data_25567 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25567 _Entry.PDB_ID 2N1M 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 25567 _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 MET HA H 2 4.416 4.416 4.839 -0.423 25567 2 1 1 . 1 1 2 2 MET CA C 2 52.847 52.847 56.384 -3.537 25567 3 1 1 . 1 1 2 2 MET CB C 2 30.672 30.672 34.392 -3.720 25567 4 1 1 . 1 1 3 3 ALA N N 3 125.563 125.563 125.385 0.178 25567 5 1 1 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.399 -0.027 25567 6 1 1 . 1 1 3 3 ALA C C 3 174.728 174.728 175.854 -1.126 25567 7 1 1 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.177 -2.829 25567 8 1 1 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.079 -3.144 25567 9 1 1 . 1 1 3 3 ALA H H 3 8.342 8.342 8.175 0.167 25567 10 1 1 . 1 1 4 4 LYS N N 4 121.767 121.767 125.919 -4.152 25567 11 1 1 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.346 -0.116 25567 12 1 1 . 1 1 4 4 LYS C C 4 174.577 174.577 176.271 -1.694 25567 13 1 1 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.975 -1.986 25567 14 1 1 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.326 -0.771 25567 15 1 1 . 1 1 4 4 LYS H H 4 8.500 8.500 8.593 -0.093 25567 16 1 1 . 1 1 5 5 LYS N N 5 129.654 129.654 124.252 5.402 25567 17 1 1 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.921 -0.395 25567 18 1 1 . 1 1 5 5 LYS C C 5 174.731 174.731 176.493 -1.762 25567 19 1 1 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.423 -0.677 25567 20 1 1 . 1 1 5 5 LYS CB C 5 29.894 29.894 34.909 -5.015 25567 21 1 1 . 1 1 5 5 LYS H H 5 10.035 10.035 8.144 1.891 25567 22 1 1 . 1 1 6 6 THR N N 6 126.212 126.212 114.726 11.486 25567 23 1 1 . 1 1 6 6 THR HA H 6 5.654 5.654 5.624 0.030 25567 24 1 1 . 1 1 6 6 THR C C 6 169.897 169.897 173.851 -3.954 25567 25 1 1 . 1 1 6 6 THR CA C 6 60.647 60.647 61.473 -0.826 25567 26 1 1 . 1 1 6 6 THR CB C 6 68.152 68.152 71.935 -3.783 25567 27 1 1 . 1 1 6 6 THR H H 6 8.557 8.557 8.661 -0.104 25567 28 1 1 . 1 1 7 7 LEU N N 7 130.776 130.776 124.487 6.289 25567 29 1 1 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.926 -0.307 25567 30 1 1 . 1 1 7 7 LEU CA C 7 50.096 50.096 54.392 -4.296 25567 31 1 1 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.898 -5.856 25567 32 1 1 . 1 1 7 7 LEU H H 7 8.610 8.610 8.722 -0.112 25567 33 1 1 . 1 1 8 8 ILE N N 8 127.175 127.175 123.710 3.465 25567 34 1 1 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.664 0.192 25567 35 1 1 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.709 -3.317 25567 36 1 1 . 1 1 8 8 ILE CB C 8 36.864 36.864 40.094 -3.230 25567 37 1 1 . 1 1 8 8 ILE H H 8 9.263 9.263 8.901 0.362 25567 38 1 1 . 1 1 9 9 LEU N N 9 127.117 127.117 128.983 -1.866 25567 39 1 1 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.197 0.499 25567 40 1 1 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.480 -3.529 25567 41 1 1 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.470 0.357 25567 42 1 1 . 1 1 9 9 LEU H H 9 9.262 9.262 8.336 0.926 25567 43 1 1 . 1 1 10 10 TYR N N 10 113.544 113.544 121.872 -8.328 25567 44 1 1 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.060 0.471 25567 45 1 1 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.071 -2.242 25567 46 1 1 . 1 1 10 10 TYR CB C 10 38.615 38.615 38.982 -0.367 25567 47 1 1 . 1 1 10 10 TYR H H 10 7.425 7.425 7.928 -0.503 25567 48 1 1 . 1 1 11 11 TYR N N 11 121.235 121.235 126.396 -5.161 25567 49 1 1 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.692 0.118 25567 50 1 1 . 1 1 11 11 TYR CA C 11 53.889 53.889 57.810 -3.921 25567 51 1 1 . 1 1 11 11 TYR CB C 11 40.467 40.467 39.254 1.213 25567 52 1 1 . 1 1 11 11 TYR H H 11 7.781 7.781 8.334 -0.553 25567 53 1 1 . 1 1 14 14 SER CA C 14 54.675 54.675 59.694 -5.019 25567 54 1 1 . 1 1 14 14 SER CB C 14 61.621 61.621 62.234 -0.613 25567 55 1 1 . 1 1 15 15 GLY N N 15 110.420 110.420 116.492 -6.072 25567 56 1 1 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.538 -1.810 25567 57 1 1 . 1 1 15 15 GLY H H 15 7.757 7.757 8.309 -0.552 25567 58 1 1 . 1 1 17 17 THR HA H 17 4.122 4.122 4.328 -0.206 25567 59 1 1 . 1 1 17 17 THR CA C 17 64.748 64.748 63.866 0.882 25567 60 1 1 . 1 1 17 17 THR CB C 17 64.532 64.532 68.861 -4.329 25567 61 1 1 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.826 -0.908 25567 62 1 1 . 1 1 18 18 LYS C C 18 173.812 173.812 178.294 -4.482 25567 63 1 1 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.495 -2.492 25567 64 1 1 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.542 -2.774 25567 65 1 1 . 1 1 19 19 LYS N N 19 116.699 116.699 118.063 -1.364 25567 66 1 1 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.013 -0.065 25567 67 1 1 . 1 1 19 19 LYS C C 19 177.221 177.221 179.189 -1.968 25567 68 1 1 . 1 1 19 19 LYS CA C 19 56.421 56.421 59.033 -2.612 25567 69 1 1 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.672 -2.038 25567 70 1 1 . 1 1 19 19 LYS H H 19 7.476 7.476 7.638 -0.163 25567 71 1 1 . 1 1 20 20 MET N N 20 118.946 118.946 116.751 2.195 25567 72 1 1 . 1 1 20 20 MET HA H 20 4.474 4.474 4.437 0.037 25567 73 1 1 . 1 1 20 20 MET C C 20 173.826 173.826 177.160 -3.334 25567 74 1 1 . 1 1 20 20 MET CA C 20 52.285 52.285 55.869 -3.584 25567 75 1 1 . 1 1 20 20 MET CB C 20 26.921 26.921 31.311 -4.390 25567 76 1 1 . 1 1 20 20 MET H H 20 7.457 7.457 7.496 -0.039 25567 77 1 1 . 1 1 21 21 ALA N N 21 123.375 123.375 122.106 1.269 25567 78 1 1 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.291 -0.739 25567 79 1 1 . 1 1 21 21 ALA C C 21 176.542 176.542 178.920 -2.378 25567 80 1 1 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.745 -1.094 25567 81 1 1 . 1 1 21 21 ALA CB C 21 16.282 16.282 18.927 -2.645 25567 82 1 1 . 1 1 21 21 ALA H H 21 8.549 8.549 7.653 0.896 25567 83 1 1 . 1 1 22 22 GLU N N 22 116.906 116.906 119.163 -2.257 25567 84 1 1 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.858 -0.185 25567 85 1 1 . 1 1 22 22 GLU C C 22 176.658 176.658 179.066 -2.408 25567 86 1 1 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.483 -2.878 25567 87 1 1 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.391 -2.742 25567 88 1 1 . 1 1 22 22 GLU H H 22 8.085 8.085 7.973 0.112 25567 89 1 1 . 1 1 23 23 LYS N N 23 123.301 123.301 119.180 4.121 25567 90 1 1 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.029 -0.209 25567 91 1 1 . 1 1 23 23 LYS C C 23 177.363 177.363 179.486 -2.123 25567 92 1 1 . 1 1 23 23 LYS CA C 23 56.971 56.971 58.961 -1.990 25567 93 1 1 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.130 -2.599 25567 94 1 1 . 1 1 23 23 LYS H H 23 7.703 7.703 7.362 0.341 25567 95 1 1 . 1 1 24 24 ILE N N 24 121.894 121.894 119.024 2.870 25567 96 1 1 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.632 -0.336 25567 97 1 1 . 1 1 24 24 ILE C C 24 174.944 174.944 177.990 -3.046 25567 98 1 1 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.216 -0.983 25567 99 1 1 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.430 -2.686 25567 100 1 1 . 1 1 24 24 ILE H H 24 8.458 8.458 7.428 1.030 25567 101 1 1 . 1 1 25 25 ASN N N 25 118.580 118.580 117.992 0.588 25567 102 1 1 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.391 -0.157 25567 103 1 1 . 1 1 25 25 ASN C C 25 173.567 173.567 177.545 -3.978 25567 104 1 1 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.025 -3.701 25567 105 1 1 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.408 -0.225 25567 106 1 1 . 1 1 25 25 ASN H H 25 8.273 8.273 7.942 0.331 25567 107 1 1 . 1 1 26 26 SER N N 26 112.132 112.132 113.508 -1.376 25567 108 1 1 . 1 1 26 26 SER HA H 26 4.148 4.148 4.462 -0.314 25567 109 1 1 . 1 1 26 26 SER C C 26 172.083 172.083 174.966 -2.883 25567 110 1 1 . 1 1 26 26 SER CA C 26 57.865 57.865 60.087 -2.222 25567 111 1 1 . 1 1 26 26 SER CB C 26 60.816 60.816 63.140 -2.324 25567 112 1 1 . 1 1 26 26 SER H H 26 7.444 7.444 7.711 -0.267 25567 113 1 1 . 1 1 27 27 GLU N N 27 120.080 120.080 119.628 0.452 25567 114 1 1 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.363 -0.263 25567 115 1 1 . 1 1 27 27 GLU C C 27 173.647 173.647 176.657 -3.010 25567 116 1 1 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.686 -2.484 25567 117 1 1 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.456 -3.572 25567 118 1 1 . 1 1 27 27 GLU H H 27 7.453 7.453 7.855 -0.402 25567 119 1 1 . 1 1 28 28 ILE N N 28 118.759 118.759 120.939 -2.180 25567 120 1 1 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.305 -0.101 25567 121 1 1 . 1 1 28 28 ILE C C 28 172.474 172.474 175.009 -2.535 25567 122 1 1 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.036 -2.289 25567 123 1 1 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.868 -5.070 25567 124 1 1 . 1 1 28 28 ILE H H 28 7.258 7.258 7.279 -0.021 25567 125 1 1 . 1 1 29 29 LYS N N 29 130.618 130.618 126.313 4.305 25567 126 1 1 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.243 -0.238 25567 127 1 1 . 1 1 29 29 LYS C C 29 174.375 174.375 176.693 -2.318 25567 128 1 1 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.060 -1.401 25567 129 1 1 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.843 -3.283 25567 130 1 1 . 1 1 29 29 LYS H H 29 8.588 8.588 8.678 -0.090 25567 131 1 1 . 1 1 30 30 ASP N N 30 119.366 119.366 121.814 -2.448 25567 132 1 1 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.399 0.003 25567 133 1 1 . 1 1 30 30 ASP C C 30 172.580 172.580 174.975 -2.395 25567 134 1 1 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.194 -1.570 25567 135 1 1 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.373 -3.545 25567 136 1 1 . 1 1 30 30 ASP H H 30 8.940 8.940 8.874 0.066 25567 137 1 1 . 1 1 31 31 SER N N 31 114.035 114.035 113.373 0.662 25567 138 1 1 . 1 1 31 31 SER HA H 31 4.781 4.781 4.774 0.007 25567 139 1 1 . 1 1 31 31 SER C C 31 171.136 171.136 173.130 -1.994 25567 140 1 1 . 1 1 31 31 SER CA C 31 55.638 55.638 57.450 -1.812 25567 141 1 1 . 1 1 31 31 SER CB C 31 62.388 62.388 64.715 -2.327 25567 142 1 1 . 1 1 31 31 SER H H 31 8.030 8.030 7.643 0.387 25567 143 1 1 . 1 1 32 32 GLU N N 32 121.406 121.406 118.973 2.433 25567 144 1 1 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.679 0.056 25567 145 1 1 . 1 1 32 32 GLU C C 32 171.205 171.205 174.063 -2.858 25567 146 1 1 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.699 -3.630 25567 147 1 1 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.702 -2.812 25567 148 1 1 . 1 1 32 32 GLU H H 32 8.188 8.188 8.464 -0.276 25567 149 1 1 . 1 1 33 33 LEU N N 33 126.143 126.143 122.119 4.024 25567 150 1 1 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.113 0.172 25567 151 1 1 . 1 1 33 33 LEU C C 33 173.401 173.401 176.076 -2.675 25567 152 1 1 . 1 1 33 33 LEU CA C 33 51.334 51.334 54.218 -2.884 25567 153 1 1 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.060 -0.437 25567 154 1 1 . 1 1 33 33 LEU H H 33 8.627 8.627 8.715 -0.088 25567 155 1 1 . 1 1 34 34 LYS N N 34 127.122 127.122 125.473 1.649 25567 156 1 1 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.782 -0.183 25567 157 1 1 . 1 1 34 34 LYS C C 34 169.644 169.644 174.845 -5.201 25567 158 1 1 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.287 -1.934 25567 159 1 1 . 1 1 34 34 LYS CB C 34 34.172 34.172 36.596 -2.424 25567 160 1 1 . 1 1 34 34 LYS H H 34 9.399 9.399 9.119 0.280 25567 161 1 1 . 1 1 35 35 GLU N N 35 122.766 122.766 120.904 1.862 25567 162 1 1 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.054 -0.696 25567 163 1 1 . 1 1 35 35 GLU C C 35 172.875 172.875 174.849 -1.974 25567 164 1 1 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.397 -2.757 25567 165 1 1 . 1 1 35 35 GLU CB C 35 29.268 29.268 30.919 -1.651 25567 166 1 1 . 1 1 35 35 GLU H H 35 8.166 8.166 8.417 -0.251 25567 167 1 1 . 1 1 36 36 VAL N N 36 126.674 126.674 123.803 2.871 25567 168 1 1 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.570 -0.709 25567 169 1 1 . 1 1 36 36 VAL C C 36 171.451 171.451 174.754 -3.303 25567 170 1 1 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.773 -1.236 25567 171 1 1 . 1 1 36 36 VAL CB C 36 29.689 29.689 32.668 -2.979 25567 172 1 1 . 1 1 36 36 VAL H H 36 8.632 8.632 8.332 0.300 25567 173 1 1 . 1 1 37 37 LYS N N 37 126.181 126.181 128.267 -2.086 25567 174 1 1 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.505 0.434 25567 175 1 1 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.906 -2.727 25567 176 1 1 . 1 1 37 37 LYS CB C 37 32.898 32.898 35.046 -2.148 25567 177 1 1 . 1 1 37 37 LYS H H 37 7.867 7.867 8.596 -0.729 25567 178 1 1 . 1 1 38 38 VAL N N 38 113.540 113.540 116.015 -2.475 25567 179 1 1 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.849 -0.163 25567 180 1 1 . 1 1 38 38 VAL C C 38 173.633 173.633 175.679 -2.046 25567 181 1 1 . 1 1 38 38 VAL CA C 38 57.284 57.284 58.888 -1.604 25567 182 1 1 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.624 -1.660 25567 183 1 1 . 1 1 38 38 VAL H H 38 8.389 8.389 7.904 0.485 25567 184 1 1 . 1 1 39 39 SER N N 39 118.860 118.860 118.584 0.276 25567 185 1 1 . 1 1 39 39 SER HA H 39 4.194 4.194 4.312 -0.118 25567 186 1 1 . 1 1 39 39 SER C C 39 173.059 173.059 174.154 -1.095 25567 187 1 1 . 1 1 39 39 SER CA C 39 56.227 56.227 59.365 -3.139 25567 188 1 1 . 1 1 39 39 SER CB C 39 60.771 60.771 63.706 -2.934 25567 189 1 1 . 1 1 39 39 SER H H 39 8.668 8.668 8.483 0.185 25567 190 1 1 . 1 1 40 40 GLU N N 40 125.769 125.769 118.151 7.618 25567 191 1 1 . 1 1 40 40 GLU HA H 40 4.157 4.157 3.843 0.314 25567 192 1 1 . 1 1 40 40 GLU C C 40 174.484 174.484 176.868 -2.384 25567 193 1 1 . 1 1 40 40 GLU CA C 40 55.550 55.550 57.993 -2.443 25567 194 1 1 . 1 1 40 40 GLU CB C 40 27.054 27.054 29.805 -2.752 25567 195 1 1 . 1 1 40 40 GLU H H 40 8.878 8.878 8.563 0.315 25567 196 1 1 . 1 1 41 41 GLY N N 41 112.165 112.165 107.227 4.938 25567 197 1 1 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.879 -3.172 25567 198 1 1 . 1 1 41 41 GLY H H 41 8.743 8.743 8.475 0.268 25567 199 1 1 . 1 1 44 44 ASP N N 44 122.324 122.324 122.613 -0.289 25567 200 1 1 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.792 1.364 25567 201 1 1 . 1 1 44 44 ASP H H 44 7.918 7.918 7.367 0.551 25567 202 1 1 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.006 0.056 25567 203 1 1 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.802 -1.392 25567 204 1 1 . 1 1 45 45 ALA CB C 45 16.376 16.376 18.009 -1.633 25567 205 1 1 . 1 1 47 47 MET CA C 47 54.118 54.118 54.163 -0.045 25567 206 1 1 . 1 1 47 47 MET CB C 47 27.527 27.527 34.453 -6.926 25567 207 1 1 . 1 1 48 48 TYR N N 48 120.075 120.075 116.765 3.310 25567 208 1 1 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.482 -0.328 25567 209 1 1 . 1 1 48 48 TYR C C 48 172.217 172.217 175.359 -3.142 25567 210 1 1 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.159 -1.782 25567 211 1 1 . 1 1 48 48 TYR CB C 48 34.496 34.496 39.063 -4.567 25567 212 1 1 . 1 1 48 48 TYR H H 48 7.810 7.810 8.246 -0.436 25567 213 1 1 . 1 1 49 49 LYS N N 49 118.369 118.369 119.297 -0.928 25567 214 1 1 . 1 1 49 49 LYS H H 49 8.116 8.116 8.691 -0.575 25567 215 1 1 . 1 1 50 50 THR N N 50 116.979 116.979 116.042 0.937 25567 216 1 1 . 1 1 50 50 THR CB C 50 66.373 66.373 67.048 -0.675 25567 217 1 1 . 1 1 50 50 THR H H 50 7.741 7.741 8.724 -0.983 25567 218 1 1 . 1 1 51 51 SER N N 51 116.155 116.155 113.820 2.335 25567 219 1 1 . 1 1 51 51 SER HA H 51 3.771 3.771 4.747 -0.976 25567 220 1 1 . 1 1 51 51 SER C C 51 170.563 170.563 173.861 -3.298 25567 221 1 1 . 1 1 51 51 SER CA C 51 54.840 54.840 58.026 -3.186 25567 222 1 1 . 1 1 51 51 SER CB C 51 60.318 60.318 64.959 -4.641 25567 223 1 1 . 1 1 51 51 SER H H 51 7.853 7.853 7.955 -0.102 25567 224 1 1 . 1 1 54 54 ALA N N 54 123.234 123.234 126.988 -3.754 25567 225 1 1 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.378 -0.130 25567 226 1 1 . 1 1 54 54 ALA CA C 54 51.268 51.268 54.012 -2.744 25567 227 1 1 . 1 1 54 54 ALA CB C 54 16.434 16.434 19.035 -2.600 25567 228 1 1 . 1 1 54 54 ALA H H 54 8.207 8.207 8.386 -0.179 25567 229 1 1 . 1 1 55 55 LEU N N 55 118.603 118.603 119.998 -1.395 25567 230 1 1 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.299 -0.359 25567 231 1 1 . 1 1 55 55 LEU CA C 55 54.711 54.711 54.951 -0.240 25567 232 1 1 . 1 1 55 55 LEU CB C 55 38.913 38.913 40.172 -1.259 25567 233 1 1 . 1 1 55 55 LEU H H 55 7.960 7.960 8.169 -0.209 25567 234 1 1 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.090 -0.414 25567 235 1 1 . 1 1 58 58 ILE CA C 58 61.494 61.494 62.204 -0.710 25567 236 1 1 . 1 1 58 58 ILE CB C 58 36.054 36.054 40.117 -4.063 25567 237 1 1 . 1 1 59 59 GLN N N 59 117.579 117.579 119.784 -2.205 25567 238 1 1 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.524 -0.391 25567 239 1 1 . 1 1 59 59 GLN CA C 59 54.009 54.009 55.262 -1.253 25567 240 1 1 . 1 1 59 59 GLN CB C 59 26.651 26.651 29.348 -2.697 25567 241 1 1 . 1 1 59 59 GLN H H 59 8.268 8.268 7.728 0.540 25567 242 1 1 . 1 1 60 60 GLY N N 60 107.308 107.308 111.683 -4.375 25567 243 1 1 . 1 1 60 60 GLY CA C 60 42.979 42.979 44.997 -2.018 25567 244 1 1 . 1 1 60 60 GLY H H 60 7.780 7.780 8.716 -0.936 25567 245 1 1 . 1 1 61 61 ASN N N 61 117.747 117.747 118.635 -0.888 25567 246 1 1 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.956 -0.422 25567 247 1 1 . 1 1 61 61 ASN CA C 61 51.235 51.235 51.736 -0.501 25567 248 1 1 . 1 1 61 61 ASN CB C 61 36.424 36.424 41.392 -4.968 25567 249 1 1 . 1 1 61 61 ASN H H 61 8.108 8.108 7.876 0.232 25567 250 1 1 . 1 1 64 64 PHE N N 64 120.102 120.102 119.249 0.853 25567 251 1 1 . 1 1 64 64 PHE HA H 64 4.379 4.379 5.015 -0.636 25567 252 1 1 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.132 -2.384 25567 253 1 1 . 1 1 64 64 PHE CB C 64 35.275 35.275 39.264 -3.989 25567 254 1 1 . 1 1 64 64 PHE H H 64 8.300 8.300 7.331 0.969 25567 255 1 1 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.700 -0.365 25567 256 1 1 . 1 1 65 65 PRO C C 65 173.870 173.870 176.719 -2.849 25567 257 1 1 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.489 -2.472 25567 258 1 1 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.893 -3.258 25567 259 1 1 . 1 1 66 66 GLU N N 66 121.258 121.258 119.575 1.683 25567 260 1 1 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.384 -0.150 25567 261 1 1 . 1 1 66 66 GLU C C 66 173.981 173.981 177.040 -3.059 25567 262 1 1 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.078 -2.291 25567 263 1 1 . 1 1 66 66 GLU CB C 66 27.775 27.775 31.209 -3.434 25567 264 1 1 . 1 1 66 66 GLU H H 66 8.316 8.316 8.572 -0.256 25567 265 1 1 . 1 1 67 67 ILE N N 67 114.290 114.290 114.450 -0.160 25567 266 1 1 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.796 0.333 25567 267 1 1 . 1 1 67 67 ILE C C 67 172.700 172.700 175.585 -2.885 25567 268 1 1 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.554 -3.115 25567 269 1 1 . 1 1 67 67 ILE CB C 67 39.159 39.159 40.278 -1.119 25567 270 1 1 . 1 1 67 67 ILE H H 67 8.366 8.366 8.205 0.161 25567 271 1 1 . 1 1 68 68 GLN N N 68 121.422 121.422 119.980 1.442 25567 272 1 1 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.774 -0.273 25567 273 1 1 . 1 1 68 68 GLN C C 68 171.675 171.675 174.140 -2.465 25567 274 1 1 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.747 -2.474 25567 275 1 1 . 1 1 68 68 GLN CB C 68 27.143 27.143 32.835 -5.692 25567 276 1 1 . 1 1 68 68 GLN H H 68 8.737 8.737 8.498 0.239 25567 277 1 1 . 1 1 69 69 LEU N N 69 125.311 125.311 116.312 8.999 25567 278 1 1 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.772 -0.266 25567 279 1 1 . 1 1 69 69 LEU C C 69 172.634 172.634 174.875 -2.241 25567 280 1 1 . 