1 18 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.782 0.498 18135 17064 1 18 . 1 1 149 149 ARG H H 149 7.648 7.648 8.283 -0.635 18135 17065 1 18 . 1 1 150 150 SER N N 150 118.109 118.109 115.530 2.579 18135 17066 1 18 . 1 1 150 150 SER HA H 150 3.339 3.339 4.432 -1.093 18135 17067 1 18 . 1 1 150 150 SER C C 150 177.292 177.292 176.303 0.989 18135 17068 1 18 . 1 1 150 150 SER CA C 150 61.316 61.316 61.978 -0.662 18135 17069 1 18 . 1 1 150 150 SER CB C 150 60.288 60.288 62.622 -2.334 18135 17070 1 18 . 1 1 150 150 SER H H 150 9.194 9.194 8.728 0.466 18135 17071 1 18 . 1 1 151 151 PHE N N 151 125.265 125.265 123.073 2.192 18135 17072 1 18 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.234 -0.198 18135 17073 1 18 . 1 1 151 151 PHE C C 151 178.696 178.696 177.272 1.424 18135 17074 1 18 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.316 2.104 18135 17075 1 18 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.789 0.097 18135 17076 1 18 . 1 1 151 151 PHE H H 151 9.455 9.455 8.374 1.081 18135 17077 1 18 . 1 1 152 152 SER N N 152 115.963 115.963 116.066 -0.103 18135 17078 1 18 . 1 1 152 152 SER HA H 152 3.880 3.880 3.818 0.062 18135 17079 1 18 . 1 1 152 152 SER C C 152 175.858 175.858 176.865 -1.007 18135 17080 1 18 . 1 1 152 152 SER CA C 152 62.388 62.388 61.411 0.977 18135 17081 1 18 . 1 1 152 152 SER CB C 152 62.519 62.519 63.206 -0.687 18135 17082 1 18 . 1 1 152 152 SER H H 152 7.839 7.839 8.518 -0.679 18135 17083 1 18 . 1 1 153 153 LEU N N 153 121.365 121.365 122.898 -1.533 18135 17084 1 18 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.195 -0.114 18135 17085 1 18 . 1 1 153 153 LEU C C 153 179.515 179.515 177.845 1.670 18135 17086 1 18 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.835 0.048 18135 17087 1 18 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.661 0.681 18135 17088 1 18 . 1 1 153 153 LEU H H 153 7.775 7.775 7.990 -0.215 18135 17089 1 18 . 1 1 154 154 SER N N 154 113.950 113.950 112.573 1.377 18135 17090 1 18 . 1 1 154 154 SER HA H 154 3.781 3.781 4.421 -0.640 18135 17091 1 18 . 1 1 154 154 SER C C 154 174.312 174.312 176.576 -2.264 18135 17092 1 18 . 1 1 154 154 SER CA C 154 61.366 61.366 61.473 -0.107 18135 17093 1 18 . 1 1 154 154 SER CB C 154 63.242 63.242 64.046 -0.804 18135 17094 1 18 . 1 1 154 154 SER H H 154 7.874 7.874 8.544 -0.670 18135 17095 1 18 . 1 1 155 155 THR N N 155 109.346 109.346 111.456 -2.110 18135 17096 1 18 . 1 1 155 155 THR HA H 155 4.060 4.060 4.281 -0.221 18135 17097 1 18 . 1 1 155 155 THR C C 155 174.798 174.798 176.440 -1.642 18135 17098 1 18 . 1 1 155 155 THR CA C 155 62.275 62.275 64.600 -2.325 18135 17099 1 18 . 1 1 155 155 THR CB C 155 69.342 69.342 69.132 0.210 18135 17100 1 18 . 1 1 155 155 THR H H 155 7.176 7.176 7.890 -0.714 18135 17101 1 18 . 1 1 156 156 ASN N N 156 119.785 119.785 120.199 -0.414 18135 17102 1 18 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.724 -0.197 18135 17103 1 18 . 1 1 156 156 ASN C C 156 175.528 175.528 175.050 0.478 18135 17104 1 18 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.969 0.968 18135 17105 1 18 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.514 0.825 18135 17106 1 18 . 1 1 156 156 ASN H H 156 7.749 7.749 8.004 -0.255 18135 17107 1 18 . 1 1 157 157 LEU N N 157 120.552 120.552 120.041 0.511 18135 17108 1 18 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.461 -0.206 18135 17109 1 18 . 1 1 157 157 LEU C C 157 174.702 174.702 177.946 -3.244 18135 17110 1 18 . 1 1 157 157 LEU CA C 157 55.674 55.674 55.352 0.322 18135 17111 1 18 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.325 0.026 18135 17112 1 18 . 1 1 157 157 LEU H H 157 8.097 8.097 7.969 0.128 18135 17113 1 18 . 1 1 158 158 GLN N N 158 119.860 119.860 117.606 2.254 18135 17114 1 18 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.251 -0.071 18135 17115 1 18 . 1 1 158 158 GLN C C 158 176.434 176.434 176.133 0.301 18135 17116 1 18 . 1 1 158 158 GLN CA C 158 56.897 56.897 56.400 0.497 18135 17117 1 18 . 1 1 158 158 GLN CB C 158 29.010 29.010 30.260 -1.250 18135 17118 1 18 . 1 1 158 158 GLN H H 158 8.230 8.230 8.034 0.196 18135 17119 1 18 . 1 1 159 159 GLU N N 159 120.461 120.461 117.050 3.411 18135 17120 1 18 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.954 0.265 18135 17121 1 18 . 1 1 159 159 GLU C C 159 175.251 175.251 175.557 -0.306 18135 17122 1 18 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.539 -0.844 18135 17123 1 18 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.482 0.499 18135 17124 1 18 . 1 1 159 159 GLU H H 159 8.300 8.300 8.609 -0.309 18135 17125 1 18 . 1 1 160 160 SER N N 160 115.719 115.719 112.877 2.842 18135 17126 1 18 . 1 1 160 160 SER HA H 160 4.372 4.372 4.552 -0.180 18135 17127 1 18 . 1 1 160 160 SER C C 160 174.188 174.188 173.936 0.252 18135 17128 1 18 . 1 1 160 160 SER CA C 160 58.481 58.481 58.369 0.112 18135 17129 1 18 . 1 1 160 160 SER CB C 160 63.731 63.731 63.694 0.037 18135 17130 1 18 . 1 1 160 160 SER H H 160 8.113 8.113 8.408 -0.295 18135 17131 1 18 . 1 1 161 161 LEU N N 161 123.794 123.794 121.096 2.698 18135 17132 1 18 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.453 -0.173 18135 17133 1 18 . 1 1 161 161 LEU C C 161 177.293 177.293 177.236 0.057 18135 17134 1 18 . 1 1 161 161 LEU CA C 161 55.190 55.190 54.490 0.700 18135 17135 1 18 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.781 -0.497 18135 17136 1 18 . 1 1 161 161 LEU H H 161 8.032 8.032 7.613 0.419 18135 17137 1 18 . 1 1 162 162 ARG N N 162 120.715 120.715 120.802 -0.087 18135 17138 1 18 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.183 -0.014 18135 17139 1 18 . 1 1 162 162 ARG C C 162 176.288 176.288 175.715 0.573 18135 17140 1 18 . 1 1 162 162 ARG CA C 162 57.046 57.046 57.120 -0.074 18135 17141 1 18 . 1 1 162 162 ARG CB C 162 30.935 30.935 30.159 0.776 18135 17142 1 18 . 1 1 162 162 ARG H H 162 8.094 8.094 8.568 -0.474 18135 17143 1 18 . 1 1 163 163 SER N N 163 116.670 116.670 116.523 0.147 18135 17144 1 18 . 1 1 163 163 SER HA H 163 4.372 4.372 4.524 -0.152 18135 17145 1 18 . 1 1 163 163 SER C C 163 174.184 174.184 174.471 -0.287 18135 17146 1 18 . 1 1 163 163 SER CA C 163 58.481 58.481 58.572 -0.090 18135 17147 1 18 . 1 1 163 163 SER CB C 163 63.745 63.745 64.066 -0.321 18135 17148 1 18 . 1 1 163 163 SER H H 163 8.191 8.191 8.310 -0.119 18135 17149 1 18 . 1 1 164 164 LYS N N 164 123.100 123.100 122.329 0.771 18135 17150 1 18 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.534 -0.257 18135 17151 1 18 . 1 1 164 164 LYS C C 164 175.617 175.617 176.155 -0.538 18135 17152 1 18 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.577 -0.264 18135 17153 1 18 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.815 0.150 18135 17154 1 18 . 1 1 164 164 LYS H H 164 8.251 8.251 8.029 0.222 18135 17155 1 19 . 1 1 2 2 ASP N N 2 125.691 125.691 119.836 5.855 18135 17156 1 19 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.652 0.058 18135 17157 1 19 . 1 1 2 2 ASP C C 2 174.758 174.758 175.928 -1.170 18135 17158 1 19 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.768 -1.925 18135 17159 1 19 . 1 1 2 2 ASP CB C 2 39.321 39.321 41.367 -2.046 18135 17160 1 19 . 1 1 2 2 ASP H H 2 8.773 8.773 8.384 0.389 18135 17161 1 19 . 1 1 3 3 LEU N N 3 123.957 123.957 118.851 5.106 18135 17162 1 19 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.370 0.031 18135 17163 1 19 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.926 0.727 18135 17164 1 19 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.421 0.134 18135 17165 1 19 . 1 1 3 3 LEU H H 3 8.164 8.164 7.435 0.729 18135 17166 1 19 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.639 -0.325 18135 17167 1 19 . 1 1 4 4 PRO C C 4 176.213 176.213 176.882 -0.669 18135 17168 1 19 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.092 0.816 18135 17169 1 19 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.889 1.005 18135 17170 1 19 . 1 1 5 5 GLN N N 5 121.621 121.621 123.156 -1.535 18135 17171 1 19 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.116 0.110 18135 17172 1 19 . 1 1 5 5 GLN C C 5 176.995 176.995 176.528 0.467 18135 17173 1 19 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.266 -1.556 18135 17174 1 19 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.122 -0.171 18135 17175 1 19 . 1 1 5 5 GLN H H 5 8.767 8.767 8.568 0.199 18135 17176 1 19 . 1 1 6 6 THR N N 6 111.419 111.419 109.638 1.781 18135 17177 1 19 . 1 1 6 6 THR HA H 6 4.135 4.135 4.323 -0.188 18135 17178 1 19 . 1 1 6 6 THR C C 6 174.695 174.695 175.071 -0.376 18135 17179 1 19 . 1 1 6 6 THR CA C 6 62.661 62.661 62.723 -0.062 18135 17180 1 19 . 1 1 6 6 THR CB C 6 69.365 69.365 68.779 0.586 18135 17181 1 19 . 1 1 6 6 THR H H 6 7.865 7.865 8.286 -0.421 18135 17182 1 19 . 1 1 7 7 HIS N N 7 119.137 119.137 118.833 0.304 18135 17183 1 19 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.695 -0.110 18135 17184 1 19 . 1 1 7 7 HIS C C 7 174.980 174.980 175.780 -0.800 18135 17185 1 19 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.702 -2.697 18135 17186 1 19 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.779 -1.615 18135 17187 1 19 . 1 1 7 7 HIS H H 7 8.567 8.567 8.503 0.064 18135 17188 1 19 . 1 1 8 8 SER N N 8 115.796 115.796 114.149 1.647 18135 17189 1 19 . 1 1 8 8 SER HA H 8 4.363 4.363 4.416 -0.053 18135 17190 1 19 . 1 1 8 8 SER C C 8 175.312 175.312 175.456 -0.144 18135 17191 1 19 . 1 1 8 8 SER CA C 8 58.969 58.969 60.559 -1.590 18135 17192 1 19 . 1 1 8 8 SER CB C 8 63.439 63.439 63.758 -0.319 18135 17193 1 19 . 1 1 8 8 SER H H 8 8.180 8.180 7.888 0.292 18135 17194 1 19 . 1 1 9 9 LEU N N 9 123.844 123.844 117.444 6.400 18135 17195 1 19 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.604 -0.449 18135 17196 1 19 . 1 1 9 9 LEU C C 9 178.568 178.568 178.642 -0.074 18135 17197 1 19 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.463 0.503 18135 17198 1 19 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.368 -0.572 18135 17199 1 19 . 1 1 9 9 LEU H H 9 8.404 8.404 7.597 0.807 18135 17200 1 19 . 1 1 10 10 GLY N N 10 107.582 107.582 107.747 -0.165 18135 17201 1 19 . 1 1 10 10 GLY C C 10 174.586 174.586 175.099 -0.513 18135 17202 1 19 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.186 -0.281 18135 17203 1 19 . 1 1 10 10 GLY H H 10 8.438 8.438 8.632 -0.194 18135 17204 1 19 . 1 1 11 11 SER N N 11 118.806 118.806 117.723 1.083 18135 17205 1 19 . 1 1 11 11 SER HA H 11 4.156 4.156 4.162 -0.006 18135 17206 1 19 . 1 1 11 11 SER C C 11 175.749 175.749 176.570 -0.821 18135 17207 1 19 . 1 1 11 11 SER CA C 11 61.299 61.299 61.965 -0.666 18135 17208 1 19 . 1 1 11 11 SER CB C 11 62.653 62.653 62.709 -0.056 18135 17209 1 19 . 1 1 11 11 SER H H 11 8.249 8.249 8.405 -0.156 18135 17210 1 19 . 1 1 12 12 ARG N N 12 121.986 121.986 122.547 -0.561 18135 17211 1 19 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.143 -0.189 18135 17212 1 19 . 1 1 12 12 ARG C C 12 178.283 178.283 178.250 0.033 18135 17213 1 19 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.563 1.267 18135 17214 1 19 . 1 1 12 12 ARG CB C 12 29.584 29.584 29.894 -0.310 18135 17215 1 19 . 1 1 12 12 ARG H H 12 8.027 8.027 7.627 0.400 18135 17216 1 19 . 1 1 13 13 ARG N N 13 119.432 119.432 118.663 0.769 18135 17217 1 19 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.048 -0.209 18135 17218 1 19 . 1 1 13 13 ARG C C 13 178.480 178.480 178.586 -0.106 18135 17219 1 19 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.457 1.034 18135 17220 1 19 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.592 0.490 18135 17221 1 19 . 1 1 13 13 ARG H H 13 8.437 8.437 7.701 0.736 18135 17222 1 19 . 1 1 14 14 THR N N 14 116.879 116.879 116.529 0.350 18135 17223 1 19 . 1 1 14 14 THR HA H 14 3.532 3.532 4.184 -0.652 18135 17224 1 19 . 1 1 14 14 THR C C 14 175.584 175.584 177.081 -1.497 18135 17225 1 19 . 1 1 14 14 THR CA C 14 68.036 68.036 66.541 1.495 18135 17226 1 19 . 1 1 14 14 THR CB C 14 67.969 67.969 68.504 -0.535 18135 17227 1 19 . 1 1 14 14 THR H H 14 7.957 7.957 8.367 -0.410 18135 17228 1 19 . 1 1 15 15 LEU N N 15 120.252 120.252 122.432 -2.180 18135 17229 1 19 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.905 0.041 18135 17230 1 19 . 1 1 15 15 LEU C C 15 178.652 178.652 179.220 -0.568 18135 17231 1 19 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.498 -0.410 18135 17232 1 19 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.734 -0.180 18135 17233 1 19 . 1 1 15 15 LEU H H 15 7.550 7.550 8.010 -0.460 18135 17234 1 19 . 1 1 16 16 MET N N 16 118.788 118.788 117.383 1.405 18135 17235 1 19 . 1 1 16 16 MET HA H 16 4.023 4.023 3.924 0.099 18135 17236 1 19 . 1 1 16 16 MET C C 16 178.718 178.718 178.657 0.061 18135 17237 1 19 . 1 1 16 16 MET CA C 16 58.513 58.513 59.430 -0.917 18135 17238 1 19 . 1 1 16 16 MET CB C 16 32.150 32.150 32.319 -0.169 18135 17239 1 19 . 1 1 16 16 MET H H 16 7.985 7.985 8.314 -0.329 18135 17240 1 19 . 1 1 17 17 LEU N N 17 120.644 120.644 119.486 1.158 18135 17241 1 19 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.915 0.057 18135 17242 1 19 . 1 1 17 17 LEU C C 17 178.238 178.238 179.254 -1.016 18135 17243 1 19 . 1 1 17 17 LEU CA C 17 57.727 57.727 57.661 0.066 18135 17244 1 19 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.591 0.544 18135 17245 1 19 . 1 1 17 17 LEU H H 17 7.829 7.829 8.478 -0.649 18135 17246 1 19 . 1 1 18 18 LEU N N 18 118.280 118.280 117.657 0.623 18135 17247 1 19 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.824 -0.318 18135 17248 1 19 . 1 1 18 18 LEU C C 18 175.739 175.739 178.193 -2.454 18135 17249 1 19 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.332 0.324 18135 17250 1 19 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.532 0.710 18135 17251 1 19 . 1 1 18 18 LEU H H 18 7.499 7.499 8.421 -0.922 18135 17252 1 19 . 1 1 19 19 ALA N N 19 121.961 121.961 120.330 1.631 18135 17253 1 19 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.154 -0.317 18135 17254 1 19 . 1 1 19 19 ALA C C 19 180.736 180.736 178.660 2.076 18135 17255 1 19 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.038 1.028 18135 17256 1 19 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.256 -1.179 18135 17257 1 19 . 1 1 19 19 ALA H H 19 7.950 7.950 7.496 0.454 18135 17258 1 19 . 1 1 20 20 GLN N N 20 118.605 118.605 116.375 2.230 18135 17259 1 19 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.187 -0.252 18135 17260 1 19 . 1 1 20 20 GLN C C 20 176.945 176.945 177.271 -0.326 18135 17261 1 19 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.436 0.579 18135 17262 1 19 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.198 -0.724 18135 17263 1 19 . 1 1 20 20 GLN H H 20 7.958 7.958 8.107 -0.149 18135 17264 1 19 . 1 1 21 21 MET N N 21 116.693 116.693 118.052 -1.359 18135 17265 1 19 . 1 1 21 21 MET HA H 21 3.861 3.861 4.494 -0.633 18135 17266 1 19 . 1 1 21 21 MET C C 21 174.671 174.671 175.108 -0.437 18135 17267 1 19 . 1 1 21 21 MET CA C 21 57.111 57.111 57.400 -0.289 18135 17268 1 19 . 1 1 21 21 MET CB C 21 34.073 34.073 33.245 0.828 18135 17269 1 19 . 1 1 21 21 MET H H 21 7.420 7.420 7.900 -0.480 18135 17270 1 19 . 1 1 22 22 ARG N N 22 115.451 115.451 120.032 -4.581 18135 17271 1 19 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.858 -0.005 18135 17272 1 19 . 1 1 22 22 ARG C C 22 175.950 175.950 175.166 0.784 18135 17273 1 19 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.014 3.438 18135 17274 1 19 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.541 0.973 18135 17275 1 19 . 1 1 22 22 ARG H H 22 6.484 6.484 7.214 -0.730 18135 17276 1 19 . 1 1 23 23 LYS N N 23 128.593 128.593 123.458 5.135 18135 17277 1 19 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.577 -0.092 18135 17278 1 19 . 1 1 23 23 LYS C C 23 176.643 176.643 174.790 1.853 18135 17279 1 19 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.674 1.613 18135 17280 1 19 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.369 4.892 18135 17281 1 19 . 1 1 23 23 LYS H H 23 10.212 10.212 8.742 1.470 18135 17282 1 19 . 1 1 24 24 ILE N N 24 118.605 118.605 123.279 -4.674 18135 17283 1 19 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.373 0.111 18135 17284 1 19 . 1 1 24 24 ILE C C 24 173.878 173.878 174.093 -0.215 18135 17285 1 19 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.413 -0.816 18135 17286 1 19 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.179 0.277 18135 17287 1 19 . 1 1 24 24 ILE H H 24 8.465 8.465 8.417 0.048 18135 17288 1 19 . 1 1 25 25 SER N N 25 113.658 113.658 117.860 -4.202 18135 17289 1 19 . 1 1 25 25 SER HA H 25 4.481 4.481 5.029 -0.548 18135 17290 1 19 . 1 1 25 25 SER C C 25 176.359 176.359 175.821 0.538 18135 17291 1 19 . 1 1 25 25 SER CA C 25 56.975 56.975 56.690 0.285 18135 17292 1 19 . 1 1 25 25 SER CB C 25 64.759 64.759 63.931 0.828 18135 17293 1 19 . 1 1 25 25 SER H H 25 8.104 8.104 8.546 -0.442 18135 17294 1 19 . 1 1 26 26 LEU N N 26 127.566 127.566 125.879 1.687 18135 17295 1 19 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.498 -0.621 18135 17296 1 19 . 1 1 26 26 LEU C C 26 178.946 178.946 177.345 1.601 18135 17297 1 19 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.336 0.343 18135 17298 1 19 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.087 -0.368 18135 17299 1 19 . 1 1 26 26 LEU H H 26 8.802 8.802 9.000 -0.198 18135 17300 1 19 . 1 1 27 27 PHE N N 27 117.143 117.143 116.827 0.316 18135 17301 1 19 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.646 -0.408 18135 17302 1 19 . 1 1 27 27 PHE C C 27 177.067 177.067 176.581 0.486 18135 17303 1 19 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.985 1.105 18135 17304 1 19 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.767 -0.504 18135 17305 1 19 . 1 1 27 27 PHE H H 27 7.986 7.986 8.038 -0.052 18135 17306 1 19 . 1 1 28 28 SER N N 28 115.200 115.200 116.286 -1.086 18135 17307 1 19 . 1 1 28 28 SER HA H 28 4.505 4.505 4.436 0.069 18135 17308 1 19 . 1 1 28 28 SER C C 28 174.533 174.533 174.851 -0.318 18135 17309 1 19 . 1 1 28 28 SER CA C 28 59.447 59.447 60.781 -1.334 18135 17310 1 19 . 1 1 28 28 SER CB C 28 63.790 63.790 63.683 0.107 18135 17311 1 19 . 1 1 28 28 SER H H 28 7.929 7.929 8.203 -0.274 18135 17312 1 19 . 1 1 29 29 CYS N N 29 119.870 119.870 120.127 -0.257 18135 17313 1 19 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.675 0.407 18135 17314 1 19 . 1 1 29 29 CYS C C 29 176.475 176.475 174.440 2.035 18135 17315 1 19 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.477 -5.047 18135 17316 1 19 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.471 9.771 18135 17317 1 19 . 1 1 29 29 CYS H H 29 7.865 7.865 8.376 -0.511 18135 17318 1 19 . 1 1 30 30 LEU N N 30 122.259 122.259 123.737 -1.478 18135 17319 1 19 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.394 -0.433 18135 17320 1 19 . 1 1 30 30 LEU C C 30 179.774 179.774 178.103 1.671 18135 17321 1 19 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.092 2.211 18135 17322 1 19 . 1 1 30 30 LEU CB C 30 41.576 41.576 41.809 -0.233 18135 17323 1 19 . 1 1 30 30 LEU H H 30 7.812 7.812 8.577 -0.765 18135 17324 1 19 . 1 1 31 31 LYS N N 31 117.731 117.731 119.131 -1.400 18135 17325 1 19 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.370 0.320 18135 17326 1 19 . 1 1 31 31 LYS C C 31 176.692 176.692 176.462 0.230 18135 17327 1 19 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.442 -3.365 18135 17328 1 19 . 1 1 31 31 LYS CB C 31 31.587 31.587 32.393 -0.806 18135 17329 1 19 . 1 1 31 31 LYS H H 31 8.597 8.597 7.802 0.795 18135 17330 1 19 . 1 1 32 32 ASP N N 32 117.841 117.841 116.720 1.121 18135 17331 1 19 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.572 0.122 18135 17332 1 19 . 1 1 32 32 ASP C C 32 175.505 175.505 176.517 -1.012 18135 17333 1 19 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.329 -0.241 18135 17334 1 19 . 1 1 32 32 ASP CB C 32 41.808 41.808 41.522 0.286 18135 17335 1 19 . 1 1 32 32 ASP H H 32 7.808 7.808 7.850 -0.042 18135 17336 1 19 . 1 1 33 33 ARG N N 33 120.876 120.876 118.380 2.496 18135 17337 1 19 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.029 0.012 18135 17338 1 19 . 1 1 33 33 ARG C C 33 175.286 175.286 175.635 -0.349 18135 17339 1 19 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.500 -0.417 18135 17340 1 19 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.169 -0.156 18135 17341 1 19 . 1 1 33 33 ARG H H 33 7.378 7.378 7.789 -0.411 18135 17342 1 19 . 1 1 34 34 HIS N N 34 120.555 120.555 114.787 5.768 18135 17343 1 19 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.729 -0.517 18135 17344 1 19 . 1 1 34 34 HIS C C 34 170.494 170.494 172.987 -2.493 18135 17345 1 19 . 1 1 34 34 HIS CA C 34 54.607 54.607 54.389 0.218 18135 17346 1 19 . 1 1 34 34 HIS CB C 34 31.488 31.488 32.276 -0.788 18135 17347 1 19 . 1 1 34 34 HIS H H 34 7.974 7.974 7.756 0.218 18135 17348 1 19 . 1 1 35 35 ASP N N 35 125.061 125.061 121.767 3.294 18135 17349 1 19 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.264 0.374 18135 17350 1 19 . 1 1 35 35 ASP C C 35 175.943 175.943 176.644 -0.701 18135 17351 1 19 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.508 -2.139 18135 17352 1 19 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.165 -0.803 18135 17353 1 19 . 1 1 35 35 ASP H H 35 7.805 7.805 8.423 -0.618 18135 17354 1 19 . 1 1 36 36 PHE N N 36 122.860 122.860 120.452 2.408 18135 17355 1 19 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.275 0.050 18135 17356 1 19 . 1 1 36 36 PHE C C 36 176.643 176.643 177.391 -0.748 18135 17357 1 19 . 1 1 36 36 PHE CA C 36 59.639 59.639 59.156 0.483 18135 17358 1 19 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.038 1.653 18135 17359 1 19 . 1 1 36 36 PHE H H 36 8.973 8.973 7.457 1.516 18135 17360 1 19 . 1 1 37 37 GLY N N 37 111.856 111.856 109.128 2.728 18135 17361 1 19 . 1 1 37 37 GLY C C 37 175.185 175.185 173.498 1.687 18135 17362 1 19 . 1 1 37 37 GLY CA C 37 48.143 48.143 45.079 3.064 18135 17363 1 19 . 1 1 37 37 GLY H H 37 8.727 8.727 8.202 0.525 18135 17364 1 19 . 1 1 38 38 PHE N N 38 123.178 123.178 120.937 2.241 18135 17365 1 19 . 1 1 38 38 PHE HA H 38 3.914 3.914 5.010 -1.096 18135 17366 1 19 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.078 2.726 18135 17367 1 19 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.650 0.007 18135 17368 1 19 . 1 1 38 38 PHE H H 38 9.169 9.169 7.597 1.572 18135 17369 1 19 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.457 0.072 18135 17370 1 19 . 1 1 39 39 PRO C C 39 174.634 174.634 177.000 -2.366 18135 17371 1 19 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.742 -1.199 18135 17372 1 19 . 1 1 39 39 PRO CB C 39 28.704 28.704 31.093 -2.389 18135 17373 1 19 . 1 1 40 40 GLN N N 40 123.608 123.608 123.934 -0.326 18135 17374 1 19 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.308 -0.689 18135 17375 1 19 . 1 1 40 40 GLN C C 40 176.958 176.958 177.709 -0.751 18135 17376 1 19 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.456 -0.383 18135 17377 1 19 . 1 1 40 40 GLN CB C 40 28.817 28.817 28.346 0.471 18135 17378 1 19 . 1 1 40 40 GLN H H 40 7.966 7.966 8.297 -0.331 18135 17379 1 19 . 1 1 41 41 GLU N N 41 119.446 119.446 118.385 1.061 18135 17380 1 19 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.117 0.020 18135 17381 1 19 . 1 1 41 41 GLU C C 41 177.346 177.346 177.715 -0.369 18135 17382 1 19 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.812 -0.883 18135 17383 1 19 . 1 1 41 41 GLU CB C 41 27.833 27.833 28.888 -1.055 18135 17384 1 19 . 1 1 41 41 GLU H H 41 9.044 9.044 8.814 0.230 18135 17385 1 19 . 1 1 42 42 GLU N N 42 117.196 117.196 117.995 -0.799 18135 17386 1 19 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.273 -0.210 18135 17387 1 19 . 1 1 42 42 GLU C C 42 174.886 174.886 177.543 -2.657 18135 17388 1 19 . 1 1 42 42 GLU CA C 42 56.384 56.384 56.903 -0.519 18135 17389 1 19 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.803 -2.245 18135 17390 1 19 . 1 1 42 42 GLU H H 42 7.646 7.646 7.947 -0.301 18135 17391 1 19 . 1 1 43 43 PHE N N 43 115.527 115.527 120.670 -5.143 18135 17392 1 19 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.680 -0.194 18135 17393 1 19 . 1 1 43 43 PHE C C 43 175.615 175.615 175.706 -0.091 18135 17394 1 19 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.803 -1.255 18135 17395 1 19 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.367 -0.474 18135 17396 1 19 . 1 1 43 43 PHE H H 43 7.601 7.601 7.651 -0.050 18135 17397 1 19 . 1 1 44 44 GLY N N 44 107.243 107.243 109.222 -1.979 18135 17398 1 19 . 1 1 44 44 GLY C C 44 174.032 174.032 173.677 0.355 18135 17399 1 19 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.040 0.572 18135 17400 1 19 . 1 1 44 44 GLY H H 44 7.733 7.733 7.703 0.030 18135 17401 1 19 . 1 1 45 45 ASN N N 45 117.599 117.599 116.273 1.326 18135 17402 1 19 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.679 -0.128 18135 17403 1 19 . 1 1 45 45 ASN C C 45 175.894 175.894 174.445 1.449 18135 17404 1 19 . 1 1 45 45 ASN CA C 45 53.849 53.849 55.051 -1.202 18135 17405 1 19 . 1 1 45 45 ASN CB C 45 38.419 38.419 38.382 0.037 18135 17406 1 19 . 1 1 45 45 ASN H H 45 8.343 8.343 8.745 -0.402 18135 17407 1 19 . 1 1 46 46 GLN N N 46 118.916 118.916 114.499 4.417 18135 17408 1 19 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.363 -0.281 18135 17409 1 19 . 1 1 46 46 GLN C C 46 175.851 175.851 175.450 0.401 18135 17410 1 19 . 1 1 46 46 GLN CA C 46 56.646 56.646 54.443 2.203 18135 17411 1 19 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.677 0.767 18135 17412 1 19 . 1 1 46 46 GLN H H 46 8.652 8.652 8.104 0.548 18135 17413 1 19 . 1 1 47 47 PHE N N 47 119.511 119.511 115.413 4.098 18135 17414 1 19 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.764 -0.202 18135 17415 1 19 . 1 1 47 47 PHE C C 47 176.258 176.258 174.948 1.310 18135 17416 1 19 . 1 1 47 47 PHE CA C 47 57.920 57.920 57.548 0.372 18135 17417 1 19 . 1 1 47 47 PHE CB C 47 39.858 39.858 38.921 0.937 18135 17418 1 19 . 1 1 47 47 PHE H H 47 7.904 7.904 7.856 0.048 18135 17419 1 19 . 1 1 48 48 GLN N N 48 120.127 120.127 120.547 -0.420 18135 17420 1 19 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.192 0.183 18135 17421 1 19 . 1 1 48 48 GLN C C 48 181.265 181.265 175.535 5.730 18135 17422 1 19 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.513 1.063 18135 17423 1 19 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.480 -0.012 18135 17424 1 19 . 1 1 48 48 GLN H H 48 8.255 8.255 7.285 0.970 18135 17425 1 19 . 1 1 49 49 LYS N N 49 121.777 121.777 120.393 1.384 18135 17426 1 19 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.117 -0.014 18135 17427 1 19 . 1 1 49 49 LYS C C 49 177.968 177.968 177.947 0.021 18135 17428 1 19 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.941 -0.792 18135 17429 1 19 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.221 0.169 18135 17430 1 19 . 1 1 49 49 LYS H H 49 8.426 8.426 8.531 -0.105 18135 17431 1 19 . 1 1 50 50 ALA N N 50 120.573 120.573 118.298 2.275 18135 17432 1 19 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.295 -0.225 18135 17433 1 19 . 1 1 50 50 ALA C C 50 178.697 178.697 177.244 1.453 18135 17434 1 19 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.322 1.446 18135 17435 1 19 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.128 0.746 18135 17436 1 19 . 1 1 50 50 ALA H H 50 8.578 8.578 8.048 0.530 18135 17437 1 19 . 1 1 51 51 GLU N N 51 115.015 115.015 116.513 -1.498 18135 17438 1 19 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.212 0.054 18135 17439 1 19 . 1 1 51 51 GLU C C 51 176.995 176.995 176.741 0.254 18135 17440 1 19 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.094 -0.101 18135 17441 1 19 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.911 -1.006 18135 17442 1 19 . 1 1 51 51 GLU H H 51 7.907 7.907 8.229 -0.322 18135 17443 1 19 . 1 1 52 52 THR N N 52 111.210 111.210 114.901 -3.691 18135 17444 1 19 . 1 1 52 52 THR HA H 52 4.114 4.114 4.356 -0.242 18135 17445 1 19 . 1 1 52 52 THR C C 52 175.271 175.271 175.895 -0.624 18135 17446 1 19 . 1 1 52 52 THR CA C 52 63.611 63.611 65.445 -1.834 18135 17447 1 19 . 1 1 52 52 THR CB C 52 69.673 69.673 69.264 0.409 18135 17448 1 19 . 1 1 52 52 THR H H 52 7.863 7.863 7.337 0.526 18135 17449 1 19 . 1 1 53 53 ILE N N 53 119.113 119.113 123.028 -3.915 18135 17450 1 19 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.289 -0.425 18135 17451 1 19 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.522 1.385 18135 17452 1 19 . 1 1 53 53 ILE CB C 53 34.953 34.953 35.940 -0.987 18135 17453 1 19 . 1 1 53 53 ILE H H 53 8.341 8.341 8.189 0.152 18135 17454 1 19 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.344 -0.058 18135 17455 1 19 . 1 1 54 54 PRO C C 54 179.655 179.655 178.986 0.669 18135 17456 1 19 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.169 -0.118 18135 17457 1 19 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.359 0.526 18135 17458 1 19 . 1 1 55 55 VAL N N 55 116.355 116.355 116.077 0.278 18135 17459 1 19 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.858 -0.177 18135 17460 1 19 . 1 1 55 55 VAL C C 55 177.649 177.649 178.138 -0.489 18135 17461 1 19 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.775 0.062 18135 17462 1 19 . 1 1 55 55 VAL CB C 55 31.471 31.471 31.362 0.109 18135 17463 1 19 . 1 1 55 55 VAL H H 55 7.119 7.119 7.433 -0.314 18135 17464 1 19 . 1 1 56 56 LEU N N 56 123.038 123.038 121.293 1.745 18135 17465 1 19 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.064 0.246 18135 17466 1 19 . 1 1 56 56 LEU C C 56 178.637 178.637 177.788 0.849 18135 17467 1 19 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.294 -0.208 18135 17468 1 19 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.426 0.892 18135 17469 1 19 . 1 1 56 56 LEU H H 56 8.535 8.535 8.536 -0.001 18135 17470 1 19 . 1 1 57 57 HIS N N 57 117.041 117.041 118.480 -1.439 18135 17471 1 19 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.006 -0.221 18135 17472 1 19 . 1 1 57 57 HIS C C 57 175.640 175.640 177.388 -1.748 18135 17473 1 19 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.693 0.838 18135 17474 1 19 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.096 -1.887 18135 17475 1 19 . 1 1 57 57 HIS H H 57 9.047 9.047 7.998 1.049 18135 17476 1 19 . 1 1 58 58 GLU N N 58 119.521 119.521 118.603 0.918 18135 17477 1 19 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.802 0.205 18135 17478 1 19 . 1 1 58 58 GLU C C 58 179.029 179.029 179.015 0.014 18135 17479 1 19 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.338 -0.371 18135 17480 1 19 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.390 -1.100 18135 17481 1 19 . 1 1 58 58 GLU H H 58 7.860 7.860 8.149 -0.288 18135 17482 1 19 . 1 1 59 59 MET N N 59 119.512 119.512 118.944 0.568 18135 17483 1 19 . 1 1 59 59 MET HA H 59 4.074 4.074 4.333 -0.259 18135 17484 1 19 . 1 1 59 59 MET C C 59 177.031 177.031 179.112 -2.081 18135 17485 1 19 . 1 1 59 59 MET CA C 59 59.408 59.408 59.321 0.088 18135 17486 1 19 . 1 1 59 59 MET CB C 59 32.525 32.525 32.731 -0.206 18135 17487 1 19 . 1 1 59 59 MET H H 59 8.442 8.442 7.982 0.460 18135 17488 1 19 . 1 1 60 60 ILE N N 60 117.183 117.183 117.825 -0.642 18135 17489 1 19 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.534 -0.117 18135 17490 1 19 . 1 1 60 60 ILE C C 60 177.524 177.524 178.214 -0.690 18135 17491 1 19 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.793 0.533 18135 17492 1 19 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.000 -0.140 18135 17493 1 19 . 1 1 60 60 ILE H H 60 8.338 8.338 7.876 0.462 18135 17494 1 19 . 1 1 61 61 GLN N N 61 120.191 120.191 120.134 0.057 18135 17495 1 19 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.732 -0.030 18135 17496 1 19 . 1 1 61 61 GLN C C 61 178.270 178.270 177.768 0.502 18135 17497 1 19 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.224 -0.438 18135 17498 1 19 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.196 0.470 18135 17499 1 19 . 1 1 61 61 GLN H H 61 8.234 8.234 8.073 0.161 18135 17500 1 19 . 1 1 62 62 GLN N N 62 116.795 116.795 118.763 -1.968 18135 17501 1 19 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.181 0.446 18135 17502 1 19 . 1 1 62 62 GLN C C 62 179.685 179.685 178.411 1.274 18135 17503 1 19 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.171 -0.163 18135 17504 1 19 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.608 -3.266 18135 17505 1 19 . 1 1 62 62 GLN H H 62 8.421 8.421 7.867 0.554 18135 17506 1 19 . 1 1 63 63 ILE N N 63 122.797 122.797 119.900 2.897 18135 17507 1 19 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.865 -0.216 18135 17508 1 19 . 1 1 63 63 ILE C C 63 177.279 177.279 177.889 -0.610 18135 17509 1 19 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.602 2.363 18135 17510 1 19 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.810 -0.495 18135 17511 1 19 . 1 1 63 63 ILE H H 63 8.164 8.164 7.602 0.562 18135 17512 1 19 . 1 1 64 64 PHE N N 64 120.820 120.820 121.183 -0.363 18135 17513 1 19 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.446 -0.730 18135 17514 1 19 . 1 1 64 64 PHE C C 64 178.402 178.402 176.644 1.758 18135 17515 1 19 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.210 0.942 18135 17516 1 19 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.629 -0.119 18135 17517 1 19 . 1 1 64 64 PHE H H 64 8.405 8.405 7.937 0.468 18135 17518 1 19 . 1 1 65 65 ASN N N 65 119.981 119.981 118.873 1.108 18135 17519 1 19 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.823 0.240 18135 17520 1 19 . 1 1 65 65 ASN C C 65 177.944 177.944 177.596 0.348 18135 17521 1 19 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.509 -0.641 18135 17522 1 19 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.584 -1.328 18135 17523 1 19 . 1 1 65 65 ASN H H 65 8.812 8.812 7.911 0.901 18135 17524 1 19 . 1 1 66 66 LEU N N 66 121.533 121.533 120.663 0.870 18135 17525 1 19 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.155 0.068 18135 17526 1 19 . 1 1 66 66 LEU C C 66 177.777 177.777 179.595 -1.818 18135 17527 1 19 . 1 1 66 66 LEU CA C 66 58.268 58.268 58.188 0.080 18135 17528 1 19 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.466 0.141 18135 17529 1 19 . 1 1 66 66 LEU H H 66 8.177 8.177 7.936 0.241 18135 17530 1 19 . 1 1 67 67 PHE N N 67 110.842 110.842 113.926 -3.084 18135 17531 1 19 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.496 0.384 18135 17532 1 19 . 1 1 67 67 PHE C C 67 177.965 177.965 176.435 1.530 18135 17533 1 19 . 1 1 67 67 PHE CA C 67 59.534 59.534 59.228 0.306 18135 17534 1 19 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.868 -0.252 18135 17535 1 19 . 1 1 67 67 PHE H H 67 8.160 8.160 8.449 -0.289 18135 17536 1 19 . 1 1 68 68 SER N N 68 119.131 119.131 112.842 6.289 18135 17537 1 19 . 1 1 68 68 SER HA H 68 4.580 4.580 4.291 0.289 18135 17538 1 19 . 1 1 68 68 SER C C 68 173.472 173.472 174.780 -1.308 18135 17539 1 19 . 1 1 68 68 SER CA C 68 59.191 59.191 59.043 0.148 18135 17540 1 19 . 1 1 68 68 SER CB C 68 63.123 63.123 63.771 -0.648 18135 17541 1 19 . 1 1 68 68 SER H H 68 8.016 8.016 7.487 0.529 18135 17542 1 19 . 1 1 69 69 THR N N 69 111.353 111.353 115.347 -3.994 18135 17543 1 19 . 1 1 69 69 THR HA H 69 4.345 4.345 4.407 -0.062 18135 17544 1 19 . 1 1 69 69 THR C C 69 175.661 175.661 174.668 0.993 18135 17545 1 19 . 1 1 69 69 THR CA C 69 61.411 61.411 60.403 1.008 18135 17546 1 19 . 1 1 69 69 THR CB C 69 72.209 72.209 70.439 1.770 18135 17547 1 19 . 1 1 69 69 THR H H 69 6.977 6.977 7.375 -0.398 18135 17548 1 19 . 1 1 70 70 LYS N N 70 121.120 121.120 123.059 -1.939 18135 17549 1 19 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.113 -0.024 18135 17550 1 19 . 1 1 70 70 LYS C C 70 179.259 179.259 177.373 1.886 18135 17551 1 19 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.874 -0.918 18135 17552 1 19 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.461 -0.711 18135 17553 1 19 . 1 1 70 70 LYS H H 70 9.065 9.065 8.602 0.463 18135 17554 1 19 . 1 1 71 71 ASP N N 71 116.374 116.374 120.058 -3.684 18135 17555 1 19 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.316 -0.141 18135 17556 1 19 . 1 1 71 71 ASP C C 71 178.372 178.372 177.090 1.282 18135 17557 1 19 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.144 -0.077 18135 17558 1 19 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.407 -0.101 18135 17559 1 19 . 1 1 71 71 ASP H H 71 7.518 7.518 7.739 -0.221 18135 17560 1 19 . 1 1 72 72 SER N N 72 117.341 117.341 113.188 4.153 18135 17561 1 19 . 1 1 72 72 SER HA H 72 3.715 3.715 3.347 0.368 18135 17562 1 19 . 1 1 72 72 SER C C 72 176.897 176.897 175.690 1.207 18135 17563 1 19 . 1 1 72 72 SER CA C 72 60.267 60.267 60.271 -0.004 18135 17564 1 19 . 1 1 72 72 SER CB C 72 62.616 62.616 63.160 -0.544 18135 17565 1 19 . 1 1 72 72 SER H H 72 8.066 8.066 7.867 0.199 18135 17566 1 19 . 1 1 73 73 SER N N 73 113.398 113.398 116.803 -3.405 18135 17567 1 19 . 1 1 73 73 SER HA H 73 4.094 4.094 4.120 -0.026 18135 17568 1 19 . 1 1 73 73 SER C C 73 174.855 174.855 175.688 -0.833 18135 17569 1 19 . 1 1 73 73 SER CA C 73 61.385 61.385 60.677 0.708 18135 17570 1 19 . 1 1 73 73 SER CB C 73 62.798 62.798 62.832 -0.034 18135 17571 1 19 . 1 1 73 73 SER H H 73 7.982 7.982 7.522 0.460 18135 17572 1 19 . 1 1 74 74 ALA N N 74 119.486 119.486 120.164 -0.678 18135 17573 1 19 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.295 -0.138 18135 17574 1 19 . 1 1 74 74 ALA C C 74 177.626 177.626 177.371 0.255 18135 17575 1 19 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.474 0.239 18135 17576 1 19 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.986 -0.239 18135 17577 1 19 . 1 1 74 74 ALA H H 74 7.095 7.095 7.912 -0.817 18135 17578 1 19 . 1 1 75 75 ALA N N 75 121.465 121.465 121.745 -0.280 18135 17579 1 19 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.642 0.054 18135 17580 1 19 . 1 1 75 75 ALA C C 75 177.197 177.197 176.106 1.091 18135 17581 1 19 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.395 0.609 18135 17582 1 19 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.681 -0.421 18135 17583 1 19 . 1 1 75 75 ALA H H 75 7.159 7.159 7.387 -0.228 18135 17584 1 19 . 1 1 76 76 TRP N N 76 116.791 116.791 116.121 0.670 18135 17585 1 19 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.711 0.339 18135 17586 1 19 . 1 1 76 76 TRP C C 76 177.617 177.617 174.810 2.807 18135 17587 1 19 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.084 -1.765 18135 17588 1 19 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.958 2.118 18135 17589 1 19 . 1 1 76 76 TRP H H 76 7.080 7.080 7.130 -0.050 18135 17590 1 19 . 1 1 77 77 ASP N N 77 119.928 119.928 121.645 -1.717 18135 17591 1 19 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.550 -0.193 18135 17592 1 19 . 1 1 77 77 ASP C C 77 176.877 176.877 177.727 -0.850 18135 17593 1 19 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.404 -0.586 18135 17594 1 19 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.856 0.759 18135 17595 1 19 . 1 1 77 77 ASP H H 77 8.259 8.259 8.568 -0.309 18135 17596 1 19 . 1 1 78 78 GLU N N 78 127.277 127.277 125.875 1.402 18135 17597 1 19 . 1 1 78 78 GLU HA H 78 3.885 3.885 4.022 -0.137 18135 17598 1 19 . 1 1 78 78 GLU C C 78 177.439 177.439 178.438 -0.999 18135 17599 1 19 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.795 -0.411 18135 17600 1 19 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.488 -0.847 18135 17601 1 19 . 1 1 78 78 GLU H H 78 8.920 8.920 8.875 0.045 18135 17602 1 19 . 1 1 79 79 THR N N 79 115.422 115.422 117.201 -1.779 18135 17603 1 19 . 1 1 79 79 THR HA H 79 3.907 3.907 4.099 -0.192 18135 17604 1 19 . 1 1 79 79 THR C C 79 177.330 177.330 176.324 1.006 18135 17605 1 19 . 1 1 79 79 THR CA C 79 66.263 66.263 66.069 0.194 18135 17606 1 19 . 1 1 79 79 THR CB C 79 68.002 68.002 68.418 -0.416 18135 17607 1 19 . 1 1 79 79 THR H H 79 8.124 8.124 8.000 0.124 18135 17608 1 19 . 1 1 80 80 LEU N N 80 121.791 121.791 121.619 0.172 18135 17609 1 19 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.117 -0.230 18135 17610 1 19 . 1 1 80 80 LEU C C 80 179.018 179.018 178.414 0.604 18135 17611 1 19 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.796 -0.557 18135 17612 1 19 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.018 0.634 18135 17613 1 19 . 1 1 80 80 LEU H H 80 7.725 7.725 8.105 -0.380 18135 17614 1 19 . 1 1 81 81 LEU N N 81 119.280 119.280 120.596 -1.316 18135 17615 1 19 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.227 -0.738 18135 17616 1 19 . 1 1 81 81 LEU C C 81 177.062 177.062 178.783 -1.721 18135 17617 1 19 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.717 -1.008 18135 17618 1 19 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.188 -1.240 18135 17619 1 19 . 1 1 81 81 LEU H H 81 8.344 8.344 8.615 -0.271 18135 17620 1 19 . 1 1 82 82 ASP N N 82 115.357 115.357 119.877 -4.520 18135 17621 1 19 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.429 -0.155 18135 17622 1 19 . 1 1 82 82 ASP C C 82 179.018 179.018 178.694 0.324 18135 17623 1 19 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.683 -0.868 18135 17624 1 19 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.934 -2.713 18135 17625 1 19 . 1 1 82 82 ASP H H 82 8.001 8.001 8.510 -0.509 18135 17626 1 19 . 1 1 83 83 LYS N N 83 119.603 119.603 119.033 0.570 18135 17627 1 19 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.888 0.094 18135 17628 1 19 . 1 1 83 83 LYS C C 83 178.624 178.624 178.813 -0.189 18135 17629 1 19 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.839 0.906 18135 17630 1 19 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.217 0.889 18135 17631 1 19 . 1 1 83 83 LYS H H 83 7.342 7.342 7.723 -0.381 18135 17632 1 19 . 1 1 84 84 PHE N N 84 123.933 123.933 121.652 2.281 18135 17633 1 19 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.028 0.007 18135 17634 1 19 . 1 1 84 84 PHE C C 84 177.210 177.210 177.083 0.127 18135 17635 1 19 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.856 -1.513 18135 17636 1 19 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.954 0.362 18135 17637 1 19 . 1 1 84 84 PHE H H 84 8.471 8.471 8.527 -0.056 18135 17638 1 19 . 1 1 85 85 TYR N N 85 118.387 118.387 117.506 0.881 18135 17639 1 19 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.804 0.264 18135 17640 1 19 . 1 1 85 85 TYR C C 85 178.104 178.104 177.637 0.467 18135 17641 1 19 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.777 -1.200 18135 17642 1 19 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.512 -0.535 18135 17643 1 19 . 1 1 85 85 TYR H H 85 9.011 9.011 8.954 0.057 18135 17644 1 19 . 1 1 86 86 THR N N 86 114.035 114.035 115.888 -1.853 18135 17645 1 19 . 1 1 86 86 THR HA H 86 3.945 3.945 3.238 0.707 18135 17646 1 19 . 1 1 86 86 THR C C 86 176.708 176.708 176.454 0.254 18135 17647 1 19 . 1 1 86 86 THR CA C 86 66.759 66.759 66.978 -0.219 18135 17648 1 19 . 1 1 86 86 THR CB C 86 68.853 68.853 67.875 0.978 18135 17649 1 19 . 1 1 86 86 THR H H 86 7.609 7.609 7.399 0.210 18135 17650 1 19 . 1 1 87 87 GLU N N 87 120.790 120.790 121.469 -0.679 18135 17651 1 19 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.941 0.106 18135 17652 1 19 . 1 1 87 87 GLU C C 87 179.606 179.606 179.101 0.505 18135 17653 1 19 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.600 -1.202 18135 17654 1 19 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.349 -1.063 18135 17655 1 19 . 1 1 87 87 GLU H H 87 7.712 7.712 7.563 0.149 18135 17656 1 19 . 1 1 88 88 LEU N N 88 120.729 120.729 119.495 1.234 18135 17657 1 19 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.900 -0.172 18135 17658 1 19 . 1 1 88 88 LEU C C 88 178.695 178.695 179.322 -0.627 18135 17659 1 19 . 1 1 88 88 LEU CA C 88 58.251 58.251 56.954 1.297 18135 17660 1 19 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.152 1.435 18135 17661 1 19 . 1 1 88 88 LEU H H 88 8.393 8.393 7.532 0.861 18135 17662 1 19 . 1 1 89 89 TYR N N 89 118.654 118.654 118.912 -0.258 18135 17663 1 19 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.087 -0.156 18135 17664 1 19 . 1 1 89 89 TYR C C 89 178.438 178.438 178.566 -0.128 18135 17665 1 19 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.420 -0.013 18135 17666 1 19 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.488 0.379 18135 17667 1 19 . 1 1 89 89 TYR H H 89 8.637 8.637 8.338 0.299 18135 17668 1 19 . 1 1 90 90 GLN N N 90 118.263 118.263 116.468 1.795 18135 17669 1 19 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.962 0.024 18135 17670 1 19 . 1 1 90 90 GLN C C 90 178.411 178.411 178.535 -0.124 18135 17671 1 19 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.540 0.242 18135 17672 1 19 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.352 -0.206 18135 17673 1 19 . 1 1 90 90 GLN H H 90 7.796 7.796 7.909 -0.113 18135 17674 1 19 . 1 1 91 91 GLN N N 91 117.959 117.959 121.716 -3.757 18135 17675 1 19 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.049 0.033 18135 17676 1 19 . 1 1 91 91 GLN C C 91 178.705 178.705 178.187 0.518 18135 17677 1 19 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.839 -0.019 18135 17678 1 19 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.396 0.777 18135 17679 1 19 . 1 1 91 91 GLN H H 91 7.727 7.727 7.993 -0.266 18135 17680 1 19 . 1 1 92 92 LEU N N 92 119.965 119.965 118.345 1.620 18135 17681 1 19 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.996 -0.262 18135 17682 1 19 . 1 1 92 92 LEU C C 92 178.984 178.984 178.947 0.037 18135 17683 1 19 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.729 -0.237 18135 17684 1 19 . 1 1 92 92 LEU CB C 92 41.379 41.379 41.000 0.379 18135 17685 1 19 . 1 1 92 92 LEU H H 92 8.465 8.465 8.438 0.027 18135 17686 1 19 . 1 1 93 93 ASN N N 93 117.793 117.793 118.305 -0.512 18135 17687 1 19 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.253 0.148 18135 17688 1 19 . 1 1 93 93 ASN C C 93 178.309 178.309 177.152 1.157 18135 17689 1 19 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.262 0.141 18135 17690 1 19 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.224 0.414 18135 17691 1 19 . 1 1 93 93 ASN H H 93 8.091 8.091 8.148 -0.057 18135 17692 1 19 . 1 1 94 94 ASP N N 94 121.133 121.133 120.090 1.043 18135 17693 1 19 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.384 0.021 18135 17694 1 19 . 1 1 94 94 ASP C C 94 178.328 178.328 178.589 -0.261 18135 17695 1 19 . 1 1 94 94 ASP CA C 94 56.547 56.547 56.740 -0.193 18135 17696 1 19 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.947 -2.298 18135 17697 1 19 . 1 1 94 94 ASP H H 94 8.362 8.362 7.918 0.444 18135 17698 1 19 . 1 1 95 95 LEU N N 95 119.160 119.160 121.059 -1.899 18135 17699 1 19 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.841 0.198 18135 17700 1 19 . 1 1 95 95 LEU C C 95 178.826 178.826 178.408 0.418 18135 17701 1 19 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.467 -1.440 18135 17702 1 19 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.051 0.159 18135 17703 1 19 . 1 1 95 95 LEU H H 95 8.143 8.143 8.326 -0.183 18135 17704 1 19 . 1 1 96 96 GLU N N 96 118.813 118.813 118.808 0.005 18135 17705 1 19 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.676 0.285 18135 17706 1 19 . 1 1 96 96 GLU C C 96 177.640 177.640 178.290 -0.650 18135 17707 1 19 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.485 -1.771 18135 17708 1 19 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.390 -1.252 18135 17709 1 19 . 1 1 96 96 GLU H H 96 8.111 8.111 8.200 -0.089 18135 17710 1 19 . 1 1 97 97 ALA N N 97 120.549 120.549 120.718 -0.169 18135 17711 1 19 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.999 0.123 18135 17712 1 19 . 1 1 97 97 ALA C C 97 179.126 179.126 180.116 -0.990 18135 17713 1 19 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.651 -0.618 18135 17714 1 19 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.968 0.012 18135 17715 1 19 . 1 1 97 97 ALA H H 97 7.798 7.798 7.764 0.034 18135 17716 1 19 . 1 1 98 98 CYS N N 98 115.510 115.510 116.849 -1.339 18135 17717 1 19 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.192 0.258 18135 17718 1 19 . 1 1 98 98 CYS C C 98 175.363 175.363 176.008 -0.645 18135 17719 1 19 . 1 1 98 98 CYS CA C 98 57.166 57.166 61.798 -4.632 18135 17720 1 19 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.505 15.374 18135 17721 1 19 . 1 1 98 98 CYS H H 98 7.597 7.597 7.818 -0.221 18135 17722 1 19 . 1 1 99 99 VAL N N 99 121.713 121.713 119.236 2.477 18135 17723 1 19 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.888 -0.094 18135 17724 1 19 . 1 1 99 99 VAL C C 99 177.357 177.357 177.584 -0.227 18135 17725 1 19 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.124 -0.541 18135 17726 1 19 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.175 -0.144 18135 17727 1 19 . 1 1 99 99 VAL H H 99 7.828 7.828 7.796 0.032 18135 17728 1 19 . 1 1 100 100 ILE N N 100 122.333 122.333 117.806 4.527 18135 17729 1 19 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.710 0.214 18135 17730 1 19 . 1 1 100 100 ILE C C 100 176.827 176.827 176.619 0.208 18135 17731 1 19 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.672 -1.434 18135 17732 1 19 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.626 0.652 18135 17733 1 19 . 1 1 100 100 ILE H H 100 8.067 8.067 8.125 -0.058 18135 17734 1 19 . 1 1 101 101 GLN N N 101 121.864 121.864 117.262 4.602 18135 17735 1 19 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.205 0.021 18135 17736 1 19 . 1 1 101 101 GLN C C 101 176.438 176.438 178.069 -1.631 18135 17737 1 19 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.523 -0.203 18135 17738 1 19 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.155 -0.144 18135 17739 1 19 . 1 1 101 101 GLN H H 101 8.062 8.062 7.431 0.631 18135 17740 1 19 . 1 1 102 102 GLY N N 102 109.288 109.288 107.747 1.541 18135 17741 1 19 . 1 1 102 102 GLY C C 102 173.855 173.855 175.329 -1.474 18135 17742 1 19 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.266 -1.107 18135 17743 1 19 . 1 1 102 102 GLY H H 102 8.087 8.087 8.775 -0.689 18135 17744 1 19 . 1 1 103 103 VAL N N 103 118.932 118.932 114.925 4.007 18135 17745 1 19 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.781 0.293 18135 17746 1 19 . 1 1 103 103 VAL C C 103 176.299 176.299 175.944 0.355 18135 17747 1 19 . 1 1 103 103 VAL CA C 103 62.499 62.499 64.024 -1.525 18135 17748 1 19 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.426 1.428 18135 17749 1 19 . 1 1 103 103 VAL H H 103 8.079 8.079 7.606 0.473 18135 17750 1 19 . 1 1 104 104 GLY N N 104 112.028 112.028 107.543 4.485 18135 17751 1 19 . 1 1 104 104 GLY C C 104 173.694 173.694 173.539 0.155 18135 17752 1 19 . 1 1 104 104 GLY CA C 104 45.402 45.402 44.867 0.535 18135 17753 1 19 . 1 1 104 104 GLY H H 104 8.446 8.446 7.539 0.907 18135 17754 1 19 . 1 1 105 105 VAL N N 105 120.439 120.439 121.953 -1.514 18135 17755 1 19 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.351 -0.163 18135 17756 1 19 . 1 1 105 105 VAL C C 105 175.963 175.963 174.623 1.340 18135 17757 1 19 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.001 1.135 18135 17758 1 19 . 1 1 105 105 VAL CB C 105 32.814 32.814 35.059 -2.245 18135 17759 1 19 . 1 1 105 105 VAL H H 105 7.867 7.867 8.037 -0.170 18135 17760 1 19 . 1 1 106 106 THR N N 106 116.366 116.366 115.755 0.611 18135 17761 1 19 . 1 1 106 106 THR HA H 106 4.548 4.548 4.539 0.009 18135 17762 1 19 . 1 1 106 106 THR C C 106 173.731 173.731 173.738 -0.007 18135 17763 1 19 . 1 1 106 106 THR CA C 106 59.419 59.419 59.871 -0.452 18135 17764 1 19 . 1 1 106 106 THR CB C 106 79.536 79.536 70.906 8.630 18135 17765 1 19 . 1 1 106 106 THR H H 106 8.565 8.565 8.086 0.479 18135 17766 1 19 . 1 1 107 107 GLU N N 107 119.743 119.743 120.083 -0.340 18135 17767 1 19 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.603 -0.141 18135 17768 1 19 . 1 1 107 107 GLU C C 107 175.639 175.639 175.964 -0.325 18135 17769 1 19 . 1 1 107 107 GLU CA C 107 55.711 55.711 55.045 0.666 18135 17770 1 19 . 1 1 107 107 GLU CB C 107 30.499 30.499 30.372 0.127 18135 17771 1 19 . 1 1 107 107 GLU H H 107 8.410 8.410 8.287 0.123 18135 17772 1 19 . 1 1 108 108 THR N N 108 114.402 114.402 110.529 3.873 18135 17773 1 19 . 1 1 108 108 THR HA H 108 4.448 4.448 4.743 -0.295 18135 17774 1 19 . 1 1 108 108 THR CA C 108 60.348 60.348 58.544 1.804 18135 17775 1 19 . 1 1 108 108 THR CB C 108 68.544 68.544 69.177 -0.633 18135 17776 1 19 . 1 1 108 108 THR H H 108 8.155 8.155 8.066 0.089 18135 17777 1 19 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.415 -0.177 18135 17778 1 19 . 1 1 109 109 PRO C C 109 178.666 178.666 177.444 1.222 18135 17779 1 19 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.221 1.155 18135 17780 1 19 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.969 -0.121 18135 17781 1 19 . 1 1 110 110 LEU N N 110 118.566 118.566 118.196 0.370 18135 17782 1 19 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.113 0.003 18135 17783 1 19 . 1 1 110 110 LEU C C 110 178.293 178.293 178.886 -0.593 18135 17784 1 19 . 1 1 110 110 LEU CA C 110 56.686 56.686 58.017 -1.331 18135 17785 1 19 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.520 0.449 18135 17786 1 19 . 1 1 110 110 LEU H H 110 8.016 8.016 7.831 0.185 18135 17787 1 19 . 1 1 111 111 MET N N 111 118.982 118.982 116.774 2.208 18135 17788 1 19 . 1 1 111 111 MET HA H 111 4.210 4.210 4.170 0.040 18135 17789 1 19 . 1 1 111 111 MET C C 111 178.720 178.720 177.794 0.926 18135 17790 1 19 . 1 1 111 111 MET CA C 111 58.144 58.144 57.151 0.993 18135 17791 1 19 . 1 1 111 111 MET CB C 111 32.374 32.374 32.062 0.312 18135 17792 1 19 . 1 1 111 111 MET H H 111 7.705 7.705 8.082 -0.377 18135 17793 1 19 . 1 1 112 112 LYS N N 112 121.377 121.377 119.186 2.191 18135 17794 1 19 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.111 -0.003 18135 17795 1 19 . 1 1 112 112 LYS C C 112 178.000 178.000 178.458 -0.458 18135 17796 1 19 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.364 -2.059 18135 17797 1 19 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.259 0.108 18135 17798 1 19 . 