1 1 69 69 LEU CA C 69 51.759 51.759 54.156 -2.397 25567 281 1 1 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.249 -0.846 25567 282 1 1 . 1 1 69 69 LEU H H 69 8.051 8.051 8.266 -0.215 25567 283 1 1 . 1 1 70 70 ASP N N 70 122.763 122.763 119.503 3.260 25567 284 1 1 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.747 -0.324 25567 285 1 1 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.239 -1.629 25567 286 1 1 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.405 -3.688 25567 287 1 1 . 1 1 70 70 ASP H H 70 8.313 8.313 8.583 -0.270 25567 288 1 1 . 1 1 71 71 ASN N N 71 117.413 117.413 119.251 -1.838 25567 289 1 1 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.747 -0.410 25567 290 1 1 . 1 1 71 71 ASN C C 71 171.770 171.770 174.589 -2.819 25567 291 1 1 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.278 -1.787 25567 292 1 1 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.845 -2.519 25567 293 1 1 . 1 1 71 71 ASN H H 71 8.407 8.407 8.480 -0.073 25567 294 1 1 . 1 1 72 72 ILE N N 72 123.752 123.752 124.312 -0.560 25567 295 1 1 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.323 -0.383 25567 296 1 1 . 1 1 72 72 ILE C C 72 171.621 171.621 174.548 -2.927 25567 297 1 1 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.872 -3.540 25567 298 1 1 . 1 1 72 72 ILE CB C 72 38.489 38.489 40.156 -1.667 25567 299 1 1 . 1 1 72 72 ILE H H 72 7.639 7.639 7.656 -0.017 25567 300 1 1 . 1 1 73 73 ASP N N 73 125.252 125.252 126.738 -1.486 25567 301 1 1 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.605 0.020 25567 302 1 1 . 1 1 73 73 ASP C C 73 174.034 174.034 176.415 -2.381 25567 303 1 1 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.334 -3.131 25567 304 1 1 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.875 -4.851 25567 305 1 1 . 1 1 73 73 ASP H H 73 8.394 8.394 8.644 -0.250 25567 306 1 1 . 1 1 74 74 TYR N N 74 123.108 123.108 123.686 -0.578 25567 307 1 1 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.348 -0.470 25567 308 1 1 . 1 1 74 74 TYR C C 74 173.637 173.637 177.440 -3.803 25567 309 1 1 . 1 1 74 74 TYR CA C 74 59.474 59.474 59.953 -0.479 25567 310 1 1 . 1 1 74 74 TYR CB C 74 34.722 34.722 37.698 -2.976 25567 311 1 1 . 1 1 74 74 TYR H H 74 7.392 7.392 8.111 -0.719 25567 312 1 1 . 1 1 75 75 ASN N N 75 109.422 109.422 115.769 -6.347 25567 313 1 1 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.695 0.231 25567 314 1 1 . 1 1 75 75 ASN C C 75 172.574 172.574 176.051 -3.477 25567 315 1 1 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.283 -2.522 25567 316 1 1 . 1 1 75 75 ASN CB C 75 35.617 35.617 37.978 -2.361 25567 317 1 1 . 1 1 75 75 ASN H H 75 8.058 8.058 8.698 -0.640 25567 318 1 1 . 1 1 76 76 ASN N N 76 117.422 117.422 117.073 0.349 25567 319 1 1 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.708 -0.253 25567 320 1 1 . 1 1 76 76 ASN C C 76 171.132 171.132 173.539 -2.407 25567 321 1 1 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.492 -2.325 25567 322 1 1 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.878 -3.150 25567 323 1 1 . 1 1 76 76 ASN H H 76 7.768 7.768 8.025 -0.257 25567 324 1 1 . 1 1 77 77 TYR N N 77 116.873 116.873 115.330 1.543 25567 325 1 1 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.679 -0.316 25567 326 1 1 . 1 1 77 77 TYR C C 77 172.175 172.175 174.651 -2.476 25567 327 1 1 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.454 -2.090 25567 328 1 1 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.394 -4.229 25567 329 1 1 . 1 1 77 77 TYR H H 77 7.825 7.825 7.698 0.127 25567 330 1 1 . 1 1 78 78 ASP N N 78 121.271 121.271 119.946 1.325 25567 331 1 1 . 1 1 78 78 ASP HA H 78 4.805 4.805 5.159 -0.354 25567 332 1 1 . 1 1 78 78 ASP C C 78 172.641 172.641 175.082 -2.441 25567 333 1 1 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.736 -0.481 25567 334 1 1 . 1 1 78 78 ASP CB C 78 41.075 41.075 44.797 -3.722 25567 335 1 1 . 1 1 78 78 ASP H H 78 9.058 9.058 8.819 0.239 25567 336 1 1 . 1 1 79 79 LEU N N 79 122.985 122.985 120.865 2.120 25567 337 1 1 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.114 -0.000 25567 338 1 1 . 1 1 79 79 LEU C C 79 170.721 170.721 174.233 -3.512 25567 339 1 1 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.531 -3.215 25567 340 1 1 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.449 -3.107 25567 341 1 1 . 1 1 79 79 LEU H H 79 7.893 7.893 8.057 -0.164 25567 342 1 1 . 1 1 80 80 ILE N N 80 126.364 126.364 125.219 1.145 25567 343 1 1 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.691 0.398 25567 344 1 1 . 1 1 80 80 ILE C C 80 171.580 171.580 174.020 -2.440 25567 345 1 1 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.329 -2.912 25567 346 1 1 . 1 1 80 80 ILE CB C 80 38.136 38.136 40.427 -2.291 25567 347 1 1 . 1 1 80 80 ILE H H 80 8.717 8.717 9.249 -0.532 25567 348 1 1 . 1 1 81 81 LEU N N 81 126.199 126.199 127.754 -1.555 25567 349 1 1 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.126 0.009 25567 350 1 1 . 1 1 81 81 LEU C C 81 172.979 172.979 175.998 -3.019 25567 351 1 1 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.267 -3.634 25567 352 1 1 . 1 1 81 81 LEU CB C 81 42.159 42.159 44.584 -2.425 25567 353 1 1 . 1 1 81 81 LEU H H 81 9.230 9.230 8.925 0.305 25567 354 1 1 . 1 1 82 82 ILE N N 82 120.505 120.505 119.374 1.131 25567 355 1 1 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.804 0.112 25567 356 1 1 . 1 1 82 82 ILE C C 82 173.011 173.011 174.193 -1.182 25567 357 1 1 . 1 1 82 82 ILE CA C 82 56.828 56.828 60.198 -3.370 25567 358 1 1 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.041 -3.973 25567 359 1 1 . 1 1 82 82 ILE H H 82 8.796 8.796 8.024 0.772 25567 360 1 1 . 1 1 83 83 GLY N N 83 120.857 120.857 112.755 8.102 25567 361 1 1 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.133 -2.330 25567 362 1 1 . 1 1 83 83 GLY H H 83 9.525 9.525 8.799 0.726 25567 363 1 1 . 1 1 84 84 SER N N 84 116.007 116.007 116.435 -0.428 25567 364 1 1 . 1 1 84 84 SER HA H 84 5.476 5.476 5.469 0.007 25567 365 1 1 . 1 1 84 84 SER CA C 84 51.937 51.937 56.119 -4.182 25567 366 1 1 . 1 1 84 84 SER CB C 84 64.533 64.533 66.609 -2.076 25567 367 1 1 . 1 1 84 84 SER H H 84 7.617 7.617 7.628 -0.011 25567 368 1 1 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.600 0.601 25567 369 1 1 . 1 1 85 85 PRO C C 85 173.574 173.574 175.155 -1.581 25567 370 1 1 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.553 -3.064 25567 371 1 1 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.909 -1.769 25567 372 1 1 . 1 1 86 86 VAL N N 86 117.603 117.603 116.703 0.900 25567 373 1 1 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.160 0.213 25567 374 1 1 . 1 1 86 86 VAL C C 86 172.777 172.777 173.407 -0.630 25567 375 1 1 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.046 -1.443 25567 376 1 1 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.224 -4.651 25567 377 1 1 . 1 1 86 86 VAL H H 86 8.194 8.194 8.047 0.147 25567 378 1 1 . 1 1 87 87 TRP N N 87 131.187 131.187 128.313 2.874 25567 379 1 1 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.999 0.199 25567 380 1 1 . 1 1 87 87 TRP C C 87 173.295 173.295 174.796 -1.501 25567 381 1 1 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.015 -7.231 25567 382 1 1 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.299 -3.553 25567 383 1 1 . 1 1 87 87 TRP H H 87 9.637 9.637 8.390 1.247 25567 384 1 1 . 1 1 88 88 SER N N 88 119.829 119.829 114.344 5.485 25567 385 1 1 . 1 1 88 88 SER HA H 88 3.986 3.986 4.704 -0.718 25567 386 1 1 . 1 1 88 88 SER C C 88 172.375 172.375 174.462 -2.087 25567 387 1 1 . 1 1 88 88 SER CA C 88 55.932 55.932 56.710 -0.778 25567 388 1 1 . 1 1 88 88 SER CB C 88 59.178 59.178 63.208 -4.030 25567 389 1 1 . 1 1 88 88 SER H H 88 9.272 9.272 7.835 1.437 25567 390 1 1 . 1 1 89 89 GLY N N 89 101.498 101.498 110.660 -9.162 25567 391 1 1 . 1 1 89 89 GLY CA C 89 42.671 42.671 45.374 -2.703 25567 392 1 1 . 1 1 89 89 GLY H H 89 7.463 7.463 8.510 -1.047 25567 393 1 1 . 1 1 90 90 TYR N N 90 121.064 121.064 116.514 4.550 25567 394 1 1 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.151 -0.935 25567 395 1 1 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.260 -0.170 25567 396 1 1 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.717 0.478 25567 397 1 1 . 1 1 90 90 TYR H H 90 8.064 8.064 7.755 0.309 25567 398 1 1 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.668 0.264 25567 399 1 1 . 1 1 91 91 PRO C C 91 171.019 171.019 175.323 -4.304 25567 400 1 1 . 1 1 91 91 PRO CA C 91 58.994 58.994 62.835 -3.841 25567 401 1 1 . 1 1 91 91 PRO CB C 91 26.493 26.493 29.592 -3.099 25567 402 1 1 . 1 1 92 92 ALA N N 92 119.893 119.893 123.158 -3.265 25567 403 1 1 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.705 -1.254 25567 404 1 1 . 1 1 92 92 ALA C C 92 176.477 176.477 175.969 0.508 25567 405 1 1 . 1 1 92 92 ALA CA C 92 49.567 49.567 52.295 -2.728 25567 406 1 1 . 1 1 92 92 ALA CB C 92 15.801 15.801 20.959 -5.158 25567 407 1 1 . 1 1 92 92 ALA H H 92 7.278 7.278 7.935 -0.657 25567 408 1 1 . 1 1 93 93 THR N N 93 112.992 112.992 112.273 0.719 25567 409 1 1 . 1 1 93 93 THR HA H 93 4.462 4.462 4.568 -0.106 25567 410 1 1 . 1 1 93 93 THR CA C 93 66.871 66.871 58.576 8.295 25567 411 1 1 . 1 1 93 93 THR CB C 93 64.362 64.362 68.562 -4.200 25567 412 1 1 . 1 1 93 93 THR H H 93 6.861 6.861 8.233 -1.372 25567 413 1 1 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.187 -0.321 25567 414 1 1 . 1 1 94 94 PRO CA C 94 63.021 63.021 64.334 -1.313 25567 415 1 1 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.563 -2.284 25567 416 1 1 . 1 1 95 95 ILE N N 95 111.298 111.298 117.479 -6.181 25567 417 1 1 . 1 1 95 95 ILE HA H 95 3.623 3.623 3.930 -0.307 25567 418 1 1 . 1 1 95 95 ILE C C 95 174.264 174.264 177.669 -3.405 25567 419 1 1 . 1 1 95 95 ILE CA C 95 57.448 57.448 60.885 -3.437 25567 420 1 1 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.650 -4.721 25567 421 1 1 . 1 1 95 95 ILE H H 95 7.974 7.974 8.003 -0.029 25567 422 1 1 . 1 1 96 96 LYS N N 96 123.045 123.045 121.871 1.174 25567 423 1 1 . 1 1 96 96 LYS HA H 96 3.112 3.112 3.888 -0.776 25567 424 1 1 . 1 1 96 96 LYS C C 96 174.590 174.590 178.652 -4.062 25567 425 1 1 . 1 1 96 96 LYS CA C 96 57.145 57.145 59.740 -2.595 25567 426 1 1 . 1 1 96 96 LYS CB C 96 28.845 28.845 31.274 -2.429 25567 427 1 1 . 1 1 96 96 LYS H H 96 6.958 6.958 8.190 -1.232 25567 428 1 1 . 1 1 97 97 THR N N 97 113.412 113.412 115.617 -2.205 25567 429 1 1 . 1 1 97 97 THR HA H 97 3.461 3.461 4.023 -0.562 25567 430 1 1 . 1 1 97 97 THR C C 97 173.247 173.247 176.498 -3.251 25567 431 1 1 . 1 1 97 97 THR CA C 97 62.809 62.809 65.585 -2.776 25567 432 1 1 . 1 1 97 97 THR CB C 97 65.654 65.654 68.688 -3.034 25567 433 1 1 . 1 1 97 97 THR H H 97 6.366 6.366 7.651 -1.285 25567 434 1 1 . 1 1 98 98 LEU N N 98 121.201 121.201 122.791 -1.590 25567 435 1 1 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.101 -0.467 25567 436 1 1 . 1 1 98 98 LEU C C 98 174.590 174.590 178.306 -3.716 25567 437 1 1 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.364 -1.743 25567 438 1 1 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.169 -1.274 25567 439 1 1 . 1 1 98 98 LEU H H 98 7.554 7.554 7.611 -0.057 25567 440 1 1 . 1 1 99 99 LEU N N 99 118.677 118.677 118.470 0.207 25567 441 1 1 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.887 -0.185 25567 442 1 1 . 1 1 99 99 LEU C C 99 177.457 177.457 178.273 -0.816 25567 443 1 1 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.905 -2.726 25567 444 1 1 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.603 -2.615 25567 445 1 1 . 1 1 99 99 LEU H H 99 8.160 8.160 8.308 -0.148 25567 446 1 1 . 1 1 100 100 ASP N N 100 118.914 118.914 115.581 3.333 25567 447 1 1 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.660 -0.431 25567 448 1 1 . 1 1 100 100 ASP C C 100 176.585 176.585 177.371 -0.786 25567 449 1 1 . 1 1 100 100 ASP CA C 100 54.516 54.516 55.682 -1.166 25567 450 1 1 . 1 1 100 100 ASP CB C 100 37.579 37.579 40.943 -3.364 25567 451 1 1 . 1 1 100 100 ASP H H 100 7.872 7.872 7.634 0.238 25567 452 1 1 . 1 1 101 101 GLN N N 101 118.135 118.135 118.409 -0.274 25567 453 1 1 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.361 -0.201 25567 454 1 1 . 1 1 101 101 GLN C C 101 174.601 174.601 177.941 -3.340 25567 455 1 1 . 1 1 101 101 GLN CA C 101 54.960 54.960 57.870 -2.910 25567 456 1 1 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.611 -4.061 25567 457 1 1 . 1 1 101 101 GLN H H 101 7.673 7.673 7.723 -0.050 25567 458 1 1 . 1 1 102 102 MET N N 102 118.420 118.420 117.116 1.304 25567 459 1 1 . 1 1 102 102 MET HA H 102 3.826 3.826 4.622 -0.796 25567 460 1 1 . 1 1 102 102 MET C C 102 172.780 172.780 176.888 -4.108 25567 461 1 1 . 1 1 102 102 MET CA C 102 53.428 53.428 56.459 -3.031 25567 462 1 1 . 1 1 102 102 MET CB C 102 31.221 31.221 31.031 0.190 25567 463 1 1 . 1 1 102 102 MET H H 102 7.462 7.462 7.992 -0.530 25567 464 1 1 . 1 1 103 103 LYS N N 103 116.066 116.066 119.756 -3.690 25567 465 1 1 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.193 -0.273 25567 466 1 1 . 1 1 103 103 LYS C C 103 173.922 173.922 177.728 -3.806 25567 467 1 1 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.585 -2.303 25567 468 1 1 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.837 -2.346 25567 469 1 1 . 1 1 103 103 LYS H H 103 6.875 6.875 7.977 -1.102 25567 470 1 1 . 1 1 104 104 ASN N N 104 114.987 114.987 114.424 0.563 25567 471 1 1 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.777 -0.036 25567 472 1 1 . 1 1 104 104 ASN C C 104 172.587 172.587 175.008 -2.421 25567 473 1 1 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.419 -1.950 25567 474 1 1 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.026 -3.204 25567 475 1 1 . 1 1 104 104 ASN H H 104 8.517 8.517 8.003 0.514 25567 476 1 1 . 1 1 105 105 TYR N N 105 122.755 122.755 122.989 -0.234 25567 477 1 1 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.430 0.145 25567 478 1 1 . 1 1 105 105 TYR C C 105 174.260 174.260 175.178 -0.918 25567 479 1 1 . 1 1 105 105 TYR CA C 105 55.493 55.493 60.123 -4.630 25567 480 1 1 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.154 -3.090 25567 481 1 1 . 1 1 105 105 TYR H H 105 8.287 8.287 7.815 0.472 25567 482 1 1 . 1 1 106 106 ARG N N 106 128.905 128.905 125.518 3.387 25567 483 1 1 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.279 -0.006 25567 484 1 1 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.288 -2.267 25567 485 1 1 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.767 -4.637 25567 486 1 1 . 1 1 106 106 ARG H H 106 8.841 8.841 8.613 0.228 25567 487 1 1 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.561 -2.064 25567 488 1 1 . 1 1 108 108 GLU N N 108 116.989 116.989 120.254 -3.265 25567 489 1 1 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.716 -0.085 25567 490 1 1 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.633 -1.957 25567 491 1 1 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.731 -3.329 25567 492 1 1 . 1 1 108 108 GLU H H 108 7.536 7.536 8.478 -0.942 25567 493 1 1 . 1 1 109 109 VAL N N 109 123.416 123.416 123.143 0.273 25567 494 1 1 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.981 0.340 25567 495 1 1 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.935 -3.492 25567 496 1 1 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.345 -0.684 25567 497 1 1 . 1 1 109 109 VAL H H 109 8.955 8.955 8.788 0.167 25567 498 1 1 . 1 1 110 110 ALA N N 110 127.975 127.975 128.539 -0.564 25567 499 1 1 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.067 -0.390 25567 500 1 1 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.541 -2.100 25567 501 1 1 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.230 -3.813 25567 502 1 1 . 1 1 110 110 ALA H H 110 8.860 8.860 8.555 0.305 25567 503 1 1 . 1 1 111 111 SER N N 111 110.482 110.482 116.272 -5.790 25567 504 1 1 . 1 1 111 111 SER HA H 111 5.502 5.502 5.093 0.409 25567 505 1 1 . 1 1 111 111 SER CA C 111 51.630 51.630 57.041 -5.411 25567 506 1 1 . 1 1 111 111 SER CB C 111 62.267 62.267 63.649 -1.382 25567 507 1 1 . 1 1 111 111 SER H H 111 7.484 7.484 8.232 -0.748 25567 508 1 1 . 1 1 112 112 PHE N N 112 125.082 125.082 123.399 1.683 25567 509 1 1 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.494 0.954 25567 510 1 1 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.402 -4.968 25567 511 1 1 . 1 1 112 112 PHE CB C 112 40.500 40.500 39.158 1.342 25567 512 1 1 . 1 1 112 112 PHE H H 112 8.025 8.025 8.674 -0.649 25567 513 1 1 . 1 1 113 113 PHE N N 113 115.872 115.872 118.408 -2.536 25567 514 1 1 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.485 0.439 25567 515 1 1 . 1 1 113 113 PHE C C 113 173.293 173.293 176.196 -2.903 25567 516 1 1 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.021 -4.553 25567 517 1 1 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.002 -2.609 25567 518 1 1 . 1 1 113 113 PHE H H 113 7.391 7.391 7.702 -0.311 25567 519 1 1 . 1 1 114 114 THR N N 114 108.721 108.721 110.245 -1.524 25567 520 1 1 . 1 1 114 114 THR HA H 114 4.933 4.933 4.625 0.308 25567 521 1 1 . 1 1 114 114 THR C C 114 171.891 171.891 174.396 -2.505 25567 522 1 1 . 1 1 114 114 THR CA C 114 56.815 56.815 61.528 -4.713 25567 523 1 1 . 1 1 114 114 THR CB C 114 67.899 67.899 69.543 -1.644 25567 524 1 1 . 1 1 114 114 THR H H 114 7.951 7.951 8.350 -0.399 25567 525 1 1 . 1 1 115 115 SER N N 115 115.159 115.159 116.937 -1.778 25567 526 1 1 . 1 1 115 115 SER HA H 115 4.608 4.608 4.634 -0.026 25567 527 1 1 . 1 1 115 115 SER C C 115 171.403 171.403 173.053 -1.650 25567 528 1 1 . 1 1 115 115 SER CA C 115 55.570 55.570 57.926 -2.356 25567 529 1 1 . 1 1 115 115 SER CB C 115 61.418 61.418 65.382 -3.964 25567 530 1 1 . 1 1 115 115 SER H H 115 8.229 8.229 7.751 0.478 25567 531 1 1 . 1 1 116 116 ALA N N 116 127.211 127.211 124.272 2.939 25567 532 1 1 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.892 -0.436 25567 533 1 1 . 1 1 116 116 ALA C C 116 175.758 175.758 178.058 -2.300 25567 534 1 1 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.086 -2.270 25567 535 1 1 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.997 -3.166 25567 536 1 1 . 1 1 116 116 ALA H H 116 8.813 8.813 8.300 0.513 25567 537 1 1 . 1 1 117 117 GLY N N 117 108.099 108.099 108.559 -0.460 25567 538 1 1 . 1 1 117 117 GLY C C 117 171.805 171.805 175.803 -3.998 25567 539 1 1 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.433 -4.564 25567 540 1 1 . 1 1 117 117 GLY H H 117 8.685 8.685 8.938 -0.253 25567 541 1 1 . 1 1 118 118 THR N N 118 111.284 111.284 108.508 2.776 25567 542 1 1 . 1 1 118 118 THR HA H 118 4.343 4.343 4.376 -0.033 25567 543 1 1 . 1 1 118 118 THR C C 118 171.769 171.769 173.707 -1.938 25567 544 1 1 . 1 1 118 118 THR CA C 118 58.933 58.933 61.693 -2.760 25567 545 1 1 . 1 1 118 118 THR CB C 118 67.304 67.304 70.284 -2.980 25567 546 1 1 . 1 1 118 118 THR H H 118 7.998 7.998 8.229 -0.231 25567 547 1 1 . 1 1 119 119 ASN N N 119 120.253 120.253 119.429 0.824 25567 548 1 1 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.915 -0.212 25567 549 1 1 . 1 1 119 119 ASN C C 119 172.353 172.353 174.233 -1.880 25567 550 1 1 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.502 -3.274 25567 551 1 1 . 1 1 119 119 ASN CB C 119 35.376 35.376 40.142 -4.766 25567 552 1 1 . 1 1 119 119 ASN H H 119 8.381 8.381 8.040 0.341 25567 553 1 1 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.490 -0.404 25567 554 1 1 . 1 1 120 120 HIS C C 120 173.395 173.395 176.076 -2.681 25567 555 1 1 . 1 1 120 120 HIS CA C 120 55.139 55.139 56.155 -1.016 25567 556 1 1 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.085 -2.663 25567 557 1 1 . 1 1 121 121 LYS N N 121 119.527 119.527 120.734 -1.207 25567 558 1 1 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.739 0.041 25567 559 1 1 . 1 1 121 121 LYS C C 121 176.053 176.053 177.882 -1.829 25567 560 1 1 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.994 -2.031 25567 561 1 1 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.605 -1.945 25567 562 1 1 . 1 1 121 121 LYS H H 121 8.106 8.106 8.611 -0.505 25567 563 1 1 . 1 1 122 122 ALA N N 122 121.585 121.585 121.552 0.033 25567 564 1 1 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.717 0.004 25567 565 1 1 . 1 1 122 122 ALA C C 122 175.128 175.128 178.850 -3.722 25567 566 1 1 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.100 -2.509 25567 567 1 1 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.634 -1.930 25567 568 1 1 . 1 1 122 122 ALA H H 122 7.702 7.702 7.748 -0.046 25567 569 1 1 . 1 1 123 123 TYR N N 123 118.803 118.803 120.350 -1.547 25567 570 1 1 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.929 -0.563 25567 571 1 1 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.265 -1.174 25567 572 1 1 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.056 -2.954 25567 573 1 1 . 1 1 123 123 TYR H H 123 7.366 7.366 7.437 -0.071 25567 574 1 1 . 1 1 124 124 VAL N N 124 117.530 117.530 117.185 0.345 25567 575 1 1 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.590 -0.391 25567 576 1 1 . 1 1 124 124 VAL C C 124 175.375 175.375 178.161 -2.786 25567 577 1 1 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.834 -2.251 25567 578 1 1 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.692 -1.489 25567 579 1 1 . 1 1 124 124 VAL H H 124 7.757 7.757 7.646 0.111 25567 580 1 1 . 1 1 125 125 SER N N 125 114.023 114.023 114.036 -0.013 25567 581 1 1 . 1 1 125 125 SER HA H 125 4.035 4.035 4.111 -0.076 25567 582 1 1 . 1 1 125 125 SER C C 125 174.636 174.636 176.404 -1.768 25567 583 1 1 . 1 1 125 125 SER CA C 125 58.885 58.885 61.548 -2.663 25567 584 1 1 . 1 1 125 125 SER CB C 125 59.666 59.666 63.077 -3.411 25567 585 1 1 . 1 1 125 125 SER H H 125 7.622 7.622 7.715 -0.093 25567 586 1 1 . 1 1 126 126 HIS N N 126 119.457 119.457 120.526 -1.069 25567 587 1 1 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.043 0.153 25567 588 1 1 . 1 1 126 126 HIS C C 126 172.942 172.942 177.681 -4.739 25567 589 1 1 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.158 -3.240 25567 590 1 1 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.705 -3.626 25567 591 1 1 . 1 1 126 126 HIS H H 126 8.067 8.067 8.030 0.037 25567 592 1 1 . 1 1 127 127 PHE N N 127 120.628 120.628 119.861 0.767 25567 593 1 1 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.929 -0.730 25567 594 1 1 . 1 1 127 127 PHE C C 127 173.515 173.515 177.199 -3.684 25567 595 1 1 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.229 1.452 25567 596 1 1 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.487 -2.120 25567 597 1 1 . 1 1 127 127 PHE H H 127 9.083 9.083 8.405 0.678 25567 598 1 1 . 1 1 128 128 ASN N N 128 114.858 114.858 118.432 -3.574 25567 599 1 1 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.020 0.058 25567 600 1 1 . 1 1 128 128 ASN C C 128 175.338 175.338 177.160 -1.822 25567 601 1 1 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.707 -2.457 25567 602 1 1 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.082 -2.061 25567 603 1 1 . 1 1 128 128 ASN H H 128 7.858 7.858 7.557 0.301 25567 604 1 1 . 1 1 129 129 GLU N N 129 119.811 119.811 117.914 1.897 25567 605 1 1 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.159 -0.118 25567 606 1 1 . 1 1 129 129 GLU C C 129 176.941 176.941 178.231 -1.290 25567 607 1 1 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.706 -2.074 25567 608 1 1 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.252 -2.314 25567 609 1 1 . 1 1 129 129 GLU H H 129 7.569 7.569 7.830 -0.261 25567 610 1 1 . 1 1 130 130 TRP N N 130 120.585 120.585 117.519 3.066 25567 611 1 1 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.779 -0.307 25567 612 1 1 . 1 1 130 130 TRP C C 130 174.262 174.262 175.511 -1.249 25567 613 1 1 . 1 1 130 130 TRP CA C 130 54.673 54.673 55.587 -0.914 25567 614 1 1 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.848 -1.892 25567 615 1 1 . 1 1 130 130 TRP H H 130 7.964 7.964 7.435 0.529 25567 616 1 1 . 1 1 131 131 ALA N N 131 120.522 120.522 120.810 -0.288 25567 617 1 1 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.398 -0.451 25567 618 1 1 . 1 1 131 131 ALA C C 131 172.489 172.489 176.207 -3.718 25567 619 1 1 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.815 -3.235 25567 620 1 1 . 1 1 131 131 ALA CB C 131 16.539 16.539 20.275 -3.736 25567 621 1 1 . 1 1 131 131 ALA H H 131 8.114 8.114 7.714 0.400 25567 622 1 1 . 1 1 132 132 ASP N N 132 117.666 117.666 121.258 -3.592 25567 623 1 1 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.297 -0.091 25567 624 1 1 . 1 1 132 132 ASP C C 132 173.779 173.779 176.762 -2.983 25567 625 1 1 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.630 -1.317 25567 626 1 1 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.106 0.350 25567 627 1 1 . 1 1 132 132 ASP H H 132 6.768 6.768 8.044 -1.276 25567 628 1 1 . 1 1 133 133 GLY N N 133 114.922 114.922 111.099 3.823 25567 629 1 1 . 1 1 133 133 GLY C C 133 172.101 172.101 174.242 -2.141 25567 630 1 1 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.808 -2.299 25567 631 1 1 . 1 1 133 133 GLY H H 133 8.645 8.645 7.536 1.109 25567 632 1 1 . 1 1 134 134 LEU N N 134 120.101 120.101 121.572 -1.471 25567 633 1 1 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.733 -0.271 25567 634 1 1 . 1 1 134 134 LEU C C 134 174.098 174.098 175.650 -1.552 25567 635 1 1 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.891 -2.807 25567 636 1 1 . 1 1 134 134 LEU CB C 134 40.509 40.509 44.013 -3.504 25567 637 1 1 . 1 1 134 134 LEU H H 134 8.049 8.049 7.578 0.471 25567 638 1 1 . 1 1 135 135 ASN N N 135 119.258 119.258 121.076 -1.818 25567 639 1 1 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.776 -0.137 25567 640 1 1 . 1 1 135 135 ASN C C 135 170.564 170.564 174.156 -3.592 25567 641 1 1 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.143 -3.890 25567 642 1 1 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.649 -5.031 25567 643 1 1 . 1 1 135 135 ASN H H 135 8.567 8.567 8.776 -0.209 25567 644 1 1 . 1 1 136 136 VAL N N 136 125.460 125.460 126.035 -0.575 25567 645 1 1 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.863 -0.267 25567 646 1 1 . 1 1 136 136 VAL C C 136 175.318 175.318 176.530 -1.212 25567 647 1 1 . 1 1 136 136 VAL CA C 136 58.722 58.722 62.021 -3.299 25567 648 1 1 . 1 1 136 136 VAL CB C 136 29.299 29.299 33.264 -3.965 25567 649 1 1 . 1 1 136 136 VAL H H 136 7.660 7.660 8.224 -0.564 25567 650 1 1 . 1 1 137 137 ILE N N 137 122.021 122.021 122.278 -0.257 25567 651 1 1 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.833 -0.405 25567 652 1 1 . 1 1 137 137 ILE C C 137 173.943 173.943 175.463 -1.520 25567 653 1 1 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.795 -0.837 25567 654 1 1 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.932 -2.764 25567 655 1 1 . 1 1 137 137 ILE H H 137 9.151 9.151 8.426 0.725 25567 656 1 1 . 1 1 138 138 GLY N N 138 108.192 108.192 108.983 -0.791 25567 657 1 1 . 1 1 138 138 GLY CA C 138 43.494 43.494 46.090 -2.596 25567 658 1 1 . 1 1 138 138 GLY H H 138 6.675 6.675 7.551 -0.876 25567 659 1 1 . 1 1 139 139 VAL N N 139 119.673 119.673 120.455 -0.782 25567 660 1 1 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.566 0.754 25567 661 1 1 . 1 1 139 139 VAL C C 139 172.291 172.291 174.644 -2.353 25567 662 1 1 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.980 -3.771 25567 663 1 1 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.049 -0.410 25567 664 1 1 . 1 1 139 139 VAL H H 139 8.158 8.158 8.819 -0.661 25567 665 1 1 . 1 1 140 140 ALA N N 140 127.104 127.104 129.628 -2.524 25567 666 1 1 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.983 -0.387 25567 667 1 1 . 1 1 140 140 ALA C C 140 171.057 171.057 174.663 -3.606 25567 668 1 1 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.963 -2.080 25567 669 1 1 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.150 -0.722 25567 670 1 1 . 1 1 140 140 ALA H H 140 9.145 9.145 8.371 0.774 25567 671 1 1 . 1 1 141 141 ARG N N 141 118.828 118.828 117.393 1.435 25567 672 1 1 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.365 -1.625 25567 673 1 1 . 1 1 141 141 ARG C C 141 173.524 173.524 176.380 -2.856 25567 674 1 1 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.756 -2.870 25567 675 1 1 . 1 1 141 141 ARG CB C 141 28.454 28.454 31.217 -2.763 25567 676 1 1 . 1 1 141 141 ARG H H 141 7.759 7.759 8.192 -0.433 25567 677 1 1 . 1 1 142 142 ASP N N 142 125.557 125.557 119.777 5.780 25567 678 1 1 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.305 -0.526 25567 679 1 1 . 1 1 142 142 ASP C C 142 169.292 169.292 175.610 -6.318 25567 680 1 1 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.879 -2.257 25567 681 1 1 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.246 -3.166 25567 682 1 1 . 1 1 142 142 ASP H H 142 9.087 9.087 8.406 0.681 25567 683 1 1 . 1 1 143 143 ASP N N 143 119.094 119.094 117.752 1.342 25567 684 1 1 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.633 -0.379 25567 685 1 1 . 1 1 143 143 ASP C C 143 175.557 175.557 175.359 0.198 25567 686 1 1 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.758 -4.679 25567 687 1 1 . 1 1 143 143 ASP CB C 143 36.442 36.442 39.743 -3.301 25567 688 1 1 . 1 1 143 143 ASP H H 143 8.175 8.175 8.509 -0.334 25567 689 1 1 . 1 1 144 144 SER N N 144 115.438 115.438 115.886 -0.448 25567 690 1 1 . 1 1 144 144 SER HA H 144 3.745 3.745 4.418 -0.673 25567 691 1 1 . 1 1 144 144 SER C C 144 172.820 172.820 174.264 -1.444 25567 692 1 1 . 1 1 144 144 SER CA C 144 59.336 59.336 58.350 0.986 25567 693 1 1 . 1 1 144 144 SER CB C 144 60.839 60.839 63.756 -2.917 25567 694 1 1 . 1 1 144 144 SER H H 144 7.742 7.742 8.062 -0.320 25567 695 1 1 . 1 1 145 145 GLU N N 145 119.631 119.631 120.256 -0.625 25567 696 1 1 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.226 0.093 25567 697 1 1 . 1 1 145 145 GLU C C 145 171.927 171.927 176.346 -4.419 25567 698 1 1 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.633 -3.549 25567 699 1 1 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.711 -2.937 25567 700 1 1 . 1 1 145 145 GLU H H 145 7.924 7.924 8.096 -0.172 25567 701 1 1 . 1 1 146 146 VAL N N 146 118.791 118.791 122.065 -3.274 25567 702 1 1 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.670 -0.714 25567 703 1 1 . 1 1 146 146 VAL C C 146 174.582 174.582 176.755 -2.173 25567 704 1 1 . 1 1 146 146 VAL CA C 146 64.078 64.078 65.224 -1.146 25567 705 1 1 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.484 -2.344 25567 706 1 1 . 1 1 146 146 VAL H H 146 6.393 6.393 7.746 -1.353 25567 707 1 1 . 1 1 147 147 ASP N N 147 119.410 119.410 117.464 1.946 25567 708 1 1 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.406 -0.336 25567 709 1 1 . 1 1 147 147 ASP C C 147 174.774 174.774 176.927 -2.153 25567 710 1 1 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.159 -1.837 25567 711 1 1 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.602 -3.398 25567 712 1 1 . 1 1 147 147 ASP H H 147 8.393 8.393 8.596 -0.203 25567 713 1 1 . 1 1 148 148 LYS N N 148 119.422 119.422 117.002 2.420 25567 714 1 1 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.461 -0.510 25567 715 1 1 . 1 1 148 148 LYS C C 148 176.410 176.410 178.452 -2.042 25567 716 1 1 . 1 1 148 148 LYS CA C 148 55.736 55.736 56.989 -1.253 25567 717 1 1 . 1 1 148 148 LYS CB C 148 29.576 29.576 33.763 -4.187 25567 718 1 1 . 1 1 148 148 LYS H H 148 7.078 7.078 7.388 -0.309 25567 719 1 1 . 1 1 149 149 TRP N N 149 118.168 118.168 123.074 -4.906 25567 720 1 1 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.866 -0.265 25567 721 1 1 . 1 1 149 149 TRP C C 149 174.199 174.199 176.362 -2.163 25567 722 1 1 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.978 -2.183 25567 723 1 1 . 1 1 149 149 TRP CB C 149 27.011 27.011 26.704 0.307 25567 724 1 1 . 1 1 149 149 TRP H H 149 7.914 7.914 7.766 0.148 25567 725 1 1 . 1 1 150 150 SER N N 150 109.636 109.636 112.514 -2.878 25567 726 1 1 . 1 1 150 150 SER HA H 150 4.242 4.242 4.553 -0.311 25567 727 1 1 . 1 1 150 150 SER C C 150 170.173 170.173 172.897 -2.724 25567 728 1 1 . 1 1 150 150 SER CA C 150 56.912 56.912 58.910 -1.998 25567 729 1 1 . 1 1 150 150 SER CB C 150 62.087 62.087 64.184 -2.097 25567 730 1 1 . 1 1 150 150 SER H H 150 7.814 7.814 8.528 -0.714 25567 731 1 2 . 1 1 2 2 MET HA H 2 4.416 4.416 5.394 -0.978 25567 732 1 2 . 1 1 2 2 MET CA C 2 52.847 52.847 53.594 -0.748 25567 733 1 2 . 1 1 2 2 MET CB C 2 30.672 30.672 34.946 -4.274 25567 734 1 2 . 1 1 3 3 ALA N N 3 125.563 125.563 128.238 -2.675 25567 735 1 2 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.653 -0.281 25567 736 1 2 . 1 1 3 3 ALA C C 3 174.728 174.728 176.070 -1.342 25567 737 1 2 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.305 -2.957 25567 738 1 2 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.055 -3.120 25567 739 1 2 . 1 1 3 3 ALA H H 3 8.342 8.342 8.480 -0.138 25567 740 1 2 . 1 1 4 4 LYS N N 4 121.767 121.767 123.590 -1.823 25567 741 1 2 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.392 -0.162 25567 742 1 2 . 1 1 4 4 LYS C C 4 174.577 174.577 175.804 -1.227 25567 743 1 2 . 1 1 4 4 LYS CA C 4 53.989 53.989 56.366 -2.377 25567 744 1 2 . 1 1 4 4 LYS CB C 4 31.555 31.555 33.022 -1.467 25567 745 1 2 . 1 1 4 4 LYS H H 4 8.500 8.500 8.166 0.334 25567 746 1 2 . 1 1 5 5 LYS N N 5 129.654 129.654 123.030 6.624 25567 747 1 2 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.710 -0.184 25567 748 1 2 . 1 1 5 5 LYS C C 5 174.731 174.731 175.970 -1.239 25567 749 1 2 . 1 1 5 5 LYS CA C 5 54.746 54.746 54.947 -0.201 25567 750 1 2 . 1 1 5 5 LYS CB C 5 29.894 29.894 35.260 -5.366 25567 751 1 2 . 1 1 5 5 LYS H H 5 10.035 10.035 8.476 1.559 25567 752 1 2 . 1 1 6 6 THR N N 6 126.212 126.212 115.491 10.721 25567 753 1 2 . 1 1 6 6 THR HA H 6 5.654 5.654 5.377 0.277 25567 754 1 2 . 1 1 6 6 THR C C 6 169.897 169.897 172.972 -3.075 25567 755 1 2 . 1 1 6 6 THR CA C 6 60.647 60.647 61.672 -1.025 25567 756 1 2 . 1 1 6 6 THR CB C 6 68.152 68.152 72.255 -4.103 25567 757 1 2 . 1 1 6 6 THR H H 6 8.557 8.557 8.883 -0.326 25567 758 1 2 . 1 1 7 7 LEU N N 7 130.776 130.776 125.485 5.291 25567 759 1 2 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.957 -0.338 25567 760 1 2 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.387 -3.291 25567 761 1 2 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.177 -5.134 25567 762 1 2 . 1 1 7 7 LEU H H 7 8.610 8.610 8.435 0.175 25567 763 1 2 . 1 1 8 8 ILE N N 8 127.175 127.175 125.150 2.025 25567 764 1 2 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.684 0.172 25567 765 1 2 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.481 -3.089 25567 766 1 2 . 1 1 8 8 ILE CB C 8 36.864 36.864 38.785 -1.921 25567 767 1 2 . 1 1 8 8 ILE H H 8 9.263 9.263 8.842 0.421 25567 768 1 2 . 1 1 9 9 LEU N N 9 127.117 127.117 128.176 -1.059 25567 769 1 2 . 1 1 9 9 LEU HA H 9 5.696 5.696 4.764 0.932 25567 770 1 2 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.944 -3.992 25567 771 1 2 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.109 0.718 25567 772 1 2 . 1 1 9 9 LEU H H 9 9.262 9.262 8.065 1.197 25567 773 1 2 . 1 1 10 10 TYR N N 10 113.544 113.544 117.899 -4.355 25567 774 1 2 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.098 0.433 25567 775 1 2 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.123 -2.294 25567 776 1 2 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.637 -2.022 25567 777 1 2 . 1 1 10 10 TYR H H 10 7.425 7.425 7.858 -0.433 25567 778 1 2 . 1 1 11 11 TYR N N 11 121.235 121.235 123.583 -2.348 25567 779 1 2 . 1 1 11 11 TYR HA H 11 4.810 4.810 5.038 -0.228 25567 780 1 2 . 1 1 11 11 TYR CA C 11 53.889 53.889 58.549 -4.660 25567 781 1 2 . 1 1 11 11 TYR CB C 11 40.467 40.467 36.414 4.053 25567 782 1 2 . 1 1 11 11 TYR H H 11 7.781 7.781 9.195 -1.414 25567 783 1 2 . 1 1 14 14 SER CA C 14 54.675 54.675 58.037 -3.362 25567 784 1 2 . 1 1 14 14 SER CB C 14 61.621 61.621 64.651 -3.030 25567 785 1 2 . 1 1 15 15 GLY N N 15 110.420 110.420 110.308 0.112 25567 786 1 2 . 1 1 15 15 GLY CA C 15 43.727 43.727 44.256 -0.529 25567 787 1 2 . 1 1 15 15 GLY H H 15 7.757 7.757 7.601 0.156 25567 788 1 2 . 1 1 17 17 THR HA H 17 4.122 4.122 4.136 -0.014 25567 789 1 2 . 1 1 17 17 THR CA C 17 64.748 64.748 64.185 0.563 25567 790 1 2 . 1 1 17 17 THR CB C 17 64.532 64.532 68.932 -4.400 25567 791 1 2 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.539 -0.621 25567 792 1 2 . 1 1 18 18 LYS C C 18 173.812 173.812 178.158 -4.346 25567 793 1 2 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.801 -2.798 25567 794 1 2 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.255 -2.487 25567 795 1 2 . 1 1 19 19 LYS N N 19 116.699 116.699 117.159 -0.460 25567 796 1 2 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.018 -0.070 25567 797 1 2 . 1 1 19 19 LYS C C 19 177.221 177.221 178.916 -1.695 25567 798 1 2 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.796 -2.375 25567 799 1 2 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.830 -2.196 25567 800 1 2 . 1 1 19 19 LYS H H 19 7.476 7.476 8.175 -0.699 25567 801 1 2 . 1 1 20 20 MET N N 20 118.946 118.946 117.702 1.244 25567 802 1 2 . 1 1 20 20 MET HA H 20 4.474 4.474 4.507 -0.033 25567 803 1 2 . 1 1 20 20 MET C C 20 173.826 173.826 175.275 -1.449 25567 804 1 2 . 1 1 20 20 MET CA C 20 52.285 52.285 53.752 -1.467 25567 805 1 2 . 1 1 20 20 MET CB C 20 26.921 26.921 30.688 -3.767 25567 806 1 2 . 1 1 20 20 MET H H 20 7.457 7.457 7.965 -0.508 25567 807 1 2 . 1 1 21 21 ALA N N 21 123.375 123.375 120.949 2.426 25567 808 1 2 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.570 -1.018 25567 809 1 2 . 1 1 21 21 ALA C C 21 176.542 176.542 178.953 -2.411 25567 810 1 2 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.233 -0.582 25567 811 1 2 . 1 1 21 21 ALA CB C 21 16.282 16.282 19.738 -3.456 25567 812 1 2 . 1 1 21 21 ALA H H 21 8.549 8.549 7.511 1.038 25567 813 1 2 . 1 1 22 22 GLU N N 22 116.906 116.906 119.792 -2.886 25567 814 1 2 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.949 -0.276 25567 815 1 2 . 1 1 22 22 GLU C C 22 176.658 176.658 178.999 -2.341 25567 816 1 2 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.440 -2.835 25567 817 1 2 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.542 -2.893 25567 818 1 2 . 1 1 22 22 GLU H H 22 8.085 8.085 7.907 0.178 25567 819 1 2 . 1 1 23 23 LYS N N 23 123.301 123.301 119.481 3.820 25567 820 1 2 . 1 1 23 23 LYS HA H 23 3.820 3.820 3.999 -0.179 25567 821 1 2 . 1 1 23 23 LYS C C 23 177.363 177.363 179.157 -1.794 25567 822 1 2 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.275 -2.304 25567 823 1 2 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.065 -2.534 25567 824 1 2 . 1 1 23 23 LYS H H 23 7.703 7.703 7.628 0.075 25567 825 1 2 . 1 1 24 24 ILE N N 24 121.894 121.894 118.206 3.688 25567 826 1 2 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.851 -0.555 25567 827 1 2 . 1 1 24 24 ILE C C 24 174.944 174.944 178.444 -3.500 25567 828 1 2 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.320 -1.087 25567 829 1 2 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.503 -2.759 25567 830 1 2 . 