1 1 112 112 LYS H H 112 8.257 8.257 7.587 0.670 18135 17799 1 19 . 1 1 113 113 GLU N N 113 119.104 119.104 119.115 -0.011 18135 17800 1 19 . 1 1 113 113 GLU HA H 113 4.066 4.066 3.991 0.075 18135 17801 1 19 . 1 1 113 113 GLU C C 113 178.289 178.289 178.550 -0.261 18135 17802 1 19 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.624 -1.371 18135 17803 1 19 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.439 -1.301 18135 17804 1 19 . 1 1 113 113 GLU H H 113 8.270 8.270 7.744 0.526 18135 17805 1 19 . 1 1 114 114 ASP N N 114 119.224 119.224 119.485 -0.261 18135 17806 1 19 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.642 -0.354 18135 17807 1 19 . 1 1 114 114 ASP C C 114 178.365 178.365 178.364 0.001 18135 17808 1 19 . 1 1 114 114 ASP CA C 114 56.108 56.108 56.666 -0.558 18135 17809 1 19 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.294 -2.059 18135 17810 1 19 . 1 1 114 114 ASP H H 114 8.618 8.618 7.718 0.900 18135 17811 1 19 . 1 1 115 115 SER N N 115 118.195 118.195 117.252 0.943 18135 17812 1 19 . 1 1 115 115 SER HA H 115 4.200 4.200 4.115 0.085 18135 17813 1 19 . 1 1 115 115 SER C C 115 175.986 175.986 176.680 -0.694 18135 17814 1 19 . 1 1 115 115 SER CA C 115 61.588 61.588 61.659 -0.071 18135 17815 1 19 . 1 1 115 115 SER CB C 115 62.653 62.653 63.193 -0.540 18135 17816 1 19 . 1 1 115 115 SER H H 115 8.181 8.181 7.502 0.679 18135 17817 1 19 . 1 1 116 116 ILE N N 116 123.340 123.340 120.390 2.950 18135 17818 1 19 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.871 -0.245 18135 17819 1 19 . 1 1 116 116 ILE C C 116 178.367 178.367 177.674 0.693 18135 17820 1 19 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.742 1.075 18135 17821 1 19 . 1 1 116 116 ILE CB C 116 37.418 37.418 37.012 0.406 18135 17822 1 19 . 1 1 116 116 ILE H H 116 7.773 7.773 8.359 -0.586 18135 17823 1 19 . 1 1 117 117 LEU N N 117 120.968 120.968 121.187 -0.219 18135 17824 1 19 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.916 -0.011 18135 17825 1 19 . 1 1 117 117 LEU C C 117 178.746 178.746 178.524 0.222 18135 17826 1 19 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.156 -0.013 18135 17827 1 19 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.651 -0.065 18135 17828 1 19 . 1 1 117 117 LEU H H 117 8.406 8.406 7.535 0.871 18135 17829 1 19 . 1 1 118 118 ALA N N 118 120.150 120.150 121.796 -1.646 18135 17830 1 19 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.801 0.311 18135 17831 1 19 . 1 1 118 118 ALA C C 118 181.633 181.633 178.725 2.908 18135 17832 1 19 . 1 1 118 118 ALA CA C 118 55.313 55.313 54.864 0.450 18135 17833 1 19 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.721 -0.611 18135 17834 1 19 . 1 1 118 118 ALA H H 118 7.894 7.894 8.082 -0.188 18135 17835 1 19 . 1 1 119 119 VAL N N 119 118.873 118.873 116.371 2.502 18135 17836 1 19 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.142 0.613 18135 17837 1 19 . 1 1 119 119 VAL C C 119 177.896 177.896 177.632 0.264 18135 17838 1 19 . 1 1 119 119 VAL CA C 119 67.181 67.181 65.682 1.499 18135 17839 1 19 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.901 0.993 18135 17840 1 19 . 1 1 119 119 VAL H H 119 7.572 7.572 7.900 -0.328 18135 17841 1 19 . 1 1 120 120 ARG N N 120 121.436 121.436 118.319 3.117 18135 17842 1 19 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.136 -0.109 18135 17843 1 19 . 1 1 120 120 ARG C C 120 179.848 179.848 178.346 1.502 18135 17844 1 19 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.160 2.107 18135 17845 1 19 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.579 0.116 18135 17846 1 19 . 1 1 120 120 ARG H H 120 8.629 8.629 8.518 0.111 18135 17847 1 19 . 1 1 121 121 LYS N N 121 119.589 119.589 120.308 -0.719 18135 17848 1 19 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.035 0.039 18135 17849 1 19 . 1 1 121 121 LYS C C 121 178.331 178.331 179.399 -1.068 18135 17850 1 19 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.600 0.840 18135 17851 1 19 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.304 -0.197 18135 17852 1 19 . 1 1 121 121 LYS H H 121 9.015 9.015 7.495 1.520 18135 17853 1 19 . 1 1 122 122 TYR N N 122 121.546 121.546 118.694 2.852 18135 17854 1 19 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.221 0.111 18135 17855 1 19 . 1 1 122 122 TYR C C 122 176.527 176.527 178.132 -1.605 18135 17856 1 19 . 1 1 122 122 TYR CA C 122 60.404 60.404 58.573 1.831 18135 17857 1 19 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.184 0.541 18135 17858 1 19 . 1 1 122 122 TYR H H 122 7.473 7.473 7.866 -0.393 18135 17859 1 19 . 1 1 123 123 PHE N N 123 116.026 116.026 119.809 -3.783 18135 17860 1 19 . 1 1 123 123 PHE HA H 123 3.740 3.740 4.025 -0.285 18135 17861 1 19 . 1 1 123 123 PHE C C 123 179.005 179.005 177.454 1.551 18135 17862 1 19 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.277 3.251 18135 17863 1 19 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.897 0.434 18135 17864 1 19 . 1 1 123 123 PHE H H 123 7.932 7.932 8.282 -0.350 18135 17865 1 19 . 1 1 124 124 GLN N N 124 123.043 123.043 118.416 4.627 18135 17866 1 19 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.472 0.707 18135 17867 1 19 . 1 1 124 124 GLN C C 124 178.772 178.772 178.572 0.200 18135 17868 1 19 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.504 -0.188 18135 17869 1 19 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.224 -0.593 18135 17870 1 19 . 1 1 124 124 GLN H H 124 8.470 8.470 8.183 0.287 18135 17871 1 19 . 1 1 125 125 ARG N N 125 120.342 120.342 118.407 1.935 18135 17872 1 19 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.167 -0.089 18135 17873 1 19 . 1 1 125 125 ARG C C 125 180.340 180.340 179.271 1.069 18135 17874 1 19 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.448 2.849 18135 17875 1 19 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.968 0.357 18135 17876 1 19 . 1 1 125 125 ARG H H 125 8.137 8.137 7.979 0.158 18135 17877 1 19 . 1 1 126 126 ILE N N 126 121.876 121.876 121.688 0.188 18135 17878 1 19 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.656 -0.305 18135 17879 1 19 . 1 1 126 126 ILE C C 126 176.857 176.857 178.048 -1.191 18135 17880 1 19 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.658 1.174 18135 17881 1 19 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.731 0.553 18135 17882 1 19 . 1 1 126 126 ILE H H 126 7.526 7.526 8.226 -0.700 18135 17883 1 19 . 1 1 127 127 THR N N 127 115.613 115.613 115.558 0.055 18135 17884 1 19 . 1 1 127 127 THR HA H 127 3.633 3.633 3.905 -0.272 18135 17885 1 19 . 1 1 127 127 THR C C 127 176.645 176.645 177.120 -0.475 18135 17886 1 19 . 1 1 127 127 THR CA C 127 67.294 67.294 65.987 1.307 18135 17887 1 19 . 1 1 127 127 THR CB C 127 68.871 68.871 68.700 0.171 18135 17888 1 19 . 1 1 127 127 THR H H 127 8.288 8.288 8.223 0.065 18135 17889 1 19 . 1 1 128 128 LEU N N 128 122.627 122.627 122.386 0.241 18135 17890 1 19 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.967 -0.011 18135 17891 1 19 . 1 1 128 128 LEU C C 128 178.331 178.331 177.786 0.545 18135 17892 1 19 . 1 1 128 128 LEU CA C 128 58.088 58.088 58.028 0.060 18135 17893 1 19 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.336 0.238 18135 17894 1 19 . 1 1 128 128 LEU H H 128 8.263 8.263 8.129 0.134 18135 17895 1 19 . 1 1 129 129 TYR N N 129 120.955 120.955 120.253 0.702 18135 17896 1 19 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.285 -0.395 18135 17897 1 19 . 1 1 129 129 TYR C C 129 176.040 176.040 177.528 -1.488 18135 17898 1 19 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.285 0.208 18135 17899 1 19 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.290 0.635 18135 17900 1 19 . 1 1 129 129 TYR H H 129 7.518 7.518 7.984 -0.466 18135 17901 1 19 . 1 1 130 130 LEU N N 130 119.155 119.155 116.660 2.495 18135 17902 1 19 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.363 -0.518 18135 17903 1 19 . 1 1 130 130 LEU C C 130 177.948 177.948 178.405 -0.457 18135 17904 1 19 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.914 0.199 18135 17905 1 19 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.569 1.017 18135 17906 1 19 . 1 1 130 130 LEU H H 130 7.717 7.717 8.051 -0.334 18135 17907 1 19 . 1 1 131 131 LYS N N 131 116.832 116.832 120.050 -3.218 18135 17908 1 19 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.870 -0.462 18135 17909 1 19 . 1 1 131 131 LYS C C 131 181.265 181.265 179.716 1.549 18135 17910 1 19 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.759 -0.028 18135 17911 1 19 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.033 0.638 18135 17912 1 19 . 1 1 131 131 LYS H H 131 7.493 7.493 8.064 -0.571 18135 17913 1 19 . 1 1 132 132 GLU N N 132 121.918 121.918 119.855 2.063 18135 17914 1 19 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.086 -0.242 18135 17915 1 19 . 1 1 132 132 GLU C C 132 178.377 178.377 178.144 0.233 18135 17916 1 19 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.698 0.189 18135 17917 1 19 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.570 -0.902 18135 17918 1 19 . 1 1 132 132 GLU H H 132 8.430 8.430 7.916 0.514 18135 17919 1 19 . 1 1 133 133 LYS N N 133 116.079 116.079 115.886 0.193 18135 17920 1 19 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.270 -0.304 18135 17921 1 19 . 1 1 133 133 LYS C C 133 175.282 175.282 175.493 -0.211 18135 17922 1 19 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.858 -0.561 18135 17923 1 19 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.901 0.097 18135 17924 1 19 . 1 1 133 133 LYS H H 133 7.390 7.390 7.322 0.068 18135 17925 1 19 . 1 1 134 134 LYS N N 134 117.759 117.759 115.931 1.828 18135 17926 1 19 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.064 -0.482 18135 17927 1 19 . 1 1 134 134 LYS C C 134 176.271 176.271 175.983 0.288 18135 17928 1 19 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.801 0.507 18135 17929 1 19 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.083 -0.281 18135 17930 1 19 . 1 1 134 134 LYS H H 134 7.716 7.716 7.582 0.134 18135 17931 1 19 . 1 1 135 135 TYR N N 135 110.598 110.598 113.764 -3.166 18135 17932 1 19 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.932 -1.055 18135 17933 1 19 . 1 1 135 135 TYR C C 135 174.148 174.148 175.179 -1.031 18135 17934 1 19 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.054 0.661 18135 17935 1 19 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.054 -0.348 18135 17936 1 19 . 1 1 135 135 TYR H H 135 8.428 8.428 8.801 -0.373 18135 17937 1 19 . 1 1 136 136 SER N N 136 113.712 113.712 115.463 -1.751 18135 17938 1 19 . 1 1 136 136 SER HA H 136 4.553 4.553 4.394 0.159 18135 17939 1 19 . 1 1 136 136 SER CA C 136 57.108 57.108 58.593 -1.485 18135 17940 1 19 . 1 1 136 136 SER CB C 136 62.500 62.500 64.041 -1.541 18135 17941 1 19 . 1 1 136 136 SER H H 136 6.744 6.744 7.383 -0.639 18135 17942 1 19 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.421 -0.256 18135 17943 1 19 . 1 1 137 137 PRO C C 137 180.675 180.675 177.600 3.075 18135 17944 1 19 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.900 0.756 18135 17945 1 19 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.747 0.236 18135 17946 1 19 . 1 1 138 138 CYS N N 138 113.914 113.914 115.968 -2.054 18135 17947 1 19 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.642 0.028 18135 17948 1 19 . 1 1 138 138 CYS C C 138 176.015 176.015 176.050 -0.035 18135 17949 1 19 . 1 1 138 138 CYS CA C 138 57.095 57.095 59.700 -2.605 18135 17950 1 19 . 1 1 138 138 CYS CB C 138 36.779 36.779 25.918 10.861 18135 17951 1 19 . 1 1 138 138 CYS H H 138 8.580 8.580 8.479 0.101 18135 17952 1 19 . 1 1 139 139 ALA N N 139 125.290 125.290 124.837 0.453 18135 17953 1 19 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.199 0.250 18135 17954 1 19 . 1 1 139 139 ALA C C 139 180.149 180.149 179.177 0.972 18135 17955 1 19 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.987 -0.209 18135 17956 1 19 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.113 0.805 18135 17957 1 19 . 1 1 139 139 ALA H H 139 8.087 8.087 8.019 0.068 18135 17958 1 19 . 1 1 140 140 TRP N N 140 116.599 116.599 118.765 -2.166 18135 17959 1 19 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.295 0.307 18135 17960 1 19 . 1 1 140 140 TRP C C 140 179.137 179.137 178.482 0.655 18135 17961 1 19 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.529 -0.995 18135 17962 1 19 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.468 -0.210 18135 17963 1 19 . 1 1 140 140 TRP H H 140 8.505 8.505 7.837 0.668 18135 17964 1 19 . 1 1 141 141 GLU N N 141 121.578 121.578 119.440 2.138 18135 17965 1 19 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.230 0.993 18135 17966 1 19 . 1 1 141 141 GLU C C 141 177.886 177.886 178.921 -1.035 18135 17967 1 19 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.932 -2.025 18135 17968 1 19 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.420 -0.703 18135 17969 1 19 . 1 1 141 141 GLU H H 141 8.182 8.182 8.096 0.086 18135 17970 1 19 . 1 1 142 142 VAL N N 142 121.202 121.202 120.315 0.887 18135 17971 1 19 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.764 -0.134 18135 17972 1 19 . 1 1 142 142 VAL C C 142 180.246 180.246 178.573 1.673 18135 17973 1 19 . 1 1 142 142 VAL CA C 142 66.983 66.983 67.050 -0.067 18135 17974 1 19 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.532 0.291 18135 17975 1 19 . 1 1 142 142 VAL H H 142 8.623 8.623 8.128 0.495 18135 17976 1 19 . 1 1 143 143 VAL N N 143 120.119 120.119 120.091 0.028 18135 17977 1 19 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.771 -0.474 18135 17978 1 19 . 1 1 143 143 VAL C C 143 176.407 176.407 178.340 -1.933 18135 17979 1 19 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.884 1.094 18135 17980 1 19 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.258 0.397 18135 17981 1 19 . 1 1 143 143 VAL H H 143 8.323 8.323 8.556 -0.233 18135 17982 1 19 . 1 1 144 144 ARG N N 144 124.102 124.102 119.256 4.846 18135 17983 1 19 . 1 1 144 144 ARG HA H 144 3.697 3.697 3.983 -0.286 18135 17984 1 19 . 1 1 144 144 ARG C C 144 178.127 178.127 178.668 -0.541 18135 17985 1 19 . 1 1 144 144 ARG CA C 144 61.001 61.001 58.522 2.479 18135 17986 1 19 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.217 0.719 18135 17987 1 19 . 1 1 144 144 ARG H H 144 9.619 9.619 8.504 1.115 18135 17988 1 19 . 1 1 145 145 ALA N N 145 119.431 119.431 121.799 -2.368 18135 17989 1 19 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.048 -0.197 18135 17990 1 19 . 1 1 145 145 ALA C C 145 180.763 180.763 179.970 0.793 18135 17991 1 19 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.350 0.025 18135 17992 1 19 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.068 0.117 18135 17993 1 19 . 1 1 145 145 ALA H H 145 8.867 8.867 8.300 0.567 18135 17994 1 19 . 1 1 146 146 GLU N N 146 121.815 121.815 119.020 2.795 18135 17995 1 19 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.182 0.029 18135 17996 1 19 . 1 1 146 146 GLU C C 146 177.296 177.296 178.958 -1.662 18135 17997 1 19 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.120 -0.740 18135 17998 1 19 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.579 -1.445 18135 17999 1 19 . 1 1 146 146 GLU H H 146 8.136 8.136 8.038 0.098 18135 18000 1 19 . 1 1 147 147 ILE N N 147 119.542 119.542 120.466 -0.924 18135 18001 1 19 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.635 0.335 18135 18002 1 19 . 1 1 147 147 ILE C C 147 178.283 178.283 177.961 0.322 18135 18003 1 19 . 1 1 147 147 ILE CA C 147 61.253 61.253 65.070 -3.817 18135 18004 1 19 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.533 -2.194 18135 18005 1 19 . 1 1 147 147 ILE H H 147 8.736 8.736 8.286 0.450 18135 18006 1 19 . 1 1 148 148 MET N N 148 119.501 119.501 118.298 1.203 18135 18007 1 19 . 1 1 148 148 MET HA H 148 3.801 3.801 4.198 -0.397 18135 18008 1 19 . 1 1 148 148 MET C C 148 178.210 178.210 178.814 -0.604 18135 18009 1 19 . 1 1 148 148 MET CA C 148 60.184 60.184 59.964 0.220 18135 18010 1 19 . 1 1 148 148 MET CB C 148 32.914 32.914 32.028 0.886 18135 18011 1 19 . 1 1 148 148 MET H H 148 8.440 8.440 8.366 0.074 18135 18012 1 19 . 1 1 149 149 ARG N N 149 119.734 119.734 120.411 -0.677 18135 18013 1 19 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.096 -0.181 18135 18014 1 19 . 1 1 149 149 ARG C C 149 178.978 178.978 178.937 0.041 18135 18015 1 19 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.651 0.211 18135 18016 1 19 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.995 0.285 18135 18017 1 19 . 1 1 149 149 ARG H H 149 7.648 7.648 8.324 -0.676 18135 18018 1 19 . 1 1 150 150 SER N N 150 118.109 118.109 116.376 1.733 18135 18019 1 19 . 1 1 150 150 SER HA H 150 3.339 3.339 3.676 -0.337 18135 18020 1 19 . 1 1 150 150 SER C C 150 177.292 177.292 176.071 1.221 18135 18021 1 19 . 1 1 150 150 SER CA C 150 61.316 61.316 61.650 -0.334 18135 18022 1 19 . 1 1 150 150 SER CB C 150 60.288 60.288 62.462 -2.174 18135 18023 1 19 . 1 1 150 150 SER H H 150 9.194 9.194 8.484 0.710 18135 18024 1 19 . 1 1 151 151 PHE N N 151 125.265 125.265 124.330 0.935 18135 18025 1 19 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.383 -0.347 18135 18026 1 19 . 1 1 151 151 PHE C C 151 178.696 178.696 177.178 1.518 18135 18027 1 19 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.672 1.748 18135 18028 1 19 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.659 0.227 18135 18029 1 19 . 1 1 151 151 PHE H H 151 9.455 9.455 8.377 1.078 18135 18030 1 19 . 1 1 152 152 SER N N 152 115.963 115.963 114.907 1.056 18135 18031 1 19 . 1 1 152 152 SER HA H 152 3.880 3.880 3.737 0.143 18135 18032 1 19 . 1 1 152 152 SER C C 152 175.858 175.858 176.656 -0.798 18135 18033 1 19 . 1 1 152 152 SER CA C 152 62.388 62.388 62.207 0.181 18135 18034 1 19 . 1 1 152 152 SER CB C 152 62.519 62.519 62.825 -0.305 18135 18035 1 19 . 1 1 152 152 SER H H 152 7.839 7.839 8.198 -0.359 18135 18036 1 19 . 1 1 153 153 LEU N N 153 121.365 121.365 122.038 -0.673 18135 18037 1 19 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.131 -0.050 18135 18038 1 19 . 1 1 153 153 LEU C C 153 179.515 179.515 177.249 2.266 18135 18039 1 19 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.345 0.538 18135 18040 1 19 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.824 0.518 18135 18041 1 19 . 1 1 153 153 LEU H H 153 7.775 7.775 8.044 -0.269 18135 18042 1 19 . 1 1 154 154 SER N N 154 113.950 113.950 112.635 1.315 18135 18043 1 19 . 1 1 154 154 SER HA H 154 3.781 3.781 4.440 -0.659 18135 18044 1 19 . 1 1 154 154 SER C C 154 174.312 174.312 176.984 -2.672 18135 18045 1 19 . 1 1 154 154 SER CA C 154 61.366 61.366 61.169 0.197 18135 18046 1 19 . 1 1 154 154 SER CB C 154 63.242 63.242 63.335 -0.093 18135 18047 1 19 . 1 1 154 154 SER H H 154 7.874 7.874 8.288 -0.414 18135 18048 1 19 . 1 1 155 155 THR N N 155 109.346 109.346 116.036 -6.690 18135 18049 1 19 . 1 1 155 155 THR HA H 155 4.060 4.060 4.111 -0.051 18135 18050 1 19 . 1 1 155 155 THR C C 155 174.798 174.798 176.310 -1.512 18135 18051 1 19 . 1 1 155 155 THR CA C 155 62.275 62.275 64.656 -2.381 18135 18052 1 19 . 1 1 155 155 THR CB C 155 69.342 69.342 69.087 0.255 18135 18053 1 19 . 1 1 155 155 THR H H 155 7.176 7.176 8.041 -0.865 18135 18054 1 19 . 1 1 156 156 ASN N N 156 119.785 119.785 119.944 -0.159 18135 18055 1 19 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.756 -0.229 18135 18056 1 19 . 1 1 156 156 ASN C C 156 175.528 175.528 175.145 0.383 18135 18057 1 19 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.438 1.500 18135 18058 1 19 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.796 0.542 18135 18059 1 19 . 1 1 156 156 ASN H H 156 7.749 7.749 7.941 -0.192 18135 18060 1 19 . 1 1 157 157 LEU N N 157 120.552 120.552 120.747 -0.195 18135 18061 1 19 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.451 -0.196 18135 18062 1 19 . 1 1 157 157 LEU C C 157 174.702 174.702 178.345 -3.643 18135 18063 1 19 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.561 -0.887 18135 18064 1 19 . 1 1 157 157 LEU CB C 157 42.351 42.351 41.700 0.652 18135 18065 1 19 . 1 1 157 157 LEU H H 157 8.097 8.097 7.649 0.448 18135 18066 1 19 . 1 1 158 158 GLN N N 158 119.860 119.860 118.668 1.192 18135 18067 1 19 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.087 0.093 18135 18068 1 19 . 1 1 158 158 GLN C C 158 176.434 176.434 175.914 0.520 18135 18069 1 19 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.654 1.243 18135 18070 1 19 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.252 -0.242 18135 18071 1 19 . 1 1 158 158 GLN H H 158 8.230 8.230 7.969 0.261 18135 18072 1 19 . 1 1 159 159 GLU N N 159 120.461 120.461 116.229 4.232 18135 18073 1 19 . 1 1 159 159 GLU HA H 159 4.219 4.219 3.973 0.246 18135 18074 1 19 . 1 1 159 159 GLU C C 159 175.251 175.251 175.623 -0.372 18135 18075 1 19 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.307 -0.612 18135 18076 1 19 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.702 0.279 18135 18077 1 19 . 1 1 159 159 GLU H H 159 8.300 8.300 8.630 -0.330 18135 18078 1 19 . 1 1 160 160 SER N N 160 115.719 115.719 112.624 3.095 18135 18079 1 19 . 1 1 160 160 SER HA H 160 4.372 4.372 4.538 -0.166 18135 18080 1 19 . 1 1 160 160 SER C C 160 174.188 174.188 173.568 0.620 18135 18081 1 19 . 1 1 160 160 SER CA C 160 58.481 58.481 58.974 -0.493 18135 18082 1 19 . 1 1 160 160 SER CB C 160 63.731 63.731 63.382 0.349 18135 18083 1 19 . 1 1 160 160 SER H H 160 8.113 8.113 8.421 -0.308 18135 18084 1 19 . 1 1 161 161 LEU N N 161 123.794 123.794 119.756 4.038 18135 18085 1 19 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.605 -0.325 18135 18086 1 19 . 1 1 161 161 LEU C C 161 177.293 177.293 176.875 0.418 18135 18087 1 19 . 1 1 161 161 LEU CA C 161 55.190 55.190 53.662 1.528 18135 18088 1 19 . 1 1 161 161 LEU CB C 161 42.284 42.284 43.431 -1.147 18135 18089 1 19 . 1 1 161 161 LEU H H 161 8.032 8.032 7.572 0.459 18135 18090 1 19 . 1 1 162 162 ARG N N 162 120.715 120.715 121.649 -0.934 18135 18091 1 19 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.309 -0.140 18135 18092 1 19 . 1 1 162 162 ARG C C 162 176.288 176.288 175.901 0.387 18135 18093 1 19 . 1 1 162 162 ARG CA C 162 57.046 57.046 56.776 0.270 18135 18094 1 19 . 1 1 162 162 ARG CB C 162 30.935 30.935 30.460 0.475 18135 18095 1 19 . 1 1 162 162 ARG H H 162 8.094 8.094 8.551 -0.457 18135 18096 1 19 . 1 1 163 163 SER N N 163 116.670 116.670 114.620 2.050 18135 18097 1 19 . 1 1 163 163 SER HA H 163 4.372 4.372 4.675 -0.303 18135 18098 1 19 . 1 1 163 163 SER C C 163 174.184 174.184 174.616 -0.432 18135 18099 1 19 . 1 1 163 163 SER CA C 163 58.481 58.481 57.477 1.004 18135 18100 1 19 . 1 1 163 163 SER CB C 163 63.745 63.745 64.861 -1.116 18135 18101 1 19 . 1 1 163 163 SER H H 163 8.191 8.191 8.212 -0.021 18135 18102 1 19 . 1 1 164 164 LYS N N 164 123.100 123.100 122.547 0.553 18135 18103 1 19 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.374 -0.097 18135 18104 1 19 . 1 1 164 164 LYS C C 164 175.617 175.617 177.181 -1.564 18135 18105 1 19 . 1 1 164 164 LYS CA C 164 56.313 56.313 57.644 -1.331 18135 18106 1 19 . 1 1 164 164 LYS CB C 164 32.965 32.965 31.831 1.134 18135 18107 1 19 . 1 1 164 164 LYS H H 164 8.251 8.251 8.862 -0.611 18135 18108 1 20 . 1 1 2 2 ASP N N 2 125.691 125.691 120.161 5.530 18135 18109 1 20 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.546 0.164 18135 18110 1 20 . 1 1 2 2 ASP C C 2 174.758 174.758 175.969 -1.211 18135 18111 1 20 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.797 -1.954 18135 18112 1 20 . 1 1 2 2 ASP CB C 2 39.321 39.321 40.725 -1.404 18135 18113 1 20 . 1 1 2 2 ASP H H 2 8.773 8.773 8.550 0.223 18135 18114 1 20 . 1 1 3 3 LEU N N 3 123.957 123.957 118.168 5.789 18135 18115 1 20 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.346 0.055 18135 18116 1 20 . 1 1 3 3 LEU CA C 3 53.653 53.653 53.368 0.285 18135 18117 1 20 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.193 0.362 18135 18118 1 20 . 1 1 3 3 LEU H H 3 8.164 8.164 7.426 0.738 18135 18119 1 20 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.526 -0.212 18135 18120 1 20 . 1 1 4 4 PRO C C 4 176.213 176.213 176.321 -0.108 18135 18121 1 20 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.216 0.692 18135 18122 1 20 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.279 1.615 18135 18123 1 20 . 1 1 5 5 GLN N N 5 121.621 121.621 122.041 -0.420 18135 18124 1 20 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.148 0.078 18135 18125 1 20 . 1 1 5 5 GLN C C 5 176.995 176.995 176.627 0.368 18135 18126 1 20 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.126 -1.416 18135 18127 1 20 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.259 -0.308 18135 18128 1 20 . 1 1 5 5 GLN H H 5 8.767 8.767 8.647 0.120 18135 18129 1 20 . 1 1 6 6 THR N N 6 111.419 111.419 110.135 1.284 18135 18130 1 20 . 1 1 6 6 THR HA H 6 4.135 4.135 4.414 -0.279 18135 18131 1 20 . 1 1 6 6 THR C C 6 174.695 174.695 174.905 -0.210 18135 18132 1 20 . 1 1 6 6 THR CA C 6 62.661 62.661 62.739 -0.078 18135 18133 1 20 . 1 1 6 6 THR CB C 6 69.365 69.365 68.674 0.691 18135 18134 1 20 . 1 1 6 6 THR H H 6 7.865 7.865 8.463 -0.598 18135 18135 1 20 . 1 1 7 7 HIS N N 7 119.137 119.137 120.002 -0.865 18135 18136 1 20 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.713 -0.128 18135 18137 1 20 . 1 1 7 7 HIS C C 7 174.980 174.980 176.274 -1.294 18135 18138 1 20 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.771 -2.767 18135 18139 1 20 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.870 -1.708 18135 18140 1 20 . 1 1 7 7 HIS H H 7 8.567 8.567 8.301 0.266 18135 18141 1 20 . 1 1 8 8 SER N N 8 115.796 115.796 115.556 0.240 18135 18142 1 20 . 1 1 8 8 SER HA H 8 4.363 4.363 4.425 -0.062 18135 18143 1 20 . 1 1 8 8 SER C C 8 175.312 175.312 176.180 -0.868 18135 18144 1 20 . 1 1 8 8 SER CA C 8 58.969 58.969 61.358 -2.389 18135 18145 1 20 . 1 1 8 8 SER CB C 8 63.439 63.439 63.263 0.176 18135 18146 1 20 . 1 1 8 8 SER H H 8 8.180 8.180 8.022 0.158 18135 18147 1 20 . 1 1 9 9 LEU N N 9 123.844 123.844 117.835 6.009 18135 18148 1 20 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.759 -0.604 18135 18149 1 20 . 1 1 9 9 LEU C C 9 178.568 178.568 178.395 0.173 18135 18150 1 20 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.684 0.282 18135 18151 1 20 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.211 -0.415 18135 18152 1 20 . 1 1 9 9 LEU H H 9 8.404 8.404 7.779 0.625 18135 18153 1 20 . 1 1 10 10 GLY N N 10 107.582 107.582 107.500 0.082 18135 18154 1 20 . 1 1 10 10 GLY C C 10 174.586 174.586 176.250 -1.664 18135 18155 1 20 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.237 -0.332 18135 18156 1 20 . 1 1 10 10 GLY H H 10 8.438 8.438 8.554 -0.116 18135 18157 1 20 . 1 1 11 11 SER N N 11 118.806 118.806 116.612 2.194 18135 18158 1 20 . 1 1 11 11 SER HA H 11 4.156 4.156 4.186 -0.030 18135 18159 1 20 . 1 1 11 11 SER C C 11 175.749 175.749 176.527 -0.778 18135 18160 1 20 . 1 1 11 11 SER CA C 11 61.299 61.299 62.176 -0.877 18135 18161 1 20 . 1 1 11 11 SER CB C 11 62.653 62.653 63.159 -0.506 18135 18162 1 20 . 