1 1 24 24 ILE H H 24 8.458 8.458 7.885 0.573 25567 831 1 2 . 1 1 25 25 ASN N N 25 118.580 118.580 118.646 -0.066 25567 832 1 2 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.369 -0.135 25567 833 1 2 . 1 1 25 25 ASN C C 25 173.567 173.567 177.210 -3.643 25567 834 1 2 . 1 1 25 25 ASN CA C 25 52.324 52.324 55.916 -3.592 25567 835 1 2 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.646 -0.463 25567 836 1 2 . 1 1 25 25 ASN H H 25 8.273 8.273 8.085 0.188 25567 837 1 2 . 1 1 26 26 SER N N 26 112.132 112.132 112.566 -0.434 25567 838 1 2 . 1 1 26 26 SER HA H 26 4.148 4.148 4.416 -0.268 25567 839 1 2 . 1 1 26 26 SER C C 26 172.083 172.083 174.953 -2.870 25567 840 1 2 . 1 1 26 26 SER CA C 26 57.865 57.865 59.826 -1.961 25567 841 1 2 . 1 1 26 26 SER CB C 26 60.816 60.816 62.764 -1.948 25567 842 1 2 . 1 1 26 26 SER H H 26 7.444 7.444 7.895 -0.451 25567 843 1 2 . 1 1 27 27 GLU N N 27 120.080 120.080 118.776 1.304 25567 844 1 2 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.458 -0.358 25567 845 1 2 . 1 1 27 27 GLU C C 27 173.647 173.647 175.563 -1.916 25567 846 1 2 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.315 -2.113 25567 847 1 2 . 1 1 27 27 GLU CB C 27 26.884 26.884 31.810 -4.926 25567 848 1 2 . 1 1 27 27 GLU H H 27 7.453 7.453 7.781 -0.328 25567 849 1 2 . 1 1 28 28 ILE N N 28 118.759 118.759 119.657 -0.898 25567 850 1 2 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.454 -0.250 25567 851 1 2 . 1 1 28 28 ILE C C 28 172.474 172.474 175.209 -2.735 25567 852 1 2 . 1 1 28 28 ILE CA C 28 57.747 57.747 59.893 -2.146 25567 853 1 2 . 1 1 28 28 ILE CB C 28 35.798 35.798 41.476 -5.678 25567 854 1 2 . 1 1 28 28 ILE H H 28 7.258 7.258 7.385 -0.127 25567 855 1 2 . 1 1 29 29 LYS N N 29 130.618 130.618 127.772 2.846 25567 856 1 2 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.214 -0.209 25567 857 1 2 . 1 1 29 29 LYS C C 29 174.375 174.375 176.250 -1.875 25567 858 1 2 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.183 -1.524 25567 859 1 2 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.906 -3.346 25567 860 1 2 . 1 1 29 29 LYS H H 29 8.588 8.588 8.435 0.153 25567 861 1 2 . 1 1 30 30 ASP N N 30 119.366 119.366 121.305 -1.939 25567 862 1 2 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.375 0.027 25567 863 1 2 . 1 1 30 30 ASP C C 30 172.580 172.580 175.268 -2.688 25567 864 1 2 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.164 -1.540 25567 865 1 2 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.329 -3.501 25567 866 1 2 . 1 1 30 30 ASP H H 30 8.940 8.940 8.933 0.007 25567 867 1 2 . 1 1 31 31 SER N N 31 114.035 114.035 113.256 0.779 25567 868 1 2 . 1 1 31 31 SER HA H 31 4.781 4.781 4.836 -0.055 25567 869 1 2 . 1 1 31 31 SER C C 31 171.136 171.136 174.718 -3.582 25567 870 1 2 . 1 1 31 31 SER CA C 31 55.638 55.638 58.429 -2.792 25567 871 1 2 . 1 1 31 31 SER CB C 31 62.388 62.388 64.780 -2.392 25567 872 1 2 . 1 1 31 31 SER H H 31 8.030 8.030 7.746 0.284 25567 873 1 2 . 1 1 32 32 GLU N N 32 121.406 121.406 121.230 0.176 25567 874 1 2 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.685 0.050 25567 875 1 2 . 1 1 32 32 GLU C C 32 171.205 171.205 174.279 -3.074 25567 876 1 2 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.362 -3.293 25567 877 1 2 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.624 -2.734 25567 878 1 2 . 1 1 32 32 GLU H H 32 8.188 8.188 8.386 -0.198 25567 879 1 2 . 1 1 33 33 LEU N N 33 126.143 126.143 122.022 4.121 25567 880 1 2 . 1 1 33 33 LEU HA H 33 5.285 5.285 4.966 0.319 25567 881 1 2 . 1 1 33 33 LEU C C 33 173.401 173.401 176.064 -2.663 25567 882 1 2 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.905 -2.571 25567 883 1 2 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.301 -0.678 25567 884 1 2 . 1 1 33 33 LEU H H 33 8.627 8.627 8.569 0.058 25567 885 1 2 . 1 1 34 34 LYS N N 34 127.122 127.122 125.196 1.926 25567 886 1 2 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.524 0.075 25567 887 1 2 . 1 1 34 34 LYS C C 34 169.644 169.644 174.006 -4.362 25567 888 1 2 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.366 -2.013 25567 889 1 2 . 1 1 34 34 LYS CB C 34 34.172 34.172 36.282 -2.111 25567 890 1 2 . 1 1 34 34 LYS H H 34 9.399 9.399 8.037 1.362 25567 891 1 2 . 1 1 35 35 GLU N N 35 122.766 122.766 123.103 -0.337 25567 892 1 2 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.248 -0.890 25567 893 1 2 . 1 1 35 35 GLU C C 35 172.875 172.875 175.933 -3.058 25567 894 1 2 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.700 -3.060 25567 895 1 2 . 1 1 35 35 GLU CB C 35 29.268 29.268 30.604 -1.336 25567 896 1 2 . 1 1 35 35 GLU H H 35 8.166 8.166 8.489 -0.323 25567 897 1 2 . 1 1 36 36 VAL N N 36 126.674 126.674 125.367 1.307 25567 898 1 2 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.112 -0.251 25567 899 1 2 . 1 1 36 36 VAL C C 36 171.451 171.451 175.869 -4.418 25567 900 1 2 . 1 1 36 36 VAL CA C 36 59.537 59.537 62.215 -2.679 25567 901 1 2 . 1 1 36 36 VAL CB C 36 29.689 29.689 32.195 -2.506 25567 902 1 2 . 1 1 36 36 VAL H H 36 8.632 8.632 8.563 0.069 25567 903 1 2 . 1 1 37 37 LYS N N 37 126.181 126.181 124.710 1.471 25567 904 1 2 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.831 0.108 25567 905 1 2 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.487 -2.308 25567 906 1 2 . 1 1 37 37 LYS CB C 37 32.898 32.898 36.834 -3.936 25567 907 1 2 . 1 1 37 37 LYS H H 37 7.867 7.867 8.700 -0.833 25567 908 1 2 . 1 1 38 38 VAL N N 38 113.540 113.540 115.746 -2.206 25567 909 1 2 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.602 0.084 25567 910 1 2 . 1 1 38 38 VAL C C 38 173.633 173.633 175.404 -1.771 25567 911 1 2 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.727 -2.443 25567 912 1 2 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.936 -1.972 25567 913 1 2 . 1 1 38 38 VAL H H 38 8.389 8.389 8.455 -0.066 25567 914 1 2 . 1 1 39 39 SER N N 39 118.860 118.860 120.634 -1.774 25567 915 1 2 . 1 1 39 39 SER HA H 39 4.194 4.194 4.401 -0.207 25567 916 1 2 . 1 1 39 39 SER C C 39 173.059 173.059 173.521 -0.462 25567 917 1 2 . 1 1 39 39 SER CA C 39 56.227 56.227 59.637 -3.410 25567 918 1 2 . 1 1 39 39 SER CB C 39 60.771 60.771 63.721 -2.950 25567 919 1 2 . 1 1 39 39 SER H H 39 8.668 8.668 8.443 0.225 25567 920 1 2 . 1 1 40 40 GLU N N 40 125.769 125.769 120.644 5.125 25567 921 1 2 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.642 -0.485 25567 922 1 2 . 1 1 40 40 GLU C C 40 174.484 174.484 175.249 -0.765 25567 923 1 2 . 1 1 40 40 GLU CA C 40 55.550 55.550 55.856 -0.306 25567 924 1 2 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.938 -3.884 25567 925 1 2 . 1 1 40 40 GLU H H 40 8.878 8.878 8.182 0.696 25567 926 1 2 . 1 1 41 41 GLY N N 41 112.165 112.165 108.566 3.599 25567 927 1 2 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.939 -3.232 25567 928 1 2 . 1 1 41 41 GLY H H 41 8.743 8.743 8.862 -0.119 25567 929 1 2 . 1 1 44 44 ASP N N 44 122.324 122.324 121.382 0.942 25567 930 1 2 . 1 1 44 44 ASP CB C 44 42.156 42.156 42.842 -0.686 25567 931 1 2 . 1 1 44 44 ASP H H 44 7.918 7.918 9.044 -1.126 25567 932 1 2 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.718 -0.656 25567 933 1 2 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.394 -0.984 25567 934 1 2 . 1 1 45 45 ALA CB C 45 16.376 16.376 18.625 -2.249 25567 935 1 2 . 1 1 47 47 MET CA C 47 54.118 54.118 55.542 -1.424 25567 936 1 2 . 1 1 47 47 MET CB C 47 27.527 27.527 31.372 -3.845 25567 937 1 2 . 1 1 48 48 TYR N N 48 120.075 120.075 119.167 0.908 25567 938 1 2 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.323 -0.169 25567 939 1 2 . 1 1 48 48 TYR C C 48 172.217 172.217 175.177 -2.960 25567 940 1 2 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.105 -1.728 25567 941 1 2 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.844 -3.348 25567 942 1 2 . 1 1 48 48 TYR H H 48 7.810 7.810 8.037 -0.227 25567 943 1 2 . 1 1 49 49 LYS N N 49 118.369 118.369 121.690 -3.321 25567 944 1 2 . 1 1 49 49 LYS H H 49 8.116 8.116 8.705 -0.589 25567 945 1 2 . 1 1 50 50 THR N N 50 116.979 116.979 115.383 1.596 25567 946 1 2 . 1 1 50 50 THR CB C 50 66.373 66.373 69.658 -3.285 25567 947 1 2 . 1 1 50 50 THR H H 50 7.741 7.741 8.146 -0.405 25567 948 1 2 . 1 1 51 51 SER N N 51 116.155 116.155 117.510 -1.355 25567 949 1 2 . 1 1 51 51 SER HA H 51 3.771 3.771 4.346 -0.575 25567 950 1 2 . 1 1 51 51 SER C C 51 170.563 170.563 174.368 -3.805 25567 951 1 2 . 1 1 51 51 SER CA C 51 54.840 54.840 59.632 -4.792 25567 952 1 2 . 1 1 51 51 SER CB C 51 60.318 60.318 62.946 -2.628 25567 953 1 2 . 1 1 51 51 SER H H 51 7.853 7.853 8.561 -0.708 25567 954 1 2 . 1 1 54 54 ALA N N 54 123.234 123.234 128.805 -5.571 25567 955 1 2 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.331 -0.083 25567 956 1 2 . 1 1 54 54 ALA CA C 54 51.268 51.268 53.844 -2.576 25567 957 1 2 . 1 1 54 54 ALA CB C 54 16.434 16.434 19.233 -2.800 25567 958 1 2 . 1 1 54 54 ALA H H 54 8.207 8.207 8.421 -0.214 25567 959 1 2 . 1 1 55 55 LEU N N 55 118.603 118.603 119.159 -0.556 25567 960 1 2 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.390 -0.450 25567 961 1 2 . 1 1 55 55 LEU CA C 55 54.711 54.711 54.436 0.275 25567 962 1 2 . 1 1 55 55 LEU CB C 55 38.913 38.913 39.133 -0.220 25567 963 1 2 . 1 1 55 55 LEU H H 55 7.960 7.960 8.200 -0.240 25567 964 1 2 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.133 -0.457 25567 965 1 2 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.444 0.050 25567 966 1 2 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.998 -3.944 25567 967 1 2 . 1 1 59 59 GLN N N 59 117.579 117.579 119.615 -2.036 25567 968 1 2 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.466 -0.333 25567 969 1 2 . 1 1 59 59 GLN CA C 59 54.009 54.009 55.174 -1.165 25567 970 1 2 . 1 1 59 59 GLN CB C 59 26.651 26.651 30.076 -3.425 25567 971 1 2 . 1 1 59 59 GLN H H 59 8.268 8.268 7.905 0.363 25567 972 1 2 . 1 1 60 60 GLY N N 60 107.308 107.308 111.629 -4.321 25567 973 1 2 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.438 -2.459 25567 974 1 2 . 1 1 60 60 GLY H H 60 7.780 7.780 8.661 -0.881 25567 975 1 2 . 1 1 61 61 ASN N N 61 117.747 117.747 118.199 -0.452 25567 976 1 2 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.990 -0.456 25567 977 1 2 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.288 -1.054 25567 978 1 2 . 1 1 61 61 ASN CB C 61 36.424 36.424 40.252 -3.829 25567 979 1 2 . 1 1 61 61 ASN H H 61 8.108 8.108 7.965 0.143 25567 980 1 2 . 1 1 64 64 PHE N N 64 120.102 120.102 121.031 -0.929 25567 981 1 2 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.482 -0.103 25567 982 1 2 . 1 1 64 64 PHE CA C 64 51.748 51.748 56.190 -4.442 25567 983 1 2 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.538 -3.263 25567 984 1 2 . 1 1 64 64 PHE H H 64 8.300 8.300 7.473 0.827 25567 985 1 2 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.678 -0.343 25567 986 1 2 . 1 1 65 65 PRO C C 65 173.870 173.870 176.269 -2.399 25567 987 1 2 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.652 -2.635 25567 988 1 2 . 1 1 65 65 PRO CB C 65 29.635 29.635 33.040 -3.405 25567 989 1 2 . 1 1 66 66 GLU N N 66 121.258 121.258 118.518 2.740 25567 990 1 2 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.717 -0.483 25567 991 1 2 . 1 1 66 66 GLU C C 66 173.981 173.981 176.718 -2.737 25567 992 1 2 . 1 1 66 66 GLU CA C 66 53.787 53.787 55.882 -2.095 25567 993 1 2 . 1 1 66 66 GLU CB C 66 27.775 27.775 31.169 -3.394 25567 994 1 2 . 1 1 66 66 GLU H H 66 8.316 8.316 8.484 -0.168 25567 995 1 2 . 1 1 67 67 ILE N N 67 114.290 114.290 114.743 -0.453 25567 996 1 2 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.536 0.593 25567 997 1 2 . 1 1 67 67 ILE C C 67 172.700 172.700 174.806 -2.106 25567 998 1 2 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.423 -2.984 25567 999 1 2 . 1 1 67 67 ILE CB C 67 39.159 39.159 41.845 -2.686 25567 1000 1 2 . 1 1 67 67 ILE H H 67 8.366 8.366 8.273 0.093 25567 1001 1 2 . 1 1 68 68 GLN N N 68 121.422 121.422 119.832 1.590 25567 1002 1 2 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.742 -0.241 25567 1003 1 2 . 1 1 68 68 GLN C C 68 171.675 171.675 173.759 -2.084 25567 1004 1 2 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.822 -2.549 25567 1005 1 2 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.104 -5.961 25567 1006 1 2 . 1 1 68 68 GLN H H 68 8.737 8.737 8.667 0.070 25567 1007 1 2 . 1 1 69 69 LEU N N 69 125.311 125.311 117.579 7.732 25567 1008 1 2 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.832 -0.326 25567 1009 1 2 . 1 1 69 69 LEU C C 69 172.634 172.634 175.134 -2.500 25567 1010 1 2 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.627 -1.868 25567 1011 1 2 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.616 -1.212 25567 1012 1 2 . 1 1 69 69 LEU H H 69 8.051 8.051 8.329 -0.278 25567 1013 1 2 . 1 1 70 70 ASP N N 70 122.763 122.763 119.027 3.736 25567 1014 1 2 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.710 -0.287 25567 1015 1 2 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.967 -2.357 25567 1016 1 2 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.825 -4.108 25567 1017 1 2 . 1 1 70 70 ASP H H 70 8.313 8.313 8.378 -0.065 25567 1018 1 2 . 1 1 71 71 ASN N N 71 117.413 117.413 118.266 -0.853 25567 1019 1 2 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.629 -0.292 25567 1020 1 2 . 1 1 71 71 ASN C C 71 171.770 171.770 174.314 -2.544 25567 1021 1 2 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.102 -1.611 25567 1022 1 2 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.527 -2.201 25567 1023 1 2 . 1 1 71 71 ASN H H 71 8.407 8.407 8.584 -0.177 25567 1024 1 2 . 1 1 72 72 ILE N N 72 123.752 123.752 121.031 2.721 25567 1025 1 2 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.160 -0.220 25567 1026 1 2 . 1 1 72 72 ILE C C 72 171.621 171.621 174.942 -3.321 25567 1027 1 2 . 1 1 72 72 ILE CA C 72 57.332 57.332 61.159 -3.827 25567 1028 1 2 . 1 1 72 72 ILE CB C 72 38.489 38.489 38.899 -0.410 25567 1029 1 2 . 1 1 72 72 ILE H H 72 7.639 7.639 7.654 -0.015 25567 1030 1 2 . 1 1 73 73 ASP N N 73 125.252 125.252 126.874 -1.622 25567 1031 1 2 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.680 -0.055 25567 1032 1 2 . 1 1 73 73 ASP C C 73 174.034 174.034 176.675 -2.641 25567 1033 1 2 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.037 -2.834 25567 1034 1 2 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.761 -4.737 25567 1035 1 2 . 1 1 73 73 ASP H H 73 8.394 8.394 8.644 -0.250 25567 1036 1 2 . 1 1 74 74 TYR N N 74 123.108 123.108 124.575 -1.467 25567 1037 1 2 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.422 -0.544 25567 1038 1 2 . 1 1 74 74 TYR C C 74 173.637 173.637 177.846 -4.209 25567 1039 1 2 . 1 1 74 74 TYR CA C 74 59.474 59.474 59.956 -0.482 25567 1040 1 2 . 1 1 74 74 TYR CB C 74 34.722 34.722 37.953 -3.231 25567 1041 1 2 . 1 1 74 74 TYR H H 74 7.392 7.392 8.460 -1.068 25567 1042 1 2 . 1 1 75 75 ASN N N 75 109.422 109.422 116.748 -7.326 25567 1043 1 2 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.634 0.292 25567 1044 1 2 . 1 1 75 75 ASN C C 75 172.574 172.574 176.119 -3.545 25567 1045 1 2 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.522 -2.761 25567 1046 1 2 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.312 -2.695 25567 1047 1 2 . 1 1 75 75 ASN H H 75 8.058 8.058 8.449 -0.391 25567 1048 1 2 . 1 1 76 76 ASN N N 76 117.422 117.422 116.877 0.545 25567 1049 1 2 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.669 -0.214 25567 1050 1 2 . 1 1 76 76 ASN C C 76 171.132 171.132 173.813 -2.681 25567 1051 1 2 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.514 -2.347 25567 1052 1 2 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.553 -2.825 25567 1053 1 2 . 1 1 76 76 ASN H H 76 7.768 7.768 7.874 -0.106 25567 1054 1 2 . 1 1 77 77 TYR N N 77 116.873 116.873 116.210 0.663 25567 1055 1 2 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.627 -0.264 25567 1056 1 2 . 1 1 77 77 TYR C C 77 172.175 172.175 173.857 -1.682 25567 1057 1 2 . 1 1 77 77 TYR CA C 77 55.364 55.364 58.047 -2.683 25567 1058 1 2 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.638 -4.473 25567 1059 1 2 . 1 1 77 77 TYR H H 77 7.825 7.825 7.581 0.244 25567 1060 1 2 . 1 1 78 78 ASP N N 78 121.271 121.271 119.041 2.230 25567 1061 1 2 . 1 1 78 78 ASP HA H 78 4.805 4.805 5.176 -0.371 25567 1062 1 2 . 1 1 78 78 ASP C C 78 172.641 172.641 175.483 -2.842 25567 1063 1 2 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.213 0.042 25567 1064 1 2 . 1 1 78 78 ASP CB C 78 41.075 41.075 43.998 -2.923 25567 1065 1 2 . 1 1 78 78 ASP H H 78 9.058 9.058 8.492 0.566 25567 1066 1 2 . 1 1 79 79 LEU N N 79 122.985 122.985 119.998 2.987 25567 1067 1 2 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.203 -0.089 25567 1068 1 2 . 1 1 79 79 LEU C C 79 170.721 170.721 174.431 -3.710 25567 1069 1 2 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.291 -2.975 25567 1070 1 2 . 1 1 79 79 LEU CB C 79 42.342 42.342 46.050 -3.708 25567 1071 1 2 . 1 1 79 79 LEU H H 79 7.893 7.893 8.042 -0.149 25567 1072 1 2 . 1 1 80 80 ILE N N 80 126.364 126.364 123.228 3.136 25567 1073 1 2 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.841 0.248 25567 1074 1 2 . 1 1 80 80 ILE C C 80 171.580 171.580 173.982 -2.402 25567 1075 1 2 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.150 -2.733 25567 1076 1 2 . 1 1 80 80 ILE CB C 80 38.136 38.136 41.634 -3.498 25567 1077 1 2 . 1 1 80 80 ILE H H 80 8.717 8.717 9.124 -0.407 25567 1078 1 2 . 1 1 81 81 LEU N N 81 126.199 126.199 126.708 -0.509 25567 1079 1 2 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.396 -0.261 25567 1080 1 2 . 1 1 81 81 LEU C C 81 172.979 172.979 176.017 -3.038 25567 1081 1 2 . 1 1 81 81 LEU CA C 81 49.633 49.633 52.988 -3.355 25567 1082 1 2 . 1 1 81 81 LEU CB C 81 42.159 42.159 44.707 -2.548 25567 1083 1 2 . 1 1 81 81 LEU H H 81 9.230 9.230 8.973 0.257 25567 1084 1 2 . 1 1 82 82 ILE N N 82 120.505 120.505 118.387 2.118 25567 1085 1 2 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.121 -0.205 25567 1086 1 2 . 1 1 82 82 ILE C C 82 173.011 173.011 174.461 -1.450 25567 1087 1 2 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.639 -2.811 25567 1088 1 2 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.325 -4.257 25567 1089 1 2 . 1 1 82 82 ILE H H 82 8.796 8.796 8.115 0.681 25567 1090 1 2 . 1 1 83 83 GLY N N 83 120.857 120.857 109.857 11.000 25567 1091 1 2 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.451 -2.648 25567 1092 1 2 . 1 1 83 83 GLY H H 83 9.525 9.525 8.017 1.508 25567 1093 1 2 . 1 1 84 84 SER N N 84 116.007 116.007 114.496 1.511 25567 1094 1 2 . 1 1 84 84 SER HA H 84 5.476 5.476 4.859 0.617 25567 1095 1 2 . 1 1 84 84 SER CA C 84 51.937 51.937 56.016 -4.079 25567 1096 1 2 . 1 1 84 84 SER CB C 84 64.533 64.533 65.397 -0.864 25567 1097 1 2 . 1 1 84 84 SER H H 84 7.617 7.617 7.709 -0.092 25567 1098 1 2 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.542 0.659 25567 1099 1 2 . 1 1 85 85 PRO C C 85 173.574 173.574 175.370 -1.796 25567 1100 1 2 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.416 -2.928 25567 1101 1 2 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.473 -1.333 25567 1102 1 2 . 1 1 86 86 VAL N N 86 117.603 117.603 116.643 0.960 25567 1103 1 2 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.306 0.067 25567 1104 1 2 . 