1 1 11 11 SER H H 11 8.249 8.249 8.173 0.076 18135 18163 1 20 . 1 1 12 12 ARG N N 12 121.986 121.986 120.671 1.315 18135 18164 1 20 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.101 -0.146 18135 18165 1 20 . 1 1 12 12 ARG C C 12 178.283 178.283 178.363 -0.080 18135 18166 1 20 . 1 1 12 12 ARG CA C 12 59.830 59.830 59.362 0.468 18135 18167 1 20 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.216 -0.632 18135 18168 1 20 . 1 1 12 12 ARG H H 12 8.027 8.027 8.137 -0.110 18135 18169 1 20 . 1 1 13 13 ARG N N 13 119.432 119.432 119.451 -0.019 18135 18170 1 20 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.071 -0.232 18135 18171 1 20 . 1 1 13 13 ARG C C 13 178.480 178.480 178.533 -0.053 18135 18172 1 20 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.391 1.100 18135 18173 1 20 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.673 0.409 18135 18174 1 20 . 1 1 13 13 ARG H H 13 8.437 8.437 7.965 0.472 18135 18175 1 20 . 1 1 14 14 THR N N 14 116.879 116.879 117.045 -0.166 18135 18176 1 20 . 1 1 14 14 THR HA H 14 3.532 3.532 4.070 -0.538 18135 18177 1 20 . 1 1 14 14 THR C C 14 175.584 175.584 177.030 -1.446 18135 18178 1 20 . 1 1 14 14 THR CA C 14 68.036 68.036 66.724 1.312 18135 18179 1 20 . 1 1 14 14 THR CB C 14 67.969 67.969 68.713 -0.744 18135 18180 1 20 . 1 1 14 14 THR H H 14 7.957 7.957 8.201 -0.244 18135 18181 1 20 . 1 1 15 15 LEU N N 15 120.252 120.252 122.538 -2.286 18135 18182 1 20 . 1 1 15 15 LEU HA H 15 3.946 3.946 3.958 -0.012 18135 18183 1 20 . 1 1 15 15 LEU C C 15 178.652 178.652 179.082 -0.430 18135 18184 1 20 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.289 -0.201 18135 18185 1 20 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.861 -0.307 18135 18186 1 20 . 1 1 15 15 LEU H H 15 7.550 7.550 8.191 -0.641 18135 18187 1 20 . 1 1 16 16 MET N N 16 118.788 118.788 117.103 1.685 18135 18188 1 20 . 1 1 16 16 MET HA H 16 4.023 4.023 4.029 -0.006 18135 18189 1 20 . 1 1 16 16 MET C C 16 178.718 178.718 178.925 -0.207 18135 18190 1 20 . 1 1 16 16 MET CA C 16 58.513 58.513 58.161 0.352 18135 18191 1 20 . 1 1 16 16 MET CB C 16 32.150 32.150 31.310 0.840 18135 18192 1 20 . 1 1 16 16 MET H H 16 7.985 7.985 8.450 -0.465 18135 18193 1 20 . 1 1 17 17 LEU N N 17 120.644 120.644 119.720 0.924 18135 18194 1 20 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.975 -0.003 18135 18195 1 20 . 1 1 17 17 LEU C C 17 178.238 178.238 179.229 -0.991 18135 18196 1 20 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.560 -0.834 18135 18197 1 20 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.350 0.785 18135 18198 1 20 . 1 1 17 17 LEU H H 17 7.829 7.829 8.123 -0.294 18135 18199 1 20 . 1 1 18 18 LEU N N 18 118.280 118.280 118.875 -0.595 18135 18200 1 20 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.735 -0.229 18135 18201 1 20 . 1 1 18 18 LEU C C 18 175.739 175.739 178.506 -2.767 18135 18202 1 20 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.425 0.231 18135 18203 1 20 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.427 0.815 18135 18204 1 20 . 1 1 18 18 LEU H H 18 7.499 7.499 8.342 -0.843 18135 18205 1 20 . 1 1 19 19 ALA N N 19 121.961 121.961 120.560 1.401 18135 18206 1 20 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.130 -0.293 18135 18207 1 20 . 1 1 19 19 ALA C C 19 180.736 180.736 178.268 2.468 18135 18208 1 20 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.169 0.897 18135 18209 1 20 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.263 -1.186 18135 18210 1 20 . 1 1 19 19 ALA H H 19 7.950 7.950 7.727 0.223 18135 18211 1 20 . 1 1 20 20 GLN N N 20 118.605 118.605 115.247 3.358 18135 18212 1 20 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.201 -0.266 18135 18213 1 20 . 1 1 20 20 GLN C C 20 176.945 176.945 177.415 -0.470 18135 18214 1 20 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.221 0.794 18135 18215 1 20 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.320 -0.846 18135 18216 1 20 . 1 1 20 20 GLN H H 20 7.958 7.958 7.894 0.064 18135 18217 1 20 . 1 1 21 21 MET N N 21 116.693 116.693 117.876 -1.183 18135 18218 1 20 . 1 1 21 21 MET HA H 21 3.861 3.861 4.378 -0.517 18135 18219 1 20 . 1 1 21 21 MET C C 21 174.671 174.671 175.277 -0.606 18135 18220 1 20 . 1 1 21 21 MET CA C 21 57.111 57.111 57.186 -0.075 18135 18221 1 20 . 1 1 21 21 MET CB C 21 34.073 34.073 33.699 0.374 18135 18222 1 20 . 1 1 21 21 MET H H 21 7.420 7.420 7.895 -0.475 18135 18223 1 20 . 1 1 22 22 ARG N N 22 115.451 115.451 119.604 -4.153 18135 18224 1 20 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.839 0.014 18135 18225 1 20 . 1 1 22 22 ARG C C 22 175.950 175.950 175.082 0.868 18135 18226 1 20 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.104 3.348 18135 18227 1 20 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.312 1.202 18135 18228 1 20 . 1 1 22 22 ARG H H 22 6.484 6.484 7.209 -0.725 18135 18229 1 20 . 1 1 23 23 LYS N N 23 128.593 128.593 123.932 4.661 18135 18230 1 20 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.596 -0.111 18135 18231 1 20 . 1 1 23 23 LYS C C 23 176.643 176.643 175.494 1.149 18135 18232 1 20 . 1 1 23 23 LYS CA C 23 57.287 57.287 56.193 1.094 18135 18233 1 20 . 1 1 23 23 LYS CB C 23 36.261 36.261 32.067 4.194 18135 18234 1 20 . 1 1 23 23 LYS H H 23 10.212 10.212 8.772 1.440 18135 18235 1 20 . 1 1 24 24 ILE N N 24 118.605 118.605 122.566 -3.961 18135 18236 1 20 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.435 0.049 18135 18237 1 20 . 1 1 24 24 ILE C C 24 173.878 173.878 174.521 -0.643 18135 18238 1 20 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.351 -0.754 18135 18239 1 20 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.464 -0.008 18135 18240 1 20 . 1 1 24 24 ILE H H 24 8.465 8.465 8.497 -0.032 18135 18241 1 20 . 1 1 25 25 SER N N 25 113.658 113.658 117.839 -4.181 18135 18242 1 20 . 1 1 25 25 SER HA H 25 4.481 4.481 4.907 -0.426 18135 18243 1 20 . 1 1 25 25 SER C C 25 176.359 176.359 175.530 0.829 18135 18244 1 20 . 1 1 25 25 SER CA C 25 56.975 56.975 56.944 0.031 18135 18245 1 20 . 1 1 25 25 SER CB C 25 64.759 64.759 63.965 0.794 18135 18246 1 20 . 1 1 25 25 SER H H 25 8.104 8.104 8.700 -0.596 18135 18247 1 20 . 1 1 26 26 LEU N N 26 127.566 127.566 126.040 1.526 18135 18248 1 20 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.219 -0.342 18135 18249 1 20 . 1 1 26 26 LEU C C 26 178.946 178.946 177.274 1.672 18135 18250 1 20 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.555 0.123 18135 18251 1 20 . 1 1 26 26 LEU CB C 26 41.719 41.719 42.460 -0.741 18135 18252 1 20 . 1 1 26 26 LEU H H 26 8.802 8.802 9.017 -0.215 18135 18253 1 20 . 1 1 27 27 PHE N N 27 117.143 117.143 114.874 2.269 18135 18254 1 20 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.591 -0.353 18135 18255 1 20 . 1 1 27 27 PHE C C 27 177.067 177.067 176.957 0.110 18135 18256 1 20 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.567 1.523 18135 18257 1 20 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.667 -0.405 18135 18258 1 20 . 1 1 27 27 PHE H H 27 7.986 7.986 8.042 -0.056 18135 18259 1 20 . 1 1 28 28 SER N N 28 115.200 115.200 116.436 -1.236 18135 18260 1 20 . 1 1 28 28 SER HA H 28 4.505 4.505 4.410 0.095 18135 18261 1 20 . 1 1 28 28 SER C C 28 174.533 174.533 174.850 -0.317 18135 18262 1 20 . 1 1 28 28 SER CA C 28 59.447 59.447 60.571 -1.124 18135 18263 1 20 . 1 1 28 28 SER CB C 28 63.790 63.790 63.557 0.233 18135 18264 1 20 . 1 1 28 28 SER H H 28 7.929 7.929 8.215 -0.286 18135 18265 1 20 . 1 1 29 29 CYS N N 29 119.870 119.870 119.900 -0.030 18135 18266 1 20 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.685 0.397 18135 18267 1 20 . 1 1 29 29 CYS C C 29 176.475 176.475 173.978 2.497 18135 18268 1 20 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.336 -4.906 18135 18269 1 20 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.299 9.944 18135 18270 1 20 . 1 1 29 29 CYS H H 29 7.865 7.865 8.213 -0.348 18135 18271 1 20 . 1 1 30 30 LEU N N 30 122.259 122.259 121.868 0.391 18135 18272 1 20 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.385 -0.424 18135 18273 1 20 . 1 1 30 30 LEU C C 30 179.774 179.774 178.591 1.183 18135 18274 1 20 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.034 2.269 18135 18275 1 20 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.525 -0.949 18135 18276 1 20 . 1 1 30 30 LEU H H 30 7.812 7.812 8.363 -0.551 18135 18277 1 20 . 1 1 31 31 LYS N N 31 117.731 117.731 117.701 0.030 18135 18278 1 20 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.141 0.549 18135 18279 1 20 . 1 1 31 31 LYS C C 31 176.692 176.692 175.708 0.984 18135 18280 1 20 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.283 -3.206 18135 18281 1 20 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.899 -0.312 18135 18282 1 20 . 1 1 31 31 LYS H H 31 8.597 8.597 8.024 0.573 18135 18283 1 20 . 1 1 32 32 ASP N N 32 117.841 117.841 117.866 -0.025 18135 18284 1 20 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.576 0.118 18135 18285 1 20 . 1 1 32 32 ASP C C 32 175.505 175.505 176.182 -0.677 18135 18286 1 20 . 1 1 32 32 ASP CA C 32 54.088 54.088 53.857 0.231 18135 18287 1 20 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.332 -0.524 18135 18288 1 20 . 1 1 32 32 ASP H H 32 7.808 7.808 7.719 0.089 18135 18289 1 20 . 1 1 33 33 ARG N N 33 120.876 120.876 117.714 3.162 18135 18290 1 20 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.052 -0.011 18135 18291 1 20 . 1 1 33 33 ARG C C 33 175.286 175.286 175.912 -0.626 18135 18292 1 20 . 1 1 33 33 ARG CA C 33 58.083 58.083 58.273 -0.190 18135 18293 1 20 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.674 -0.661 18135 18294 1 20 . 1 1 33 33 ARG H H 33 7.378 7.378 7.074 0.304 18135 18295 1 20 . 1 1 34 34 HIS N N 34 120.555 120.555 115.832 4.723 18135 18296 1 20 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.654 -0.442 18135 18297 1 20 . 1 1 34 34 HIS C C 34 170.494 170.494 173.303 -2.809 18135 18298 1 20 . 1 1 34 34 HIS CA C 34 54.607 54.607 55.369 -0.762 18135 18299 1 20 . 1 1 34 34 HIS CB C 34 31.488 31.488 30.847 0.641 18135 18300 1 20 . 1 1 34 34 HIS H H 34 7.974 7.974 7.525 0.449 18135 18301 1 20 . 1 1 35 35 ASP N N 35 125.061 125.061 124.141 0.920 18135 18302 1 20 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.417 0.221 18135 18303 1 20 . 1 1 35 35 ASP C C 35 175.943 175.943 176.180 -0.237 18135 18304 1 20 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.443 -2.074 18135 18305 1 20 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.316 -0.954 18135 18306 1 20 . 1 1 35 35 ASP H H 35 7.805 7.805 8.441 -0.636 18135 18307 1 20 . 1 1 36 36 PHE N N 36 122.860 122.860 120.286 2.574 18135 18308 1 20 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.442 -0.117 18135 18309 1 20 . 1 1 36 36 PHE C C 36 176.643 176.643 176.398 0.245 18135 18310 1 20 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.190 1.449 18135 18311 1 20 . 1 1 36 36 PHE CB C 36 40.691 40.691 39.003 1.688 18135 18312 1 20 . 1 1 36 36 PHE H H 36 8.973 8.973 7.524 1.449 18135 18313 1 20 . 1 1 37 37 GLY N N 37 111.856 111.856 109.388 2.468 18135 18314 1 20 . 1 1 37 37 GLY C C 37 175.185 175.185 174.969 0.216 18135 18315 1 20 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.939 3.204 18135 18316 1 20 . 1 1 37 37 GLY H H 37 8.727 8.727 8.260 0.467 18135 18317 1 20 . 1 1 38 38 PHE N N 38 123.178 123.178 122.009 1.169 18135 18318 1 20 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.870 -0.956 18135 18319 1 20 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.938 1.866 18135 18320 1 20 . 1 1 38 38 PHE CB C 38 38.657 38.657 39.187 -0.529 18135 18321 1 20 . 1 1 38 38 PHE H H 38 9.169 9.169 8.222 0.947 18135 18322 1 20 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.407 0.122 18135 18323 1 20 . 1 1 39 39 PRO C C 39 174.634 174.634 176.755 -2.121 18135 18324 1 20 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.596 -1.053 18135 18325 1 20 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.628 -1.924 18135 18326 1 20 . 1 1 40 40 GLN N N 40 123.608 123.608 123.319 0.289 18135 18327 1 20 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.271 -0.652 18135 18328 1 20 . 1 1 40 40 GLN C C 40 176.958 176.958 177.669 -0.711 18135 18329 1 20 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.761 -0.688 18135 18330 1 20 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.632 1.185 18135 18331 1 20 . 1 1 40 40 GLN H H 40 7.966 7.966 8.105 -0.139 18135 18332 1 20 . 1 1 41 41 GLU N N 41 119.446 119.446 119.621 -0.175 18135 18333 1 20 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.116 0.021 18135 18334 1 20 . 1 1 41 41 GLU C C 41 177.346 177.346 177.625 -0.279 18135 18335 1 20 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.837 -0.908 18135 18336 1 20 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.238 -1.405 18135 18337 1 20 . 1 1 41 41 GLU H H 41 9.044 9.044 8.623 0.421 18135 18338 1 20 . 1 1 42 42 GLU N N 42 117.196 117.196 117.955 -0.759 18135 18339 1 20 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.292 -0.229 18135 18340 1 20 . 1 1 42 42 GLU C C 42 174.886 174.886 178.019 -3.133 18135 18341 1 20 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.810 -1.426 18135 18342 1 20 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.985 -2.427 18135 18343 1 20 . 1 1 42 42 GLU H H 42 7.646 7.646 7.871 -0.225 18135 18344 1 20 . 1 1 43 43 PHE N N 43 115.527 115.527 121.963 -6.436 18135 18345 1 20 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.550 -0.064 18135 18346 1 20 . 1 1 43 43 PHE C C 43 175.615 175.615 175.739 -0.124 18135 18347 1 20 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.893 -1.345 18135 18348 1 20 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.405 -0.512 18135 18349 1 20 . 1 1 43 43 PHE H H 43 7.601 7.601 8.514 -0.913 18135 18350 1 20 . 1 1 44 44 GLY N N 44 107.243 107.243 108.422 -1.179 18135 18351 1 20 . 1 1 44 44 GLY C C 44 174.032 174.032 174.241 -0.209 18135 18352 1 20 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.943 -0.331 18135 18353 1 20 . 1 1 44 44 GLY H H 44 7.733 7.733 7.771 -0.038 18135 18354 1 20 . 1 1 45 45 ASN N N 45 117.599 117.599 120.686 -3.087 18135 18355 1 20 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.776 -0.225 18135 18356 1 20 . 1 1 45 45 ASN C C 45 175.894 175.894 174.593 1.301 18135 18357 1 20 . 1 1 45 45 ASN CA C 45 53.849 53.849 52.836 1.013 18135 18358 1 20 . 1 1 45 45 ASN CB C 45 38.419 38.419 40.133 -1.714 18135 18359 1 20 . 1 1 45 45 ASN H H 45 8.343 8.343 7.557 0.786 18135 18360 1 20 . 1 1 46 46 GLN N N 46 118.916 118.916 118.847 0.069 18135 18361 1 20 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.367 -0.285 18135 18362 1 20 . 1 1 46 46 GLN C C 46 175.851 175.851 175.474 0.377 18135 18363 1 20 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.072 1.574 18135 18364 1 20 . 1 1 46 46 GLN CB C 46 28.444 28.444 27.098 1.346 18135 18365 1 20 . 1 1 46 46 GLN H H 46 8.652 8.652 8.347 0.305 18135 18366 1 20 . 1 1 47 47 PHE N N 47 119.511 119.511 119.094 0.417 18135 18367 1 20 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.556 0.006 18135 18368 1 20 . 1 1 47 47 PHE C C 47 176.258 176.258 175.775 0.483 18135 18369 1 20 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.710 -0.790 18135 18370 1 20 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.898 -0.040 18135 18371 1 20 . 1 1 47 47 PHE H H 47 7.904 7.904 7.802 0.102 18135 18372 1 20 . 1 1 48 48 GLN N N 48 120.127 120.127 118.275 1.852 18135 18373 1 20 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.606 -0.231 18135 18374 1 20 . 1 1 48 48 GLN C C 48 181.265 181.265 175.629 5.636 18135 18375 1 20 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.349 1.227 18135 18376 1 20 . 1 1 48 48 GLN CB C 48 29.468 29.468 29.808 -0.340 18135 18377 1 20 . 1 1 48 48 GLN H H 48 8.255 8.255 7.785 0.470 18135 18378 1 20 . 1 1 49 49 LYS N N 49 121.777 121.777 121.202 0.575 18135 18379 1 20 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.336 -0.233 18135 18380 1 20 . 1 1 49 49 LYS C C 49 177.968 177.968 177.239 0.729 18135 18381 1 20 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.822 -0.673 18135 18382 1 20 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.340 0.050 18135 18383 1 20 . 1 1 49 49 LYS H H 49 8.426 8.426 8.565 -0.139 18135 18384 1 20 . 1 1 50 50 ALA N N 50 120.573 120.573 118.535 2.038 18135 18385 1 20 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.307 -0.237 18135 18386 1 20 . 1 1 50 50 ALA C C 50 178.697 178.697 177.282 1.415 18135 18387 1 20 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.135 1.633 18135 18388 1 20 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.316 0.558 18135 18389 1 20 . 1 1 50 50 ALA H H 50 8.578 8.578 8.028 0.550 18135 18390 1 20 . 1 1 51 51 GLU N N 51 115.015 115.015 115.316 -0.301 18135 18391 1 20 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.336 -0.070 18135 18392 1 20 . 1 1 51 51 GLU C C 51 176.995 176.995 176.955 0.040 18135 18393 1 20 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.090 -0.097 18135 18394 1 20 . 1 1 51 51 GLU CB C 51 28.905 28.905 30.163 -1.258 18135 18395 1 20 . 1 1 51 51 GLU H H 51 7.907 7.907 8.221 -0.314 18135 18396 1 20 . 1 1 52 52 THR N N 52 111.210 111.210 115.080 -3.870 18135 18397 1 20 . 1 1 52 52 THR HA H 52 4.114 4.114 4.307 -0.193 18135 18398 1 20 . 1 1 52 52 THR C C 52 175.271 175.271 175.903 -0.632 18135 18399 1 20 . 1 1 52 52 THR CA C 52 63.611 63.611 65.128 -1.517 18135 18400 1 20 . 1 1 52 52 THR CB C 52 69.673 69.673 68.999 0.674 18135 18401 1 20 . 1 1 52 52 THR H H 52 7.863 7.863 7.413 0.450 18135 18402 1 20 . 1 1 53 53 ILE N N 53 119.113 119.113 122.145 -3.032 18135 18403 1 20 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.075 -0.211 18135 18404 1 20 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.735 1.172 18135 18405 1 20 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.318 -1.365 18135 18406 1 20 . 1 1 53 53 ILE H H 53 8.341 8.341 8.177 0.164 18135 18407 1 20 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.390 -0.104 18135 18408 1 20 . 1 1 54 54 PRO C C 54 179.655 179.655 178.986 0.669 18135 18409 1 20 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.083 -0.032 18135 18410 1 20 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.375 0.510 18135 18411 1 20 . 1 1 55 55 VAL N N 55 116.355 116.355 116.625 -0.270 18135 18412 1 20 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.921 -0.240 18135 18413 1 20 . 1 1 55 55 VAL C C 55 177.649 177.649 177.817 -0.168 18135 18414 1 20 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.501 0.336 18135 18415 1 20 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.598 0.874 18135 18416 1 20 . 1 1 55 55 VAL H H 55 7.119 7.119 7.597 -0.478 18135 18417 1 20 . 1 1 56 56 LEU N N 56 123.038 123.038 121.884 1.154 18135 18418 1 20 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.068 0.242 18135 18419 1 20 . 1 1 56 56 LEU C C 56 178.637 178.637 178.013 0.624 18135 18420 1 20 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.510 -0.424 18135 18421 1 20 . 1 1 56 56 LEU CB C 56 42.318 42.318 40.856 1.462 18135 18422 1 20 . 1 1 56 56 LEU H H 56 8.535 8.535 8.475 0.060 18135 18423 1 20 . 1 1 57 57 HIS N N 57 117.041 117.041 118.715 -1.674 18135 18424 1 20 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.031 -0.245 18135 18425 1 20 . 1 1 57 57 HIS C C 57 175.640 175.640 177.483 -1.843 18135 18426 1 20 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.651 0.880 18135 18427 1 20 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.150 -1.941 18135 18428 1 20 . 1 1 57 57 HIS H H 57 9.047 9.047 8.165 0.882 18135 18429 1 20 . 1 1 58 58 GLU N N 58 119.521 119.521 118.489 1.032 18135 18430 1 20 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.775 0.232 18135 18431 1 20 . 1 1 58 58 GLU C C 58 179.029 179.029 178.732 0.297 18135 18432 1 20 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.404 -0.437 18135 18433 1 20 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.407 -1.117 18135 18434 1 20 . 1 1 58 58 GLU H H 58 7.860 7.860 8.204 -0.344 18135 18435 1 20 . 1 1 59 59 MET N N 59 119.512 119.512 119.851 -0.339 18135 18436 1 20 . 1 1 59 59 MET HA H 59 4.074 4.074 4.218 -0.144 18135 18437 1 20 . 1 1 59 59 MET C C 59 177.031 177.031 178.787 -1.756 18135 18438 1 20 . 1 1 59 59 MET CA C 59 59.408 59.408 59.595 -0.187 18135 18439 1 20 . 1 1 59 59 MET CB C 59 32.525 32.525 32.891 -0.366 18135 18440 1 20 . 1 1 59 59 MET H H 59 8.442 8.442 7.949 0.493 18135 18441 1 20 . 1 1 60 60 ILE N N 60 117.183 117.183 117.797 -0.614 18135 18442 1 20 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.517 -0.100 18135 18443 1 20 . 1 1 60 60 ILE C C 60 177.524 177.524 178.143 -0.619 18135 18444 1 20 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.575 0.751 18135 18445 1 20 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.148 -0.288 18135 18446 1 20 . 1 1 60 60 ILE H H 60 8.338 8.338 7.630 0.708 18135 18447 1 20 . 1 1 61 61 GLN N N 61 120.191 120.191 120.267 -0.076 18135 18448 1 20 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.746 -0.044 18135 18449 1 20 . 1 1 61 61 GLN C C 61 178.270 178.270 177.826 0.444 18135 18450 1 20 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.280 -0.494 18135 18451 1 20 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.213 0.453 18135 18452 1 20 . 1 1 61 61 GLN H H 61 8.234 8.234 8.181 0.053 18135 18453 1 20 . 1 1 62 62 GLN N N 62 116.795 116.795 118.788 -1.993 18135 18454 1 20 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.521 0.106 18135 18455 1 20 . 1 1 62 62 GLN C C 62 179.685 179.685 178.657 1.028 18135 18456 1 20 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.441 -0.433 18135 18457 1 20 . 1 1 62 62 GLN CB C 62 24.342 24.342 28.059 -3.717 18135 18458 1 20 . 1 1 62 62 GLN H H 62 8.421 8.421 8.173 0.248 18135 18459 1 20 . 1 1 63 63 ILE N N 63 122.797 122.797 120.098 2.699 18135 18460 1 20 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.948 -0.299 18135 18461 1 20 . 1 1 63 63 ILE C C 63 177.279 177.279 177.883 -0.604 18135 18462 1 20 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.466 2.499 18135 18463 1 20 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.849 -0.534 18135 18464 1 20 . 1 1 63 63 ILE H H 63 8.164 8.164 7.681 0.483 18135 18465 1 20 . 1 1 64 64 PHE N N 64 120.820 120.820 121.503 -0.683 18135 18466 1 20 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.475 -0.759 18135 18467 1 20 . 1 1 64 64 PHE C C 64 178.402 178.402 176.649 1.753 18135 18468 1 20 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.349 0.803 18135 18469 1 20 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.763 -0.253 18135 18470 1 20 . 1 1 64 64 PHE H H 64 8.405 8.405 8.046 0.359 18135 18471 1 20 . 1 1 65 65 ASN N N 65 119.981 119.981 118.435 1.546 18135 18472 1 20 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.755 0.308 18135 18473 1 20 . 1 1 65 65 ASN C C 65 177.944 177.944 177.204 0.740 18135 18474 1 20 . 1 1 65 65 ASN CA C 65 55.868 55.868 55.855 0.013 18135 18475 1 20 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.379 -1.123 18135 18476 1 20 . 1 1 65 65 ASN H H 65 8.812 8.812 8.190 0.622 18135 18477 1 20 . 1 1 66 66 LEU N N 66 121.533 121.533 119.865 1.668 18135 18478 1 20 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.302 -0.079 18135 18479 1 20 . 1 1 66 66 LEU C C 66 177.777 177.777 177.904 -0.127 18135 18480 1 20 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.668 0.600 18135 18481 1 20 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.328 0.279 18135 18482 1 20 . 1 1 66 66 LEU H H 66 8.177 8.177 7.908 0.269 18135 18483 1 20 . 1 1 67 67 PHE N N 67 110.842 110.842 113.459 -2.617 18135 18484 1 20 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.698 0.182 18135 18485 1 20 . 1 1 67 67 PHE C C 67 177.965 177.965 176.446 1.519 18135 18486 1 20 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.091 1.443 18135 18487 1 20 . 1 1 67 67 PHE CB C 67 38.616 38.616 39.194 -0.577 18135 18488 1 20 . 1 1 67 67 PHE H H 67 8.160 8.160 8.247 -0.087 18135 18489 1 20 . 1 1 68 68 SER N N 68 119.131 119.131 113.335 5.796 18135 18490 1 20 . 1 1 68 68 SER HA H 68 4.580 4.580 4.247 0.333 18135 18491 1 20 . 1 1 68 68 SER C C 68 173.472 173.472 174.215 -0.743 18135 18492 1 20 . 1 1 68 68 SER CA C 68 59.191 59.191 58.897 0.294 18135 18493 1 20 . 1 1 68 68 SER CB C 68 63.123 63.123 63.319 -0.196 18135 18494 1 20 . 1 1 68 68 SER H H 68 8.016 8.016 7.620 0.396 18135 18495 1 20 . 1 1 69 69 THR N N 69 111.353 111.353 114.538 -3.185 18135 18496 1 20 . 1 1 69 69 THR HA H 69 4.345 4.345 4.385 -0.040 18135 18497 1 20 . 1 1 69 69 THR C C 69 175.661 175.661 175.011 0.650 18135 18498 1 20 . 1 1 69 69 THR CA C 69 61.411 61.411 60.642 0.769 18135 18499 1 20 . 1 1 69 69 THR CB C 69 72.209 72.209 70.409 1.800 18135 18500 1 20 . 1 1 69 69 THR H H 69 6.977 6.977 7.208 -0.231 18135 18501 1 20 . 1 1 70 70 LYS N N 70 121.120 121.120 122.997 -1.877 18135 18502 1 20 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.144 -0.055 18135 18503 1 20 . 1 1 70 70 LYS C C 70 179.259 179.259 177.623 1.636 18135 18504 1 20 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.414 -0.458 18135 18505 1 20 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.128 -0.378 18135 18506 1 20 . 1 1 70 70 LYS H H 70 9.065 9.065 8.574 0.491 18135 18507 1 20 . 1 1 71 71 ASP N N 71 116.374 116.374 120.231 -3.857 18135 18508 1 20 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.258 -0.083 18135 18509 1 20 . 1 1 71 71 ASP C C 71 178.372 178.372 177.241 1.131 18135 18510 1 20 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.237 -0.170 18135 18511 1 20 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.468 -0.162 18135 18512 1 20 . 1 1 71 71 ASP H H 71 7.518 7.518 7.808 -0.290 18135 18513 1 20 . 1 1 72 72 SER N N 72 117.341 117.341 113.367 3.974 18135 18514 1 20 . 1 1 72 72 SER HA H 72 3.715 3.715 3.091 0.624 18135 18515 1 20 . 1 1 72 72 SER C C 72 176.897 176.897 175.604 1.293 18135 18516 1 20 . 1 1 72 72 SER CA C 72 60.267 60.267 60.705 -0.438 18135 18517 1 20 . 1 1 72 72 SER CB C 72 62.616 62.616 62.856 -0.240 18135 18518 1 20 . 1 1 72 72 SER H H 72 8.066 8.066 7.813 0.253 18135 18519 1 20 . 1 1 73 73 SER N N 73 113.398 113.398 117.367 -3.969 18135 18520 1 20 . 1 1 73 73 SER HA H 73 4.094 4.094 4.092 0.002 18135 18521 1 20 . 1 1 73 73 SER C C 73 174.855 174.855 175.078 -0.223 18135 18522 1 20 . 1 1 73 73 SER CA C 73 61.385 61.385 60.432 0.953 18135 18523 1 20 . 1 1 73 73 SER CB C 73 62.798 62.798 62.812 -0.014 18135 18524 1 20 . 1 1 73 73 SER H H 73 7.982 7.982 7.529 0.453 18135 18525 1 20 . 1 1 74 74 ALA N N 74 119.486 119.486 120.025 -0.539 18135 18526 1 20 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.221 -0.064 18135 18527 1 20 . 1 1 74 74 ALA C C 74 177.626 177.626 177.111 0.515 18135 18528 1 20 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.419 0.294 18135 18529 1 20 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.829 -0.082 18135 18530 1 20 . 