1 1 86 86 VAL C C 86 172.777 172.777 173.960 -1.183 25567 1105 1 2 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.349 -1.746 25567 1106 1 2 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.614 -5.041 25567 1107 1 2 . 1 1 86 86 VAL H H 86 8.194 8.194 8.162 0.032 25567 1108 1 2 . 1 1 87 87 TRP N N 87 131.187 131.187 125.628 5.559 25567 1109 1 2 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.788 0.410 25567 1110 1 2 . 1 1 87 87 TRP C C 87 173.295 173.295 174.795 -1.500 25567 1111 1 2 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.887 -7.103 25567 1112 1 2 . 1 1 87 87 TRP CB C 87 27.746 27.746 32.234 -4.488 25567 1113 1 2 . 1 1 87 87 TRP H H 87 9.637 9.637 8.458 1.179 25567 1114 1 2 . 1 1 88 88 SER N N 88 119.829 119.829 112.426 7.403 25567 1115 1 2 . 1 1 88 88 SER HA H 88 3.986 3.986 4.798 -0.812 25567 1116 1 2 . 1 1 88 88 SER C C 88 172.375 172.375 175.256 -2.881 25567 1117 1 2 . 1 1 88 88 SER CA C 88 55.932 55.932 56.957 -1.025 25567 1118 1 2 . 1 1 88 88 SER CB C 88 59.178 59.178 63.932 -4.754 25567 1119 1 2 . 1 1 88 88 SER H H 88 9.272 9.272 7.798 1.474 25567 1120 1 2 . 1 1 89 89 GLY N N 89 101.498 101.498 110.793 -9.295 25567 1121 1 2 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.028 -3.357 25567 1122 1 2 . 1 1 89 89 GLY H H 89 7.463 7.463 8.795 -1.332 25567 1123 1 2 . 1 1 90 90 TYR N N 90 121.064 121.064 117.214 3.850 25567 1124 1 2 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.088 -0.872 25567 1125 1 2 . 1 1 90 90 TYR CA C 90 54.090 54.090 53.963 0.127 25567 1126 1 2 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.306 -0.112 25567 1127 1 2 . 1 1 90 90 TYR H H 90 8.064 8.064 7.828 0.236 25567 1128 1 2 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.723 0.209 25567 1129 1 2 . 1 1 91 91 PRO C C 91 171.019 171.019 175.904 -4.885 25567 1130 1 2 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.775 -4.781 25567 1131 1 2 . 1 1 91 91 PRO CB C 91 26.493 26.493 33.127 -6.635 25567 1132 1 2 . 1 1 92 92 ALA N N 92 119.893 119.893 120.955 -1.062 25567 1133 1 2 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.821 -1.370 25567 1134 1 2 . 1 1 92 92 ALA C C 92 176.477 176.477 175.707 0.770 25567 1135 1 2 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.356 -1.789 25567 1136 1 2 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.549 -5.748 25567 1137 1 2 . 1 1 92 92 ALA H H 92 7.278 7.278 8.252 -0.974 25567 1138 1 2 . 1 1 93 93 THR N N 93 112.992 112.992 110.095 2.897 25567 1139 1 2 . 1 1 93 93 THR HA H 93 4.462 4.462 4.666 -0.204 25567 1140 1 2 . 1 1 93 93 THR CA C 93 66.871 66.871 59.698 7.173 25567 1141 1 2 . 1 1 93 93 THR CB C 93 64.362 64.362 68.175 -3.813 25567 1142 1 2 . 1 1 93 93 THR H H 93 6.861 6.861 8.233 -1.372 25567 1143 1 2 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.181 -0.315 25567 1144 1 2 . 1 1 94 94 PRO CA C 94 63.021 63.021 64.165 -1.144 25567 1145 1 2 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.090 -1.811 25567 1146 1 2 . 1 1 95 95 ILE N N 95 111.298 111.298 116.651 -5.353 25567 1147 1 2 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.224 -0.601 25567 1148 1 2 . 1 1 95 95 ILE C C 95 174.264 174.264 174.680 -0.416 25567 1149 1 2 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.018 -1.570 25567 1150 1 2 . 1 1 95 95 ILE CB C 95 31.929 31.929 35.184 -3.255 25567 1151 1 2 . 1 1 95 95 ILE H H 95 7.974 7.974 8.107 -0.133 25567 1152 1 2 . 1 1 96 96 LYS N N 96 123.045 123.045 121.806 1.239 25567 1153 1 2 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.415 -1.303 25567 1154 1 2 . 1 1 96 96 LYS C C 96 174.590 174.590 177.449 -2.859 25567 1155 1 2 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.733 0.412 25567 1156 1 2 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.710 -4.865 25567 1157 1 2 . 1 1 96 96 LYS H H 96 6.958 6.958 7.893 -0.935 25567 1158 1 2 . 1 1 97 97 THR N N 97 113.412 113.412 118.107 -4.695 25567 1159 1 2 . 1 1 97 97 THR HA H 97 3.461 3.461 4.021 -0.560 25567 1160 1 2 . 1 1 97 97 THR C C 97 173.247 173.247 176.702 -3.455 25567 1161 1 2 . 1 1 97 97 THR CA C 97 62.809 62.809 65.957 -3.148 25567 1162 1 2 . 1 1 97 97 THR CB C 97 65.654 65.654 68.521 -2.867 25567 1163 1 2 . 1 1 97 97 THR H H 97 6.366 6.366 7.814 -1.448 25567 1164 1 2 . 1 1 98 98 LEU N N 98 121.201 121.201 121.868 -0.667 25567 1165 1 2 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.185 -0.551 25567 1166 1 2 . 1 1 98 98 LEU C C 98 174.590 174.590 179.255 -4.665 25567 1167 1 2 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.450 -1.829 25567 1168 1 2 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.040 -1.145 25567 1169 1 2 . 1 1 98 98 LEU H H 98 7.554 7.554 7.544 0.010 25567 1170 1 2 . 1 1 99 99 LEU N N 99 118.677 118.677 119.603 -0.926 25567 1171 1 2 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.920 -0.218 25567 1172 1 2 . 1 1 99 99 LEU C C 99 177.457 177.457 179.564 -2.107 25567 1173 1 2 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.824 -2.645 25567 1174 1 2 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.392 -2.404 25567 1175 1 2 . 1 1 99 99 LEU H H 99 8.160 8.160 7.539 0.621 25567 1176 1 2 . 1 1 100 100 ASP N N 100 118.914 118.914 117.331 1.583 25567 1177 1 2 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.595 -0.366 25567 1178 1 2 . 1 1 100 100 ASP C C 100 176.585 176.585 177.545 -0.960 25567 1179 1 2 . 1 1 100 100 ASP CA C 100 54.516 54.516 55.829 -1.313 25567 1180 1 2 . 1 1 100 100 ASP CB C 100 37.579 37.579 40.689 -3.110 25567 1181 1 2 . 1 1 100 100 ASP H H 100 7.872 7.872 7.818 0.054 25567 1182 1 2 . 1 1 101 101 GLN N N 101 118.135 118.135 117.020 1.115 25567 1183 1 2 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.483 -0.323 25567 1184 1 2 . 1 1 101 101 GLN C C 101 174.601 174.601 177.006 -2.405 25567 1185 1 2 . 1 1 101 101 GLN CA C 101 54.960 54.960 56.671 -1.711 25567 1186 1 2 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.768 -4.218 25567 1187 1 2 . 1 1 101 101 GLN H H 101 7.673 7.673 7.887 -0.214 25567 1188 1 2 . 1 1 102 102 MET N N 102 118.420 118.420 117.824 0.596 25567 1189 1 2 . 1 1 102 102 MET HA H 102 3.826 3.826 4.535 -0.709 25567 1190 1 2 . 1 1 102 102 MET C C 102 172.780 172.780 176.837 -4.057 25567 1191 1 2 . 1 1 102 102 MET CA C 102 53.428 53.428 55.762 -2.334 25567 1192 1 2 . 1 1 102 102 MET CB C 102 31.221 31.221 32.357 -1.136 25567 1193 1 2 . 1 1 102 102 MET H H 102 7.462 7.462 7.698 -0.236 25567 1194 1 2 . 1 1 103 103 LYS N N 103 116.066 116.066 120.027 -3.961 25567 1195 1 2 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.035 -0.115 25567 1196 1 2 . 1 1 103 103 LYS C C 103 173.922 173.922 177.158 -3.236 25567 1197 1 2 . 1 1 103 103 LYS CA C 103 56.282 56.282 59.151 -2.869 25567 1198 1 2 . 1 1 103 103 LYS CB C 103 29.491 29.491 32.169 -2.678 25567 1199 1 2 . 1 1 103 103 LYS H H 103 6.875 6.875 8.351 -1.476 25567 1200 1 2 . 1 1 104 104 ASN N N 104 114.987 114.987 117.102 -2.115 25567 1201 1 2 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.934 -0.193 25567 1202 1 2 . 1 1 104 104 ASN C C 104 172.587 172.587 174.113 -1.526 25567 1203 1 2 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.833 -2.364 25567 1204 1 2 . 1 1 104 104 ASN CB C 104 35.822 35.822 38.096 -2.275 25567 1205 1 2 . 1 1 104 104 ASN H H 104 8.517 8.517 8.430 0.087 25567 1206 1 2 . 1 1 105 105 TYR N N 105 122.755 122.755 122.169 0.586 25567 1207 1 2 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.630 -0.055 25567 1208 1 2 . 1 1 105 105 TYR C C 105 174.260 174.260 174.333 -0.073 25567 1209 1 2 . 1 1 105 105 TYR CA C 105 55.493 55.493 58.239 -2.747 25567 1210 1 2 . 1 1 105 105 TYR CB C 105 36.064 36.064 40.370 -4.306 25567 1211 1 2 . 1 1 105 105 TYR H H 105 8.287 8.287 7.765 0.522 25567 1212 1 2 . 1 1 106 106 ARG N N 106 128.905 128.905 122.321 6.584 25567 1213 1 2 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.279 -0.006 25567 1214 1 2 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.202 -2.181 25567 1215 1 2 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.592 -5.462 25567 1216 1 2 . 1 1 106 106 ARG H H 106 8.841 8.841 8.041 0.800 25567 1217 1 2 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.644 -2.147 25567 1218 1 2 . 1 1 108 108 GLU N N 108 116.989 116.989 122.603 -5.614 25567 1219 1 2 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.730 -0.099 25567 1220 1 2 . 1 1 108 108 GLU CA C 108 53.676 53.676 56.008 -2.332 25567 1221 1 2 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.561 -3.159 25567 1222 1 2 . 1 1 108 108 GLU H H 108 7.536 7.536 8.487 -0.951 25567 1223 1 2 . 1 1 109 109 VAL N N 109 123.416 123.416 123.987 -0.571 25567 1224 1 2 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.046 0.275 25567 1225 1 2 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.486 -3.043 25567 1226 1 2 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.892 -1.231 25567 1227 1 2 . 1 1 109 109 VAL H H 109 8.955 8.955 8.274 0.681 25567 1228 1 2 . 1 1 110 110 ALA N N 110 127.975 127.975 128.820 -0.845 25567 1229 1 2 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.008 -0.331 25567 1230 1 2 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.675 -2.235 25567 1231 1 2 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.218 -3.803 25567 1232 1 2 . 1 1 110 110 ALA H H 110 8.860 8.860 8.951 -0.091 25567 1233 1 2 . 1 1 111 111 SER N N 111 110.482 110.482 115.299 -4.817 25567 1234 1 2 . 1 1 111 111 SER HA H 111 5.502 5.502 5.123 0.379 25567 1235 1 2 . 1 1 111 111 SER CA C 111 51.630 51.630 57.528 -5.898 25567 1236 1 2 . 1 1 111 111 SER CB C 111 62.267 62.267 63.552 -1.285 25567 1237 1 2 . 1 1 111 111 SER H H 111 7.484 7.484 8.030 -0.546 25567 1238 1 2 . 1 1 112 112 PHE N N 112 125.082 125.082 123.689 1.393 25567 1239 1 2 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.605 0.843 25567 1240 1 2 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.317 -4.883 25567 1241 1 2 . 1 1 112 112 PHE CB C 112 40.500 40.500 39.841 0.659 25567 1242 1 2 . 1 1 112 112 PHE H H 112 8.025 8.025 8.345 -0.320 25567 1243 1 2 . 1 1 113 113 PHE N N 113 115.872 115.872 115.454 0.418 25567 1244 1 2 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.078 0.846 25567 1245 1 2 . 1 1 113 113 PHE C C 113 173.293 173.293 176.205 -2.912 25567 1246 1 2 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.214 -4.746 25567 1247 1 2 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.483 -3.090 25567 1248 1 2 . 1 1 113 113 PHE H H 113 7.391 7.391 7.624 -0.233 25567 1249 1 2 . 1 1 114 114 THR N N 114 108.721 108.721 112.497 -3.776 25567 1250 1 2 . 1 1 114 114 THR HA H 114 4.933 4.933 4.451 0.482 25567 1251 1 2 . 1 1 114 114 THR C C 114 171.891 171.891 175.009 -3.118 25567 1252 1 2 . 1 1 114 114 THR CA C 114 56.815 56.815 63.150 -6.335 25567 1253 1 2 . 1 1 114 114 THR CB C 114 67.899 67.899 69.246 -1.347 25567 1254 1 2 . 1 1 114 114 THR H H 114 7.951 7.951 8.776 -0.825 25567 1255 1 2 . 1 1 115 115 SER N N 115 115.159 115.159 116.980 -1.821 25567 1256 1 2 . 1 1 115 115 SER HA H 115 4.608 4.608 4.699 -0.091 25567 1257 1 2 . 1 1 115 115 SER C C 115 171.403 171.403 173.177 -1.774 25567 1258 1 2 . 1 1 115 115 SER CA C 115 55.570 55.570 58.061 -2.491 25567 1259 1 2 . 1 1 115 115 SER CB C 115 61.418 61.418 65.505 -4.087 25567 1260 1 2 . 1 1 115 115 SER H H 115 8.229 8.229 7.755 0.474 25567 1261 1 2 . 1 1 116 116 ALA N N 116 127.211 127.211 124.509 2.702 25567 1262 1 2 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.724 -0.268 25567 1263 1 2 . 1 1 116 116 ALA C C 116 175.758 175.758 178.538 -2.780 25567 1264 1 2 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.951 -2.135 25567 1265 1 2 . 1 1 116 116 ALA CB C 116 16.831 16.831 20.193 -3.362 25567 1266 1 2 . 1 1 116 116 ALA H H 116 8.813 8.813 8.345 0.468 25567 1267 1 2 . 1 1 117 117 GLY N N 117 108.099 108.099 110.243 -2.144 25567 1268 1 2 . 1 1 117 117 GLY C C 117 171.805 171.805 175.414 -3.609 25567 1269 1 2 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.484 -4.615 25567 1270 1 2 . 1 1 117 117 GLY H H 117 8.685 8.685 9.057 -0.372 25567 1271 1 2 . 1 1 118 118 THR N N 118 111.284 111.284 111.600 -0.316 25567 1272 1 2 . 1 1 118 118 THR HA H 118 4.343 4.343 4.318 0.025 25567 1273 1 2 . 1 1 118 118 THR C C 118 171.769 171.769 173.025 -1.256 25567 1274 1 2 . 1 1 118 118 THR CA C 118 58.933 58.933 61.478 -2.545 25567 1275 1 2 . 1 1 118 118 THR CB C 118 67.304 67.304 69.701 -2.397 25567 1276 1 2 . 1 1 118 118 THR H H 118 7.998 7.998 8.035 -0.037 25567 1277 1 2 . 1 1 119 119 ASN N N 119 120.253 120.253 120.625 -0.372 25567 1278 1 2 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.848 -0.145 25567 1279 1 2 . 1 1 119 119 ASN C C 119 172.353 172.353 173.834 -1.481 25567 1280 1 2 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.151 -2.923 25567 1281 1 2 . 1 1 119 119 ASN CB C 119 35.376 35.376 39.848 -4.472 25567 1282 1 2 . 1 1 119 119 ASN H H 119 8.381 8.381 7.365 1.016 25567 1283 1 2 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.430 -0.344 25567 1284 1 2 . 1 1 120 120 HIS C C 120 173.395 173.395 175.783 -2.388 25567 1285 1 2 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.008 -1.869 25567 1286 1 2 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.202 -2.780 25567 1287 1 2 . 1 1 121 121 LYS N N 121 119.527 119.527 120.124 -0.597 25567 1288 1 2 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.876 -0.096 25567 1289 1 2 . 1 1 121 121 LYS C C 121 176.053 176.053 178.004 -1.951 25567 1290 1 2 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.008 -2.045 25567 1291 1 2 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.491 -1.831 25567 1292 1 2 . 1 1 121 121 LYS H H 121 8.106 8.106 8.655 -0.549 25567 1293 1 2 . 1 1 122 122 ALA N N 122 121.585 121.585 121.039 0.546 25567 1294 1 2 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.697 0.024 25567 1295 1 2 . 1 1 122 122 ALA C C 122 175.128 175.128 178.490 -3.362 25567 1296 1 2 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.287 -2.696 25567 1297 1 2 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.698 -1.994 25567 1298 1 2 . 1 1 122 122 ALA H H 122 7.702 7.702 7.887 -0.185 25567 1299 1 2 . 1 1 123 123 TYR N N 123 118.803 118.803 119.972 -1.169 25567 1300 1 2 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.881 -0.515 25567 1301 1 2 . 1 1 123 123 TYR CA C 123 60.091 60.091 60.956 -0.865 25567 1302 1 2 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.245 -3.143 25567 1303 1 2 . 1 1 123 123 TYR H H 123 7.366 7.366 7.315 0.051 25567 1304 1 2 . 1 1 124 124 VAL N N 124 117.530 117.530 116.482 1.048 25567 1305 1 2 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.553 -0.354 25567 1306 1 2 . 1 1 124 124 VAL C C 124 175.375 175.375 177.938 -2.563 25567 1307 1 2 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.357 -1.774 25567 1308 1 2 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.663 -1.460 25567 1309 1 2 . 1 1 124 124 VAL H H 124 7.757 7.757 7.618 0.139 25567 1310 1 2 . 1 1 125 125 SER N N 125 114.023 114.023 114.844 -0.821 25567 1311 1 2 . 1 1 125 125 SER HA H 125 4.035 4.035 4.132 -0.097 25567 1312 1 2 . 1 1 125 125 SER C C 125 174.636 174.636 176.305 -1.669 25567 1313 1 2 . 1 1 125 125 SER CA C 125 58.885 58.885 60.900 -2.015 25567 1314 1 2 . 1 1 125 125 SER CB C 125 59.666 59.666 63.000 -3.334 25567 1315 1 2 . 1 1 125 125 SER H H 125 7.622 7.622 7.430 0.192 25567 1316 1 2 . 1 1 126 126 HIS N N 126 119.457 119.457 120.707 -1.250 25567 1317 1 2 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.915 0.281 25567 1318 1 2 . 1 1 126 126 HIS C C 126 172.942 172.942 177.687 -4.745 25567 1319 1 2 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.405 -3.487 25567 1320 1 2 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.485 -3.406 25567 1321 1 2 . 1 1 126 126 HIS H H 126 8.067 8.067 8.055 0.012 25567 1322 1 2 . 1 1 127 127 PHE N N 127 120.628 120.628 118.282 2.346 25567 1323 1 2 . 1 1 127 127 PHE HA H 127 3.199 3.199 4.072 -0.874 25567 1324 1 2 . 1 1 127 127 PHE C C 127 173.515 173.515 176.556 -3.041 25567 1325 1 2 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.331 1.350 25567 1326 1 2 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.728 -2.361 25567 1327 1 2 . 1 1 127 127 PHE H H 127 9.083 9.083 8.389 0.694 25567 1328 1 2 . 1 1 128 128 ASN N N 128 114.858 114.858 118.075 -3.217 25567 1329 1 2 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.048 0.030 25567 1330 1 2 . 1 1 128 128 ASN C C 128 175.338 175.338 177.104 -1.766 25567 1331 1 2 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.802 -2.552 25567 1332 1 2 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.586 -2.565 25567 1333 1 2 . 1 1 128 128 ASN H H 128 7.858 7.858 7.761 0.097 25567 1334 1 2 . 1 1 129 129 GLU N N 129 119.811 119.811 119.112 0.699 25567 1335 1 2 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.149 -0.108 25567 1336 1 2 . 1 1 129 129 GLU C C 129 176.941 176.941 179.417 -2.476 25567 1337 1 2 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.745 -2.113 25567 1338 1 2 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.310 -2.372 25567 1339 1 2 . 1 1 129 129 GLU H H 129 7.569 7.569 7.654 -0.085 25567 1340 1 2 . 1 1 130 130 TRP N N 130 120.585 120.585 119.772 0.813 25567 1341 1 2 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.510 -0.038 25567 1342 1 2 . 1 1 130 130 TRP C C 130 174.262 174.262 177.317 -3.055 25567 1343 1 2 . 1 1 130 130 TRP CA C 130 54.673 54.673 57.454 -2.781 25567 1344 1 2 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.311 -1.355 25567 1345 1 2 . 1 1 130 130 TRP H H 130 7.964 7.964 8.016 -0.052 25567 1346 1 2 . 1 1 131 131 ALA N N 131 120.522 120.522 119.894 0.628 25567 1347 1 2 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.320 -0.373 25567 1348 1 2 . 1 1 131 131 ALA C C 131 172.489 172.489 175.952 -3.463 25567 1349 1 2 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.186 -2.606 25567 1350 1 2 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.459 -2.920 25567 1351 1 2 . 1 1 131 131 ALA H H 131 8.114 8.114 7.168 0.946 25567 1352 1 2 . 1 1 132 132 ASP N N 132 117.666 117.666 119.865 -2.199 25567 1353 1 2 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.263 -0.057 25567 1354 1 2 . 1 1 132 132 ASP C C 132 173.779 173.779 176.950 -3.171 25567 1355 1 2 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.454 -1.141 25567 1356 1 2 . 1 1 132 132 ASP CB C 132 39.456 39.456 40.118 -0.662 25567 1357 1 2 . 1 1 132 132 ASP H H 132 6.768 6.768 7.619 -0.851 25567 1358 1 2 . 1 1 133 133 GLY N N 133 114.922 114.922 112.819 2.103 25567 1359 1 2 . 1 1 133 133 GLY C C 133 172.101 172.101 173.755 -1.654 25567 1360 1 2 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.756 -2.247 25567 1361 1 2 . 1 1 133 133 GLY H H 133 8.645 8.645 8.280 0.365 25567 1362 1 2 . 1 1 134 134 LEU N N 134 120.101 120.101 121.616 -1.515 25567 1363 1 2 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.640 -0.178 25567 1364 1 2 . 1 1 134 134 LEU C C 134 174.098 174.098 175.612 -1.514 25567 1365 1 2 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.588 -2.504 25567 1366 1 2 . 1 1 134 134 LEU CB C 134 40.509 40.509 44.639 -4.130 25567 1367 1 2 . 1 1 134 134 LEU H H 134 8.049 8.049 7.660 0.389 25567 1368 1 2 . 1 1 135 135 ASN N N 135 119.258 119.258 122.285 -3.027 25567 1369 1 2 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.609 0.030 25567 1370 1 2 . 1 1 135 135 ASN C C 135 170.564 170.564 174.454 -3.890 25567 1371 1 2 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.420 -4.167 25567 1372 1 2 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.374 -4.756 25567 1373 1 2 . 1 1 135 135 ASN H H 135 8.567 8.567 8.632 -0.065 25567 1374 1 2 . 