1 1 74 74 ALA H H 74 7.095 7.095 7.433 -0.338 18135 18531 1 20 . 1 1 75 75 ALA N N 75 121.465 121.465 120.916 0.549 18135 18532 1 20 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.977 -0.281 18135 18533 1 20 . 1 1 75 75 ALA C C 75 177.197 177.197 175.575 1.622 18135 18534 1 20 . 1 1 75 75 ALA CA C 75 53.004 53.004 51.959 1.045 18135 18535 1 20 . 1 1 75 75 ALA CB C 75 18.260 18.260 19.131 -0.872 18135 18536 1 20 . 1 1 75 75 ALA H H 75 7.159 7.159 7.471 -0.312 18135 18537 1 20 . 1 1 76 76 TRP N N 76 116.791 116.791 116.427 0.364 18135 18538 1 20 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.696 0.354 18135 18539 1 20 . 1 1 76 76 TRP C C 76 177.617 177.617 175.011 2.606 18135 18540 1 20 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.196 -1.877 18135 18541 1 20 . 1 1 76 76 TRP CB C 76 33.076 33.076 31.104 1.972 18135 18542 1 20 . 1 1 76 76 TRP H H 76 7.080 7.080 7.184 -0.104 18135 18543 1 20 . 1 1 77 77 ASP N N 77 119.928 119.928 121.172 -1.244 18135 18544 1 20 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.593 -0.236 18135 18545 1 20 . 1 1 77 77 ASP C C 77 176.877 176.877 177.692 -0.815 18135 18546 1 20 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.310 -0.492 18135 18547 1 20 . 1 1 77 77 ASP CB C 77 42.615 42.615 41.650 0.965 18135 18548 1 20 . 1 1 77 77 ASP H H 77 8.259 8.259 8.647 -0.388 18135 18549 1 20 . 1 1 78 78 GLU N N 78 127.277 127.277 126.354 0.923 18135 18550 1 20 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.912 -0.027 18135 18551 1 20 . 1 1 78 78 GLU C C 78 177.439 177.439 178.041 -0.602 18135 18552 1 20 . 1 1 78 78 GLU CA C 78 59.384 59.384 60.132 -0.748 18135 18553 1 20 . 1 1 78 78 GLU CB C 78 28.642 28.642 28.965 -0.323 18135 18554 1 20 . 1 1 78 78 GLU H H 78 8.920 8.920 8.821 0.099 18135 18555 1 20 . 1 1 79 79 THR N N 79 115.422 115.422 117.415 -1.993 18135 18556 1 20 . 1 1 79 79 THR HA H 79 3.907 3.907 4.117 -0.210 18135 18557 1 20 . 1 1 79 79 THR C C 79 177.330 177.330 176.566 0.764 18135 18558 1 20 . 1 1 79 79 THR CA C 79 66.263 66.263 64.914 1.349 18135 18559 1 20 . 1 1 79 79 THR CB C 79 68.002 68.002 68.108 -0.106 18135 18560 1 20 . 1 1 79 79 THR H H 79 8.124 8.124 8.222 -0.098 18135 18561 1 20 . 1 1 80 80 LEU N N 80 121.791 121.791 122.606 -0.815 18135 18562 1 20 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.135 -0.248 18135 18563 1 20 . 1 1 80 80 LEU C C 80 179.018 179.018 178.752 0.266 18135 18564 1 20 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.478 -0.239 18135 18565 1 20 . 1 1 80 80 LEU CB C 80 41.652 41.652 40.901 0.751 18135 18566 1 20 . 1 1 80 80 LEU H H 80 7.725 7.725 8.088 -0.363 18135 18567 1 20 . 1 1 81 81 LEU N N 81 119.280 119.280 120.569 -1.289 18135 18568 1 20 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.197 -0.708 18135 18569 1 20 . 1 1 81 81 LEU C C 81 177.062 177.062 178.745 -1.683 18135 18570 1 20 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.547 -0.838 18135 18571 1 20 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.157 -1.209 18135 18572 1 20 . 1 1 81 81 LEU H H 81 8.344 8.344 8.809 -0.465 18135 18573 1 20 . 1 1 82 82 ASP N N 82 115.357 115.357 119.953 -4.596 18135 18574 1 20 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.381 -0.107 18135 18575 1 20 . 1 1 82 82 ASP C C 82 179.018 179.018 178.477 0.541 18135 18576 1 20 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.816 -1.001 18135 18577 1 20 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.907 -2.686 18135 18578 1 20 . 1 1 82 82 ASP H H 82 8.001 8.001 8.540 -0.539 18135 18579 1 20 . 1 1 83 83 LYS N N 83 119.603 119.603 118.762 0.841 18135 18580 1 20 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.890 0.092 18135 18581 1 20 . 1 1 83 83 LYS C C 83 178.624 178.624 178.943 -0.319 18135 18582 1 20 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.897 0.848 18135 18583 1 20 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.261 0.845 18135 18584 1 20 . 1 1 83 83 LYS H H 83 7.342 7.342 7.705 -0.363 18135 18585 1 20 . 1 1 84 84 PHE N N 84 123.933 123.933 121.836 2.097 18135 18586 1 20 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.045 -0.010 18135 18587 1 20 . 1 1 84 84 PHE C C 84 177.210 177.210 177.038 0.172 18135 18588 1 20 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.827 -1.484 18135 18589 1 20 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.928 0.389 18135 18590 1 20 . 1 1 84 84 PHE H H 84 8.471 8.471 8.426 0.045 18135 18591 1 20 . 1 1 85 85 TYR N N 85 118.387 118.387 117.523 0.864 18135 18592 1 20 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.782 0.286 18135 18593 1 20 . 1 1 85 85 TYR C C 85 178.104 178.104 177.620 0.484 18135 18594 1 20 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.718 -1.141 18135 18595 1 20 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.529 -0.552 18135 18596 1 20 . 1 1 85 85 TYR H H 85 9.011 9.011 8.968 0.043 18135 18597 1 20 . 1 1 86 86 THR N N 86 114.035 114.035 115.993 -1.958 18135 18598 1 20 . 1 1 86 86 THR HA H 86 3.945 3.945 3.200 0.745 18135 18599 1 20 . 1 1 86 86 THR C C 86 176.708 176.708 176.250 0.458 18135 18600 1 20 . 1 1 86 86 THR CA C 86 66.759 66.759 66.929 -0.170 18135 18601 1 20 . 1 1 86 86 THR CB C 86 68.853 68.853 68.002 0.851 18135 18602 1 20 . 1 1 86 86 THR H H 86 7.609 7.609 7.355 0.254 18135 18603 1 20 . 1 1 87 87 GLU N N 87 120.790 120.790 122.299 -1.509 18135 18604 1 20 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.936 0.111 18135 18605 1 20 . 1 1 87 87 GLU C C 87 179.606 179.606 178.876 0.730 18135 18606 1 20 . 1 1 87 87 GLU CA C 87 58.398 58.398 58.896 -0.498 18135 18607 1 20 . 1 1 87 87 GLU CB C 87 28.286 28.286 28.851 -0.565 18135 18608 1 20 . 1 1 87 87 GLU H H 87 7.712 7.712 7.633 0.079 18135 18609 1 20 . 1 1 88 88 LEU N N 88 120.729 120.729 120.023 0.706 18135 18610 1 20 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.896 -0.168 18135 18611 1 20 . 1 1 88 88 LEU C C 88 178.695 178.695 179.240 -0.545 18135 18612 1 20 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.473 0.778 18135 18613 1 20 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.067 1.520 18135 18614 1 20 . 1 1 88 88 LEU H H 88 8.393 8.393 7.400 0.993 18135 18615 1 20 . 1 1 89 89 TYR N N 89 118.654 118.654 118.718 -0.064 18135 18616 1 20 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.069 -0.138 18135 18617 1 20 . 1 1 89 89 TYR C C 89 178.438 178.438 178.586 -0.148 18135 18618 1 20 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.230 0.177 18135 18619 1 20 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.391 0.476 18135 18620 1 20 . 1 1 89 89 TYR H H 89 8.637 8.637 8.268 0.369 18135 18621 1 20 . 1 1 90 90 GLN N N 90 118.263 118.263 116.421 1.842 18135 18622 1 20 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.987 -0.001 18135 18623 1 20 . 1 1 90 90 GLN C C 90 178.411 178.411 178.770 -0.359 18135 18624 1 20 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.631 0.151 18135 18625 1 20 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.278 -0.131 18135 18626 1 20 . 1 1 90 90 GLN H H 90 7.796 7.796 7.820 -0.024 18135 18627 1 20 . 1 1 91 91 GLN N N 91 117.959 117.959 120.275 -2.316 18135 18628 1 20 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.057 0.025 18135 18629 1 20 . 1 1 91 91 GLN C C 91 178.705 178.705 178.518 0.187 18135 18630 1 20 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.770 0.050 18135 18631 1 20 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.353 0.820 18135 18632 1 20 . 1 1 91 91 GLN H H 91 7.727 7.727 7.996 -0.269 18135 18633 1 20 . 1 1 92 92 LEU N N 92 119.965 119.965 118.399 1.566 18135 18634 1 20 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.964 -0.230 18135 18635 1 20 . 1 1 92 92 LEU C C 92 178.984 178.984 178.673 0.311 18135 18636 1 20 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.967 -0.475 18135 18637 1 20 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.840 0.539 18135 18638 1 20 . 1 1 92 92 LEU H H 92 8.465 8.465 8.500 -0.035 18135 18639 1 20 . 1 1 93 93 ASN N N 93 117.793 117.793 118.204 -0.411 18135 18640 1 20 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.254 0.147 18135 18641 1 20 . 1 1 93 93 ASN C C 93 178.309 178.309 177.164 1.145 18135 18642 1 20 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.233 0.170 18135 18643 1 20 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.199 0.439 18135 18644 1 20 . 1 1 93 93 ASN H H 93 8.091 8.091 8.034 0.057 18135 18645 1 20 . 1 1 94 94 ASP N N 94 121.133 121.133 120.651 0.482 18135 18646 1 20 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.384 0.021 18135 18647 1 20 . 1 1 94 94 ASP C C 94 178.328 178.328 178.645 -0.317 18135 18648 1 20 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.111 -0.564 18135 18649 1 20 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.995 -2.346 18135 18650 1 20 . 1 1 94 94 ASP H H 94 8.362 8.362 7.932 0.430 18135 18651 1 20 . 1 1 95 95 LEU N N 95 119.160 119.160 121.204 -2.044 18135 18652 1 20 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.822 0.217 18135 18653 1 20 . 1 1 95 95 LEU C C 95 178.826 178.826 178.436 0.390 18135 18654 1 20 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.238 -1.211 18135 18655 1 20 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.101 0.109 18135 18656 1 20 . 1 1 95 95 LEU H H 95 8.143 8.143 8.538 -0.395 18135 18657 1 20 . 1 1 96 96 GLU N N 96 118.813 118.813 118.717 0.096 18135 18658 1 20 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.691 0.270 18135 18659 1 20 . 1 1 96 96 GLU C C 96 177.640 177.640 178.243 -0.603 18135 18660 1 20 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.464 -1.750 18135 18661 1 20 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.355 -1.217 18135 18662 1 20 . 1 1 96 96 GLU H H 96 8.111 8.111 8.303 -0.192 18135 18663 1 20 . 1 1 97 97 ALA N N 97 120.549 120.549 120.952 -0.403 18135 18664 1 20 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.983 0.139 18135 18665 1 20 . 1 1 97 97 ALA C C 97 179.126 179.126 180.301 -1.175 18135 18666 1 20 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.695 -0.662 18135 18667 1 20 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.879 0.101 18135 18668 1 20 . 1 1 97 97 ALA H H 97 7.798 7.798 7.747 0.051 18135 18669 1 20 . 1 1 98 98 CYS N N 98 115.510 115.510 117.286 -1.776 18135 18670 1 20 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.163 0.287 18135 18671 1 20 . 1 1 98 98 CYS C C 98 175.363 175.363 175.931 -0.568 18135 18672 1 20 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.313 -5.147 18135 18673 1 20 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.067 15.812 18135 18674 1 20 . 1 1 98 98 CYS H H 98 7.597 7.597 7.849 -0.252 18135 18675 1 20 . 1 1 99 99 VAL N N 99 121.713 121.713 118.787 2.926 18135 18676 1 20 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.821 -0.027 18135 18677 1 20 . 1 1 99 99 VAL C C 99 177.357 177.357 177.565 -0.208 18135 18678 1 20 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.426 -0.843 18135 18679 1 20 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.289 -0.258 18135 18680 1 20 . 1 1 99 99 VAL H H 99 7.828 7.828 7.527 0.301 18135 18681 1 20 . 1 1 100 100 ILE N N 100 122.333 122.333 117.455 4.878 18135 18682 1 20 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.743 0.181 18135 18683 1 20 . 1 1 100 100 ILE C C 100 176.827 176.827 176.661 0.166 18135 18684 1 20 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.620 -1.382 18135 18685 1 20 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.736 0.542 18135 18686 1 20 . 1 1 100 100 ILE H H 100 8.067 8.067 8.156 -0.089 18135 18687 1 20 . 1 1 101 101 GLN N N 101 121.864 121.864 117.380 4.484 18135 18688 1 20 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.245 -0.019 18135 18689 1 20 . 1 1 101 101 GLN C C 101 176.438 176.438 178.017 -1.579 18135 18690 1 20 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.400 -0.080 18135 18691 1 20 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.191 -0.180 18135 18692 1 20 . 1 1 101 101 GLN H H 101 8.062 8.062 7.406 0.656 18135 18693 1 20 . 1 1 102 102 GLY N N 102 109.288 109.288 107.921 1.367 18135 18694 1 20 . 1 1 102 102 GLY C C 102 173.855 173.855 175.353 -1.498 18135 18695 1 20 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.036 -0.877 18135 18696 1 20 . 1 1 102 102 GLY H H 102 8.087 8.087 8.836 -0.749 18135 18697 1 20 . 1 1 103 103 VAL N N 103 118.932 118.932 115.672 3.260 18135 18698 1 20 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.830 0.244 18135 18699 1 20 . 1 1 103 103 VAL C C 103 176.299 176.299 175.635 0.664 18135 18700 1 20 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.895 -1.397 18135 18701 1 20 . 1 1 103 103 VAL CB C 103 32.854 32.854 30.738 2.116 18135 18702 1 20 . 1 1 103 103 VAL H H 103 8.079 8.079 7.658 0.421 18135 18703 1 20 . 1 1 104 104 GLY N N 104 112.028 112.028 109.042 2.986 18135 18704 1 20 . 1 1 104 104 GLY C C 104 173.694 173.694 173.209 0.485 18135 18705 1 20 . 1 1 104 104 GLY CA C 104 45.402 45.402 44.821 0.581 18135 18706 1 20 . 1 1 104 104 GLY H H 104 8.446 8.446 7.541 0.905 18135 18707 1 20 . 1 1 105 105 VAL N N 105 120.439 120.439 121.938 -1.499 18135 18708 1 20 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.403 -0.215 18135 18709 1 20 . 1 1 105 105 VAL C C 105 175.963 175.963 174.387 1.576 18135 18710 1 20 . 1 1 105 105 VAL CA C 105 62.136 62.136 60.527 1.609 18135 18711 1 20 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.349 -1.535 18135 18712 1 20 . 1 1 105 105 VAL H H 105 7.867 7.867 7.984 -0.117 18135 18713 1 20 . 1 1 106 106 THR N N 106 116.366 116.366 117.617 -1.251 18135 18714 1 20 . 1 1 106 106 THR HA H 106 4.548 4.548 4.619 -0.071 18135 18715 1 20 . 1 1 106 106 THR C C 106 173.731 173.731 173.717 0.014 18135 18716 1 20 . 1 1 106 106 THR CA C 106 59.419 59.419 60.276 -0.858 18135 18717 1 20 . 1 1 106 106 THR CB C 106 79.536 79.536 70.778 8.758 18135 18718 1 20 . 1 1 106 106 THR H H 106 8.565 8.565 8.080 0.485 18135 18719 1 20 . 1 1 107 107 GLU N N 107 119.743 119.743 119.017 0.726 18135 18720 1 20 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.593 -0.131 18135 18721 1 20 . 1 1 107 107 GLU C C 107 175.639 175.639 175.994 -0.355 18135 18722 1 20 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.902 0.809 18135 18723 1 20 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.369 -0.870 18135 18724 1 20 . 1 1 107 107 GLU H H 107 8.410 8.410 8.380 0.030 18135 18725 1 20 . 1 1 108 108 THR N N 108 114.402 114.402 111.811 2.591 18135 18726 1 20 . 1 1 108 108 THR HA H 108 4.448 4.448 4.801 -0.352 18135 18727 1 20 . 1 1 108 108 THR CA C 108 60.348 60.348 58.256 2.092 18135 18728 1 20 . 1 1 108 108 THR CB C 108 68.544 68.544 68.526 0.018 18135 18729 1 20 . 1 1 108 108 THR H H 108 8.155 8.155 8.582 -0.427 18135 18730 1 20 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.433 -0.195 18135 18731 1 20 . 1 1 109 109 PRO C C 109 178.666 178.666 177.437 1.229 18135 18732 1 20 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.178 1.198 18135 18733 1 20 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.978 -0.130 18135 18734 1 20 . 1 1 110 110 LEU N N 110 118.566 118.566 117.963 0.603 18135 18735 1 20 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.206 -0.090 18135 18736 1 20 . 1 1 110 110 LEU C C 110 178.293 178.293 178.984 -0.691 18135 18737 1 20 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.663 -0.977 18135 18738 1 20 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.152 0.817 18135 18739 1 20 . 1 1 110 110 LEU H H 110 8.016 8.016 8.029 -0.013 18135 18740 1 20 . 1 1 111 111 MET N N 111 118.982 118.982 116.045 2.937 18135 18741 1 20 . 1 1 111 111 MET HA H 111 4.210 4.210 4.266 -0.056 18135 18742 1 20 . 1 1 111 111 MET C C 111 178.720 178.720 177.919 0.801 18135 18743 1 20 . 1 1 111 111 MET CA C 111 58.144 58.144 58.029 0.115 18135 18744 1 20 . 1 1 111 111 MET CB C 111 32.374 32.374 32.946 -0.572 18135 18745 1 20 . 1 1 111 111 MET H H 111 7.705 7.705 7.990 -0.285 18135 18746 1 20 . 1 1 112 112 LYS N N 112 121.377 121.377 120.362 1.015 18135 18747 1 20 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.045 0.063 18135 18748 1 20 . 1 1 112 112 LYS C C 112 178.000 178.000 178.416 -0.416 18135 18749 1 20 . 1 1 112 112 LYS CA C 112 56.305 56.305 59.269 -2.964 18135 18750 1 20 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.225 0.142 18135 18751 1 20 . 1 1 112 112 LYS H H 112 8.257 8.257 7.625 0.632 18135 18752 1 20 . 1 1 113 113 GLU N N 113 119.104 119.104 118.750 0.354 18135 18753 1 20 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.000 0.066 18135 18754 1 20 . 1 1 113 113 GLU C C 113 178.289 178.289 178.807 -0.518 18135 18755 1 20 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.885 -1.632 18135 18756 1 20 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.235 -1.097 18135 18757 1 20 . 1 1 113 113 GLU H H 113 8.270 8.270 7.821 0.449 18135 18758 1 20 . 1 1 114 114 ASP N N 114 119.224 119.224 120.004 -0.780 18135 18759 1 20 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.419 -0.131 18135 18760 1 20 . 1 1 114 114 ASP C C 114 178.365 178.365 178.762 -0.397 18135 18761 1 20 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.185 -1.077 18135 18762 1 20 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.067 -1.832 18135 18763 1 20 . 1 1 114 114 ASP H H 114 8.618 8.618 7.839 0.779 18135 18764 1 20 . 1 1 115 115 SER N N 115 118.195 118.195 116.219 1.976 18135 18765 1 20 . 1 1 115 115 SER HA H 115 4.200 4.200 4.134 0.066 18135 18766 1 20 . 1 1 115 115 SER C C 115 175.986 175.986 176.751 -0.765 18135 18767 1 20 . 1 1 115 115 SER CA C 115 61.588 61.588 61.915 -0.327 18135 18768 1 20 . 1 1 115 115 SER CB C 115 62.653 62.653 62.973 -0.320 18135 18769 1 20 . 1 1 115 115 SER H H 115 8.181 8.181 7.461 0.720 18135 18770 1 20 . 1 1 116 116 ILE N N 116 123.340 123.340 122.834 0.506 18135 18771 1 20 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.906 -0.280 18135 18772 1 20 . 1 1 116 116 ILE C C 116 178.367 178.367 178.626 -0.259 18135 18773 1 20 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.402 1.415 18135 18774 1 20 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.641 0.777 18135 18775 1 20 . 1 1 116 116 ILE H H 116 7.773 7.773 8.498 -0.725 18135 18776 1 20 . 1 1 117 117 LEU N N 117 120.968 120.968 121.580 -0.612 18135 18777 1 20 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.947 -0.042 18135 18778 1 20 . 1 1 117 117 LEU C C 117 178.746 178.746 178.358 0.388 18135 18779 1 20 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.648 -0.504 18135 18780 1 20 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.604 -0.018 18135 18781 1 20 . 1 1 117 117 LEU H H 117 8.406 8.406 8.206 0.200 18135 18782 1 20 . 1 1 118 118 ALA N N 118 120.150 120.150 122.038 -1.888 18135 18783 1 20 . 1 1 118 118 ALA HA H 118 4.112 4.112 4.047 0.065 18135 18784 1 20 . 1 1 118 118 ALA C C 118 181.633 181.633 179.621 2.012 18135 18785 1 20 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.417 -0.104 18135 18786 1 20 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.630 -0.520 18135 18787 1 20 . 1 1 118 118 ALA H H 118 7.894 7.894 8.170 -0.276 18135 18788 1 20 . 1 1 119 119 VAL N N 119 118.873 118.873 116.310 2.563 18135 18789 1 20 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.499 0.256 18135 18790 1 20 . 1 1 119 119 VAL C C 119 177.896 177.896 178.019 -0.123 18135 18791 1 20 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.246 0.935 18135 18792 1 20 . 1 1 119 119 VAL CB C 119 31.894 31.894 31.269 0.625 18135 18793 1 20 . 1 1 119 119 VAL H H 119 7.572 7.572 7.999 -0.427 18135 18794 1 20 . 1 1 120 120 ARG N N 120 121.436 121.436 120.786 0.650 18135 18795 1 20 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.078 -0.051 18135 18796 1 20 . 1 1 120 120 ARG C C 120 179.848 179.848 178.789 1.059 18135 18797 1 20 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.995 1.272 18135 18798 1 20 . 1 1 120 120 ARG CB C 120 29.695 29.695 30.078 -0.383 18135 18799 1 20 . 1 1 120 120 ARG H H 120 8.629 8.629 8.443 0.186 18135 18800 1 20 . 1 1 121 121 LYS N N 121 119.589 119.589 119.476 0.113 18135 18801 1 20 . 1 1 121 121 LYS HA H 121 4.074 4.074 4.005 0.069 18135 18802 1 20 . 1 1 121 121 LYS C C 121 178.331 178.331 178.942 -0.611 18135 18803 1 20 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.252 1.188 18135 18804 1 20 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.048 0.059 18135 18805 1 20 . 1 1 121 121 LYS H H 121 9.015 9.015 8.111 0.904 18135 18806 1 20 . 1 1 122 122 TYR N N 122 121.546 121.546 120.526 1.020 18135 18807 1 20 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.014 0.318 18135 18808 1 20 . 1 1 122 122 TYR C C 122 176.527 176.527 177.760 -1.233 18135 18809 1 20 . 1 1 122 122 TYR CA C 122 60.404 60.404 62.068 -1.664 18135 18810 1 20 . 1 1 122 122 TYR CB C 122 37.725 37.725 38.389 -0.665 18135 18811 1 20 . 1 1 122 122 TYR H H 122 7.473 7.473 8.095 -0.622 18135 18812 1 20 . 1 1 123 123 PHE N N 123 116.026 116.026 118.818 -2.792 18135 18813 1 20 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.949 -0.209 18135 18814 1 20 . 1 1 123 123 PHE C C 123 179.005 179.005 177.602 1.403 18135 18815 1 20 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.716 2.812 18135 18816 1 20 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.802 0.529 18135 18817 1 20 . 1 1 123 123 PHE H H 123 7.932 7.932 8.443 -0.511 18135 18818 1 20 . 1 1 124 124 GLN N N 124 123.043 123.043 118.281 4.762 18135 18819 1 20 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.315 0.864 18135 18820 1 20 . 1 1 124 124 GLN C C 124 178.772 178.772 178.752 0.020 18135 18821 1 20 . 1 1 124 124 GLN CA C 124 59.316 59.316 58.883 0.433 18135 18822 1 20 . 1 1 124 124 GLN CB C 124 27.631 27.631 27.958 -0.327 18135 18823 1 20 . 1 1 124 124 GLN H H 124 8.470 8.470 8.545 -0.075 18135 18824 1 20 . 1 1 125 125 ARG N N 125 120.342 120.342 118.672 1.670 18135 18825 1 20 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.092 -0.014 18135 18826 1 20 . 1 1 125 125 ARG C C 125 180.340 180.340 178.918 1.422 18135 18827 1 20 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.300 2.997 18135 18828 1 20 . 1 1 125 125 ARG CB C 125 30.325 30.325 29.999 0.326 18135 18829 1 20 . 1 1 125 125 ARG H H 125 8.137 8.137 8.257 -0.120 18135 18830 1 20 . 1 1 126 126 ILE N N 126 121.876 121.876 121.387 0.489 18135 18831 1 20 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.254 0.097 18135 18832 1 20 . 1 1 126 126 ILE C C 126 176.857 176.857 177.765 -0.908 18135 18833 1 20 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.738 1.094 18135 18834 1 20 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.590 0.694 18135 18835 1 20 . 1 1 126 126 ILE H H 126 7.526 7.526 8.198 -0.672 18135 18836 1 20 . 1 1 127 127 THR N N 127 115.613 115.613 115.040 0.573 18135 18837 1 20 . 1 1 127 127 THR HA H 127 3.633 3.633 3.805 -0.172 18135 18838 1 20 . 1 1 127 127 THR C C 127 176.645 176.645 177.014 -0.369 18135 18839 1 20 . 1 1 127 127 THR CA C 127 67.294 67.294 66.587 0.707 18135 18840 1 20 . 1 1 127 127 THR CB C 127 68.871 68.871 68.925 -0.054 18135 18841 1 20 . 1 1 127 127 THR H H 127 8.288 8.288 8.084 0.204 18135 18842 1 20 . 1 1 128 128 LEU N N 128 122.627 122.627 122.385 0.242 18135 18843 1 20 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.916 0.041 18135 18844 1 20 . 1 1 128 128 LEU C C 128 178.331 178.331 177.795 0.536 18135 18845 1 20 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.864 0.224 18135 18846 1 20 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.234 0.340 18135 18847 1 20 . 1 1 128 128 LEU H H 128 8.263 8.263 7.820 0.443 18135 18848 1 20 . 1 1 129 129 TYR N N 129 120.955 120.955 120.270 0.685 18135 18849 1 20 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.068 -0.178 18135 18850 1 20 . 1 1 129 129 TYR C C 129 176.040 176.040 177.504 -1.464 18135 18851 1 20 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.275 0.218 18135 18852 1 20 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.155 0.770 18135 18853 1 20 . 1 1 129 129 TYR H H 129 7.518 7.518 8.313 -0.795 18135 18854 1 20 . 1 1 130 130 LEU N N 130 119.155 119.155 116.271 2.884 18135 18855 1 20 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.236 -0.391 18135 18856 1 20 . 1 1 130 130 LEU C C 130 177.948 177.948 178.289 -0.341 18135 18857 1 20 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.827 0.286 18135 18858 1 20 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.440 1.146 18135 18859 1 20 . 1 1 130 130 LEU H H 130 7.717 7.717 7.916 -0.199 18135 18860 1 20 . 1 1 131 131 LYS N N 131 116.832 116.832 119.636 -2.804 18135 18861 1 20 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.816 -0.408 18135 18862 1 20 . 1 1 131 131 LYS C C 131 181.265 181.265 179.381 1.884 18135 18863 1 20 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.974 -0.243 18135 18864 1 20 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.130 0.542 18135 18865 1 20 . 1 1 131 131 LYS H H 131 7.493 7.493 7.786 -0.293 18135 18866 1 20 . 1 1 132 132 GLU N N 132 121.918 121.918 119.807 2.111 18135 18867 1 20 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.023 -0.179 18135 18868 1 20 . 1 1 132 132 GLU C C 132 178.377 178.377 178.212 0.165 18135 18869 1 20 . 1 1 132 132 GLU CA C 132 58.887 58.887 59.121 -0.234 18135 18870 1 20 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.567 -0.900 18135 18871 1 20 . 1 1 132 132 GLU H H 132 8.430 8.430 8.203 0.227 18135 18872 1 20 . 1 1 133 133 LYS N N 133 116.079 116.079 116.803 -0.724 18135 18873 1 20 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.255 -0.289 18135 18874 1 20 . 1 1 133 133 LYS C C 133 175.282 175.282 176.111 -0.829 18135 18875 1 20 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.198 0.100 18135 18876 1 20 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.273 0.725 18135 18877 1 20 . 1 1 133 133 LYS H H 133 7.390 7.390 7.348 0.042 18135 18878 1 20 . 1 1 134 134 LYS N N 134 117.759 117.759 116.752 1.007 18135 18879 1 20 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.019 -0.437 18135 18880 1 20 . 1 1 134 134 LYS C C 134 176.271 176.271 175.923 0.348 18135 18881 1 20 . 1 1 134 134 LYS CA C 134 57.308 57.308 57.202 0.106 18135 18882 1 20 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.515 -0.713 18135 18883 1 20 . 1 1 134 134 LYS H H 134 7.716 7.716 7.577 0.139 18135 18884 1 20 . 1 1 135 135 TYR N N 135 110.598 110.598 112.807 -2.209 18135 18885 1 20 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.850 -0.973 18135 18886 1 20 . 1 1 135 135 TYR C C 135 174.148 174.148 175.654 -1.506 18135 18887 1 20 . 1 1 135 135 TYR CA C 135 59.715 59.715 58.949 0.766 18135 18888 1 20 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.312 -0.606 18135 18889 1 20 . 1 1 135 135 TYR H H 135 8.428 8.428 8.655 -0.227 18135 18890 1 20 . 1 1 136 136 SER N N 136 113.712 113.712 116.448 -2.736 18135 18891 1 20 . 1 1 136 136 SER HA H 136 4.553 4.553 4.393 0.160 18135 18892 1 20 . 1 1 136 136 SER CA C 136 57.108 57.108 58.757 -1.649 18135 18893 1 20 . 1 1 136 136 SER CB C 136 62.500 62.500 64.424 -1.924 18135 18894 1 20 . 1 1 136 136 SER H H 136 6.744 6.744 7.582 -0.838 18135 18895 1 20 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.501 -0.336 18135 18896 1 20 . 1 1 137 137 PRO C C 137 180.675 180.675 177.744 2.931 18135 18897 1 20 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.634 1.023 18135 18898 1 20 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.474 0.509 18135 18899 1 20 . 1 1 138 138 CYS N N 138 113.914 113.914 117.173 -3.259 18135 18900 1 20 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.731 -0.061 18135 18901 1 20 . 1 1 138 138 CYS C C 138 176.015 176.015 176.088 -0.073 18135 18902 1 20 . 1 1 138 138 CYS CA C 138 57.095 57.095 59.518 -2.423 18135 18903 1 20 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.390 10.389 18135 18904 1 20 . 1 1 138 138 CYS H H 138 8.580 8.580 8.477 0.103 18135 18905 1 20 . 1 1 139 139 ALA N N 139 125.290 125.290 124.795 0.495 18135 18906 1 20 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.182 0.267 18135 18907 1 20 . 1 1 139 139 ALA C C 139 180.149 180.149 179.333 0.816 18135 18908 1 20 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.942 -0.164 18135 18909 1 20 . 1 1 139 139 ALA CB C 139 18.918 18.918 17.744 1.174 18135 18910 1 20 . 1 1 139 139 ALA H H 139 8.087 8.087 7.450 0.637 18135 18911 1 20 . 1 1 140 140 TRP N N 140 116.599 116.599 118.623 -2.024 18135 18912 1 20 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.269 0.333 18135 18913 1 20 . 1 1 140 140 TRP C C 140 179.137 179.137 178.536 0.601 18135 18914 1 20 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.097 -0.563 18135 18915 1 20 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.395 -0.137 18135 18916 1 20 . 1 1 140 140 TRP H H 140 8.505 8.505 7.720 0.785 18135 18917 1 20 . 1 1 141 141 GLU N N 141 121.578 121.578 119.608 1.970 18135 18918 1 20 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.261 0.962 18135 18919 1 20 . 1 1 141 141 GLU C C 141 177.886 177.886 179.017 -1.131 18135 18920 1 20 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.998 -2.091 18135 18921 1 20 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.520 -0.803 18135 18922 1 20 . 1 1 141 141 GLU H H 141 8.182 8.182 8.104 0.078 18135 18923 1 20 . 1 1 142 142 VAL N N 142 121.202 121.202 119.893 1.309 18135 18924 1 20 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.804 -0.174 18135 18925 1 20 . 1 1 142 142 VAL C C 142 180.246 180.246 178.903 1.343 18135 18926 1 20 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.342 0.641 18135 18927 1 20 . 1 1 142 142 VAL CB C 142 31.822 31.822 30.986 0.836 18135 18928 1 20 . 1 1 142 142 VAL H H 142 8.623 8.623 8.295 0.328 18135 18929 1 20 . 1 1 143 143 VAL N N 143 120.119 120.119 119.718 0.401 18135 18930 1 20 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.787 -0.490 18135 18931 1 20 . 1 1 143 143 VAL C C 143 176.407 176.407 178.383 -1.976 18135 18932 1 20 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.908 1.070 18135 18933 1 20 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.104 0.551 18135 18934 1 20 . 1 1 143 143 VAL H H 143 8.323 8.323 8.773 -0.450 18135 18935 1 20 . 1 1 144 144 ARG N N 144 124.102 124.102 119.404 4.698 18135 18936 1 20 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.039 -0.342 18135 18937 1 20 . 1 1 144 144 ARG C C 144 178.127 178.127 178.674 -0.547 18135 18938 1 20 . 1 1 144 144 ARG CA C 144 61.001 61.001 58.896 2.105 18135 18939 1 20 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.629 0.307 18135 18940 1 20 . 1 1 144 144 ARG H H 144 9.619 9.619 8.465 1.154 18135 18941 1 20 . 1 1 145 145 ALA N N 145 119.431 119.431 122.076 -2.645 18135 18942 1 20 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.048 -0.197 18135 18943 1 20 . 1 1 145 145 ALA C C 145 180.763 180.763 180.239 0.524 18135 18944 1 20 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.435 -0.060 18135 18945 1 20 . 1 1 145 145 ALA CB C 145 18.185 18.185 18.090 0.095 18135 18946 1 20 . 1 1 145 145 ALA H H 145 8.867 8.867 8.416 0.451 18135 18947 1 20 . 1 1 146 146 GLU N N 146 121.815 121.815 118.397 3.418 18135 18948 1 20 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.240 -0.029 18135 18949 1 20 . 1 1 146 146 GLU C C 146 177.296 177.296 179.333 -2.037 18135 18950 1 20 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.096 -0.717 18135 18951 1 20 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.285 -1.151 18135 18952 1 20 . 1 1 146 146 GLU H H 146 8.136 8.136 8.158 -0.022 18135 18953 1 20 . 1 1 147 147 ILE N N 147 119.542 119.542 121.660 -2.118 18135 18954 1 20 . 1 1 147 147 ILE HA H 147 3.970 3.970 4.035 -0.065 18135 18955 1 20 . 1 1 147 147 ILE C C 147 178.283 178.283 178.612 -0.329 18135 18956 1 20 . 1 1 147 147 ILE CA C 147 61.253 61.253 65.047 -3.794 18135 18957 1 20 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.731 -2.393 18135 18958 1 20 . 1 1 147 147 ILE H H 147 8.736 8.736 8.179 0.557 18135 18959 1 20 . 1 1 148 148 MET N N 148 119.501 119.501 118.498 1.003 18135 18960 1 20 . 1 1 148 148 MET HA H 148 3.801 3.801 4.238 -0.437 18135 18961 1 20 . 1 1 148 148 MET C C 148 178.210 178.210 178.719 -0.509 18135 18962 1 20 . 1 1 148 148 MET CA C 148 60.184 60.184 59.843 0.341 18135 18963 1 20 . 1 1 148 148 MET CB C 148 32.914 32.914 32.041 0.873 18135 18964 1 20 . 1 1 148 148 MET H H 148 8.440 8.440 8.341 0.099 18135 18965 1 20 . 1 1 149 149 ARG N N 149 119.734 119.734 120.225 -0.491 18135 18966 1 20 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.090 -0.175 18135 18967 1 20 . 1 1 149 149 ARG C C 149 178.978 178.978 178.993 -0.015 18135 18968 1 20 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.494 0.369 18135 18969 1 20 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.767 0.513 18135 18970 1 20 . 1 1 149 149 ARG H H 149 7.648 7.648 8.436 -0.788 18135 18971 1 20 . 1 1 150 150 SER N N 150 118.109 118.109 115.769 2.340 18135 18972 1 20 . 1 1 150 150 SER HA H 150 3.339 3.339 3.935 -0.596 18135 18973 1 20 . 1 1 150 150 SER C C 150 177.292 177.292 176.120 1.172 18135 18974 1 20 . 1 1 150 150 SER CA C 150 61.316 61.316 61.876 -0.560 18135 18975 1 20 . 1 1 150 150 SER CB C 150 60.288 60.288 62.400 -2.112 18135 18976 1 20 . 1 1 150 150 SER H H 150 9.194 9.194 8.713 0.481 18135 18977 1 20 . 1 1 151 151 PHE N N 151 125.265 125.265 124.214 1.051 18135 18978 1 20 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.338 -0.302 18135 18979 1 20 . 1 1 151 151 PHE C C 151 178.696 178.696 177.617 1.079 18135 18980 1 20 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.120 2.300 18135 18981 1 20 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.494 0.392 18135 18982 1 20 . 1 1 151 151 PHE H H 151 9.455 9.455 8.450 1.005 18135 18983 1 20 . 1 1 152 152 SER N N 152 115.963 115.963 116.284 -0.321 18135 18984 1 20 . 1 1 152 152 SER HA H 152 3.880 3.880 3.719 0.161 18135 18985 1 20 . 1 1 152 152 SER C C 152 175.858 175.858 176.709 -0.851 18135 18986 1 20 . 1 1 152 152 SER CA C 152 62.388 62.388 62.069 0.319 18135 18987 1 20 . 1 1 152 152 SER CB C 152 62.519 62.519 63.308 -0.789 18135 18988 1 20 . 1 1 152 152 SER H H 152 7.839 7.839 8.263 -0.424 18135 18989 1 20 . 1 1 153 153 LEU N N 153 121.365 121.365 122.432 -1.067 18135 18990 1 20 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.100 -0.019 18135 18991 1 20 . 1 1 153 153 LEU C C 153 179.515 179.515 177.764 1.751 18135 18992 1 20 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.850 0.033 18135 18993 1 20 . 1 1 153 153 LEU CB C 153 42.342 42.342 42.311 0.031 18135 18994 1 20 . 1 1 153 153 LEU H H 153 7.775 7.775 8.116 -0.341 18135 18995 1 20 . 1 1 154 154 SER N N 154 113.950 113.950 111.885 2.065 18135 18996 1 20 . 1 1 154 154 SER HA H 154 3.781 3.781 4.363 -0.582 18135 18997 1 20 . 1 1 154 154 SER C C 154 174.312 174.312 176.734 -2.422 18135 18998 1 20 . 1 1 154 154 SER CA C 154 61.366 61.366 61.150 0.216 18135 18999 1 20 . 1 1 154 154 SER CB C 154 63.242 63.242 63.202 0.040 18135 19000 1 20 . 1 1 154 154 SER H H 154 7.874 7.874 8.300 -0.426 18135 19001 1 20 . 1 1 155 155 THR N N 155 109.346 109.346 114.463 -5.117 18135 19002 1 20 . 1 1 155 155 THR HA H 155 4.060 4.060 4.172 -0.112 18135 19003 1 20 . 1 1 155 155 THR C C 155 174.798 174.798 175.574 -0.776 18135 19004 1 20 . 1 1 155 155 THR CA C 155 62.275 62.275 63.991 -1.716 18135 19005 1 20 . 1 1 155 155 THR CB C 155 69.342 69.342 68.847 0.494 18135 19006 1 20 . 1 1 155 155 THR H H 155 7.176 7.176 7.835 -0.659 18135 19007 1 20 . 1 1 156 156 ASN N N 156 119.785 119.785 120.981 -1.196 18135 19008 1 20 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.765 -0.238 18135 19009 1 20 . 1 1 156 156 ASN C C 156 175.528 175.528 175.209 0.319 18135 19010 1 20 . 1 1 156 156 ASN CA C 156 53.937 53.937 51.761 2.176 18135 19011 1 20 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.477 0.861 18135 19012 1 20 . 1 1 156 156 ASN H H 156 7.749 7.749 7.904 -0.155 18135 19013 1 20 . 1 1 157 157 LEU N N 157 120.552 120.552 121.514 -0.962 18135 19014 1 20 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.327 -0.072 18135 19015 1 20 . 1 1 157 157 LEU C C 157 174.702 174.702 178.055 -3.353 18135 19016 1 20 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.744 -1.070 18135 19017 1 20 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.052 0.299 18135 19018 1 20 . 1 1 157 157 LEU H H 157 8.097 8.097 7.542 0.555 18135 19019 1 20 . 1 1 158 158 GLN N N 158 119.860 119.860 117.121 2.739 18135 19020 1 20 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.152 0.028 18135 19021 1 20 . 1 1 158 158 GLN C C 158 176.434 176.434 175.899 0.535 18135 19022 1 20 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.389 1.508 18135 19023 1 20 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.434 -0.424 18135 19024 1 20 . 1 1 158 158 GLN H H 158 8.230 8.230 7.927 0.303 18135 19025 1 20 . 1 1 159 159 GLU N N 159 120.461 120.461 119.045 1.416 18135 19026 1 20 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.050 0.169 18135 19027 1 20 . 1 1 159 159 GLU C C 159 175.251 175.251 175.198 0.053 18135 19028 1 20 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.291 -0.596 18135 19029 1 20 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.222 0.759 18135 19030 1 20 . 1 1 159 159 GLU H H 159 8.300 8.300 8.259 0.041 18135 19031 1 20 . 1 1 160 160 SER N N 160 115.719 115.719 113.970 1.749 18135 19032 1 20 . 1 1 160 160 SER HA H 160 4.372 4.372 4.551 -0.179 18135 19033 1 20 . 1 1 160 160 SER C C 160 174.188 174.188 174.409 -0.221 18135 19034 1 20 . 1 1 160 160 SER CA C 160 58.481 58.481 57.978 0.503 18135 19035 1 20 . 1 1 160 160 SER CB C 160 63.731 63.731 63.136 0.595 18135 19036 1 20 . 1 1 160 160 SER H H 160 8.113 8.113 8.442 -0.329 18135 19037 1 20 . 1 1 161 161 LEU N N 161 123.794 123.794 121.903 1.891 18135 19038 1 20 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.356 -0.076 18135 19039 1 20 . 1 1 161 161 LEU C C 161 177.293 177.293 176.906 0.387 18135 19040 1 20 . 1 1 161 161 LEU CA C 161 55.190 55.190 56.070 -0.880 18135 19041 1 20 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.488 -0.204 18135 19042 1 20 . 1 1 161 161 LEU H H 161 8.032 8.032 8.011 0.021 18135 19043 1 20 . 1 1 162 162 ARG N N 162 120.715 120.715 119.595 1.120 18135 19044 1 20 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.693 -0.524 18135 19045 1 20 . 1 1 162 162 ARG C C 162 176.288 176.288 175.618 0.670 18135 19046 1 20 . 1 1 162 162 ARG CA C 162 57.046 57.046 55.342 1.704 18135 19047 1 20 . 1 1 162 162 ARG CB C 162 30.935 30.935 31.617 -0.682 18135 19048 1 20 . 1 1 162 162 ARG H H 162 8.094 8.094 8.221 -0.127 18135 19049 1 20 . 1 1 163 163 SER N N 163 116.670 116.670 118.526 -1.856 18135 19050 1 20 . 1 1 163 163 SER HA H 163 4.372 4.372 4.829 -0.457 18135 19051 1 20 . 1 1 163 163 SER C C 163 174.184 174.184 174.922 -0.738 18135 19052 1 20 . 1 1 163 163 SER CA C 163 58.481 58.481 57.604 0.877 18135 19053 1 20 . 1 1 163 163 SER CB C 163 63.745 63.745 64.977 -1.232 18135 19054 1 20 . 1 1 163 163 SER H H 163 8.191 8.191 8.542 -0.351 18135 19055 1 20 . 1 1 164 164 LYS N N 164 123.100 123.100 119.645 3.455 18135 19056 1 20 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.579 -0.302 18135 19057 1 20 . 1 1 164 164 LYS C C 164 175.617 175.617 177.255 -1.638 18135 19058 1 20 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.377 -0.064 18135 19059 1 20 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.849 0.116 18135 19060 1 20 . 1 1 164 164 LYS H H 164 8.251 8.251 8.538 -0.287 18135 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 158 2.482 -0.252 2.477 18135 2 1 1 "Average Difference" HA 168 0.296 0.066 0.289 18135 3 1 1 "Average Difference" C 158 1.276 -0.000 1.280 18135 4 1 1 "Average Difference" CA 163 1.380 0.106 1.380 18135 5 1 1 "Average Difference" CB 158 2.116 -0.208 2.112 18135 6 1 1 "Average Difference" HN 158 0.504 -0.051 0.504 18135 7 1 2 "Average Difference" N 158 2.289 -0.236 2.285 18135 8 1 2 "Average Difference" HA 168 0.300 0.074 0.292 18135 9 1 2 "Average Difference" C 158 1.244 -0.000 1.248 18135 10 1 2 "Average Difference" CA 163 1.347 0.042 1.350 18135 11 1 2 "Average Difference" CB 158 2.123 -0.205 2.120 18135 12 1 2 "Average Difference" HN 158 0.557 -0.040 0.557 18135 13 1 3 "Average Difference" N 158 2.364 -0.328 2.349 18135 14 1 3 "Average Difference" HA 168 0.306 0.070 0.299 18135 15 1 3 "Average Difference" C 158 1.226 0.005 1.230 18135 16 1 3 "Average Difference" CA 163 1.349 0.056 1.352 18135 17 1 3 "Average Difference" CB 158 2.105 -0.167 2.105 18135 18 1 3 "Average Difference" HN 158 0.529 -0.058 0.528 18135 19 1 4 "Average Difference" N 158 2.410 -0.311 2.397 18135 20 1 4 "Average Difference" HA 168 0.309 0.064 0.304 18135 21 1 4 "Average Difference" C 158 1.193 -0.023 1.196 18135 22 1 4 "Average Difference" CA 163 1.346 0.077 1.348 18135 23 1 4 "Average Difference" CB 158 2.149 -0.208 2.146 18135 24 1 4 "Average Difference" HN 158 0.524 -0.037 0.524 18135 25 1 5 "Average Difference" N 158 2.361 -0.278 2.352 18135 26 1 5 "Average Difference" HA 168 0.305 0.076 0.296 18135 27 1 5 "Average Difference" C 158 1.215 -0.015 1.219 18135 28 1 5 "Average Difference" CA 163 1.284 0.084 1.285 18135 29 1 5 "Average Difference" CB 158 2.078 -0.161 2.078 18135 30 1 5 "Average Difference" HN 158 0.520 -0.062 0.518 18135 31 1 6 "Average Difference" N 158 2.428 -0.353 2.410 18135 32 1 6 "Average Difference" HA 168 0.299 0.064 0.293 18135 33 1 6 "Average Difference" C 158 1.250 -0.014 1.254 18135 34 1 6 "Average Difference" CA 163 1.353 -0.019 1.357 18135 35 1 6 "Average Difference" CB 158 2.117 -0.196 2.114 18135 36 1 6 "Average Difference" HN 158 0.533 -0.054 0.532 18135 37 1 7 "Average Difference" N 158 2.331 -0.353 2.311 18135 38 1 7 "Average Difference" HA 168 0.300 0.063 0.294 18135 39 1 7 "Average Difference" C 158 1.226 0.002 1.230 18135 40 1 7 "Average Difference" CA 163 1.396 0.104 1.396 18135 41 1 7 "Average Difference" CB 158 2.130 -0.212 2.126 18135 42 1 7 "Average Difference" HN 158 0.518 -0.046 0.518 18135 43 1 8 "Average Difference" N 158 2.370 -0.322 2.355 18135 44 1 8 "Average Difference" HA 168 0.316 0.071 0.308 18135 45 1 8 "Average Difference" C 158 1.220 0.019 1.224 18135 46 1 8 "Average Difference" CA 163 1.350 0.067 1.353 18135 47 1 8 "Average Difference" CB 158 2.128 -0.170 2.128 18135 48 1 8 "Average Difference" HN 158 0.526 -0.078 0.522 18135 49 1 9 "Average Difference" N 158 2.420 -0.368 2.400 18135 50 1 9 "Average Difference" HA 168 0.309 0.059 0.305 18135 51 1 9 "Average Difference" C 158 1.222 -0.021 1.226 18135 52 1 9 "Average Difference" CA 163 1.352 0.095 1.353 18135 53 1 9 "Average Difference" CB 158 2.100 -0.212 2.096 18135 54 1 9 "Average Difference" HN 158 0.514 -0.055 0.513 18135 55 1 10 "Average Difference" N 158 2.422 -0.328 2.407 18135 56 1 10 "Average Difference" HA 168 0.296 0.068 0.289 18135 57 1 10 "Average Difference" C 158 1.201 0.028 1.204 18135 58 1 10 "Average Difference" CA 163 1.382 0.148 1.379 18135 59 1 10 "Average Difference" CB 158 2.161 -0.215 2.157 18135 60 1 10 "Average Difference" HN 158 0.518 -0.054 0.516 18135 61 1 11 "Average Difference" N 158 2.278 -0.359 2.257 18135 62 1 11 "Average Difference" HA 168 0.305 0.070 0.297 18135 63 1 11 "Average Difference" C 158 1.253 -0.012 1.257 18135 64 1 11 "Average Difference" CA 163 1.333 0.016 1.337 18135 65 1 11 "Average Difference" CB 158 2.069 -0.152 2.070 18135 66 1 11 "Average Difference" HN 158 0.538 -0.075 0.535 18135 67 1 12 "Average Difference" N 158 2.343 -0.339 2.326 18135 68 1 12 "Average Difference" HA 168 0.299 0.065 0.293 18135 69 1 12 "Average Difference" C 158 1.220 -0.031 1.223 18135 70 1 12 "Average Difference" CA 163 1.358 0.066 1.360 18135 71 1 12 "Average Difference" CB 158 2.076 -0.196 2.074 18135 72 1 12 "Average Difference" HN 158 0.524 -0.070 0.520 18135 73 1 13 "Average Difference" N 158 2.479 -0.358 2.461 18135 74 1 13 "Average Difference" HA 168 0.301 0.062 0.296 18135 75 1 13 "Average Difference" C 158 1.234 -0.000 1.237 18135 76 1 13 "Average Difference" CA 163 1.384 0.064 1.387 18135 77 1 13 "Average Difference" CB 158 2.134 -0.202 2.131 18135 78 1 13 "Average Difference" HN 158 0.531 -0.057 0.530 18135 79 1 14 "Average Difference" N 158 2.512 -0.474 2.475 18135 80 1 14 "Average Difference" HA 168 0.310 0.068 0.303 18135 81 1 14 "Average Difference" C 158 1.229 -0.004 1.233 18135 82 1 14 "Average Difference" CA 163 1.327 0.052 1.330 18135 83 1 14 "Average Difference" CB 158 2.122 -0.202 2.119 18135 84 1 14 "Average Difference" HN 158 0.520 -0.078 0.516 18135 85 1 15 "Average Difference" N 158 2.449 -0.420 2.420 18135 86 1 15 "Average Difference" HA 168 0.305 0.067 0.298 18135 87 1 15 "Average Difference" C 158 1.267 -0.044 1.270 18135 88 1 15 "Average Difference" CA 163 1.356 0.044 1.359 18135 89 1 15 "Average Difference" CB 158 2.085 -0.166 2.085 18135 90 1 15 "Average Difference" HN 158 0.512 -0.076 0.509 18135 91 1 16 "Average Difference" N 158 2.347 -0.333 2.331 18135 92 1 16 "Average Difference" HA 168 0.309 0.074 0.301 18135 93 1 16 "Average Difference" C 158 1.233 0.011 1.237 18135 94 1 16 "Average Difference" CA 163 1.388 0.100 1.388 18135 95 1 16 "Average Difference" CB 158 2.098 -0.189 2.097 18135 96 1 16 "Average Difference" HN 158 0.490 -0.055 0.488 18135 97 1 17 "Average Difference" N 158 2.557 -0.449 2.525 18135 98 1 17 "Average Difference" HA 168 0.306 0.045 0.303 18135 99 1 17 "Average Difference" C 158 1.283 0.018 1.287 18135 100 1 17 "Average Difference" CA 163 1.340 0.106 1.340 18135 101 1 17 "Average Difference" CB 158 2.081 -0.207 2.077 18135 102 1 17 "Average Difference" HN 158 0.535 -0.051 0.534 18135 103 1 18 "Average Difference" N 158 2.314 -0.289 2.303 18135 104 1 18 "Average Difference" HA 168 0.313 0.076 0.305 18135 105 1 18 "Average Difference" C 158 1.219 -0.017 1.223 18135 106 1 18 "Average Difference" CA 163 1.442 0.070 1.445 18135 107 1 18 "Average Difference" CB 158 2.144 -0.193 2.142 18135 108 1 18 "Average Difference" HN 158 0.499 -0.032 0.499 18135 109 1 19 "Average Difference" N 158 2.504 -0.486 2.464 18135 110 1 19 "Average Difference" HA 168 0.310 0.073 0.303 18135 111 1 19 "Average Difference" C 158 1.239 -0.038 1.243 18135 112 1 19 "Average Difference" CA 163 1.341 0.024 1.345 18135 113 1 19 "Average Difference" CB 158 2.073 -0.184 2.072 18135 114 1 19 "Average Difference" HN 158 0.514 -0.077 0.510 18135 115 1 20 "Average Difference" N 158 2.325 -0.312 2.311 18135 116 1 20 "Average Difference" HA 168 0.298 0.075 0.289 18135 117 1 20 "Average Difference" C 158 1.195 -0.009 1.199 18135 118 1 20 "Average Difference" CA 163 1.350 0.044 1.353 18135 119 1 20 "Average Difference" CB 158 2.102 -0.186 2.100 18135 120 1 20 "Average Difference" HN 158 0.478 -0.051 0.476 18135 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 18135 _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 ASP N N 2 125.691 125.691 120.898 4.793 18135 2 1 . 1 1 2 2 ASP HA H 2 4.710 4.710 4.591 0.119 18135 3 1 . 1 1 2 2 ASP C C 2 174.758 174.758 175.842 -1.084 18135 4 1 . 1 1 2 2 ASP CA C 2 52.843 52.843 54.494 -1.651 18135 5 1 . 1 1 2 2 ASP CB C 2 39.321 39.321 40.877 -1.556 18135 6 1 . 1 1 2 2 ASP H H 2 8.773 8.773 8.475 0.298 18135 7 1 . 1 1 3 3 LEU N N 3 123.957 123.957 117.873 6.084 18135 8 1 . 1 1 3 3 LEU HA H 3 4.401 4.401 4.390 0.011 18135 9 1 . 1 1 3 3 LEU CA C 3 53.653 53.653 52.801 0.852 18135 10 1 . 1 1 3 3 LEU CB C 3 40.555 40.555 40.646 -0.091 18135 11 1 . 1 1 3 3 LEU H H 3 8.164 8.164 7.441 0.723 18135 12 1 . 1 1 4 4 PRO HA H 4 4.314 4.314 4.533 -0.219 18135 13 1 . 1 1 4 4 PRO C C 4 176.213 176.213 176.553 -0.340 18135 14 1 . 1 1 4 4 PRO CA C 4 63.908 63.908 63.088 0.820 18135 15 1 . 1 1 4 4 PRO CB C 4 31.894 31.894 30.384 1.510 18135 16 1 . 1 1 5 5 GLN N N 5 121.621 121.621 121.927 -0.306 18135 17 1 . 1 1 5 5 GLN HA H 5 4.226 4.226 4.151 0.075 18135 18 1 . 1 1 5 5 GLN C C 5 176.995 176.995 176.715 0.280 18135 19 1 . 1 1 5 5 GLN CA C 5 57.710 57.710 59.119 -1.409 18135 20 1 . 1 1 5 5 GLN CB C 5 28.951 28.951 29.165 -0.214 18135 21 1 . 1 1 5 5 GLN H H 5 8.767 8.767 8.651 0.116 18135 22 1 . 1 1 6 6 THR N N 6 111.419 111.419 110.804 0.615 18135 23 1 . 1 1 6 6 THR HA H 6 4.135 4.135 4.431 -0.296 18135 24 1 . 1 1 6 6 THR C C 6 174.695 174.695 175.135 -0.440 18135 25 1 . 1 1 6 6 THR CA C 6 62.661 62.661 62.980 -0.319 18135 26 1 . 1 1 6 6 THR CB C 6 69.365 69.365 68.815 0.550 18135 27 1 . 1 1 6 6 THR H H 6 7.865 7.865 8.451 -0.586 18135 28 1 . 1 1 7 7 HIS N N 7 119.137 119.137 119.255 -0.118 18135 29 1 . 1 1 7 7 HIS HA H 7 4.585 4.585 4.664 -0.079 18135 30 1 . 1 1 7 7 HIS C C 7 174.980 174.980 175.497 -0.517 18135 31 1 . 1 1 7 7 HIS CA C 7 56.004 56.004 58.573 -2.569 18135 32 1 . 1 1 7 7 HIS CB C 7 28.163 28.163 29.946 -1.784 18135 33 1 . 1 1 7 7 HIS H H 7 8.567 8.567 8.442 0.125 18135 34 1 . 1 1 8 8 SER N N 8 115.796 115.796 113.969 1.827 18135 35 1 . 1 1 8 8 SER HA H 8 4.363 4.363 4.429 -0.066 18135 36 1 . 1 1 8 8 SER C C 8 175.312 175.312 175.836 -0.524 18135 37 1 . 1 1 8 8 SER CA C 8 58.969 58.969 60.756 -1.787 18135 38 1 . 1 1 8 8 SER CB C 8 63.439 63.439 63.854 -0.415 18135 39 1 . 1 1 8 8 SER H H 8 8.180 8.180 7.927 0.253 18135 40 1 . 1 1 9 9 LEU N N 9 123.844 123.844 118.139 5.705 18135 41 1 . 1 1 9 9 LEU HA H 9 4.155 4.155 4.717 -0.562 18135 42 1 . 1 1 9 9 LEU C C 9 178.568 178.568 178.407 0.161 18135 43 1 . 1 1 9 9 LEU CA C 9 56.966 56.966 56.620 0.346 18135 44 1 . 1 1 9 9 LEU CB C 9 41.796 41.796 42.341 -0.545 18135 45 1 . 1 1 9 9 LEU H H 9 8.404 8.404 7.701 0.703 18135 46 1 . 1 1 10 10 GLY N N 10 107.582 107.582 107.717 -0.135 18135 47 1 . 1 1 10 10 GLY C C 10 174.586 174.586 175.831 -1.244 18135 48 1 . 1 1 10 10 GLY CA C 10 46.905 46.905 47.271 -0.366 18135 49 1 . 1 1 10 10 GLY H H 10 8.438 8.438 8.546 -0.108 18135 50 1 . 1 1 11 11 SER N N 11 118.806 118.806 117.215 1.591 18135 51 1 . 1 1 11 11 SER HA H 11 4.156 4.156 4.143 0.013 18135 52 1 . 1 1 11 11 SER C C 11 175.749 175.749 176.547 -0.798 18135 53 1 . 1 1 11 11 SER CA C 11 61.299 61.299 61.975 -0.676 18135 54 1 . 1 1 11 11 SER CB C 11 62.653 62.653 62.918 -0.265 18135 55 1 . 1 1 11 11 SER H H 11 8.249 8.249 8.235 0.014 18135 56 1 . 1 1 12 12 ARG N N 12 121.986 121.986 121.521 0.465 18135 57 1 . 1 1 12 12 ARG HA H 12 3.954 3.954 4.117 -0.163 18135 58 1 . 1 1 12 12 ARG C C 12 178.283 178.283 178.429 -0.146 18135 59 1 . 1 1 12 12 ARG CA C 12 59.830 59.830 58.838 0.992 18135 60 1 . 1 1 12 12 ARG CB C 12 29.584 29.584 30.024 -0.440 18135 61 1 . 1 1 12 12 ARG H H 12 8.027 8.027 8.071 -0.044 18135 62 1 . 1 1 13 13 ARG N N 13 119.432 119.432 119.061 0.371 18135 63 1 . 1 1 13 13 ARG HA H 13 3.839 3.839 4.066 -0.227 18135 64 1 . 1 1 13 13 ARG C C 13 178.480 178.480 178.512 -0.032 18135 65 1 . 1 1 13 13 ARG CA C 13 60.491 60.491 59.756 0.735 18135 66 1 . 1 1 13 13 ARG CB C 13 30.082 30.082 29.843 0.239 18135 67 1 . 1 1 13 13 ARG H H 13 8.437 8.437 7.981 0.456 18135 68 1 . 1 1 14 14 THR N N 14 116.879 116.879 116.925 -0.046 18135 69 1 . 1 1 14 14 THR HA H 14 3.532 3.532 4.137 -0.605 18135 70 1 . 1 1 14 14 THR C C 14 175.584 175.584 176.949 -1.365 18135 71 1 . 1 1 14 14 THR CA C 14 68.036 68.036 66.969 1.067 18135 72 1 . 1 1 14 14 THR CB C 14 67.969 67.969 68.621 -0.652 18135 73 1 . 1 1 14 14 THR H H 14 7.957 7.957 8.223 -0.266 18135 74 1 . 1 1 15 15 LEU N N 15 120.252 120.252 122.319 -2.067 18135 75 1 . 1 1 15 15 LEU HA H 15 3.946 3.946 4.000 -0.054 18135 76 1 . 1 1 15 15 LEU C C 15 178.652 178.652 178.947 -0.295 18135 77 1 . 1 1 15 15 LEU CA C 15 58.088 58.088 58.334 -0.246 18135 78 1 . 1 1 15 15 LEU CB C 15 41.554 41.554 41.808 -0.254 18135 79 1 . 1 1 15 15 LEU H H 15 7.550 7.550 8.175 -0.625 18135 80 1 . 1 1 16 16 MET N N 16 118.788 118.788 117.416 1.372 18135 81 1 . 1 1 16 16 MET HA H 16 4.023 4.023 3.984 0.039 18135 82 1 . 1 1 16 16 MET C C 16 178.718 178.718 178.760 -0.042 18135 83 1 . 1 1 16 16 MET CA C 16 58.513 58.513 58.906 -0.393 18135 84 1 . 1 1 16 16 MET CB C 16 32.150 32.150 32.012 0.138 18135 85 1 . 1 1 16 16 MET H H 16 7.985 7.985 8.310 -0.325 18135 86 1 . 1 1 17 17 LEU N N 17 120.644 120.644 119.614 1.030 18135 87 1 . 1 1 17 17 LEU HA H 17 3.972 3.972 3.984 -0.012 18135 88 1 . 1 1 17 17 LEU C C 17 178.238 178.238 179.319 -1.081 18135 89 1 . 1 1 17 17 LEU CA C 17 57.727 57.727 58.164 -0.437 18135 90 1 . 1 1 17 17 LEU CB C 17 42.135 42.135 41.160 0.975 18135 91 1 . 1 1 17 17 LEU H H 17 7.829 7.829 8.216 -0.387 18135 92 1 . 1 1 18 18 LEU N N 18 118.280 118.280 118.770 -0.490 18135 93 1 . 1 1 18 18 LEU HA H 18 3.506 3.506 3.773 -0.267 18135 94 1 . 1 1 18 18 LEU C C 18 175.739 175.739 178.531 -2.792 18135 95 1 . 1 1 18 18 LEU CA C 18 57.656 57.656 57.383 0.273 18135 96 1 . 1 1 18 18 LEU CB C 18 42.242 42.242 41.383 0.859 18135 97 1 . 1 1 18 18 LEU H H 18 7.499 7.499 8.375 -0.876 18135 98 1 . 1 1 19 19 ALA N N 19 121.961 121.961 120.672 1.289 18135 99 1 . 1 1 19 19 ALA HA H 19 3.837 3.837 4.145 -0.308 18135 100 1 . 1 1 19 19 ALA C C 19 180.736 180.736 178.681 2.055 18135 101 1 . 1 1 19 19 ALA CA C 19 55.066 55.066 54.179 0.887 18135 102 1 . 1 1 19 19 ALA CB C 19 18.077 18.077 19.230 -1.153 18135 103 1 . 1 1 19 19 ALA H H 19 7.950 7.950 7.737 0.213 18135 104 1 . 1 1 20 20 GLN N N 20 118.605 118.605 116.072 2.533 18135 105 1 . 1 1 20 20 GLN HA H 20 3.935 3.935 4.176 -0.241 18135 106 1 . 1 1 20 20 GLN C C 20 176.945 176.945 177.322 -0.377 18135 107 1 . 1 1 20 20 GLN CA C 20 58.015 58.015 57.482 0.533 18135 108 1 . 1 1 20 20 GLN CB C 20 28.474 28.474 29.170 -0.696 18135 109 1 . 1 1 20 20 GLN H H 20 7.958 7.958 8.051 -0.093 18135 110 1 . 1 1 21 21 MET N N 21 116.693 116.693 117.372 -0.679 18135 111 1 . 1 1 21 21 MET HA H 21 3.861 3.861 4.420 -0.559 18135 112 1 . 1 1 21 21 MET C C 21 174.671 174.671 175.487 -0.816 18135 113 1 . 1 1 21 21 MET CA C 21 57.111 57.111 57.088 0.023 18135 114 1 . 1 1 21 21 MET CB C 21 34.073 34.073 33.578 0.495 18135 115 1 . 1 1 21 21 MET H H 21 7.420 7.420 7.760 -0.340 18135 116 1 . 1 1 22 22 ARG N N 22 115.451 115.451 120.681 -5.230 18135 117 1 . 