1 1 136 136 VAL N N 136 125.460 125.460 125.698 -0.238 25567 1375 1 2 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.603 -0.007 25567 1376 1 2 . 1 1 136 136 VAL C C 136 175.318 175.318 176.499 -1.181 25567 1377 1 2 . 1 1 136 136 VAL CA C 136 58.722 58.722 62.422 -3.700 25567 1378 1 2 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.729 -3.430 25567 1379 1 2 . 1 1 136 136 VAL H H 136 7.660 7.660 8.257 -0.597 25567 1380 1 2 . 1 1 137 137 ILE N N 137 122.021 122.021 121.986 0.035 25567 1381 1 2 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.575 -0.147 25567 1382 1 2 . 1 1 137 137 ILE C C 137 173.943 173.943 174.453 -0.510 25567 1383 1 2 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.656 -0.698 25567 1384 1 2 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.820 -2.651 25567 1385 1 2 . 1 1 137 137 ILE H H 137 9.151 9.151 8.862 0.289 25567 1386 1 2 . 1 1 138 138 GLY N N 138 108.192 108.192 108.435 -0.243 25567 1387 1 2 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.722 -2.228 25567 1388 1 2 . 1 1 138 138 GLY H H 138 6.675 6.675 7.351 -0.676 25567 1389 1 2 . 1 1 139 139 VAL N N 139 119.673 119.673 121.162 -1.489 25567 1390 1 2 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.599 0.721 25567 1391 1 2 . 1 1 139 139 VAL C C 139 172.291 172.291 175.410 -3.119 25567 1392 1 2 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.352 -3.143 25567 1393 1 2 . 1 1 139 139 VAL CB C 139 32.639 32.639 32.876 -0.237 25567 1394 1 2 . 1 1 139 139 VAL H H 139 8.158 8.158 8.536 -0.378 25567 1395 1 2 . 1 1 140 140 ALA N N 140 127.104 127.104 128.388 -1.284 25567 1396 1 2 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.725 -0.129 25567 1397 1 2 . 1 1 140 140 ALA C C 140 171.057 171.057 175.469 -4.412 25567 1398 1 2 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.203 -1.320 25567 1399 1 2 . 1 1 140 140 ALA CB C 140 21.428 21.428 21.781 -0.353 25567 1400 1 2 . 1 1 140 140 ALA H H 140 9.145 9.145 8.092 1.053 25567 1401 1 2 . 1 1 141 141 ARG N N 141 118.828 118.828 120.338 -1.510 25567 1402 1 2 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.042 -0.302 25567 1403 1 2 . 1 1 141 141 ARG C C 141 173.524 173.524 176.795 -3.271 25567 1404 1 2 . 1 1 141 141 ARG CA C 141 51.886 51.886 55.926 -4.040 25567 1405 1 2 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.925 -2.471 25567 1406 1 2 . 1 1 141 141 ARG H H 141 7.759 7.759 8.506 -0.747 25567 1407 1 2 . 1 1 142 142 ASP N N 142 125.557 125.557 124.648 0.909 25567 1408 1 2 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.291 -0.512 25567 1409 1 2 . 1 1 142 142 ASP C C 142 169.292 169.292 176.422 -7.130 25567 1410 1 2 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.671 -2.049 25567 1411 1 2 . 1 1 142 142 ASP CB C 142 37.080 37.080 39.826 -2.746 25567 1412 1 2 . 1 1 142 142 ASP H H 142 9.087 9.087 8.730 0.357 25567 1413 1 2 . 1 1 143 143 ASP N N 143 119.094 119.094 117.105 1.989 25567 1414 1 2 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.173 0.081 25567 1415 1 2 . 1 1 143 143 ASP C C 143 175.557 175.557 177.377 -1.820 25567 1416 1 2 . 1 1 143 143 ASP CA C 143 49.079 49.079 55.275 -6.196 25567 1417 1 2 . 1 1 143 143 ASP CB C 143 36.442 36.442 39.722 -3.280 25567 1418 1 2 . 1 1 143 143 ASP H H 143 8.175 8.175 8.484 -0.309 25567 1419 1 2 . 1 1 144 144 SER N N 144 115.438 115.438 115.577 -0.139 25567 1420 1 2 . 1 1 144 144 SER HA H 144 3.745 3.745 4.177 -0.432 25567 1421 1 2 . 1 1 144 144 SER C C 144 172.820 172.820 174.613 -1.793 25567 1422 1 2 . 1 1 144 144 SER CA C 144 59.336 59.336 60.933 -1.597 25567 1423 1 2 . 1 1 144 144 SER CB C 144 60.839 60.839 63.130 -2.291 25567 1424 1 2 . 1 1 144 144 SER H H 144 7.742 7.742 7.902 -0.160 25567 1425 1 2 . 1 1 145 145 GLU N N 145 119.631 119.631 118.075 1.556 25567 1426 1 2 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.240 0.079 25567 1427 1 2 . 1 1 145 145 GLU C C 145 171.927 171.927 176.473 -4.546 25567 1428 1 2 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.575 -3.491 25567 1429 1 2 . 1 1 145 145 GLU CB C 145 26.774 26.774 30.340 -3.566 25567 1430 1 2 . 1 1 145 145 GLU H H 145 7.924 7.924 7.848 0.076 25567 1431 1 2 . 1 1 146 146 VAL N N 146 118.791 118.791 120.319 -1.528 25567 1432 1 2 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.268 -0.312 25567 1433 1 2 . 1 1 146 146 VAL C C 146 174.582 174.582 176.950 -2.368 25567 1434 1 2 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.529 -2.451 25567 1435 1 2 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.615 -2.475 25567 1436 1 2 . 1 1 146 146 VAL H H 146 6.393 6.393 6.966 -0.573 25567 1437 1 2 . 1 1 147 147 ASP N N 147 119.410 119.410 118.320 1.090 25567 1438 1 2 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.314 -0.244 25567 1439 1 2 . 1 1 147 147 ASP C C 147 174.774 174.774 177.348 -2.574 25567 1440 1 2 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.973 -2.651 25567 1441 1 2 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.657 -3.453 25567 1442 1 2 . 1 1 147 147 ASP H H 147 8.393 8.393 8.047 0.346 25567 1443 1 2 . 1 1 148 148 LYS N N 148 119.422 119.422 118.810 0.612 25567 1444 1 2 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.089 -0.138 25567 1445 1 2 . 1 1 148 148 LYS C C 148 176.410 176.410 177.111 -0.701 25567 1446 1 2 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.546 -2.810 25567 1447 1 2 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.609 -3.033 25567 1448 1 2 . 1 1 148 148 LYS H H 148 7.078 7.078 7.576 -0.498 25567 1449 1 2 . 1 1 149 149 TRP N N 149 118.168 118.168 116.162 2.006 25567 1450 1 2 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.961 -0.360 25567 1451 1 2 . 1 1 149 149 TRP C C 149 174.199 174.199 176.047 -1.848 25567 1452 1 2 . 1 1 149 149 TRP CA C 149 53.795 53.795 54.692 -0.897 25567 1453 1 2 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.351 -1.340 25567 1454 1 2 . 1 1 149 149 TRP H H 149 7.914 7.914 6.997 0.917 25567 1455 1 2 . 1 1 150 150 SER N N 150 109.636 109.636 116.079 -6.443 25567 1456 1 2 . 1 1 150 150 SER HA H 150 4.242 4.242 4.770 -0.528 25567 1457 1 2 . 1 1 150 150 SER C C 150 170.173 170.173 175.297 -5.124 25567 1458 1 2 . 1 1 150 150 SER CA C 150 56.912 56.912 58.850 -1.938 25567 1459 1 2 . 1 1 150 150 SER CB C 150 62.087 62.087 63.793 -1.706 25567 1460 1 2 . 1 1 150 150 SER H H 150 7.814 7.814 7.747 0.067 25567 1461 1 3 . 1 1 2 2 MET HA H 2 4.416 4.416 5.133 -0.717 25567 1462 1 3 . 1 1 2 2 MET CA C 2 52.847 52.847 54.949 -2.102 25567 1463 1 3 . 1 1 2 2 MET CB C 2 30.672 30.672 34.456 -3.784 25567 1464 1 3 . 1 1 3 3 ALA N N 3 125.563 125.563 124.704 0.859 25567 1465 1 3 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.604 -0.232 25567 1466 1 3 . 1 1 3 3 ALA C C 3 174.728 174.728 176.121 -1.393 25567 1467 1 3 . 1 1 3 3 ALA CA C 3 49.348 49.348 51.871 -2.523 25567 1468 1 3 . 1 1 3 3 ALA CB C 3 16.935 16.935 21.114 -4.179 25567 1469 1 3 . 1 1 3 3 ALA H H 3 8.342 8.342 8.134 0.208 25567 1470 1 3 . 1 1 4 4 LYS N N 4 121.767 121.767 126.290 -4.523 25567 1471 1 3 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.275 -0.045 25567 1472 1 3 . 1 1 4 4 LYS C C 4 174.577 174.577 176.202 -1.625 25567 1473 1 3 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.993 -2.004 25567 1474 1 3 . 1 1 4 4 LYS CB C 4 31.555 31.555 31.388 0.167 25567 1475 1 3 . 1 1 4 4 LYS H H 4 8.500 8.500 8.621 -0.121 25567 1476 1 3 . 1 1 5 5 LYS N N 5 129.654 129.654 123.650 6.004 25567 1477 1 3 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.371 0.155 25567 1478 1 3 . 1 1 5 5 LYS C C 5 174.731 174.731 176.386 -1.655 25567 1479 1 3 . 1 1 5 5 LYS CA C 5 54.746 54.746 57.346 -2.600 25567 1480 1 3 . 1 1 5 5 LYS CB C 5 29.894 29.894 33.745 -3.851 25567 1481 1 3 . 1 1 5 5 LYS H H 5 10.035 10.035 7.995 2.040 25567 1482 1 3 . 1 1 6 6 THR N N 6 126.212 126.212 114.733 11.479 25567 1483 1 3 . 1 1 6 6 THR HA H 6 5.654 5.654 5.288 0.366 25567 1484 1 3 . 1 1 6 6 THR C C 6 169.897 169.897 173.049 -3.152 25567 1485 1 3 . 1 1 6 6 THR CA C 6 60.647 60.647 61.569 -0.922 25567 1486 1 3 . 1 1 6 6 THR CB C 6 68.152 68.152 71.969 -3.817 25567 1487 1 3 . 1 1 6 6 THR H H 6 8.557 8.557 8.388 0.169 25567 1488 1 3 . 1 1 7 7 LEU N N 7 130.776 130.776 124.497 6.279 25567 1489 1 3 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.804 -0.185 25567 1490 1 3 . 1 1 7 7 LEU CA C 7 50.096 50.096 52.947 -2.851 25567 1491 1 3 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.270 -5.227 25567 1492 1 3 . 1 1 7 7 LEU H H 7 8.610 8.610 8.791 -0.181 25567 1493 1 3 . 1 1 8 8 ILE N N 8 127.175 127.175 121.511 5.664 25567 1494 1 3 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.726 0.130 25567 1495 1 3 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.691 -3.299 25567 1496 1 3 . 1 1 8 8 ILE CB C 8 36.864 36.864 40.516 -3.652 25567 1497 1 3 . 1 1 8 8 ILE H H 8 9.263 9.263 8.013 1.250 25567 1498 1 3 . 1 1 9 9 LEU N N 9 127.117 127.117 128.925 -1.808 25567 1499 1 3 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.302 0.394 25567 1500 1 3 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.445 -3.493 25567 1501 1 3 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.450 0.376 25567 1502 1 3 . 1 1 9 9 LEU H H 9 9.262 9.262 9.182 0.080 25567 1503 1 3 . 1 1 10 10 TYR N N 10 113.544 113.544 122.518 -8.974 25567 1504 1 3 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.161 0.370 25567 1505 1 3 . 1 1 10 10 TYR CA C 10 52.829 52.829 54.748 -1.919 25567 1506 1 3 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.230 -1.615 25567 1507 1 3 . 1 1 10 10 TYR H H 10 7.425 7.425 8.104 -0.679 25567 1508 1 3 . 1 1 11 11 TYR N N 11 121.235 121.235 127.011 -5.776 25567 1509 1 3 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.855 -0.045 25567 1510 1 3 . 1 1 11 11 TYR CA C 11 53.889 53.889 56.780 -2.891 25567 1511 1 3 . 1 1 11 11 TYR CB C 11 40.467 40.467 41.265 -0.798 25567 1512 1 3 . 1 1 11 11 TYR H H 11 7.781 7.781 8.371 -0.590 25567 1513 1 3 . 1 1 14 14 SER CA C 14 54.675 54.675 59.288 -4.613 25567 1514 1 3 . 1 1 14 14 SER CB C 14 61.621 61.621 62.914 -1.294 25567 1515 1 3 . 1 1 15 15 GLY N N 15 110.420 110.420 108.895 1.525 25567 1516 1 3 . 1 1 15 15 GLY CA C 15 43.727 43.727 44.994 -1.267 25567 1517 1 3 . 1 1 15 15 GLY H H 15 7.757 7.757 7.933 -0.176 25567 1518 1 3 . 1 1 17 17 THR HA H 17 4.122 4.122 3.964 0.158 25567 1519 1 3 . 1 1 17 17 THR CA C 17 64.748 64.748 65.367 -0.619 25567 1520 1 3 . 1 1 17 17 THR CB C 17 64.532 64.532 68.286 -3.754 25567 1521 1 3 . 1 1 18 18 LYS HA H 18 2.918 2.918 2.625 0.293 25567 1522 1 3 . 1 1 18 18 LYS C C 18 173.812 173.812 177.837 -4.025 25567 1523 1 3 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.377 -2.374 25567 1524 1 3 . 1 1 18 18 LYS CB C 18 29.768 29.768 31.814 -2.046 25567 1525 1 3 . 1 1 19 19 LYS N N 19 116.699 116.699 117.584 -0.885 25567 1526 1 3 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.972 -0.024 25567 1527 1 3 . 1 1 19 19 LYS C C 19 177.221 177.221 179.582 -2.361 25567 1528 1 3 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.868 -2.447 25567 1529 1 3 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.000 -2.366 25567 1530 1 3 . 1 1 19 19 LYS H H 19 7.476 7.476 7.539 -0.063 25567 1531 1 3 . 1 1 20 20 MET N N 20 118.946 118.946 118.258 0.688 25567 1532 1 3 . 1 1 20 20 MET HA H 20 4.474 4.474 4.284 0.190 25567 1533 1 3 . 1 1 20 20 MET C C 20 173.826 173.826 178.144 -4.318 25567 1534 1 3 . 1 1 20 20 MET CA C 20 52.285 52.285 57.576 -5.291 25567 1535 1 3 . 1 1 20 20 MET CB C 20 26.921 26.921 32.385 -5.464 25567 1536 1 3 . 1 1 20 20 MET H H 20 7.457 7.457 7.519 -0.062 25567 1537 1 3 . 1 1 21 21 ALA N N 21 123.375 123.375 122.890 0.485 25567 1538 1 3 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.026 -0.474 25567 1539 1 3 . 1 1 21 21 ALA C C 21 176.542 176.542 179.722 -3.180 25567 1540 1 3 . 1 1 21 21 ALA CA C 21 52.651 52.651 55.691 -3.039 25567 1541 1 3 . 1 1 21 21 ALA CB C 21 16.282 16.282 18.053 -1.771 25567 1542 1 3 . 1 1 21 21 ALA H H 21 8.549 8.549 8.557 -0.008 25567 1543 1 3 . 1 1 22 22 GLU N N 22 116.906 116.906 117.137 -0.231 25567 1544 1 3 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.055 -0.382 25567 1545 1 3 . 1 1 22 22 GLU C C 22 176.658 176.658 179.216 -2.558 25567 1546 1 3 . 1 1 22 22 GLU CA C 22 56.605 56.605 58.372 -1.767 25567 1547 1 3 . 1 1 22 22 GLU CB C 22 26.649 26.649 28.901 -2.252 25567 1548 1 3 . 1 1 22 22 GLU H H 22 8.085 8.085 8.152 -0.067 25567 1549 1 3 . 1 1 23 23 LYS N N 23 123.301 123.301 120.265 3.036 25567 1550 1 3 . 1 1 23 23 LYS HA H 23 3.820 3.820 3.992 -0.172 25567 1551 1 3 . 1 1 23 23 LYS C C 23 177.363 177.363 179.271 -1.908 25567 1552 1 3 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.157 -2.186 25567 1553 1 3 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.128 -2.597 25567 1554 1 3 . 1 1 23 23 LYS H H 23 7.703 7.703 7.342 0.361 25567 1555 1 3 . 1 1 24 24 ILE N N 24 121.894 121.894 118.513 3.381 25567 1556 1 3 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.612 -0.316 25567 1557 1 3 . 1 1 24 24 ILE C C 24 174.944 174.944 177.806 -2.862 25567 1558 1 3 . 1 1 24 24 ILE CA C 24 63.233 63.233 65.019 -1.786 25567 1559 1 3 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.292 -2.548 25567 1560 1 3 . 1 1 24 24 ILE H H 24 8.458 8.458 7.434 1.024 25567 1561 1 3 . 1 1 25 25 ASN N N 25 118.580 118.580 119.115 -0.535 25567 1562 1 3 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.309 -0.075 25567 1563 1 3 . 1 1 25 25 ASN C C 25 173.567 173.567 177.085 -3.518 25567 1564 1 3 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.732 -4.408 25567 1565 1 3 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.330 -0.147 25567 1566 1 3 . 1 1 25 25 ASN H H 25 8.273 8.273 8.071 0.202 25567 1567 1 3 . 1 1 26 26 SER N N 26 112.132 112.132 113.931 -1.799 25567 1568 1 3 . 1 1 26 26 SER HA H 26 4.148 4.148 4.361 -0.212 25567 1569 1 3 . 1 1 26 26 SER C C 26 172.083 172.083 175.187 -3.104 25567 1570 1 3 . 1 1 26 26 SER CA C 26 57.865 57.865 60.112 -2.247 25567 1571 1 3 . 1 1 26 26 SER CB C 26 60.816 60.816 63.265 -2.449 25567 1572 1 3 . 1 1 26 26 SER H H 26 7.444 7.444 7.867 -0.423 25567 1573 1 3 . 1 1 27 27 GLU N N 27 120.080 120.080 119.316 0.764 25567 1574 1 3 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.507 -0.407 25567 1575 1 3 . 1 1 27 27 GLU C C 27 173.647 173.647 175.977 -2.330 25567 1576 1 3 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.016 -1.814 25567 1577 1 3 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.325 -3.441 25567 1578 1 3 . 1 1 27 27 GLU H H 27 7.453 7.453 7.757 -0.304 25567 1579 1 3 . 1 1 28 28 ILE N N 28 118.759 118.759 118.738 0.021 25567 1580 1 3 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.327 -0.123 25567 1581 1 3 . 1 1 28 28 ILE C C 28 172.474 172.474 174.389 -1.915 25567 1582 1 3 . 1 1 28 28 ILE CA C 28 57.747 57.747 59.917 -2.170 25567 1583 1 3 . 1 1 28 28 ILE CB C 28 35.798 35.798 41.108 -5.310 25567 1584 1 3 . 1 1 28 28 ILE H H 28 7.258 7.258 7.194 0.064 25567 1585 1 3 . 1 1 29 29 LYS N N 29 130.618 130.618 122.077 8.541 25567 1586 1 3 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.505 -0.500 25567 1587 1 3 . 1 1 29 29 LYS C C 29 174.375 174.375 176.722 -2.347 25567 1588 1 3 . 1 1 29 29 LYS CA C 29 55.659 55.659 55.762 -0.103 25567 1589 1 3 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.975 -4.415 25567 1590 1 3 . 1 1 29 29 LYS H H 29 8.588 8.588 8.614 -0.026 25567 1591 1 3 . 1 1 30 30 ASP N N 30 119.366 119.366 121.453 -2.087 25567 1592 1 3 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.362 0.040 25567 1593 1 3 . 1 1 30 30 ASP C C 30 172.580 172.580 175.097 -2.517 25567 1594 1 3 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.161 -1.537 25567 1595 1 3 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.643 -3.815 25567 1596 1 3 . 1 1 30 30 ASP H H 30 8.940 8.940 8.904 0.036 25567 1597 1 3 . 1 1 31 31 SER N N 31 114.035 114.035 112.359 1.676 25567 1598 1 3 . 1 1 31 31 SER HA H 31 4.781 4.781 4.770 0.011 25567 1599 1 3 . 1 1 31 31 SER C C 31 171.136 171.136 174.485 -3.349 25567 1600 1 3 . 1 1 31 31 SER CA C 31 55.638 55.638 58.167 -2.529 25567 1601 1 3 . 1 1 31 31 SER CB C 31 62.388 62.388 64.922 -2.534 25567 1602 1 3 . 1 1 31 31 SER H H 31 8.030 8.030 8.043 -0.013 25567 1603 1 3 . 1 1 32 32 GLU N N 32 121.406 121.406 121.360 0.046 25567 1604 1 3 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.754 -0.019 25567 1605 1 3 . 1 1 32 32 GLU C C 32 171.205 171.205 174.625 -3.420 25567 1606 1 3 . 1 1 32 32 GLU CA C 32 52.069 52.069 54.668 -2.599 25567 1607 1 3 . 1 1 32 32 GLU CB C 32 30.890 30.890 34.040 -3.150 25567 1608 1 3 . 1 1 32 32 GLU H H 32 8.188 8.188 8.474 -0.286 25567 1609 1 3 . 1 1 33 33 LEU N N 33 126.143 126.143 116.172 9.971 25567 1610 1 3 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.184 0.101 25567 1611 1 3 . 1 1 33 33 LEU C C 33 173.401 173.401 175.498 -2.097 25567 1612 1 3 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.483 -2.149 25567 1613 1 3 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.945 -1.322 25567 1614 1 3 . 1 1 33 33 LEU H H 33 8.627 8.627 8.276 0.351 25567 1615 1 3 . 1 1 34 34 LYS N N 34 127.122 127.122 123.417 3.705 25567 1616 1 3 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.783 -0.184 25567 1617 1 3 . 1 1 34 34 LYS C C 34 169.644 169.644 175.266 -5.622 25567 1618 1 3 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.156 -1.803 25567 1619 1 3 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.410 -3.238 25567 1620 1 3 . 1 1 34 34 LYS H H 34 9.399 9.399 8.882 0.517 25567 1621 1 3 . 1 1 35 35 GLU N N 35 122.766 122.766 120.456 2.310 25567 1622 1 3 . 1 1 35 35 GLU HA H 35 3.358 3.358 3.894 -0.536 25567 1623 1 3 . 1 1 35 35 GLU C C 35 172.875 172.875 176.330 -3.455 25567 1624 1 3 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.593 -2.954 25567 1625 1 3 . 1 1 35 35 GLU CB C 35 29.268 29.268 30.553 -1.285 25567 1626 1 3 . 1 1 35 35 GLU H H 35 8.166 8.166 8.334 -0.168 25567 1627 1 3 . 1 1 36 36 VAL N N 36 126.674 126.674 117.310 9.364 25567 1628 1 3 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.356 -0.495 25567 1629 1 3 . 1 1 36 36 VAL C C 36 171.451 171.451 175.566 -4.115 25567 1630 1 3 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.829 -1.292 25567 1631 1 3 . 1 1 36 36 VAL CB C 36 29.689 29.689 34.728 -5.039 25567 1632 1 3 . 1 1 36 36 VAL H H 36 8.632 8.632 7.793 0.840 25567 1633 1 3 . 1 1 37 37 LYS N N 37 126.181 126.181 121.449 4.732 25567 1634 1 3 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.931 0.008 25567 1635 1 3 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.653 -2.474 25567 1636 1 3 . 1 1 37 37 LYS CB C 37 32.898 32.898 37.132 -4.234 25567 1637 1 3 . 1 1 37 37 LYS H H 37 7.867 7.867 8.907 -1.040 25567 1638 1 3 . 1 1 38 38 VAL N N 38 113.540 113.540 114.711 -1.171 25567 1639 1 3 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.684 0.002 25567 1640 1 3 . 1 1 38 38 VAL C C 38 173.633 173.633 175.201 -1.568 25567 1641 1 3 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.637 -2.353 25567 1642 1 3 . 1 1 38 38 VAL CB C 38 31.964 31.964 35.416 -3.452 25567 1643 1 3 . 1 1 38 38 VAL H H 38 8.389 8.389 8.537 -0.148 25567 1644 1 3 . 1 1 39 39 SER N N 39 118.860 118.860 119.448 -0.588 25567 1645 1 3 . 1 1 39 39 SER HA H 39 4.194 4.194 4.461 -0.267 25567 1646 1 3 . 1 1 39 39 SER C C 39 173.059 173.059 174.367 -1.308 25567 1647 1 3 . 1 1 39 39 SER CA C 39 56.227 56.227 59.368 -3.142 25567 1648 1 3 . 1 1 39 39 SER CB C 39 60.771 60.771 63.761 -2.990 25567 1649 1 3 . 