1 1 22 22 ARG HA H 22 3.853 3.853 3.651 0.202 18135 118 1 . 1 1 22 22 ARG C C 22 175.950 175.950 174.845 1.105 18135 119 1 . 1 1 22 22 ARG CA C 22 58.452 58.452 55.170 3.282 18135 120 1 . 1 1 22 22 ARG CB C 22 31.514 31.514 30.215 1.299 18135 121 1 . 1 1 22 22 ARG H H 22 6.484 6.484 7.265 -0.781 18135 122 1 . 1 1 23 23 LYS N N 23 128.593 128.593 125.634 2.959 18135 123 1 . 1 1 23 23 LYS HA H 23 4.485 4.485 4.576 -0.091 18135 124 1 . 1 1 23 23 LYS C C 23 176.643 176.643 175.172 1.471 18135 125 1 . 1 1 23 23 LYS CA C 23 57.287 57.287 55.843 1.444 18135 126 1 . 1 1 23 23 LYS CB C 23 36.261 36.261 31.904 4.357 18135 127 1 . 1 1 23 23 LYS H H 23 10.212 10.212 8.634 1.578 18135 128 1 . 1 1 24 24 ILE N N 24 118.605 118.605 122.395 -3.790 18135 129 1 . 1 1 24 24 ILE HA H 24 4.484 4.484 4.416 0.068 18135 130 1 . 1 1 24 24 ILE C C 24 173.878 173.878 174.541 -0.663 18135 131 1 . 1 1 24 24 ILE CA C 24 59.597 59.597 60.667 -1.070 18135 132 1 . 1 1 24 24 ILE CB C 24 41.456 41.456 41.238 0.218 18135 133 1 . 1 1 24 24 ILE H H 24 8.465 8.465 8.397 0.068 18135 134 1 . 1 1 25 25 SER N N 25 113.658 113.658 118.082 -4.424 18135 135 1 . 1 1 25 25 SER HA H 25 4.481 4.481 4.949 -0.468 18135 136 1 . 1 1 25 25 SER C C 25 176.359 176.359 175.716 0.643 18135 137 1 . 1 1 25 25 SER CA C 25 56.975 56.975 57.086 -0.111 18135 138 1 . 1 1 25 25 SER CB C 25 64.759 64.759 63.891 0.868 18135 139 1 . 1 1 25 25 SER H H 25 8.104 8.104 8.598 -0.494 18135 140 1 . 1 1 26 26 LEU N N 26 127.566 127.566 125.762 1.804 18135 141 1 . 1 1 26 26 LEU HA H 26 3.877 3.877 4.286 -0.409 18135 142 1 . 1 1 26 26 LEU C C 26 178.946 178.946 177.547 1.399 18135 143 1 . 1 1 26 26 LEU CA C 26 57.678 57.678 57.362 0.316 18135 144 1 . 1 1 26 26 LEU CB C 26 41.719 41.719 41.984 -0.265 18135 145 1 . 1 1 26 26 LEU H H 26 8.802 8.802 9.032 -0.230 18135 146 1 . 1 1 27 27 PHE N N 27 117.143 117.143 116.476 0.667 18135 147 1 . 1 1 27 27 PHE HA H 27 4.238 4.238 4.603 -0.365 18135 148 1 . 1 1 27 27 PHE C C 27 177.067 177.067 176.802 0.265 18135 149 1 . 1 1 27 27 PHE CA C 27 60.090 60.090 58.530 1.560 18135 150 1 . 1 1 27 27 PHE CB C 27 38.262 38.262 38.449 -0.187 18135 151 1 . 1 1 27 27 PHE H H 27 7.986 7.986 8.012 -0.025 18135 152 1 . 1 1 28 28 SER N N 28 115.200 115.200 116.069 -0.869 18135 153 1 . 1 1 28 28 SER HA H 28 4.505 4.505 4.407 0.098 18135 154 1 . 1 1 28 28 SER C C 28 174.533 174.533 174.603 -0.070 18135 155 1 . 1 1 28 28 SER CA C 28 59.447 59.447 60.546 -1.099 18135 156 1 . 1 1 28 28 SER CB C 28 63.790 63.790 63.622 0.169 18135 157 1 . 1 1 28 28 SER H H 28 7.929 7.929 8.147 -0.218 18135 158 1 . 1 1 29 29 CYS N N 29 119.870 119.870 119.357 0.513 18135 159 1 . 1 1 29 29 CYS HA H 29 5.082 5.082 4.677 0.405 18135 160 1 . 1 1 29 29 CYS C C 29 176.475 176.475 174.274 2.201 18135 161 1 . 1 1 29 29 CYS CA C 29 53.430 53.430 58.548 -5.118 18135 162 1 . 1 1 29 29 CYS CB C 29 37.242 37.242 27.382 9.860 18135 163 1 . 1 1 29 29 CYS H H 29 7.865 7.865 8.017 -0.152 18135 164 1 . 1 1 30 30 LEU N N 30 122.259 122.259 123.390 -1.131 18135 165 1 . 1 1 30 30 LEU HA H 30 3.961 3.961 4.323 -0.362 18135 166 1 . 1 1 30 30 LEU C C 30 179.774 179.774 178.103 1.671 18135 167 1 . 1 1 30 30 LEU CA C 30 58.303 58.303 56.064 2.239 18135 168 1 . 1 1 30 30 LEU CB C 30 41.576 41.576 42.056 -0.480 18135 169 1 . 1 1 30 30 LEU H H 30 7.812 7.812 8.491 -0.679 18135 170 1 . 1 1 31 31 LYS N N 31 117.731 117.731 115.915 1.816 18135 171 1 . 1 1 31 31 LYS HA H 31 4.690 4.690 4.242 0.448 18135 172 1 . 1 1 31 31 LYS C C 31 176.692 176.692 176.021 0.671 18135 173 1 . 1 1 31 31 LYS CA C 31 54.077 54.077 57.052 -2.975 18135 174 1 . 1 1 31 31 LYS CB C 31 31.587 31.587 31.968 -0.381 18135 175 1 . 1 1 31 31 LYS H H 31 8.597 8.597 8.100 0.497 18135 176 1 . 1 1 32 32 ASP N N 32 117.841 117.841 118.069 -0.228 18135 177 1 . 1 1 32 32 ASP HA H 32 4.694 4.694 4.702 -0.008 18135 178 1 . 1 1 32 32 ASP C C 32 175.505 175.505 176.211 -0.706 18135 179 1 . 1 1 32 32 ASP CA C 32 54.088 54.088 54.249 -0.161 18135 180 1 . 1 1 32 32 ASP CB C 32 41.808 41.808 42.274 -0.466 18135 181 1 . 1 1 32 32 ASP H H 32 7.808 7.808 7.887 -0.079 18135 182 1 . 1 1 33 33 ARG N N 33 120.876 120.876 119.381 1.495 18135 183 1 . 1 1 33 33 ARG HA H 33 4.041 4.041 4.071 -0.030 18135 184 1 . 1 1 33 33 ARG C C 33 175.286 175.286 175.796 -0.510 18135 185 1 . 1 1 33 33 ARG CA C 33 58.083 58.083 57.297 0.786 18135 186 1 . 1 1 33 33 ARG CB C 33 30.013 30.013 30.490 -0.477 18135 187 1 . 1 1 33 33 ARG H H 33 7.378 7.378 7.354 0.024 18135 188 1 . 1 1 34 34 HIS N N 34 120.555 120.555 116.705 3.850 18135 189 1 . 1 1 34 34 HIS HA H 34 4.212 4.212 4.572 -0.360 18135 190 1 . 1 1 34 34 HIS C C 34 170.494 170.494 173.593 -3.099 18135 191 1 . 1 1 34 34 HIS CA C 34 54.607 54.607 56.358 -1.751 18135 192 1 . 1 1 34 34 HIS CB C 34 31.488 31.488 29.847 1.641 18135 193 1 . 1 1 34 34 HIS H H 34 7.974 7.974 8.215 -0.241 18135 194 1 . 1 1 35 35 ASP N N 35 125.061 125.061 121.957 3.104 18135 195 1 . 1 1 35 35 ASP HA H 35 4.638 4.638 4.428 0.210 18135 196 1 . 1 1 35 35 ASP C C 35 175.943 175.943 176.352 -0.409 18135 197 1 . 1 1 35 35 ASP CA C 35 52.369 52.369 54.352 -1.983 18135 198 1 . 1 1 35 35 ASP CB C 35 40.362 40.362 41.722 -1.360 18135 199 1 . 1 1 35 35 ASP H H 35 7.805 7.805 8.279 -0.474 18135 200 1 . 1 1 36 36 PHE N N 36 122.860 122.860 119.861 2.999 18135 201 1 . 1 1 36 36 PHE HA H 36 4.325 4.325 4.361 -0.036 18135 202 1 . 1 1 36 36 PHE C C 36 176.643 176.643 176.816 -0.173 18135 203 1 . 1 1 36 36 PHE CA C 36 59.639 59.639 58.568 1.071 18135 204 1 . 1 1 36 36 PHE CB C 36 40.691 40.691 38.830 1.861 18135 205 1 . 1 1 36 36 PHE H H 36 8.973 8.973 7.381 1.592 18135 206 1 . 1 1 37 37 GLY N N 37 111.856 111.856 108.830 3.025 18135 207 1 . 1 1 37 37 GLY C C 37 175.185 175.185 174.275 0.910 18135 208 1 . 1 1 37 37 GLY CA C 37 48.143 48.143 44.903 3.240 18135 209 1 . 1 1 37 37 GLY H H 37 8.727 8.727 8.120 0.607 18135 210 1 . 1 1 38 38 PHE N N 38 123.178 123.178 121.282 1.896 18135 211 1 . 1 1 38 38 PHE HA H 38 3.914 3.914 4.740 -0.826 18135 212 1 . 1 1 38 38 PHE CA C 38 55.804 55.804 53.568 2.236 18135 213 1 . 1 1 38 38 PHE CB C 38 38.657 38.657 38.358 0.299 18135 214 1 . 1 1 38 38 PHE H H 38 9.169 9.169 7.558 1.611 18135 215 1 . 1 1 39 39 PRO HA H 39 4.529 4.529 4.458 0.071 18135 216 1 . 1 1 39 39 PRO C C 39 174.634 174.634 177.050 -2.416 18135 217 1 . 1 1 39 39 PRO CA C 39 61.543 61.543 62.652 -1.109 18135 218 1 . 1 1 39 39 PRO CB C 39 28.704 28.704 30.562 -1.858 18135 219 1 . 1 1 40 40 GLN N N 40 123.608 123.608 123.316 0.292 18135 220 1 . 1 1 40 40 GLN HA H 40 3.619 3.619 4.252 -0.633 18135 221 1 . 1 1 40 40 GLN C C 40 176.958 176.958 177.569 -0.611 18135 222 1 . 1 1 40 40 GLN CA C 40 58.073 58.073 58.963 -0.890 18135 223 1 . 1 1 40 40 GLN CB C 40 28.817 28.817 27.802 1.015 18135 224 1 . 1 1 40 40 GLN H H 40 7.966 7.966 8.267 -0.301 18135 225 1 . 1 1 41 41 GLU N N 41 119.446 119.446 119.610 -0.164 18135 226 1 . 1 1 41 41 GLU HA H 41 4.137 4.137 4.109 0.028 18135 227 1 . 1 1 41 41 GLU C C 41 177.346 177.346 177.848 -0.502 18135 228 1 . 1 1 41 41 GLU CA C 41 57.929 57.929 58.937 -1.008 18135 229 1 . 1 1 41 41 GLU CB C 41 27.833 27.833 29.087 -1.254 18135 230 1 . 1 1 41 41 GLU H H 41 9.044 9.044 8.710 0.334 18135 231 1 . 1 1 42 42 GLU N N 42 117.196 117.196 117.568 -0.372 18135 232 1 . 1 1 42 42 GLU HA H 42 4.063 4.063 4.302 -0.239 18135 233 1 . 1 1 42 42 GLU C C 42 174.886 174.886 177.859 -2.973 18135 234 1 . 1 1 42 42 GLU CA C 42 56.384 56.384 57.531 -1.147 18135 235 1 . 1 1 42 42 GLU CB C 42 27.558 27.558 29.985 -2.427 18135 236 1 . 1 1 42 42 GLU H H 42 7.646 7.646 7.892 -0.246 18135 237 1 . 1 1 43 43 PHE N N 43 115.527 115.527 121.970 -6.443 18135 238 1 . 1 1 43 43 PHE HA H 43 4.486 4.486 4.620 -0.134 18135 239 1 . 1 1 43 43 PHE C C 43 175.615 175.615 175.984 -0.369 18135 240 1 . 1 1 43 43 PHE CA C 43 57.548 57.548 58.831 -1.283 18135 241 1 . 1 1 43 43 PHE CB C 43 39.893 39.893 40.160 -0.267 18135 242 1 . 1 1 43 43 PHE H H 43 7.601 7.601 8.405 -0.804 18135 243 1 . 1 1 44 44 GLY N N 44 107.243 107.243 108.795 -1.552 18135 244 1 . 1 1 44 44 GLY C C 44 174.032 174.032 173.926 0.106 18135 245 1 . 1 1 44 44 GLY CA C 44 45.612 45.612 45.565 0.047 18135 246 1 . 1 1 44 44 GLY H H 44 7.733 7.733 7.813 -0.080 18135 247 1 . 1 1 45 45 ASN N N 45 117.599 117.599 119.322 -1.723 18135 248 1 . 1 1 45 45 ASN HA H 45 4.551 4.551 4.715 -0.164 18135 249 1 . 1 1 45 45 ASN C C 45 175.894 175.894 174.842 1.052 18135 250 1 . 1 1 45 45 ASN CA C 45 53.849 53.849 53.197 0.652 18135 251 1 . 1 1 45 45 ASN CB C 45 38.419 38.419 39.283 -0.864 18135 252 1 . 1 1 45 45 ASN H H 45 8.343 8.343 8.007 0.336 18135 253 1 . 1 1 46 46 GLN N N 46 118.916 118.916 117.752 1.164 18135 254 1 . 1 1 46 46 GLN HA H 46 4.082 4.082 4.381 -0.299 18135 255 1 . 1 1 46 46 GLN C C 46 175.851 175.851 176.004 -0.153 18135 256 1 . 1 1 46 46 GLN CA C 46 56.646 56.646 55.375 1.271 18135 257 1 . 1 1 46 46 GLN CB C 46 28.444 28.444 28.006 0.438 18135 258 1 . 1 1 46 46 GLN H H 46 8.652 8.652 8.409 0.243 18135 259 1 . 1 1 47 47 PHE N N 47 119.511 119.511 118.231 1.280 18135 260 1 . 1 1 47 47 PHE HA H 47 4.562 4.562 4.506 0.056 18135 261 1 . 1 1 47 47 PHE C C 47 176.258 176.258 175.321 0.937 18135 262 1 . 1 1 47 47 PHE CA C 47 57.920 57.920 58.155 -0.235 18135 263 1 . 1 1 47 47 PHE CB C 47 39.858 39.858 39.123 0.735 18135 264 1 . 1 1 47 47 PHE H H 47 7.904 7.904 7.919 -0.015 18135 265 1 . 1 1 48 48 GLN N N 48 120.127 120.127 118.445 1.682 18135 266 1 . 1 1 48 48 GLN HA H 48 4.375 4.375 4.434 -0.059 18135 267 1 . 1 1 48 48 GLN C C 48 181.265 181.265 175.706 5.559 18135 268 1 . 1 1 48 48 GLN CA C 48 55.576 55.576 54.427 1.149 18135 269 1 . 1 1 48 48 GLN CB C 48 29.468 29.468 30.146 -0.678 18135 270 1 . 1 1 48 48 GLN H H 48 8.255 8.255 7.643 0.612 18135 271 1 . 1 1 49 49 LYS N N 49 121.777 121.777 122.092 -0.315 18135 272 1 . 1 1 49 49 LYS HA H 49 4.103 4.103 4.246 -0.143 18135 273 1 . 1 1 49 49 LYS C C 49 177.968 177.968 177.471 0.497 18135 274 1 . 1 1 49 49 LYS CA C 49 58.149 58.149 58.535 -0.387 18135 275 1 . 1 1 49 49 LYS CB C 49 32.390 32.390 32.187 0.203 18135 276 1 . 1 1 49 49 LYS H H 49 8.426 8.426 8.619 -0.193 18135 277 1 . 1 1 50 50 ALA N N 50 120.573 120.573 119.891 0.682 18135 278 1 . 1 1 50 50 ALA HA H 50 4.070 4.070 4.291 -0.221 18135 279 1 . 1 1 50 50 ALA C C 50 178.697 178.697 177.476 1.221 18135 280 1 . 1 1 50 50 ALA CA C 50 54.768 54.768 53.370 1.398 18135 281 1 . 1 1 50 50 ALA CB C 50 18.874 18.874 18.492 0.382 18135 282 1 . 1 1 50 50 ALA H H 50 8.578 8.578 7.965 0.613 18135 283 1 . 1 1 51 51 GLU N N 51 115.015 115.015 115.466 -0.451 18135 284 1 . 1 1 51 51 GLU HA H 51 4.266 4.266 4.255 0.011 18135 285 1 . 1 1 51 51 GLU C C 51 176.995 176.995 176.871 0.124 18135 286 1 . 1 1 51 51 GLU CA C 51 56.993 56.993 57.296 -0.303 18135 287 1 . 1 1 51 51 GLU CB C 51 28.905 28.905 29.964 -1.059 18135 288 1 . 1 1 51 51 GLU H H 51 7.907 7.907 8.293 -0.386 18135 289 1 . 1 1 52 52 THR N N 52 111.210 111.210 114.999 -3.789 18135 290 1 . 1 1 52 52 THR HA H 52 4.114 4.114 4.306 -0.192 18135 291 1 . 1 1 52 52 THR C C 52 175.271 175.271 175.709 -0.438 18135 292 1 . 1 1 52 52 THR CA C 52 63.611 63.611 64.888 -1.276 18135 293 1 . 1 1 52 52 THR CB C 52 69.673 69.673 68.849 0.824 18135 294 1 . 1 1 52 52 THR H H 52 7.863 7.863 7.531 0.332 18135 295 1 . 1 1 53 53 ILE N N 53 119.113 119.113 122.206 -3.093 18135 296 1 . 1 1 53 53 ILE HA H 53 3.864 3.864 4.144 -0.280 18135 297 1 . 1 1 53 53 ILE CA C 53 66.907 66.907 65.994 0.913 18135 298 1 . 1 1 53 53 ILE CB C 53 34.953 34.953 36.222 -1.269 18135 299 1 . 1 1 53 53 ILE H H 53 8.341 8.341 8.044 0.297 18135 300 1 . 1 1 54 54 PRO HA H 54 4.286 4.286 4.396 -0.110 18135 301 1 . 1 1 54 54 PRO C C 54 179.655 179.655 178.944 0.711 18135 302 1 . 1 1 54 54 PRO CA C 54 66.051 66.051 66.124 -0.073 18135 303 1 . 1 1 54 54 PRO CB C 54 31.885 31.885 31.352 0.533 18135 304 1 . 1 1 55 55 VAL N N 55 116.355 116.355 116.514 -0.159 18135 305 1 . 1 1 55 55 VAL HA H 55 3.681 3.681 3.868 -0.187 18135 306 1 . 1 1 55 55 VAL C C 55 177.649 177.649 178.101 -0.452 18135 307 1 . 1 1 55 55 VAL CA C 55 65.837 65.837 65.740 0.097 18135 308 1 . 1 1 55 55 VAL CB C 55 31.471 31.471 30.828 0.643 18135 309 1 . 1 1 55 55 VAL H H 55 7.119 7.119 7.503 -0.384 18135 310 1 . 1 1 56 56 LEU N N 56 123.038 123.038 121.328 1.710 18135 311 1 . 1 1 56 56 LEU HA H 56 4.310 4.310 4.047 0.263 18135 312 1 . 1 1 56 56 LEU C C 56 178.637 178.637 177.987 0.650 18135 313 1 . 1 1 56 56 LEU CA C 56 58.086 58.086 58.504 -0.419 18135 314 1 . 1 1 56 56 LEU CB C 56 42.318 42.318 41.417 0.901 18135 315 1 . 1 1 56 56 LEU H H 56 8.535 8.535 8.482 0.053 18135 316 1 . 1 1 57 57 HIS N N 57 117.041 117.041 118.440 -1.399 18135 317 1 . 1 1 57 57 HIS HA H 57 3.786 3.786 4.010 -0.224 18135 318 1 . 1 1 57 57 HIS C C 57 175.640 175.640 177.473 -1.833 18135 319 1 . 1 1 57 57 HIS CA C 57 60.531 60.531 59.742 0.789 18135 320 1 . 1 1 57 57 HIS CB C 57 28.209 28.209 30.080 -1.871 18135 321 1 . 1 1 57 57 HIS H H 57 9.047 9.047 8.073 0.973 18135 322 1 . 1 1 58 58 GLU N N 58 119.521 119.521 118.571 0.950 18135 323 1 . 1 1 58 58 GLU HA H 58 4.007 4.007 3.801 0.206 18135 324 1 . 1 1 58 58 GLU C C 58 179.029 179.029 178.869 0.160 18135 325 1 . 1 1 58 58 GLU CA C 58 58.967 58.967 59.303 -0.336 18135 326 1 . 1 1 58 58 GLU CB C 58 28.290 28.290 29.327 -1.037 18135 327 1 . 1 1 58 58 GLU H H 58 7.860 7.860 8.204 -0.344 18135 328 1 . 1 1 59 59 MET N N 59 119.512 119.512 119.658 -0.146 18135 329 1 . 1 1 59 59 MET HA H 59 4.074 4.074 4.267 -0.193 18135 330 1 . 1 1 59 59 MET C C 59 177.031 177.031 178.916 -1.885 18135 331 1 . 1 1 59 59 MET CA C 59 59.408 59.408 59.201 0.207 18135 332 1 . 1 1 59 59 MET CB C 59 32.525 32.525 32.743 -0.218 18135 333 1 . 1 1 59 59 MET H H 59 8.442 8.442 7.954 0.488 18135 334 1 . 1 1 60 60 ILE N N 60 117.183 117.183 118.060 -0.877 18135 335 1 . 1 1 60 60 ILE HA H 60 3.417 3.417 3.497 -0.080 18135 336 1 . 1 1 60 60 ILE C C 60 177.524 177.524 178.163 -0.639 18135 337 1 . 1 1 60 60 ILE CA C 60 65.326 65.326 64.913 0.413 18135 338 1 . 1 1 60 60 ILE CB C 60 36.860 36.860 37.156 -0.296 18135 339 1 . 1 1 60 60 ILE H H 60 8.338 8.338 7.766 0.572 18135 340 1 . 1 1 61 61 GLN N N 61 120.191 120.191 119.861 0.330 18135 341 1 . 1 1 61 61 GLN HA H 61 3.702 3.702 3.801 -0.099 18135 342 1 . 1 1 61 61 GLN C C 61 178.270 178.270 177.773 0.497 18135 343 1 . 1 1 61 61 GLN CA C 61 58.786 58.786 59.326 -0.540 18135 344 1 . 1 1 61 61 GLN CB C 61 28.666 28.666 28.199 0.467 18135 345 1 . 1 1 61 61 GLN H H 61 8.234 8.234 8.165 0.069 18135 346 1 . 1 1 62 62 GLN N N 62 116.795 116.795 118.854 -2.059 18135 347 1 . 1 1 62 62 GLN HA H 62 3.627 3.627 3.272 0.355 18135 348 1 . 1 1 62 62 GLN C C 62 179.685 179.685 178.394 1.291 18135 349 1 . 1 1 62 62 GLN CA C 62 58.008 58.008 58.341 -0.333 18135 350 1 . 1 1 62 62 GLN CB C 62 24.342 24.342 27.802 -3.460 18135 351 1 . 1 1 62 62 GLN H H 62 8.421 8.421 8.044 0.377 18135 352 1 . 1 1 63 63 ILE N N 63 122.797 122.797 120.042 2.755 18135 353 1 . 1 1 63 63 ILE HA H 63 3.649 3.649 3.892 -0.243 18135 354 1 . 1 1 63 63 ILE C C 63 177.279 177.279 177.869 -0.590 18135 355 1 . 1 1 63 63 ILE CA C 63 66.965 66.965 64.687 2.278 18135 356 1 . 1 1 63 63 ILE CB C 63 37.315 37.315 37.813 -0.499 18135 357 1 . 1 1 63 63 ILE H H 63 8.164 8.164 7.598 0.566 18135 358 1 . 1 1 64 64 PHE N N 64 120.820 120.820 121.274 -0.454 18135 359 1 . 1 1 64 64 PHE HA H 64 3.716 3.716 4.463 -0.747 18135 360 1 . 1 1 64 64 PHE C C 64 178.402 178.402 176.758 1.644 18135 361 1 . 1 1 64 64 PHE CA C 64 62.152 62.152 61.236 0.916 18135 362 1 . 1 1 64 64 PHE CB C 64 38.510 38.510 38.631 -0.121 18135 363 1 . 1 1 64 64 PHE H H 64 8.405 8.405 7.941 0.464 18135 364 1 . 1 1 65 65 ASN N N 65 119.981 119.981 118.231 1.750 18135 365 1 . 1 1 65 65 ASN HA H 65 4.063 4.063 3.663 0.400 18135 366 1 . 1 1 65 65 ASN C C 65 177.944 177.944 177.369 0.575 18135 367 1 . 1 1 65 65 ASN CA C 65 55.868 55.868 56.069 -0.201 18135 368 1 . 1 1 65 65 ASN CB C 65 37.256 37.256 38.355 -1.099 18135 369 1 . 1 1 65 65 ASN H H 65 8.812 8.812 7.873 0.939 18135 370 1 . 1 1 66 66 LEU N N 66 121.533 121.533 120.283 1.250 18135 371 1 . 1 1 66 66 LEU HA H 66 4.223 4.223 4.207 0.016 18135 372 1 . 1 1 66 66 LEU C C 66 177.777 177.777 178.955 -1.178 18135 373 1 . 1 1 66 66 LEU CA C 66 58.268 58.268 57.873 0.395 18135 374 1 . 1 1 66 66 LEU CB C 66 42.607 42.607 42.376 0.231 18135 375 1 . 1 1 66 66 LEU H H 66 8.177 8.177 7.859 0.318 18135 376 1 . 1 1 67 67 PHE N N 67 110.842 110.842 114.312 -3.470 18135 377 1 . 1 1 67 67 PHE HA H 67 4.880 4.880 4.600 0.280 18135 378 1 . 1 1 67 67 PHE C C 67 177.965 177.965 176.651 1.314 18135 379 1 . 1 1 67 67 PHE CA C 67 59.534 59.534 58.674 0.860 18135 380 1 . 1 1 67 67 PHE CB C 67 38.616 38.616 38.923 -0.307 18135 381 1 . 1 1 67 67 PHE H H 67 8.160 8.160 8.475 -0.315 18135 382 1 . 1 1 68 68 SER N N 68 119.131 119.131 113.334 5.797 18135 383 1 . 1 1 68 68 SER HA H 68 4.580 4.580 4.324 0.256 18135 384 1 . 1 1 68 68 SER C C 68 173.472 173.472 174.870 -1.398 18135 385 1 . 1 1 68 68 SER CA C 68 59.191 59.191 59.122 0.069 18135 386 1 . 1 1 68 68 SER CB C 68 63.123 63.123 63.598 -0.475 18135 387 1 . 1 1 68 68 SER H H 68 8.016 8.016 7.619 0.397 18135 388 1 . 1 1 69 69 THR N N 69 111.353 111.353 115.557 -4.204 18135 389 1 . 1 1 69 69 THR HA H 69 4.345 4.345 4.436 -0.091 18135 390 1 . 1 1 69 69 THR C C 69 175.661 175.661 174.588 1.073 18135 391 1 . 1 1 69 69 THR CA C 69 61.411 61.411 60.634 0.777 18135 392 1 . 1 1 69 69 THR CB C 69 72.209 72.209 70.594 1.615 18135 393 1 . 1 1 69 69 THR H H 69 6.977 6.977 7.363 -0.386 18135 394 1 . 1 1 70 70 LYS N N 70 121.120 121.120 122.956 -1.836 18135 395 1 . 1 1 70 70 LYS HA H 70 4.089 4.089 4.125 -0.036 18135 396 1 . 1 1 70 70 LYS C C 70 179.259 179.259 177.408 1.851 18135 397 1 . 1 1 70 70 LYS CA C 70 57.956 57.956 58.830 -0.874 18135 398 1 . 1 1 70 70 LYS CB C 70 31.750 31.750 32.346 -0.596 18135 399 1 . 1 1 70 70 LYS H H 70 9.065 9.065 8.597 0.468 18135 400 1 . 1 1 71 71 ASP N N 71 116.374 116.374 119.936 -3.562 18135 401 1 . 1 1 71 71 ASP HA H 71 4.175 4.175 4.284 -0.109 18135 402 1 . 1 1 71 71 ASP C C 71 178.372 178.372 177.287 1.085 18135 403 1 . 1 1 71 71 ASP CA C 71 57.067 57.067 57.074 -0.007 18135 404 1 . 1 1 71 71 ASP CB C 71 40.306 40.306 40.429 -0.123 18135 405 1 . 1 1 71 71 ASP H H 71 7.518 7.518 7.806 -0.288 18135 406 1 . 1 1 72 72 SER N N 72 117.341 117.341 114.089 3.252 18135 407 1 . 1 1 72 72 SER HA H 72 3.715 3.715 3.253 0.462 18135 408 1 . 1 1 72 72 SER C C 72 176.897 176.897 175.942 0.955 18135 409 1 . 1 1 72 72 SER CA C 72 60.267 60.267 60.588 -0.322 18135 410 1 . 1 1 72 72 SER CB C 72 62.616 62.616 63.060 -0.444 18135 411 1 . 1 1 72 72 SER H H 72 8.066 8.066 7.876 0.190 18135 412 1 . 1 1 73 73 SER N N 73 113.398 113.398 117.583 -4.185 18135 413 1 . 1 1 73 73 SER HA H 73 4.094 4.094 4.118 -0.024 18135 414 1 . 1 1 73 73 SER C C 73 174.855 174.855 175.128 -0.273 18135 415 1 . 1 1 73 73 SER CA C 73 61.385 61.385 60.560 0.825 18135 416 1 . 1 1 73 73 SER CB C 73 62.798 62.798 62.924 -0.126 18135 417 1 . 1 1 73 73 SER H H 73 7.982 7.982 7.641 0.341 18135 418 1 . 1 1 74 74 ALA N N 74 119.486 119.486 119.979 -0.493 18135 419 1 . 1 1 74 74 ALA HA H 74 4.157 4.157 4.231 -0.074 18135 420 1 . 1 1 74 74 ALA C C 74 177.626 177.626 177.318 0.308 18135 421 1 . 1 1 74 74 ALA CA C 74 52.713 52.713 52.535 0.178 18135 422 1 . 1 1 74 74 ALA CB C 74 18.747 18.747 18.901 -0.154 18135 423 1 . 1 1 74 74 ALA H H 74 7.095 7.095 7.598 -0.503 18135 424 1 . 1 1 75 75 ALA N N 75 121.465 121.465 121.082 0.383 18135 425 1 . 1 1 75 75 ALA HA H 75 3.696 3.696 3.848 -0.152 18135 426 1 . 1 1 75 75 ALA C C 75 177.197 177.197 176.061 1.136 18135 427 1 . 1 1 75 75 ALA CA C 75 53.004 53.004 52.019 0.985 18135 428 1 . 1 1 75 75 ALA CB C 75 18.260 18.260 18.999 -0.739 18135 429 1 . 1 1 75 75 ALA H H 75 7.159 7.159 7.365 -0.206 18135 430 1 . 1 1 76 76 TRP N N 76 116.791 116.791 116.536 0.255 18135 431 1 . 1 1 76 76 TRP HA H 76 5.050 5.050 4.718 0.332 18135 432 1 . 1 1 76 76 TRP C C 76 177.617 177.617 174.863 2.754 18135 433 1 . 1 1 76 76 TRP CA C 76 53.319 53.319 55.085 -1.766 18135 434 1 . 1 1 76 76 TRP CB C 76 33.076 33.076 30.994 2.082 18135 435 1 . 1 1 76 76 TRP H H 76 7.080 7.080 7.142 -0.062 18135 436 1 . 1 1 77 77 ASP N N 77 119.928 119.928 121.300 -1.372 18135 437 1 . 1 1 77 77 ASP HA H 77 4.357 4.357 4.534 -0.177 18135 438 1 . 1 1 77 77 ASP C C 77 176.877 176.877 177.701 -0.824 18135 439 1 . 1 1 77 77 ASP CA C 77 54.818 54.818 55.444 -0.626 18135 440 1 . 1 1 77 77 ASP CB C 77 42.615 42.615 42.066 0.549 18135 441 1 . 1 1 77 77 ASP H H 77 8.259 8.259 8.726 -0.467 18135 442 1 . 1 1 78 78 GLU N N 78 127.277 127.277 126.089 1.188 18135 443 1 . 1 1 78 78 GLU HA H 78 3.885 3.885 3.989 -0.104 18135 444 1 . 1 1 78 78 GLU C C 78 177.439 177.439 178.234 -0.794 18135 445 1 . 1 1 78 78 GLU CA C 78 59.384 59.384 59.846 -0.462 18135 446 1 . 1 1 78 78 GLU CB C 78 28.642 28.642 29.350 -0.708 18135 447 1 . 1 1 78 78 GLU H H 78 8.920 8.920 8.883 0.037 18135 448 1 . 1 1 79 79 THR N N 79 115.422 115.422 117.300 -1.878 18135 449 1 . 1 1 79 79 THR HA H 79 3.907 3.907 4.057 -0.150 18135 450 1 . 1 1 79 79 THR C C 79 177.330 177.330 176.495 0.835 18135 451 1 . 1 1 79 79 THR CA C 79 66.263 66.263 65.845 0.418 18135 452 1 . 1 1 79 79 THR CB C 79 68.002 68.002 68.390 -0.388 18135 453 1 . 1 1 79 79 THR H H 79 8.124 8.124 8.079 0.045 18135 454 1 . 1 1 80 80 LEU N N 80 121.791 121.791 122.202 -0.411 18135 455 1 . 1 1 80 80 LEU HA H 80 3.887 3.887 4.136 -0.249 18135 456 1 . 1 1 80 80 LEU C C 80 179.018 179.018 178.799 0.219 18135 457 1 . 1 1 80 80 LEU CA C 80 57.239 57.239 57.645 -0.406 18135 458 1 . 1 1 80 80 LEU CB C 80 41.652 41.652 41.091 0.561 18135 459 1 . 1 1 80 80 LEU H H 80 7.725 7.725 8.012 -0.287 18135 460 1 . 1 1 81 81 LEU N N 81 119.280 119.280 120.560 -1.280 18135 461 1 . 1 1 81 81 LEU HA H 81 3.489 3.489 4.215 -0.726 18135 462 1 . 1 1 81 81 LEU C C 81 177.062 177.062 178.852 -1.790 18135 463 1 . 1 1 81 81 LEU CA C 81 57.709 57.709 58.759 -1.050 18135 464 1 . 1 1 81 81 LEU CB C 81 40.948 40.948 42.001 -1.053 18135 465 1 . 1 1 81 81 LEU H H 81 8.344 8.344 8.708 -0.364 18135 466 1 . 1 1 82 82 ASP N N 82 115.357 115.357 119.863 -4.506 18135 467 1 . 1 1 82 82 ASP HA H 82 4.274 4.274 4.417 -0.143 18135 468 1 . 1 1 82 82 ASP C C 82 179.018 179.018 178.579 0.439 18135 469 1 . 1 1 82 82 ASP CA C 82 56.815 56.815 57.629 -0.814 18135 470 1 . 1 1 82 82 ASP CB C 82 38.221 38.221 40.791 -2.570 18135 471 1 . 1 1 82 82 ASP H H 82 8.001 8.001 8.565 -0.564 18135 472 1 . 1 1 83 83 LYS N N 83 119.603 119.603 118.880 0.723 18135 473 1 . 1 1 83 83 LYS HA H 83 3.982 3.982 3.877 0.106 18135 474 1 . 1 1 83 83 LYS C C 83 178.624 178.624 178.891 -0.267 18135 475 1 . 1 1 83 83 LYS CA C 83 59.745 59.745 58.967 0.778 18135 476 1 . 1 1 83 83 LYS CB C 83 33.106 33.106 32.255 0.851 18135 477 1 . 1 1 83 83 LYS H H 83 7.342 7.342 7.697 -0.355 18135 478 1 . 1 1 84 84 PHE N N 84 123.933 123.933 121.797 2.136 18135 479 1 . 1 1 84 84 PHE HA H 84 4.035 4.035 4.030 0.006 18135 480 1 . 1 1 84 84 PHE C C 84 177.210 177.210 176.979 0.231 18135 481 1 . 1 1 84 84 PHE CA C 84 60.343 60.343 61.789 -1.446 18135 482 1 . 1 1 84 84 PHE CB C 84 39.316 39.316 38.967 0.349 18135 483 1 . 1 1 84 84 PHE H H 84 8.471 8.471 8.441 0.030 18135 484 1 . 1 1 85 85 TYR N N 85 118.387 118.387 117.588 0.799 18135 485 1 . 1 1 85 85 TYR HA H 85 4.068 4.068 3.753 0.315 18135 486 1 . 1 1 85 85 TYR C C 85 178.104 178.104 177.430 0.674 18135 487 1 . 1 1 85 85 TYR CA C 85 58.577 58.577 59.712 -1.135 18135 488 1 . 1 1 85 85 TYR CB C 85 36.977 36.977 37.163 -0.186 18135 489 1 . 1 1 85 85 TYR H H 85 9.011 9.011 8.980 0.031 18135 490 1 . 1 1 86 86 THR N N 86 114.035 114.035 116.333 -2.298 18135 491 1 . 1 1 86 86 THR HA H 86 3.945 3.945 3.227 0.718 18135 492 1 . 1 1 86 86 THR C C 86 176.708 176.708 176.342 0.366 18135 493 1 . 1 1 86 86 THR CA C 86 66.759 66.759 66.894 -0.135 18135 494 1 . 1 1 86 86 THR CB C 86 68.853 68.853 67.956 0.896 18135 495 1 . 1 1 86 86 THR H H 86 7.609 7.609 7.368 0.241 18135 496 1 . 1 1 87 87 GLU N N 87 120.790 120.790 121.615 -0.825 18135 497 1 . 1 1 87 87 GLU HA H 87 4.047 4.047 3.923 0.124 18135 498 1 . 1 1 87 87 GLU C C 87 179.606 179.606 178.845 0.761 18135 499 1 . 1 1 87 87 GLU CA C 87 58.398 58.398 59.373 -0.975 18135 500 1 . 1 1 87 87 GLU CB C 87 28.286 28.286 29.151 -0.865 18135 501 1 . 1 1 87 87 GLU H H 87 7.712 7.712 7.619 0.093 18135 502 1 . 1 1 88 88 LEU N N 88 120.729 120.729 119.900 0.829 18135 503 1 . 1 1 88 88 LEU HA H 88 3.728 3.728 3.906 -0.178 18135 504 1 . 1 1 88 88 LEU C C 88 178.695 178.695 179.306 -0.611 18135 505 1 . 1 1 88 88 LEU CA C 88 58.251 58.251 57.222 1.029 18135 506 1 . 1 1 88 88 LEU CB C 88 41.587 41.587 40.049 1.538 18135 507 1 . 1 1 88 88 LEU H H 88 8.393 8.393 7.458 0.935 18135 508 1 . 1 1 89 89 TYR N N 89 118.654 118.654 118.977 -0.323 18135 509 1 . 1 1 89 89 TYR HA H 89 3.931 3.931 4.018 -0.087 18135 510 1 . 1 1 89 89 TYR C C 89 178.438 178.438 178.599 -0.161 18135 511 1 . 1 1 89 89 TYR CA C 89 61.407 61.407 61.160 0.247 18135 512 1 . 1 1 89 89 TYR CB C 89 37.867 37.867 37.384 0.483 18135 513 1 . 1 1 89 89 TYR H H 89 8.637 8.637 8.246 0.391 18135 514 1 . 1 1 90 90 GLN N N 90 118.263 118.263 116.552 1.711 18135 515 1 . 1 1 90 90 GLN HA H 90 3.986 3.986 3.974 0.012 18135 516 1 . 1 1 90 90 GLN C C 90 178.411 178.411 178.713 -0.302 18135 517 1 . 1 1 90 90 GLN CA C 90 58.782 58.782 58.748 0.034 18135 518 1 . 1 1 90 90 GLN CB C 90 28.147 28.147 28.338 -0.191 18135 519 1 . 1 1 90 90 GLN H H 90 7.796 7.796 7.810 -0.014 18135 520 1 . 1 1 91 91 GLN N N 91 117.959 117.959 119.995 -2.036 18135 521 1 . 1 1 91 91 GLN HA H 91 4.082 4.082 4.052 0.030 18135 522 1 . 1 1 91 91 GLN C C 91 178.705 178.705 178.556 0.149 18135 523 1 . 1 1 91 91 GLN CA C 91 58.820 58.820 58.768 0.052 18135 524 1 . 1 1 91 91 GLN CB C 91 29.173 29.173 28.342 0.831 18135 525 1 . 1 1 91 91 GLN H H 91 7.727 7.727 8.197 -0.470 18135 526 1 . 1 1 92 92 LEU N N 92 119.965 119.965 118.422 1.543 18135 527 1 . 1 1 92 92 LEU HA H 92 3.734 3.734 3.983 -0.249 18135 528 1 . 1 1 92 92 LEU C C 92 178.984 178.984 178.711 0.273 18135 529 1 . 1 1 92 92 LEU CA C 92 58.492 58.492 58.846 -0.354 18135 530 1 . 1 1 92 92 LEU CB C 92 41.379 41.379 40.903 0.476 18135 531 1 . 1 1 92 92 LEU H H 92 8.465 8.465 8.489 -0.024 18135 532 1 . 1 1 93 93 ASN N N 93 117.793 117.793 118.404 -0.611 18135 533 1 . 1 1 93 93 ASN HA H 93 4.401 4.401 4.277 0.124 18135 534 1 . 1 1 93 93 ASN C C 93 178.309 178.309 177.143 1.166 18135 535 1 . 1 1 93 93 ASN CA C 93 56.403 56.403 56.224 0.179 18135 536 1 . 1 1 93 93 ASN CB C 93 38.638 38.638 38.235 0.403 18135 537 1 . 1 1 93 93 ASN H H 93 8.091 8.091 8.016 0.075 18135 538 1 . 1 1 94 94 ASP N N 94 121.133 121.133 120.655 0.478 18135 539 1 . 1 1 94 94 ASP HA H 94 4.405 4.405 4.378 0.027 18135 540 1 . 1 1 94 94 ASP C C 94 178.328 178.328 178.661 -0.333 18135 541 1 . 1 1 94 94 ASP CA C 94 56.547 56.547 57.267 -0.720 18135 542 1 . 1 1 94 94 ASP CB C 94 38.649 38.649 40.992 -2.344 18135 543 1 . 1 1 94 94 ASP H H 94 8.362 8.362 8.050 0.312 18135 544 1 . 