1 1 39 39 SER H H 39 8.668 8.668 8.304 0.364 25567 1650 1 3 . 1 1 40 40 GLU N N 40 125.769 125.769 121.969 3.800 25567 1651 1 3 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.274 -0.117 25567 1652 1 3 . 1 1 40 40 GLU C C 40 174.484 174.484 176.646 -2.162 25567 1653 1 3 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.421 -0.871 25567 1654 1 3 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.888 -3.834 25567 1655 1 3 . 1 1 40 40 GLU H H 40 8.878 8.878 8.375 0.503 25567 1656 1 3 . 1 1 41 41 GLY N N 41 112.165 112.165 107.992 4.173 25567 1657 1 3 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.935 -2.228 25567 1658 1 3 . 1 1 41 41 GLY H H 41 8.743 8.743 8.739 0.004 25567 1659 1 3 . 1 1 44 44 ASP N N 44 122.324 122.324 120.972 1.352 25567 1660 1 3 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.197 1.959 25567 1661 1 3 . 1 1 44 44 ASP H H 44 7.918 7.918 8.673 -0.755 25567 1662 1 3 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.138 -0.076 25567 1663 1 3 . 1 1 45 45 ALA CA C 45 51.410 51.410 51.249 0.161 25567 1664 1 3 . 1 1 45 45 ALA CB C 45 16.376 16.376 20.365 -3.989 25567 1665 1 3 . 1 1 47 47 MET CA C 47 54.118 54.118 55.462 -1.344 25567 1666 1 3 . 1 1 47 47 MET CB C 47 27.527 27.527 36.003 -8.476 25567 1667 1 3 . 1 1 48 48 TYR N N 48 120.075 120.075 124.068 -3.993 25567 1668 1 3 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.392 -0.238 25567 1669 1 3 . 1 1 48 48 TYR C C 48 172.217 172.217 175.192 -2.975 25567 1670 1 3 . 1 1 48 48 TYR CA C 48 57.377 57.377 58.880 -1.503 25567 1671 1 3 . 1 1 48 48 TYR CB C 48 34.496 34.496 38.202 -3.706 25567 1672 1 3 . 1 1 48 48 TYR H H 48 7.810 7.810 8.639 -0.829 25567 1673 1 3 . 1 1 49 49 LYS N N 49 118.369 118.369 127.639 -9.270 25567 1674 1 3 . 1 1 49 49 LYS H H 49 8.116 8.116 8.257 -0.141 25567 1675 1 3 . 1 1 50 50 THR N N 50 116.979 116.979 112.772 4.207 25567 1676 1 3 . 1 1 50 50 THR CB C 50 66.373 66.373 69.681 -3.308 25567 1677 1 3 . 1 1 50 50 THR H H 50 7.741 7.741 7.546 0.195 25567 1678 1 3 . 1 1 51 51 SER N N 51 116.155 116.155 119.393 -3.238 25567 1679 1 3 . 1 1 51 51 SER HA H 51 3.771 3.771 4.779 -1.008 25567 1680 1 3 . 1 1 51 51 SER C C 51 170.563 170.563 174.408 -3.845 25567 1681 1 3 . 1 1 51 51 SER CA C 51 54.840 54.840 58.294 -3.454 25567 1682 1 3 . 1 1 51 51 SER CB C 51 60.318 60.318 62.077 -1.759 25567 1683 1 3 . 1 1 51 51 SER H H 51 7.853 7.853 8.234 -0.381 25567 1684 1 3 . 1 1 54 54 ALA N N 54 123.234 123.234 128.849 -5.615 25567 1685 1 3 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.976 -0.728 25567 1686 1 3 . 1 1 54 54 ALA CA C 54 51.268 51.268 51.806 -0.537 25567 1687 1 3 . 1 1 54 54 ALA CB C 54 16.434 16.434 20.569 -4.135 25567 1688 1 3 . 1 1 54 54 ALA H H 54 8.207 8.207 7.937 0.270 25567 1689 1 3 . 1 1 55 55 LEU N N 55 118.603 118.603 120.280 -1.677 25567 1690 1 3 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.337 -0.397 25567 1691 1 3 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.921 -1.210 25567 1692 1 3 . 1 1 55 55 LEU CB C 55 38.913 38.913 41.971 -3.058 25567 1693 1 3 . 1 1 55 55 LEU H H 55 7.960 7.960 8.478 -0.518 25567 1694 1 3 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.219 -0.543 25567 1695 1 3 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.846 -0.352 25567 1696 1 3 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.391 -3.337 25567 1697 1 3 . 1 1 59 59 GLN N N 59 117.579 117.579 121.996 -4.417 25567 1698 1 3 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.210 -0.077 25567 1699 1 3 . 1 1 59 59 GLN CA C 59 54.009 54.009 57.038 -3.030 25567 1700 1 3 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.062 -1.411 25567 1701 1 3 . 1 1 59 59 GLN H H 59 8.268 8.268 7.964 0.304 25567 1702 1 3 . 1 1 60 60 GLY N N 60 107.308 107.308 112.597 -5.289 25567 1703 1 3 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.002 -2.023 25567 1704 1 3 . 1 1 60 60 GLY H H 60 7.780 7.780 8.850 -1.070 25567 1705 1 3 . 1 1 61 61 ASN N N 61 117.747 117.747 119.786 -2.039 25567 1706 1 3 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.784 -0.250 25567 1707 1 3 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.958 -1.723 25567 1708 1 3 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.736 -3.312 25567 1709 1 3 . 1 1 61 61 ASN H H 61 8.108 8.108 7.777 0.331 25567 1710 1 3 . 1 1 64 64 PHE N N 64 120.102 120.102 122.551 -2.449 25567 1711 1 3 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.529 -0.150 25567 1712 1 3 . 1 1 64 64 PHE CA C 64 51.748 51.748 53.443 -1.695 25567 1713 1 3 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.098 -2.823 25567 1714 1 3 . 1 1 64 64 PHE H H 64 8.300 8.300 7.821 0.479 25567 1715 1 3 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.491 -0.156 25567 1716 1 3 . 1 1 65 65 PRO C C 65 173.870 173.870 176.283 -2.413 25567 1717 1 3 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.606 -2.589 25567 1718 1 3 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.561 -2.926 25567 1719 1 3 . 1 1 66 66 GLU N N 66 121.258 121.258 118.929 2.329 25567 1720 1 3 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.299 -0.065 25567 1721 1 3 . 1 1 66 66 GLU C C 66 173.981 173.981 177.251 -3.270 25567 1722 1 3 . 1 1 66 66 GLU CA C 66 53.787 53.787 55.966 -2.179 25567 1723 1 3 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.349 -2.574 25567 1724 1 3 . 1 1 66 66 GLU H H 66 8.316 8.316 8.542 -0.226 25567 1725 1 3 . 1 1 67 67 ILE N N 67 114.290 114.290 117.315 -3.025 25567 1726 1 3 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.313 0.816 25567 1727 1 3 . 1 1 67 67 ILE C C 67 172.700 172.700 175.649 -2.949 25567 1728 1 3 . 1 1 67 67 ILE CA C 67 56.439 56.439 60.437 -3.998 25567 1729 1 3 . 1 1 67 67 ILE CB C 67 39.159 39.159 39.725 -0.566 25567 1730 1 3 . 1 1 67 67 ILE H H 67 8.366 8.366 8.277 0.089 25567 1731 1 3 . 1 1 68 68 GLN N N 68 121.422 121.422 119.117 2.305 25567 1732 1 3 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.739 -0.238 25567 1733 1 3 . 1 1 68 68 GLN C C 68 171.675 171.675 174.480 -2.805 25567 1734 1 3 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.539 -2.267 25567 1735 1 3 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.144 -6.001 25567 1736 1 3 . 1 1 68 68 GLN H H 68 8.737 8.737 8.462 0.275 25567 1737 1 3 . 1 1 69 69 LEU N N 69 125.311 125.311 116.285 9.026 25567 1738 1 3 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.779 -0.273 25567 1739 1 3 . 1 1 69 69 LEU C C 69 172.634 172.634 174.976 -2.342 25567 1740 1 3 . 1 1 69 69 LEU CA C 69 51.759 51.759 54.143 -2.384 25567 1741 1 3 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.661 -1.257 25567 1742 1 3 . 1 1 69 69 LEU H H 69 8.051 8.051 8.248 -0.197 25567 1743 1 3 . 1 1 70 70 ASP N N 70 122.763 122.763 119.990 2.773 25567 1744 1 3 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.573 -0.150 25567 1745 1 3 . 1 1 70 70 ASP CA C 70 51.610 51.610 54.321 -2.711 25567 1746 1 3 . 1 1 70 70 ASP CB C 70 38.717 38.717 41.742 -3.025 25567 1747 1 3 . 1 1 70 70 ASP H H 70 8.313 8.313 8.703 -0.390 25567 1748 1 3 . 1 1 71 71 ASN N N 71 117.413 117.413 118.937 -1.524 25567 1749 1 3 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.699 -0.362 25567 1750 1 3 . 1 1 71 71 ASN C C 71 171.770 171.770 174.584 -2.814 25567 1751 1 3 . 1 1 71 71 ASN CA C 71 51.491 51.491 52.959 -1.468 25567 1752 1 3 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.921 -2.595 25567 1753 1 3 . 1 1 71 71 ASN H H 71 8.407 8.407 8.453 -0.046 25567 1754 1 3 . 1 1 72 72 ILE N N 72 123.752 123.752 124.541 -0.789 25567 1755 1 3 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.135 -0.195 25567 1756 1 3 . 1 1 72 72 ILE C C 72 171.621 171.621 174.622 -3.001 25567 1757 1 3 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.800 -3.468 25567 1758 1 3 . 1 1 72 72 ILE CB C 72 38.489 38.489 38.294 0.195 25567 1759 1 3 . 1 1 72 72 ILE H H 72 7.639 7.639 7.710 -0.071 25567 1760 1 3 . 1 1 73 73 ASP N N 73 125.252 125.252 127.370 -2.118 25567 1761 1 3 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.687 -0.062 25567 1762 1 3 . 1 1 73 73 ASP C C 73 174.034 174.034 176.278 -2.244 25567 1763 1 3 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.771 -3.568 25567 1764 1 3 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.377 -5.353 25567 1765 1 3 . 1 1 73 73 ASP H H 73 8.394 8.394 8.573 -0.179 25567 1766 1 3 . 1 1 74 74 TYR N N 74 123.108 123.108 124.550 -1.442 25567 1767 1 3 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.547 -0.669 25567 1768 1 3 . 1 1 74 74 TYR C C 74 173.637 173.637 177.384 -3.747 25567 1769 1 3 . 1 1 74 74 TYR CA C 74 59.474 59.474 60.081 -0.607 25567 1770 1 3 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.353 -3.631 25567 1771 1 3 . 1 1 74 74 TYR H H 74 7.392 7.392 8.941 -1.549 25567 1772 1 3 . 1 1 75 75 ASN N N 75 109.422 109.422 116.931 -7.509 25567 1773 1 3 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.535 0.391 25567 1774 1 3 . 1 1 75 75 ASN C C 75 172.574 172.574 175.699 -3.125 25567 1775 1 3 . 1 1 75 75 ASN CA C 75 52.761 52.761 56.377 -3.615 25567 1776 1 3 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.838 -3.221 25567 1777 1 3 . 1 1 75 75 ASN H H 75 8.058 8.058 8.095 -0.037 25567 1778 1 3 . 1 1 76 76 ASN N N 76 117.422 117.422 114.940 2.482 25567 1779 1 3 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.588 -0.133 25567 1780 1 3 . 1 1 76 76 ASN C C 76 171.132 171.132 174.636 -3.504 25567 1781 1 3 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.184 -2.017 25567 1782 1 3 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.439 -2.711 25567 1783 1 3 . 1 1 76 76 ASN H H 76 7.768 7.768 7.583 0.185 25567 1784 1 3 . 1 1 77 77 TYR N N 77 116.873 116.873 118.741 -1.868 25567 1785 1 3 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.680 -0.317 25567 1786 1 3 . 1 1 77 77 TYR C C 77 172.175 172.175 174.592 -2.417 25567 1787 1 3 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.320 -1.956 25567 1788 1 3 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.310 -3.145 25567 1789 1 3 . 1 1 77 77 TYR H H 77 7.825 7.825 7.554 0.271 25567 1790 1 3 . 1 1 78 78 ASP N N 78 121.271 121.271 122.713 -1.442 25567 1791 1 3 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.950 -0.145 25567 1792 1 3 . 1 1 78 78 ASP C C 78 172.641 172.641 175.629 -2.988 25567 1793 1 3 . 1 1 78 78 ASP CA C 78 53.255 53.255 55.274 -2.019 25567 1794 1 3 . 1 1 78 78 ASP CB C 78 41.075 41.075 42.249 -1.174 25567 1795 1 3 . 1 1 78 78 ASP H H 78 9.058 9.058 8.374 0.684 25567 1796 1 3 . 1 1 79 79 LEU N N 79 122.985 122.985 118.405 4.580 25567 1797 1 3 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.002 0.112 25567 1798 1 3 . 1 1 79 79 LEU C C 79 170.721 170.721 174.427 -3.706 25567 1799 1 3 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.379 -3.063 25567 1800 1 3 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.282 -2.939 25567 1801 1 3 . 1 1 79 79 LEU H H 79 7.893 7.893 7.700 0.193 25567 1802 1 3 . 1 1 80 80 ILE N N 80 126.364 126.364 124.708 1.656 25567 1803 1 3 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.894 0.195 25567 1804 1 3 . 1 1 80 80 ILE C C 80 171.580 171.580 174.044 -2.464 25567 1805 1 3 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.257 -2.840 25567 1806 1 3 . 1 1 80 80 ILE CB C 80 38.136 38.136 41.339 -3.203 25567 1807 1 3 . 1 1 80 80 ILE H H 80 8.717 8.717 8.999 -0.282 25567 1808 1 3 . 1 1 81 81 LEU N N 81 126.199 126.199 127.422 -1.223 25567 1809 1 3 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.026 0.109 25567 1810 1 3 . 1 1 81 81 LEU C C 81 172.979 172.979 175.768 -2.789 25567 1811 1 3 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.547 -3.914 25567 1812 1 3 . 1 1 81 81 LEU CB C 81 42.159 42.159 43.982 -1.823 25567 1813 1 3 . 1 1 81 81 LEU H H 81 9.230 9.230 8.828 0.402 25567 1814 1 3 . 1 1 82 82 ILE N N 82 120.505 120.505 122.692 -2.187 25567 1815 1 3 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.923 -0.007 25567 1816 1 3 . 1 1 82 82 ILE C C 82 173.011 173.011 174.852 -1.841 25567 1817 1 3 . 1 1 82 82 ILE CA C 82 56.828 56.828 60.179 -3.351 25567 1818 1 3 . 1 1 82 82 ILE CB C 82 38.068 38.068 40.691 -2.623 25567 1819 1 3 . 1 1 82 82 ILE H H 82 8.796 8.796 8.788 0.008 25567 1820 1 3 . 1 1 83 83 GLY N N 83 120.857 120.857 114.525 6.332 25567 1821 1 3 . 1 1 83 83 GLY CA C 83 40.803 40.803 42.912 -2.109 25567 1822 1 3 . 1 1 83 83 GLY H H 83 9.525 9.525 8.862 0.663 25567 1823 1 3 . 1 1 84 84 SER N N 84 116.007 116.007 117.848 -1.841 25567 1824 1 3 . 1 1 84 84 SER HA H 84 5.476 5.476 5.338 0.138 25567 1825 1 3 . 1 1 84 84 SER CA C 84 51.937 51.937 55.218 -3.281 25567 1826 1 3 . 1 1 84 84 SER CB C 84 64.533 64.533 65.304 -0.771 25567 1827 1 3 . 1 1 84 84 SER H H 84 7.617 7.617 8.315 -0.698 25567 1828 1 3 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.611 0.590 25567 1829 1 3 . 1 1 85 85 PRO C C 85 173.574 173.574 176.199 -2.625 25567 1830 1 3 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.294 -2.806 25567 1831 1 3 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.665 -1.525 25567 1832 1 3 . 1 1 86 86 VAL N N 86 117.603 117.603 117.732 -0.129 25567 1833 1 3 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.453 -0.080 25567 1834 1 3 . 1 1 86 86 VAL C C 86 172.777 172.777 174.519 -1.742 25567 1835 1 3 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.628 -2.025 25567 1836 1 3 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.186 -4.613 25567 1837 1 3 . 1 1 86 86 VAL H H 86 8.194 8.194 8.062 0.132 25567 1838 1 3 . 1 1 87 87 TRP N N 87 131.187 131.187 127.666 3.521 25567 1839 1 3 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.778 0.420 25567 1840 1 3 . 1 1 87 87 TRP C C 87 173.295 173.295 174.349 -1.054 25567 1841 1 3 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.514 -7.729 25567 1842 1 3 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.665 -3.918 25567 1843 1 3 . 1 1 87 87 TRP H H 87 9.637 9.637 8.525 1.112 25567 1844 1 3 . 1 1 88 88 SER N N 88 119.829 119.829 113.095 6.734 25567 1845 1 3 . 1 1 88 88 SER HA H 88 3.986 3.986 4.732 -0.746 25567 1846 1 3 . 1 1 88 88 SER C C 88 172.375 172.375 174.964 -2.589 25567 1847 1 3 . 1 1 88 88 SER CA C 88 55.932 55.932 57.416 -1.484 25567 1848 1 3 . 1 1 88 88 SER CB C 88 59.178 59.178 63.442 -4.264 25567 1849 1 3 . 1 1 88 88 SER H H 88 9.272 9.272 7.700 1.572 25567 1850 1 3 . 1 1 89 89 GLY N N 89 101.498 101.498 110.835 -9.337 25567 1851 1 3 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.850 -4.179 25567 1852 1 3 . 1 1 89 89 GLY H H 89 7.463 7.463 9.015 -1.552 25567 1853 1 3 . 1 1 90 90 TYR N N 90 121.064 121.064 116.979 4.085 25567 1854 1 3 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.176 -0.960 25567 1855 1 3 . 1 1 90 90 TYR CA C 90 54.090 54.090 55.035 -0.945 25567 1856 1 3 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.288 -1.093 25567 1857 1 3 . 1 1 90 90 TYR H H 90 8.064 8.064 8.000 0.064 25567 1858 1 3 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.801 0.131 25567 1859 1 3 . 1 1 91 91 PRO C C 91 171.019 171.019 176.305 -5.286 25567 1860 1 3 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.557 -4.563 25567 1861 1 3 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.459 -5.966 25567 1862 1 3 . 1 1 92 92 ALA N N 92 119.893 119.893 121.389 -1.496 25567 1863 1 3 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.710 -1.259 25567 1864 1 3 . 1 1 92 92 ALA C C 92 176.477 176.477 175.598 0.879 25567 1865 1 3 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.453 -1.886 25567 1866 1 3 . 1 1 92 92 ALA CB C 92 15.801 15.801 22.259 -6.458 25567 1867 1 3 . 1 1 92 92 ALA H H 92 7.278 7.278 7.763 -0.485 25567 1868 1 3 . 1 1 93 93 THR N N 93 112.992 112.992 109.067 3.925 25567 1869 1 3 . 1 1 93 93 THR HA H 93 4.462 4.462 4.836 -0.374 25567 1870 1 3 . 1 1 93 93 THR CA C 93 66.871 66.871 59.861 7.010 25567 1871 1 3 . 1 1 93 93 THR CB C 93 64.362 64.362 67.874 -3.512 25567 1872 1 3 . 1 1 93 93 THR H H 93 6.861 6.861 8.335 -1.474 25567 1873 1 3 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.434 -0.568 25567 1874 1 3 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.066 -0.045 25567 1875 1 3 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.759 -2.480 25567 1876 1 3 . 1 1 95 95 ILE N N 95 111.298 111.298 117.981 -6.683 25567 1877 1 3 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.555 -0.932 25567 1878 1 3 . 1 1 95 95 ILE C C 95 174.264 174.264 175.160 -0.896 25567 1879 1 3 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.023 -1.575 25567 1880 1 3 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.276 -4.347 25567 1881 1 3 . 1 1 95 95 ILE H H 95 7.974 7.974 7.811 0.163 25567 1882 1 3 . 1 1 96 96 LYS N N 96 123.045 123.045 121.476 1.569 25567 1883 1 3 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.815 -1.703 25567 1884 1 3 . 1 1 96 96 LYS C C 96 174.590 174.590 177.929 -3.339 25567 1885 1 3 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.508 -0.363 25567 1886 1 3 . 1 1 96 96 LYS CB C 96 28.845 28.845 34.087 -5.242 25567 1887 1 3 . 1 1 96 96 LYS H H 96 6.958 6.958 8.144 -1.186 25567 1888 1 3 . 1 1 97 97 THR N N 97 113.412 113.412 117.080 -3.668 25567 1889 1 3 . 1 1 97 97 THR HA H 97 3.461 3.461 4.076 -0.615 25567 1890 1 3 . 1 1 97 97 THR C C 97 173.247 173.247 176.740 -3.493 25567 1891 1 3 . 1 1 97 97 THR CA C 97 62.809 62.809 66.011 -3.202 25567 1892 1 3 . 1 1 97 97 THR CB C 97 65.654 65.654 68.726 -3.072 25567 1893 1 3 . 1 1 97 97 THR H H 97 6.366 6.366 8.345 -1.979 25567 1894 1 3 . 1 1 98 98 LEU N N 98 121.201 121.201 122.762 -1.561 25567 1895 1 3 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.010 -0.376 25567 1896 1 3 . 1 1 98 98 LEU C C 98 174.590 174.590 177.925 -3.335 25567 1897 1 3 . 1 1 98 98 LEU CA C 98 55.621 55.621 58.495 -2.874 25567 1898 1 3 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.752 -1.857 25567 1899 1 3 . 1 1 98 98 LEU H H 98 7.554 7.554 8.177 -0.623 25567 1900 1 3 . 1 1 99 99 LEU N N 99 118.677 118.677 116.269 2.408 25567 1901 1 3 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.837 -0.135 25567 1902 1 3 . 1 1 99 99 LEU C C 99 177.457 177.457 178.384 -0.927 25567 1903 1 3 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.178 -1.998 25567 1904 1 3 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.461 -1.473 25567 1905 1 3 . 1 1 99 99 LEU H H 99 8.160 8.160 8.055 0.105 25567 1906 1 3 . 1 1 100 100 ASP N N 100 118.914 118.914 116.015 2.899 25567 1907 1 3 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.447 -0.218 25567 1908 1 3 . 1 1 100 100 ASP C C 100 176.585 176.585 179.271 -2.686 25567 1909 1 3 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.303 -1.787 25567 1910 1 3 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.223 -3.644 25567 1911 1 3 . 1 1 100 100 ASP H H 100 7.872 7.872 7.786 0.086 25567 1912 1 3 . 1 1 101 101 GLN N N 101 118.135 118.135 119.331 -1.196 25567 1913 1 3 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.187 -0.027 25567 1914 1 3 . 1 1 101 101 GLN C C 101 174.601 174.601 178.092 -3.491 25567 1915 1 3 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.295 -3.335 25567 1916 1 3 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.199 -3.649 25567 1917 1 3 . 1 1 101 101 GLN H H 101 7.673 7.673 7.796 -0.123 25567 1918 1 3 . 1 1 102 102 MET N N 102 118.420 118.420 116.745 1.675 25567 1919 1 3 . 1 1 102 102 MET HA H 102 3.826 3.826 4.149 -0.323 25567 1920 1 3 . 1 1 102 102 MET C C 102 172.780 172.780 176.847 -4.067 25567 1921 1 3 . 1 1 102 102 MET CA C 102 53.428 53.428 56.331 -2.903 25567 1922 1 3 . 