1 1 95 95 LEU N N 95 119.160 119.160 120.863 -1.703 18135 545 1 . 1 1 95 95 LEU HA H 95 4.039 4.039 3.856 0.183 18135 546 1 . 1 1 95 95 LEU C C 95 178.826 178.826 178.488 0.338 18135 547 1 . 1 1 95 95 LEU CA C 95 57.027 57.027 58.142 -1.115 18135 548 1 . 1 1 95 95 LEU CB C 95 42.210 42.210 42.042 0.168 18135 549 1 . 1 1 95 95 LEU H H 95 8.143 8.143 8.507 -0.364 18135 550 1 . 1 1 96 96 GLU N N 96 118.813 118.813 118.916 -0.103 18135 551 1 . 1 1 96 96 GLU HA H 96 3.961 3.961 3.728 0.233 18135 552 1 . 1 1 96 96 GLU C C 96 177.640 177.640 178.206 -0.566 18135 553 1 . 1 1 96 96 GLU CA C 96 57.714 57.714 59.392 -1.678 18135 554 1 . 1 1 96 96 GLU CB C 96 28.138 28.138 29.445 -1.307 18135 555 1 . 1 1 96 96 GLU H H 96 8.111 8.111 8.172 -0.061 18135 556 1 . 1 1 97 97 ALA N N 97 120.549 120.549 121.140 -0.591 18135 557 1 . 1 1 97 97 ALA HA H 97 4.122 4.122 3.978 0.144 18135 558 1 . 1 1 97 97 ALA C C 97 179.126 179.126 180.268 -1.142 18135 559 1 . 1 1 97 97 ALA CA C 97 54.033 54.033 54.720 -0.687 18135 560 1 . 1 1 97 97 ALA CB C 97 17.980 17.980 17.897 0.083 18135 561 1 . 1 1 97 97 ALA H H 97 7.798 7.798 7.788 0.010 18135 562 1 . 1 1 98 98 CYS N N 98 115.510 115.510 117.262 -1.752 18135 563 1 . 1 1 98 98 CYS HA H 98 4.450 4.450 4.152 0.297 18135 564 1 . 1 1 98 98 CYS C C 98 175.363 175.363 176.152 -0.789 18135 565 1 . 1 1 98 98 CYS CA C 98 57.166 57.166 62.407 -5.241 18135 566 1 . 1 1 98 98 CYS CB C 98 41.879 41.879 26.158 15.721 18135 567 1 . 1 1 98 98 CYS H H 98 7.597 7.597 7.910 -0.313 18135 568 1 . 1 1 99 99 VAL N N 99 121.713 121.713 119.153 2.560 18135 569 1 . 1 1 99 99 VAL HA H 99 3.794 3.794 3.877 -0.083 18135 570 1 . 1 1 99 99 VAL C C 99 177.357 177.357 177.655 -0.298 18135 571 1 . 1 1 99 99 VAL CA C 99 64.583 64.583 65.285 -0.702 18135 572 1 . 1 1 99 99 VAL CB C 99 32.031 32.031 32.132 -0.102 18135 573 1 . 1 1 99 99 VAL H H 99 7.828 7.828 7.515 0.313 18135 574 1 . 1 1 100 100 ILE N N 100 122.333 122.333 118.504 3.829 18135 575 1 . 1 1 100 100 ILE HA H 100 3.924 3.924 3.718 0.206 18135 576 1 . 1 1 100 100 ILE C C 100 176.827 176.827 176.719 0.108 18135 577 1 . 1 1 100 100 ILE CA C 100 62.238 62.238 63.631 -1.393 18135 578 1 . 1 1 100 100 ILE CB C 100 38.278 38.278 37.669 0.609 18135 579 1 . 1 1 100 100 ILE H H 100 8.067 8.067 8.233 -0.166 18135 580 1 . 1 1 101 101 GLN N N 101 121.864 121.864 117.419 4.445 18135 581 1 . 1 1 101 101 GLN HA H 101 4.226 4.226 4.237 -0.011 18135 582 1 . 1 1 101 101 GLN C C 101 176.438 176.438 177.889 -1.451 18135 583 1 . 1 1 101 101 GLN CA C 101 56.320 56.320 56.313 0.007 18135 584 1 . 1 1 101 101 GLN CB C 101 29.011 29.011 29.092 -0.081 18135 585 1 . 1 1 101 101 GLN H H 101 8.062 8.062 7.437 0.625 18135 586 1 . 1 1 102 102 GLY N N 102 109.288 109.288 108.313 0.975 18135 587 1 . 1 1 102 102 GLY C C 102 173.855 173.855 175.369 -1.514 18135 588 1 . 1 1 102 102 GLY CA C 102 45.159 45.159 46.086 -0.927 18135 589 1 . 1 1 102 102 GLY H H 102 8.087 8.087 8.742 -0.655 18135 590 1 . 1 1 103 103 VAL N N 103 118.932 118.932 117.332 1.600 18135 591 1 . 1 1 103 103 VAL HA H 103 4.074 4.074 3.816 0.258 18135 592 1 . 1 1 103 103 VAL C C 103 176.299 176.299 175.973 0.326 18135 593 1 . 1 1 103 103 VAL CA C 103 62.499 62.499 63.932 -1.433 18135 594 1 . 1 1 103 103 VAL CB C 103 32.854 32.854 31.508 1.346 18135 595 1 . 1 1 103 103 VAL H H 103 8.079 8.079 7.604 0.475 18135 596 1 . 1 1 104 104 GLY N N 104 112.028 112.028 107.817 4.211 18135 597 1 . 1 1 104 104 GLY C C 104 173.694 173.694 173.291 0.403 18135 598 1 . 1 1 104 104 GLY CA C 104 45.402 45.402 45.062 0.340 18135 599 1 . 1 1 104 104 GLY H H 104 8.446 8.446 7.753 0.693 18135 600 1 . 1 1 105 105 VAL N N 105 120.439 120.439 121.189 -0.750 18135 601 1 . 1 1 105 105 VAL HA H 105 4.188 4.188 4.381 -0.193 18135 602 1 . 1 1 105 105 VAL C C 105 175.963 175.963 174.349 1.614 18135 603 1 . 1 1 105 105 VAL CA C 105 62.136 62.136 61.045 1.091 18135 604 1 . 1 1 105 105 VAL CB C 105 32.814 32.814 34.538 -1.724 18135 605 1 . 1 1 105 105 VAL H H 105 7.867 7.867 7.933 -0.066 18135 606 1 . 1 1 106 106 THR N N 106 116.366 116.366 115.853 0.513 18135 607 1 . 1 1 106 106 THR HA H 106 4.548 4.548 4.588 -0.040 18135 608 1 . 1 1 106 106 THR C C 106 173.731 173.731 173.635 0.096 18135 609 1 . 1 1 106 106 THR CA C 106 59.419 59.419 60.500 -1.081 18135 610 1 . 1 1 106 106 THR CB C 106 79.536 79.536 70.954 8.582 18135 611 1 . 1 1 106 106 THR H H 106 8.565 8.565 8.053 0.512 18135 612 1 . 1 1 107 107 GLU N N 107 119.743 119.743 120.790 -1.047 18135 613 1 . 1 1 107 107 GLU HA H 107 4.462 4.462 4.694 -0.232 18135 614 1 . 1 1 107 107 GLU C C 107 175.639 175.639 176.136 -0.497 18135 615 1 . 1 1 107 107 GLU CA C 107 55.711 55.711 54.811 0.900 18135 616 1 . 1 1 107 107 GLU CB C 107 30.499 30.499 31.860 -1.361 18135 617 1 . 1 1 107 107 GLU H H 107 8.410 8.410 8.488 -0.078 18135 618 1 . 1 1 108 108 THR N N 108 114.402 114.402 111.866 2.536 18135 619 1 . 1 1 108 108 THR HA H 108 4.448 4.448 4.759 -0.311 18135 620 1 . 1 1 108 108 THR CA C 108 60.348 60.348 58.705 1.644 18135 621 1 . 1 1 108 108 THR CB C 108 68.544 68.544 69.011 -0.467 18135 622 1 . 1 1 108 108 THR H H 108 8.155 8.155 8.329 -0.174 18135 623 1 . 1 1 109 109 PRO HA H 109 4.238 4.238 4.435 -0.197 18135 624 1 . 1 1 109 109 PRO C C 109 178.666 178.666 177.628 1.038 18135 625 1 . 1 1 109 109 PRO CA C 109 65.376 65.376 64.235 1.141 18135 626 1 . 1 1 109 109 PRO CB C 109 31.848 31.848 31.893 -0.045 18135 627 1 . 1 1 110 110 LEU N N 110 118.566 118.566 118.395 0.171 18135 628 1 . 1 1 110 110 LEU HA H 110 4.116 4.116 4.126 -0.010 18135 629 1 . 1 1 110 110 LEU C C 110 178.293 178.293 179.156 -0.863 18135 630 1 . 1 1 110 110 LEU CA C 110 56.686 56.686 57.848 -1.162 18135 631 1 . 1 1 110 110 LEU CB C 110 41.969 41.969 41.524 0.445 18135 632 1 . 1 1 110 110 LEU H H 110 8.016 8.016 7.823 0.193 18135 633 1 . 1 1 111 111 MET N N 111 118.982 118.982 115.965 3.017 18135 634 1 . 1 1 111 111 MET HA H 111 4.210 4.210 4.290 -0.080 18135 635 1 . 1 1 111 111 MET C C 111 178.720 178.720 177.797 0.923 18135 636 1 . 1 1 111 111 MET CA C 111 58.144 58.144 57.489 0.655 18135 637 1 . 1 1 111 111 MET CB C 111 32.374 32.374 32.468 -0.094 18135 638 1 . 1 1 111 111 MET H H 111 7.705 7.705 7.929 -0.224 18135 639 1 . 1 1 112 112 LYS N N 112 121.377 121.377 119.737 1.640 18135 640 1 . 1 1 112 112 LYS HA H 112 4.108 4.108 4.130 -0.022 18135 641 1 . 1 1 112 112 LYS C C 112 178.000 178.000 178.410 -0.409 18135 642 1 . 1 1 112 112 LYS CA C 112 56.305 56.305 58.787 -2.482 18135 643 1 . 1 1 112 112 LYS CB C 112 32.367 32.367 32.127 0.240 18135 644 1 . 1 1 112 112 LYS H H 112 8.257 8.257 7.631 0.626 18135 645 1 . 1 1 113 113 GLU N N 113 119.104 119.104 118.902 0.202 18135 646 1 . 1 1 113 113 GLU HA H 113 4.066 4.066 4.009 0.057 18135 647 1 . 1 1 113 113 GLU C C 113 178.289 178.289 178.705 -0.416 18135 648 1 . 1 1 113 113 GLU CA C 113 58.253 58.253 59.437 -1.184 18135 649 1 . 1 1 113 113 GLU CB C 113 28.138 28.138 29.184 -1.046 18135 650 1 . 1 1 113 113 GLU H H 113 8.270 8.270 7.748 0.522 18135 651 1 . 1 1 114 114 ASP N N 114 119.224 119.224 119.466 -0.242 18135 652 1 . 1 1 114 114 ASP HA H 114 4.288 4.288 4.517 -0.229 18135 653 1 . 1 1 114 114 ASP C C 114 178.365 178.365 178.355 0.010 18135 654 1 . 1 1 114 114 ASP CA C 114 56.108 56.108 57.153 -1.045 18135 655 1 . 1 1 114 114 ASP CB C 114 38.235 38.235 40.803 -2.568 18135 656 1 . 1 1 114 114 ASP H H 114 8.618 8.618 7.704 0.914 18135 657 1 . 1 1 115 115 SER N N 115 118.195 118.195 116.675 1.520 18135 658 1 . 1 1 115 115 SER HA H 115 4.200 4.200 4.133 0.067 18135 659 1 . 1 1 115 115 SER C C 115 175.986 175.986 176.656 -0.670 18135 660 1 . 1 1 115 115 SER CA C 115 61.588 61.588 61.878 -0.290 18135 661 1 . 1 1 115 115 SER CB C 115 62.653 62.653 63.009 -0.356 18135 662 1 . 1 1 115 115 SER H H 115 8.181 8.181 7.549 0.632 18135 663 1 . 1 1 116 116 ILE N N 116 123.340 123.340 121.516 1.824 18135 664 1 . 1 1 116 116 ILE HA H 116 3.626 3.626 3.870 -0.244 18135 665 1 . 1 1 116 116 ILE C C 116 178.367 178.367 178.141 0.226 18135 666 1 . 1 1 116 116 ILE CA C 116 64.817 64.817 63.448 1.369 18135 667 1 . 1 1 116 116 ILE CB C 116 37.418 37.418 36.686 0.732 18135 668 1 . 1 1 116 116 ILE H H 116 7.773 7.773 8.371 -0.598 18135 669 1 . 1 1 117 117 LEU N N 117 120.968 120.968 121.499 -0.531 18135 670 1 . 1 1 117 117 LEU HA H 117 3.905 3.905 3.919 -0.014 18135 671 1 . 1 1 117 117 LEU C C 117 178.746 178.746 178.374 0.372 18135 672 1 . 1 1 117 117 LEU CA C 117 58.143 58.143 58.435 -0.292 18135 673 1 . 1 1 117 117 LEU CB C 117 41.586 41.586 41.529 0.057 18135 674 1 . 1 1 117 117 LEU H H 117 8.406 8.406 7.627 0.779 18135 675 1 . 1 1 118 118 ALA N N 118 120.150 120.150 121.959 -1.809 18135 676 1 . 1 1 118 118 ALA HA H 118 4.112 4.112 3.799 0.313 18135 677 1 . 1 1 118 118 ALA C C 118 181.633 181.633 179.008 2.625 18135 678 1 . 1 1 118 118 ALA CA C 118 55.313 55.313 55.176 0.137 18135 679 1 . 1 1 118 118 ALA CB C 118 18.110 18.110 18.438 -0.328 18135 680 1 . 1 1 118 118 ALA H H 118 7.894 7.894 8.187 -0.293 18135 681 1 . 1 1 119 119 VAL N N 119 118.873 118.873 116.701 2.172 18135 682 1 . 1 1 119 119 VAL HA H 119 3.755 3.755 3.365 0.390 18135 683 1 . 1 1 119 119 VAL C C 119 177.896 177.896 177.852 0.044 18135 684 1 . 1 1 119 119 VAL CA C 119 67.181 67.181 66.015 1.166 18135 685 1 . 1 1 119 119 VAL CB C 119 31.894 31.894 30.869 1.025 18135 686 1 . 1 1 119 119 VAL H H 119 7.572 7.572 7.888 -0.316 18135 687 1 . 1 1 120 120 ARG N N 120 121.436 121.436 119.775 1.661 18135 688 1 . 1 1 120 120 ARG HA H 120 4.027 4.027 4.061 -0.034 18135 689 1 . 1 1 120 120 ARG C C 120 179.848 179.848 178.695 1.153 18135 690 1 . 1 1 120 120 ARG CA C 120 61.267 61.267 59.581 1.686 18135 691 1 . 1 1 120 120 ARG CB C 120 29.695 29.695 29.731 -0.036 18135 692 1 . 1 1 120 120 ARG H H 120 8.629 8.629 8.347 0.282 18135 693 1 . 1 1 121 121 LYS N N 121 119.589 119.589 119.919 -0.331 18135 694 1 . 1 1 121 121 LYS HA H 121 4.074 4.074 3.988 0.086 18135 695 1 . 1 1 121 121 LYS C C 121 178.331 178.331 179.242 -0.911 18135 696 1 . 1 1 121 121 LYS CA C 121 60.440 60.440 59.537 0.903 18135 697 1 . 1 1 121 121 LYS CB C 121 32.107 32.107 32.205 -0.098 18135 698 1 . 1 1 121 121 LYS H H 121 9.015 9.015 8.026 0.989 18135 699 1 . 1 1 122 122 TYR N N 122 121.546 121.546 119.284 2.262 18135 700 1 . 1 1 122 122 TYR HA H 122 4.332 4.332 4.159 0.173 18135 701 1 . 1 1 122 122 TYR C C 122 176.527 176.527 178.067 -1.540 18135 702 1 . 1 1 122 122 TYR CA C 122 60.404 60.404 59.829 0.575 18135 703 1 . 1 1 122 122 TYR CB C 122 37.725 37.725 37.673 0.052 18135 704 1 . 1 1 122 122 TYR H H 122 7.473 7.473 7.836 -0.363 18135 705 1 . 1 1 123 123 PHE N N 123 116.026 116.026 119.734 -3.708 18135 706 1 . 1 1 123 123 PHE HA H 123 3.740 3.740 3.976 -0.236 18135 707 1 . 1 1 123 123 PHE C C 123 179.005 179.005 177.531 1.474 18135 708 1 . 1 1 123 123 PHE CA C 123 63.528 63.528 60.448 3.080 18135 709 1 . 1 1 123 123 PHE CB C 123 39.331 39.331 38.803 0.528 18135 710 1 . 1 1 123 123 PHE H H 123 7.932 7.932 8.407 -0.475 18135 711 1 . 1 1 124 124 GLN N N 124 123.043 123.043 118.613 4.430 18135 712 1 . 1 1 124 124 GLN HA H 124 4.179 4.179 3.417 0.762 18135 713 1 . 1 1 124 124 GLN C C 124 178.772 178.772 178.507 0.265 18135 714 1 . 1 1 124 124 GLN CA C 124 59.316 59.316 59.169 0.147 18135 715 1 . 1 1 124 124 GLN CB C 124 27.631 27.631 28.164 -0.533 18135 716 1 . 1 1 124 124 GLN H H 124 8.470 8.470 8.487 -0.017 18135 717 1 . 1 1 125 125 ARG N N 125 120.342 120.342 119.062 1.280 18135 718 1 . 1 1 125 125 ARG HA H 125 4.078 4.078 4.145 -0.068 18135 719 1 . 1 1 125 125 ARG C C 125 180.340 180.340 179.222 1.118 18135 720 1 . 1 1 125 125 ARG CA C 125 61.297 61.297 58.766 2.531 18135 721 1 . 1 1 125 125 ARG CB C 125 30.325 30.325 30.036 0.289 18135 722 1 . 1 1 125 125 ARG H H 125 8.137 8.137 8.045 0.092 18135 723 1 . 1 1 126 126 ILE N N 126 121.876 121.876 121.133 0.743 18135 724 1 . 1 1 126 126 ILE HA H 126 3.351 3.351 3.525 -0.174 18135 725 1 . 1 1 126 126 ILE C C 126 176.857 176.857 177.773 -0.916 18135 726 1 . 1 1 126 126 ILE CA C 126 65.832 65.832 64.847 0.985 18135 727 1 . 1 1 126 126 ILE CB C 126 37.284 37.284 36.750 0.534 18135 728 1 . 1 1 126 126 ILE H H 126 7.526 7.526 8.299 -0.773 18135 729 1 . 1 1 127 127 THR N N 127 115.613 115.613 115.150 0.463 18135 730 1 . 1 1 127 127 THR HA H 127 3.633 3.633 3.842 -0.209 18135 731 1 . 1 1 127 127 THR C C 127 176.645 176.645 176.992 -0.347 18135 732 1 . 1 1 127 127 THR CA C 127 67.294 67.294 66.476 0.818 18135 733 1 . 1 1 127 127 THR CB C 127 68.871 68.871 68.841 0.030 18135 734 1 . 1 1 127 127 THR H H 127 8.288 8.288 8.114 0.174 18135 735 1 . 1 1 128 128 LEU N N 128 122.627 122.627 122.231 0.396 18135 736 1 . 1 1 128 128 LEU HA H 128 3.956 3.956 3.938 0.018 18135 737 1 . 1 1 128 128 LEU C C 128 178.331 178.331 177.643 0.688 18135 738 1 . 1 1 128 128 LEU CA C 128 58.088 58.088 57.908 0.180 18135 739 1 . 1 1 128 128 LEU CB C 128 41.574 41.574 41.291 0.283 18135 740 1 . 1 1 128 128 LEU H H 128 8.263 8.263 8.028 0.235 18135 741 1 . 1 1 129 129 TYR N N 129 120.955 120.955 120.353 0.602 18135 742 1 . 1 1 129 129 TYR HA H 129 3.890 3.890 4.127 -0.237 18135 743 1 . 1 1 129 129 TYR C C 129 176.040 176.040 177.461 -1.421 18135 744 1 . 1 1 129 129 TYR CA C 129 61.493 61.493 61.533 -0.040 18135 745 1 . 1 1 129 129 TYR CB C 129 38.925 38.925 38.248 0.677 18135 746 1 . 1 1 129 129 TYR H H 129 7.518 7.518 8.230 -0.712 18135 747 1 . 1 1 130 130 LEU N N 130 119.155 119.155 116.420 2.735 18135 748 1 . 1 1 130 130 LEU HA H 130 2.845 2.845 3.320 -0.475 18135 749 1 . 1 1 130 130 LEU C C 130 177.948 177.948 178.349 -0.401 18135 750 1 . 1 1 130 130 LEU CA C 130 58.113 58.113 57.886 0.227 18135 751 1 . 1 1 130 130 LEU CB C 130 41.586 41.586 40.520 1.066 18135 752 1 . 1 1 130 130 LEU H H 130 7.717 7.717 7.975 -0.258 18135 753 1 . 1 1 131 131 LYS N N 131 116.832 116.832 119.980 -3.148 18135 754 1 . 1 1 131 131 LYS HA H 131 3.408 3.408 3.845 -0.437 18135 755 1 . 1 1 131 131 LYS C C 131 181.265 181.265 179.708 1.557 18135 756 1 . 1 1 131 131 LYS CA C 131 59.731 59.731 59.696 0.035 18135 757 1 . 1 1 131 131 LYS CB C 131 32.672 32.672 32.027 0.645 18135 758 1 . 1 1 131 131 LYS H H 131 7.493 7.493 7.892 -0.399 18135 759 1 . 1 1 132 132 GLU N N 132 121.918 121.918 119.538 2.380 18135 760 1 . 1 1 132 132 GLU HA H 132 3.844 3.844 4.075 -0.231 18135 761 1 . 1 1 132 132 GLU C C 132 178.377 178.377 178.047 0.330 18135 762 1 . 1 1 132 132 GLU CA C 132 58.887 58.887 58.752 0.135 18135 763 1 . 1 1 132 132 GLU CB C 132 28.667 28.667 29.519 -0.852 18135 764 1 . 1 1 132 132 GLU H H 132 8.430 8.430 8.032 0.398 18135 765 1 . 1 1 133 133 LYS N N 133 116.079 116.079 116.284 -0.205 18135 766 1 . 1 1 133 133 LYS HA H 133 3.966 3.966 4.267 -0.301 18135 767 1 . 1 1 133 133 LYS C C 133 175.282 175.282 175.757 -0.475 18135 768 1 . 1 1 133 133 LYS CA C 133 54.298 54.298 54.611 -0.313 18135 769 1 . 1 1 133 133 LYS CB C 133 31.998 31.998 31.817 0.181 18135 770 1 . 1 1 133 133 LYS H H 133 7.390 7.390 7.339 0.051 18135 771 1 . 1 1 134 134 LYS N N 134 117.759 117.759 115.968 1.791 18135 772 1 . 1 1 134 134 LYS HA H 134 3.582 3.582 4.055 -0.473 18135 773 1 . 1 1 134 134 LYS C C 134 176.271 176.271 175.997 0.274 18135 774 1 . 1 1 134 134 LYS CA C 134 57.308 57.308 56.888 0.420 18135 775 1 . 1 1 134 134 LYS CB C 134 28.802 28.802 29.195 -0.393 18135 776 1 . 1 1 134 134 LYS H H 134 7.716 7.716 7.567 0.149 18135 777 1 . 1 1 135 135 TYR N N 135 110.598 110.598 113.370 -2.772 18135 778 1 . 1 1 135 135 TYR HA H 135 2.877 2.877 3.921 -1.044 18135 779 1 . 1 1 135 135 TYR C C 135 174.148 174.148 175.332 -1.184 18135 780 1 . 1 1 135 135 TYR CA C 135 59.715 59.715 59.075 0.640 18135 781 1 . 1 1 135 135 TYR CB C 135 34.706 34.706 35.197 -0.491 18135 782 1 . 1 1 135 135 TYR H H 135 8.428 8.428 8.803 -0.375 18135 783 1 . 1 1 136 136 SER N N 136 113.712 113.712 115.513 -1.801 18135 784 1 . 1 1 136 136 SER HA H 136 4.553 4.553 4.389 0.164 18135 785 1 . 1 1 136 136 SER CA C 136 57.108 57.108 58.840 -1.732 18135 786 1 . 1 1 136 136 SER CB C 136 62.500 62.500 64.047 -1.547 18135 787 1 . 1 1 136 136 SER H H 136 6.744 6.744 7.409 -0.665 18135 788 1 . 1 1 137 137 PRO HA H 137 4.165 4.165 4.414 -0.249 18135 789 1 . 1 1 137 137 PRO C C 137 180.675 180.675 177.424 3.251 18135 790 1 . 1 1 137 137 PRO CA C 137 65.657 65.657 64.764 0.893 18135 791 1 . 1 1 137 137 PRO CB C 137 31.983 31.983 31.769 0.214 18135 792 1 . 1 1 138 138 CYS N N 138 113.914 113.914 115.923 -2.009 18135 793 1 . 1 1 138 138 CYS HA H 138 4.670 4.670 4.587 0.083 18135 794 1 . 1 1 138 138 CYS C C 138 176.015 176.015 176.200 -0.185 18135 795 1 . 1 1 138 138 CYS CA C 138 57.095 57.095 60.420 -3.325 18135 796 1 . 1 1 138 138 CYS CB C 138 36.779 36.779 26.204 10.575 18135 797 1 . 1 1 138 138 CYS H H 138 8.580 8.580 8.484 0.096 18135 798 1 . 1 1 139 139 ALA N N 139 125.290 125.290 124.418 0.872 18135 799 1 . 1 1 139 139 ALA HA H 139 4.449 4.449 4.171 0.278 18135 800 1 . 1 1 139 139 ALA C C 139 180.149 180.149 179.266 0.883 18135 801 1 . 1 1 139 139 ALA CA C 139 54.778 54.778 54.955 -0.177 18135 802 1 . 1 1 139 139 ALA CB C 139 18.918 18.918 18.082 0.836 18135 803 1 . 1 1 139 139 ALA H H 139 8.087 8.087 7.993 0.094 18135 804 1 . 1 1 140 140 TRP N N 140 116.599 116.599 118.616 -2.017 18135 805 1 . 1 1 140 140 TRP HA H 140 4.602 4.602 4.300 0.302 18135 806 1 . 1 1 140 140 TRP C C 140 179.137 179.137 178.578 0.559 18135 807 1 . 1 1 140 140 TRP CA C 140 60.534 60.534 61.433 -0.899 18135 808 1 . 1 1 140 140 TRP CB C 140 29.258 29.258 29.363 -0.105 18135 809 1 . 1 1 140 140 TRP H H 140 8.505 8.505 7.793 0.712 18135 810 1 . 1 1 141 141 GLU N N 141 121.578 121.578 119.355 2.223 18135 811 1 . 1 1 141 141 GLU HA H 141 5.223 5.223 4.271 0.952 18135 812 1 . 1 1 141 141 GLU C C 141 177.886 177.886 178.956 -1.070 18135 813 1 . 1 1 141 141 GLU CA C 141 57.907 57.907 59.800 -1.893 18135 814 1 . 1 1 141 141 GLU CB C 141 28.717 28.717 29.288 -0.571 18135 815 1 . 1 1 141 141 GLU H H 141 8.182 8.182 8.100 0.083 18135 816 1 . 1 1 142 142 VAL N N 142 121.202 121.202 120.122 1.080 18135 817 1 . 1 1 142 142 VAL HA H 142 3.630 3.630 3.682 -0.052 18135 818 1 . 1 1 142 142 VAL C C 142 180.246 180.246 178.518 1.728 18135 819 1 . 1 1 142 142 VAL CA C 142 66.983 66.983 66.875 0.108 18135 820 1 . 1 1 142 142 VAL CB C 142 31.822 31.822 31.505 0.317 18135 821 1 . 1 1 142 142 VAL H H 142 8.623 8.623 8.096 0.527 18135 822 1 . 1 1 143 143 VAL N N 143 120.119 120.119 119.779 0.340 18135 823 1 . 1 1 143 143 VAL HA H 143 3.297 3.297 3.726 -0.429 18135 824 1 . 1 1 143 143 VAL C C 143 176.407 176.407 178.376 -1.968 18135 825 1 . 1 1 143 143 VAL CA C 143 67.978 67.978 66.817 1.161 18135 826 1 . 1 1 143 143 VAL CB C 143 31.655 31.655 31.300 0.355 18135 827 1 . 1 1 143 143 VAL H H 143 8.323 8.323 8.500 -0.177 18135 828 1 . 1 1 144 144 ARG N N 144 124.102 124.102 119.512 4.590 18135 829 1 . 1 1 144 144 ARG HA H 144 3.697 3.697 4.030 -0.333 18135 830 1 . 1 1 144 144 ARG C C 144 178.127 178.127 178.454 -0.327 18135 831 1 . 1 1 144 144 ARG CA C 144 61.001 61.001 58.930 2.071 18135 832 1 . 1 1 144 144 ARG CB C 144 29.936 29.936 29.448 0.488 18135 833 1 . 1 1 144 144 ARG H H 144 9.619 9.619 8.451 1.168 18135 834 1 . 1 1 145 145 ALA N N 145 119.431 119.431 121.804 -2.373 18135 835 1 . 1 1 145 145 ALA HA H 145 3.851 3.851 4.041 -0.190 18135 836 1 . 1 1 145 145 ALA C C 145 180.763 180.763 179.980 0.783 18135 837 1 . 1 1 145 145 ALA CA C 145 55.375 55.375 55.386 -0.011 18135 838 1 . 1 1 145 145 ALA CB C 145 18.185 18.185 17.997 0.188 18135 839 1 . 1 1 145 145 ALA H H 145 8.867 8.867 8.351 0.516 18135 840 1 . 1 1 146 146 GLU N N 146 121.815 121.815 118.719 3.096 18135 841 1 . 1 1 146 146 GLU HA H 146 4.211 4.211 4.211 0.000 18135 842 1 . 1 1 146 146 GLU C C 146 177.296 177.296 179.179 -1.883 18135 843 1 . 1 1 146 146 GLU CA C 146 58.379 58.379 59.342 -0.963 18135 844 1 . 1 1 146 146 GLU CB C 146 28.134 28.134 29.583 -1.449 18135 845 1 . 1 1 146 146 GLU H H 146 8.136 8.136 8.020 0.116 18135 846 1 . 1 1 147 147 ILE N N 147 119.542 119.542 120.965 -1.423 18135 847 1 . 1 1 147 147 ILE HA H 147 3.970 3.970 3.822 0.148 18135 848 1 . 1 1 147 147 ILE C C 147 178.283 178.283 178.276 0.007 18135 849 1 . 1 1 147 147 ILE CA C 147 61.253 61.253 64.752 -3.499 18135 850 1 . 1 1 147 147 ILE CB C 147 35.339 35.339 37.565 -2.226 18135 851 1 . 1 1 147 147 ILE H H 147 8.736 8.736 8.209 0.527 18135 852 1 . 1 1 148 148 MET N N 148 119.501 119.501 118.519 0.982 18135 853 1 . 1 1 148 148 MET HA H 148 3.801 3.801 4.198 -0.397 18135 854 1 . 1 1 148 148 MET C C 148 178.210 178.210 178.710 -0.500 18135 855 1 . 1 1 148 148 MET CA C 148 60.184 60.184 59.873 0.311 18135 856 1 . 1 1 148 148 MET CB C 148 32.914 32.914 32.008 0.906 18135 857 1 . 1 1 148 148 MET H H 148 8.440 8.440 8.413 0.027 18135 858 1 . 1 1 149 149 ARG N N 149 119.734 119.734 119.944 -0.210 18135 859 1 . 1 1 149 149 ARG HA H 149 3.915 3.915 4.122 -0.207 18135 860 1 . 1 1 149 149 ARG C C 149 178.978 178.978 179.053 -0.075 18135 861 1 . 1 1 149 149 ARG CA C 149 59.863 59.863 59.141 0.722 18135 862 1 . 1 1 149 149 ARG CB C 149 30.280 30.280 29.635 0.645 18135 863 1 . 1 1 149 149 ARG H H 149 7.648 7.648 8.380 -0.732 18135 864 1 . 1 1 150 150 SER N N 150 118.109 118.109 115.324 2.785 18135 865 1 . 1 1 150 150 SER HA H 150 3.339 3.339 3.911 -0.572 18135 866 1 . 1 1 150 150 SER C C 150 177.292 177.292 176.344 0.948 18135 867 1 . 1 1 150 150 SER CA C 150 61.316 61.316 61.554 -0.238 18135 868 1 . 1 1 150 150 SER CB C 150 60.288 60.288 62.504 -2.216 18135 869 1 . 1 1 150 150 SER H H 150 9.194 9.194 8.411 0.783 18135 870 1 . 1 1 151 151 PHE N N 151 125.265 125.265 123.920 1.344 18135 871 1 . 1 1 151 151 PHE HA H 151 4.036 4.036 4.331 -0.295 18135 872 1 . 1 1 151 151 PHE C C 151 178.696 178.696 177.486 1.210 18135 873 1 . 1 1 151 151 PHE CA C 151 61.420 61.420 59.538 1.882 18135 874 1 . 1 1 151 151 PHE CB C 151 38.886 38.886 38.655 0.232 18135 875 1 . 1 1 151 151 PHE H H 151 9.455 9.455 8.382 1.073 18135 876 1 . 1 1 152 152 SER N N 152 115.963 115.963 115.835 0.128 18135 877 1 . 1 1 152 152 SER HA H 152 3.880 3.880 3.781 0.099 18135 878 1 . 1 1 152 152 SER C C 152 175.858 175.858 176.784 -0.926 18135 879 1 . 1 1 152 152 SER CA C 152 62.388 62.388 61.455 0.933 18135 880 1 . 1 1 152 152 SER CB C 152 62.519 62.519 63.210 -0.691 18135 881 1 . 1 1 152 152 SER H H 152 7.839 7.839 8.413 -0.574 18135 882 1 . 1 1 153 153 LEU N N 153 121.365 121.365 122.528 -1.163 18135 883 1 . 1 1 153 153 LEU HA H 153 4.081 4.081 4.142 -0.061 18135 884 1 . 1 1 153 153 LEU C C 153 179.515 179.515 178.241 1.274 18135 885 1 . 1 1 153 153 LEU CA C 153 57.883 57.883 57.752 0.131 18135 886 1 . 1 1 153 153 LEU CB C 153 42.342 42.342 41.708 0.634 18135 887 1 . 1 1 153 153 LEU H H 153 7.775 7.775 8.162 -0.387 18135 888 1 . 1 1 154 154 SER N N 154 113.950 113.950 113.108 0.842 18135 889 1 . 1 1 154 154 SER HA H 154 3.781 3.781 4.421 -0.640 18135 890 1 . 1 1 154 154 SER C C 154 174.312 174.312 176.586 -2.274 18135 891 1 . 1 1 154 154 SER CA C 154 61.366 61.366 61.309 0.057 18135 892 1 . 1 1 154 154 SER CB C 154 63.242 63.242 63.552 -0.310 18135 893 1 . 1 1 154 154 SER H H 154 7.874 7.874 8.468 -0.594 18135 894 1 . 1 1 155 155 THR N N 155 109.346 109.346 112.716 -3.370 18135 895 1 . 1 1 155 155 THR HA H 155 4.060 4.060 4.300 -0.240 18135 896 1 . 1 1 155 155 THR C C 155 174.798 174.798 176.002 -1.204 18135 897 1 . 1 1 155 155 THR CA C 155 62.275 62.275 64.434 -2.159 18135 898 1 . 1 1 155 155 THR CB C 155 69.342 69.342 69.041 0.301 18135 899 1 . 1 1 155 155 THR H H 155 7.176 7.176 7.921 -0.745 18135 900 1 . 1 1 156 156 ASN N N 156 119.785 119.785 120.877 -1.092 18135 901 1 . 1 1 156 156 ASN HA H 156 4.527 4.527 4.746 -0.219 18135 902 1 . 1 1 156 156 ASN C C 156 175.528 175.528 175.209 0.319 18135 903 1 . 1 1 156 156 ASN CA C 156 53.937 53.937 52.959 0.978 18135 904 1 . 1 1 156 156 ASN CB C 156 38.338 38.338 37.685 0.653 18135 905 1 . 1 1 156 156 ASN H H 156 7.749 7.749 7.963 -0.214 18135 906 1 . 1 1 157 157 LEU N N 157 120.552 120.552 121.021 -0.469 18135 907 1 . 1 1 157 157 LEU HA H 157 4.255 4.255 4.455 -0.200 18135 908 1 . 1 1 157 157 LEU C C 157 174.702 174.702 178.226 -3.524 18135 909 1 . 1 1 157 157 LEU CA C 157 55.674 55.674 56.446 -0.772 18135 910 1 . 1 1 157 157 LEU CB C 157 42.351 42.351 42.080 0.271 18135 911 1 . 1 1 157 157 LEU H H 157 8.097 8.097 7.803 0.294 18135 912 1 . 1 1 158 158 GLN N N 158 119.860 119.860 117.651 2.209 18135 913 1 . 1 1 158 158 GLN HA H 158 4.180 4.180 4.251 -0.071 18135 914 1 . 1 1 158 158 GLN C C 158 176.434 176.434 175.813 0.621 18135 915 1 . 1 1 158 158 GLN CA C 158 56.897 56.897 55.831 1.066 18135 916 1 . 1 1 158 158 GLN CB C 158 29.010 29.010 29.461 -0.451 18135 917 1 . 1 1 158 158 GLN H H 158 8.230 8.230 8.016 0.214 18135 918 1 . 1 1 159 159 GLU N N 159 120.461 120.461 117.157 3.304 18135 919 1 . 1 1 159 159 GLU HA H 159 4.219 4.219 4.037 0.182 18135 920 1 . 1 1 159 159 GLU C C 159 175.251 175.251 175.445 -0.194 18135 921 1 . 1 1 159 159 GLU CA C 159 56.695 56.695 57.370 -0.675 18135 922 1 . 1 1 159 159 GLU CB C 159 28.981 28.981 28.836 0.145 18135 923 1 . 1 1 159 159 GLU H H 159 8.300 8.300 8.549 -0.249 18135 924 1 . 1 1 160 160 SER N N 160 115.719 115.719 112.854 2.865 18135 925 1 . 1 1 160 160 SER HA H 160 4.372 4.372 4.554 -0.182 18135 926 1 . 1 1 160 160 SER C C 160 174.188 174.188 174.400 -0.212 18135 927 1 . 1 1 160 160 SER CA C 160 58.481 58.481 58.257 0.224 18135 928 1 . 1 1 160 160 SER CB C 160 63.731 63.731 63.358 0.373 18135 929 1 . 1 1 160 160 SER H H 160 8.113 8.113 8.364 -0.251 18135 930 1 . 1 1 161 161 LEU N N 161 123.794 123.794 122.054 1.740 18135 931 1 . 1 1 161 161 LEU HA H 161 4.280 4.280 4.342 -0.062 18135 932 1 . 1 1 161 161 LEU C C 161 177.293 177.293 176.964 0.329 18135 933 1 . 1 1 161 161 LEU CA C 161 55.190 55.190 55.627 -0.437 18135 934 1 . 1 1 161 161 LEU CB C 161 42.284 42.284 42.483 -0.199 18135 935 1 . 1 1 161 161 LEU H H 161 8.032 8.032 7.876 0.156 18135 936 1 . 1 1 162 162 ARG N N 162 120.715 120.715 119.715 1.000 18135 937 1 . 1 1 162 162 ARG HA H 162 4.169 4.169 4.385 -0.216 18135 938 1 . 1 1 162 162 ARG C C 162 176.288 176.288 175.444 0.845 18135 939 1 . 1 1 162 162 ARG CA C 162 57.046 57.046 56.049 0.997 18135 940 1 . 1 1 162 162 ARG CB C 162 30.935 30.935 30.560 0.375 18135 941 1 . 1 1 162 162 ARG H H 162 8.094 8.094 8.352 -0.258 18135 942 1 . 1 1 163 163 SER N N 163 116.670 116.670 116.455 0.215 18135 943 1 . 1 1 163 163 SER HA H 163 4.372 4.372 4.579 -0.207 18135 944 1 . 1 1 163 163 SER C C 163 174.184 174.184 174.744 -0.560 18135 945 1 . 1 1 163 163 SER CA C 163 58.481 58.481 58.233 0.248 18135 946 1 . 1 1 163 163 SER CB C 163 63.745 63.745 64.288 -0.543 18135 947 1 . 1 1 163 163 SER H H 163 8.191 8.191 8.329 -0.138 18135 948 1 . 1 1 164 164 LYS N N 164 123.100 123.100 122.106 0.994 18135 949 1 . 1 1 164 164 LYS HA H 164 4.277 4.277 4.363 -0.086 18135 950 1 . 1 1 164 164 LYS C C 164 175.617 175.617 176.618 -1.001 18135 951 1 . 1 1 164 164 LYS CA C 164 56.313 56.313 56.938 -0.625 18135 952 1 . 1 1 164 164 LYS CB C 164 32.965 32.965 32.420 0.545 18135 953 1 . 1 1 164 164 LYS H H 164 8.251 8.251 8.492 -0.241 18135 stop_ save_