1 1 102 102 MET CB C 102 31.221 31.221 31.341 -0.120 25567 1923 1 3 . 1 1 102 102 MET H H 102 7.462 7.462 7.708 -0.246 25567 1924 1 3 . 1 1 103 103 LYS N N 103 116.066 116.066 119.533 -3.467 25567 1925 1 3 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.196 -0.276 25567 1926 1 3 . 1 1 103 103 LYS C C 103 173.922 173.922 177.097 -3.175 25567 1927 1 3 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.156 -1.874 25567 1928 1 3 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.637 -2.146 25567 1929 1 3 . 1 1 103 103 LYS H H 103 6.875 6.875 7.672 -0.797 25567 1930 1 3 . 1 1 104 104 ASN N N 104 114.987 114.987 116.486 -1.499 25567 1931 1 3 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.990 -0.249 25567 1932 1 3 . 1 1 104 104 ASN C C 104 172.587 172.587 174.793 -2.206 25567 1933 1 3 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.669 -2.200 25567 1934 1 3 . 1 1 104 104 ASN CB C 104 35.822 35.822 40.223 -4.401 25567 1935 1 3 . 1 1 104 104 ASN H H 104 8.517 8.517 8.128 0.389 25567 1936 1 3 . 1 1 105 105 TYR N N 105 122.755 122.755 121.012 1.743 25567 1937 1 3 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.437 0.138 25567 1938 1 3 . 1 1 105 105 TYR C C 105 174.260 174.260 175.217 -0.957 25567 1939 1 3 . 1 1 105 105 TYR CA C 105 55.493 55.493 58.501 -3.008 25567 1940 1 3 . 1 1 105 105 TYR CB C 105 36.064 36.064 38.500 -2.436 25567 1941 1 3 . 1 1 105 105 TYR H H 105 8.287 8.287 8.113 0.174 25567 1942 1 3 . 1 1 106 106 ARG N N 106 128.905 128.905 124.286 4.619 25567 1943 1 3 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.317 -0.044 25567 1944 1 3 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.401 -2.381 25567 1945 1 3 . 1 1 106 106 ARG CB C 106 28.130 28.130 30.526 -2.396 25567 1946 1 3 . 1 1 106 106 ARG H H 106 8.841 8.841 9.006 -0.165 25567 1947 1 3 . 1 1 107 107 GLY CA C 107 42.497 42.497 45.560 -3.063 25567 1948 1 3 . 1 1 108 108 GLU N N 108 116.989 116.989 119.342 -2.353 25567 1949 1 3 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.924 -0.293 25567 1950 1 3 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.399 -1.723 25567 1951 1 3 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.402 -3.000 25567 1952 1 3 . 1 1 108 108 GLU H H 108 7.536 7.536 8.181 -0.645 25567 1953 1 3 . 1 1 109 109 VAL N N 109 123.416 123.416 121.776 1.640 25567 1954 1 3 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.034 0.287 25567 1955 1 3 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.308 -2.865 25567 1956 1 3 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.372 -0.711 25567 1957 1 3 . 1 1 109 109 VAL H H 109 8.955 8.955 8.904 0.051 25567 1958 1 3 . 1 1 110 110 ALA N N 110 127.975 127.975 129.404 -1.429 25567 1959 1 3 . 1 1 110 110 ALA HA H 110 4.677 4.677 4.980 -0.303 25567 1960 1 3 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.935 -2.494 25567 1961 1 3 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.278 -3.862 25567 1962 1 3 . 1 1 110 110 ALA H H 110 8.860 8.860 8.372 0.488 25567 1963 1 3 . 1 1 111 111 SER N N 111 110.482 110.482 117.403 -6.921 25567 1964 1 3 . 1 1 111 111 SER HA H 111 5.502 5.502 5.241 0.261 25567 1965 1 3 . 1 1 111 111 SER CA C 111 51.630 51.630 56.319 -4.689 25567 1966 1 3 . 1 1 111 111 SER CB C 111 62.267 62.267 63.261 -0.994 25567 1967 1 3 . 1 1 111 111 SER H H 111 7.484 7.484 7.954 -0.470 25567 1968 1 3 . 1 1 112 112 PHE N N 112 125.082 125.082 123.244 1.838 25567 1969 1 3 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.464 0.984 25567 1970 1 3 . 1 1 112 112 PHE CA C 112 50.434 50.434 54.717 -4.283 25567 1971 1 3 . 1 1 112 112 PHE CB C 112 40.500 40.500 40.222 0.278 25567 1972 1 3 . 1 1 112 112 PHE H H 112 8.025 8.025 8.764 -0.739 25567 1973 1 3 . 1 1 113 113 PHE N N 113 115.872 115.872 118.544 -2.672 25567 1974 1 3 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.532 0.392 25567 1975 1 3 . 1 1 113 113 PHE C C 113 173.293 173.293 174.860 -1.567 25567 1976 1 3 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.045 -4.577 25567 1977 1 3 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.946 -3.553 25567 1978 1 3 . 1 1 113 113 PHE H H 113 7.391 7.391 8.256 -0.865 25567 1979 1 3 . 1 1 114 114 THR N N 114 108.721 108.721 111.050 -2.329 25567 1980 1 3 . 1 1 114 114 THR HA H 114 4.933 4.933 4.550 0.383 25567 1981 1 3 . 1 1 114 114 THR C C 114 171.891 171.891 174.451 -2.560 25567 1982 1 3 . 1 1 114 114 THR CA C 114 56.815 56.815 60.905 -4.090 25567 1983 1 3 . 1 1 114 114 THR CB C 114 67.899 67.899 70.328 -2.429 25567 1984 1 3 . 1 1 114 114 THR H H 114 7.951 7.951 8.135 -0.184 25567 1985 1 3 . 1 1 115 115 SER N N 115 115.159 115.159 118.972 -3.813 25567 1986 1 3 . 1 1 115 115 SER HA H 115 4.608 4.608 4.742 -0.134 25567 1987 1 3 . 1 1 115 115 SER C C 115 171.403 171.403 173.223 -1.820 25567 1988 1 3 . 1 1 115 115 SER CA C 115 55.570 55.570 58.259 -2.689 25567 1989 1 3 . 1 1 115 115 SER CB C 115 61.418 61.418 65.113 -3.695 25567 1990 1 3 . 1 1 115 115 SER H H 115 8.229 8.229 8.206 0.023 25567 1991 1 3 . 1 1 116 116 ALA N N 116 127.211 127.211 127.056 0.155 25567 1992 1 3 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.934 -0.478 25567 1993 1 3 . 1 1 116 116 ALA C C 116 175.758 175.758 178.307 -2.549 25567 1994 1 3 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.778 -1.962 25567 1995 1 3 . 1 1 116 116 ALA CB C 116 16.831 16.831 20.055 -3.224 25567 1996 1 3 . 1 1 116 116 ALA H H 116 8.813 8.813 8.287 0.526 25567 1997 1 3 . 1 1 117 117 GLY N N 117 108.099 108.099 108.774 -0.675 25567 1998 1 3 . 1 1 117 117 GLY C C 117 171.805 171.805 175.832 -4.027 25567 1999 1 3 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.196 -4.327 25567 2000 1 3 . 1 1 117 117 GLY H H 117 8.685 8.685 8.773 -0.088 25567 2001 1 3 . 1 1 118 118 THR N N 118 111.284 111.284 112.291 -1.007 25567 2002 1 3 . 1 1 118 118 THR HA H 118 4.343 4.343 4.370 -0.027 25567 2003 1 3 . 1 1 118 118 THR C C 118 171.769 171.769 173.449 -1.680 25567 2004 1 3 . 1 1 118 118 THR CA C 118 58.933 58.933 62.014 -3.081 25567 2005 1 3 . 1 1 118 118 THR CB C 118 67.304 67.304 69.576 -2.272 25567 2006 1 3 . 1 1 118 118 THR H H 118 7.998 7.998 8.226 -0.228 25567 2007 1 3 . 1 1 119 119 ASN N N 119 120.253 120.253 118.845 1.408 25567 2008 1 3 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.923 -0.220 25567 2009 1 3 . 1 1 119 119 ASN C C 119 172.353 172.353 173.646 -1.293 25567 2010 1 3 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.211 -2.983 25567 2011 1 3 . 1 1 119 119 ASN CB C 119 35.376 35.376 41.094 -5.718 25567 2012 1 3 . 1 1 119 119 ASN H H 119 8.381 8.381 7.822 0.559 25567 2013 1 3 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.317 -0.231 25567 2014 1 3 . 1 1 120 120 HIS C C 120 173.395 173.395 176.128 -2.733 25567 2015 1 3 . 1 1 120 120 HIS CA C 120 55.139 55.139 56.958 -1.819 25567 2016 1 3 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.374 -2.952 25567 2017 1 3 . 1 1 121 121 LYS N N 121 119.527 119.527 120.350 -0.823 25567 2018 1 3 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.829 -0.049 25567 2019 1 3 . 1 1 121 121 LYS C C 121 176.053 176.053 178.005 -1.952 25567 2020 1 3 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.213 -2.250 25567 2021 1 3 . 1 1 121 121 LYS CB C 121 29.660 29.660 32.106 -2.446 25567 2022 1 3 . 1 1 121 121 LYS H H 121 8.106 8.106 8.475 -0.369 25567 2023 1 3 . 1 1 122 122 ALA N N 122 121.585 121.585 121.876 -0.291 25567 2024 1 3 . 1 1 122 122 ALA HA H 122 3.721 3.721 4.011 -0.290 25567 2025 1 3 . 1 1 122 122 ALA C C 122 175.128 175.128 178.738 -3.610 25567 2026 1 3 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.128 -2.537 25567 2027 1 3 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.867 -2.163 25567 2028 1 3 . 1 1 122 122 ALA H H 122 7.702 7.702 7.903 -0.201 25567 2029 1 3 . 1 1 123 123 TYR N N 123 118.803 118.803 120.061 -1.258 25567 2030 1 3 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.834 -0.468 25567 2031 1 3 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.323 -1.232 25567 2032 1 3 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.345 -3.243 25567 2033 1 3 . 1 1 123 123 TYR H H 123 7.366 7.366 7.750 -0.384 25567 2034 1 3 . 1 1 124 124 VAL N N 124 117.530 117.530 118.239 -0.709 25567 2035 1 3 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.616 -0.417 25567 2036 1 3 . 1 1 124 124 VAL C C 124 175.375 175.375 178.159 -2.784 25567 2037 1 3 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.717 -2.134 25567 2038 1 3 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.540 -1.337 25567 2039 1 3 . 1 1 124 124 VAL H H 124 7.757 7.757 7.526 0.231 25567 2040 1 3 . 1 1 125 125 SER N N 125 114.023 114.023 114.983 -0.960 25567 2041 1 3 . 1 1 125 125 SER HA H 125 4.035 4.035 4.086 -0.051 25567 2042 1 3 . 1 1 125 125 SER C C 125 174.636 174.636 176.513 -1.877 25567 2043 1 3 . 1 1 125 125 SER CA C 125 58.885 58.885 61.663 -2.779 25567 2044 1 3 . 1 1 125 125 SER CB C 125 59.666 59.666 62.999 -3.333 25567 2045 1 3 . 1 1 125 125 SER H H 125 7.622 7.622 7.618 0.004 25567 2046 1 3 . 1 1 126 126 HIS N N 126 119.457 119.457 122.383 -2.926 25567 2047 1 3 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.887 0.309 25567 2048 1 3 . 1 1 126 126 HIS C C 126 172.942 172.942 176.745 -3.803 25567 2049 1 3 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.736 -3.818 25567 2050 1 3 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.414 -3.335 25567 2051 1 3 . 1 1 126 126 HIS H H 126 8.067 8.067 8.032 0.035 25567 2052 1 3 . 1 1 127 127 PHE N N 127 120.628 120.628 119.550 1.078 25567 2053 1 3 . 1 1 127 127 PHE HA H 127 3.199 3.199 4.044 -0.845 25567 2054 1 3 . 1 1 127 127 PHE C C 127 173.515 173.515 177.128 -3.613 25567 2055 1 3 . 1 1 127 127 PHE CA C 127 60.681 60.681 60.412 0.269 25567 2056 1 3 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.868 -2.501 25567 2057 1 3 . 1 1 127 127 PHE H H 127 9.083 9.083 8.246 0.837 25567 2058 1 3 . 1 1 128 128 ASN N N 128 114.858 114.858 116.206 -1.348 25567 2059 1 3 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.213 -0.135 25567 2060 1 3 . 1 1 128 128 ASN C C 128 175.338 175.338 178.200 -2.862 25567 2061 1 3 . 1 1 128 128 ASN CA C 128 54.250 54.250 55.632 -1.382 25567 2062 1 3 . 1 1 128 128 ASN CB C 128 36.021 36.021 37.864 -1.843 25567 2063 1 3 . 1 1 128 128 ASN H H 128 7.858 7.858 8.192 -0.334 25567 2064 1 3 . 1 1 129 129 GLU N N 129 119.811 119.811 120.671 -0.860 25567 2065 1 3 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.166 -0.125 25567 2066 1 3 . 1 1 129 129 GLU C C 129 176.941 176.941 178.779 -1.838 25567 2067 1 3 . 1 1 129 129 GLU CA C 129 56.632 56.632 59.124 -2.492 25567 2068 1 3 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.997 -3.059 25567 2069 1 3 . 1 1 129 129 GLU H H 129 7.569 7.569 7.887 -0.318 25567 2070 1 3 . 1 1 130 130 TRP N N 130 120.585 120.585 118.341 2.244 25567 2071 1 3 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.806 -0.334 25567 2072 1 3 . 1 1 130 130 TRP C C 130 174.262 174.262 175.287 -1.025 25567 2073 1 3 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.001 -1.328 25567 2074 1 3 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.741 -2.784 25567 2075 1 3 . 1 1 130 130 TRP H H 130 7.964 7.964 7.947 0.017 25567 2076 1 3 . 1 1 131 131 ALA N N 131 120.522 120.522 118.199 2.323 25567 2077 1 3 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.397 -0.450 25567 2078 1 3 . 1 1 131 131 ALA C C 131 172.489 172.489 175.112 -2.623 25567 2079 1 3 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.429 -2.849 25567 2080 1 3 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.305 -2.766 25567 2081 1 3 . 1 1 131 131 ALA H H 131 8.114 8.114 7.304 0.810 25567 2082 1 3 . 1 1 132 132 ASP N N 132 117.666 117.666 120.735 -3.069 25567 2083 1 3 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.373 -0.167 25567 2084 1 3 . 1 1 132 132 ASP C C 132 173.779 173.779 176.455 -2.676 25567 2085 1 3 . 1 1 132 132 ASP CA C 132 54.313 54.313 54.813 -0.500 25567 2086 1 3 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.234 0.222 25567 2087 1 3 . 1 1 132 132 ASP H H 132 6.768 6.768 8.126 -1.357 25567 2088 1 3 . 1 1 133 133 GLY N N 133 114.922 114.922 112.057 2.865 25567 2089 1 3 . 1 1 133 133 GLY C C 133 172.101 172.101 173.675 -1.574 25567 2090 1 3 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.495 -2.986 25567 2091 1 3 . 1 1 133 133 GLY H H 133 8.645 8.645 8.008 0.637 25567 2092 1 3 . 1 1 134 134 LEU N N 134 120.101 120.101 121.077 -0.976 25567 2093 1 3 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.328 0.134 25567 2094 1 3 . 1 1 134 134 LEU C C 134 174.098 174.098 176.389 -2.291 25567 2095 1 3 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.499 -2.415 25567 2096 1 3 . 1 1 134 134 LEU CB C 134 40.509 40.509 41.941 -1.433 25567 2097 1 3 . 1 1 134 134 LEU H H 134 8.049 8.049 7.422 0.627 25567 2098 1 3 . 1 1 135 135 ASN N N 135 119.258 119.258 121.062 -1.804 25567 2099 1 3 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.818 -0.179 25567 2100 1 3 . 1 1 135 135 ASN C C 135 170.564 170.564 174.408 -3.844 25567 2101 1 3 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.025 -3.772 25567 2102 1 3 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.194 -4.576 25567 2103 1 3 . 1 1 135 135 ASN H H 135 8.567 8.567 8.520 0.047 25567 2104 1 3 . 1 1 136 136 VAL N N 136 125.460 125.460 125.591 -0.131 25567 2105 1 3 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.861 -0.265 25567 2106 1 3 . 1 1 136 136 VAL C C 136 175.318 175.318 176.618 -1.300 25567 2107 1 3 . 1 1 136 136 VAL CA C 136 58.722 58.722 62.453 -3.731 25567 2108 1 3 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.285 -2.986 25567 2109 1 3 . 1 1 136 136 VAL H H 136 7.660 7.660 8.088 -0.428 25567 2110 1 3 . 1 1 137 137 ILE N N 137 122.021 122.021 123.296 -1.275 25567 2111 1 3 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.713 -0.285 25567 2112 1 3 . 1 1 137 137 ILE C C 137 173.943 173.943 175.261 -1.318 25567 2113 1 3 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.858 -0.900 25567 2114 1 3 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.936 -2.767 25567 2115 1 3 . 1 1 137 137 ILE H H 137 9.151 9.151 8.368 0.783 25567 2116 1 3 . 1 1 138 138 GLY N N 138 108.192 108.192 109.319 -1.127 25567 2117 1 3 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.930 -2.436 25567 2118 1 3 . 1 1 138 138 GLY H H 138 6.675 6.675 7.668 -0.993 25567 2119 1 3 . 1 1 139 139 VAL N N 139 119.673 119.673 116.854 2.819 25567 2120 1 3 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.793 0.527 25567 2121 1 3 . 1 1 139 139 VAL C C 139 172.291 172.291 174.816 -2.525 25567 2122 1 3 . 1 1 139 139 VAL CA C 139 58.209 58.209 60.866 -2.657 25567 2123 1 3 . 1 1 139 139 VAL CB C 139 32.639 32.639 32.240 0.398 25567 2124 1 3 . 1 1 139 139 VAL H H 139 8.158 8.158 8.510 -0.352 25567 2125 1 3 . 1 1 140 140 ALA N N 140 127.104 127.104 126.237 0.867 25567 2126 1 3 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.832 -0.236 25567 2127 1 3 . 1 1 140 140 ALA C C 140 171.057 171.057 177.098 -6.041 25567 2128 1 3 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.761 -1.878 25567 2129 1 3 . 1 1 140 140 ALA CB C 140 21.428 21.428 21.794 -0.366 25567 2130 1 3 . 1 1 140 140 ALA H H 140 9.145 9.145 8.191 0.954 25567 2131 1 3 . 1 1 141 141 ARG N N 141 118.828 118.828 118.878 -0.050 25567 2132 1 3 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.777 -1.037 25567 2133 1 3 . 1 1 141 141 ARG C C 141 173.524 173.524 176.548 -3.024 25567 2134 1 3 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.186 -2.300 25567 2135 1 3 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.203 -1.749 25567 2136 1 3 . 1 1 141 141 ARG H H 141 7.759 7.759 8.326 -0.567 25567 2137 1 3 . 1 1 142 142 ASP N N 142 125.557 125.557 121.127 4.430 25567 2138 1 3 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.184 -0.405 25567 2139 1 3 . 1 1 142 142 ASP C C 142 169.292 169.292 176.496 -7.204 25567 2140 1 3 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.302 -2.680 25567 2141 1 3 . 1 1 142 142 ASP CB C 142 37.080 37.080 39.914 -2.834 25567 2142 1 3 . 1 1 142 142 ASP H H 142 9.087 9.087 8.278 0.809 25567 2143 1 3 . 1 1 143 143 ASP N N 143 119.094 119.094 118.098 0.996 25567 2144 1 3 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.641 -0.387 25567 2145 1 3 . 1 1 143 143 ASP C C 143 175.557 175.557 177.755 -2.198 25567 2146 1 3 . 1 1 143 143 ASP CA C 143 49.079 49.079 54.587 -5.508 25567 2147 1 3 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.804 -4.362 25567 2148 1 3 . 1 1 143 143 ASP H H 143 8.175 8.175 8.667 -0.492 25567 2149 1 3 . 1 1 144 144 SER N N 144 115.438 115.438 115.318 0.120 25567 2150 1 3 . 1 1 144 144 SER HA H 144 3.745 3.745 4.143 -0.398 25567 2151 1 3 . 1 1 144 144 SER C C 144 172.820 172.820 173.903 -1.083 25567 2152 1 3 . 1 1 144 144 SER CA C 144 59.336 59.336 60.404 -1.067 25567 2153 1 3 . 1 1 144 144 SER CB C 144 60.839 60.839 63.086 -2.247 25567 2154 1 3 . 1 1 144 144 SER H H 144 7.742 7.742 7.477 0.265 25567 2155 1 3 . 1 1 145 145 GLU N N 145 119.631 119.631 118.055 1.576 25567 2156 1 3 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.151 0.168 25567 2157 1 3 . 1 1 145 145 GLU C C 145 171.927 171.927 175.903 -3.976 25567 2158 1 3 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.022 -2.938 25567 2159 1 3 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.576 -2.803 25567 2160 1 3 . 1 1 145 145 GLU H H 145 7.924 7.924 7.717 0.207 25567 2161 1 3 . 1 1 146 146 VAL N N 146 118.791 118.791 121.051 -2.260 25567 2162 1 3 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.512 -0.556 25567 2163 1 3 . 1 1 146 146 VAL C C 146 174.582 174.582 177.219 -2.637 25567 2164 1 3 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.609 -2.530 25567 2165 1 3 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.179 -2.039 25567 2166 1 3 . 1 1 146 146 VAL H H 146 6.393 6.393 7.449 -1.056 25567 2167 1 3 . 1 1 147 147 ASP N N 147 119.410 119.410 116.797 2.613 25567 2168 1 3 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.331 -0.261 25567 2169 1 3 . 1 1 147 147 ASP C C 147 174.774 174.774 176.861 -2.087 25567 2170 1 3 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.822 -2.500 25567 2171 1 3 . 1 1 147 147 ASP CB C 147 37.204 37.204 39.926 -2.722 25567 2172 1 3 . 1 1 147 147 ASP H H 147 8.393 8.393 8.727 -0.334 25567 2173 1 3 . 1 1 148 148 LYS N N 148 119.422 119.422 116.347 3.075 25567 2174 1 3 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.502 -0.551 25567 2175 1 3 . 1 1 148 148 LYS C C 148 176.410 176.410 176.985 -0.575 25567 2176 1 3 . 1 1 148 148 LYS CA C 148 55.736 55.736 56.465 -0.730 25567 2177 1 3 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.873 -3.297 25567 2178 1 3 . 1 1 148 148 LYS H H 148 7.078 7.078 7.332 -0.254 25567 2179 1 3 . 1 1 149 149 TRP N N 149 118.168 118.168 120.875 -2.707 25567 2180 1 3 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.970 -0.369 25567 2181 1 3 . 1 1 149 149 TRP C C 149 174.199 174.199 176.244 -2.045 25567 2182 1 3 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.769 -1.974 25567 2183 1 3 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.175 -1.164 25567 2184 1 3 . 1 1 149 149 TRP H H 149 7.914 7.914 7.811 0.103 25567 2185 1 3 . 1 1 150 150 SER N N 150 109.636 109.636 113.977 -4.341 25567 2186 1 3 . 1 1 150 150 SER HA H 150 4.242 4.242 4.572 -0.330 25567 2187 1 3 . 1 1 150 150 SER C C 150 170.173 170.173 174.496 -4.323 25567 2188 1 3 . 1 1 150 150 SER CA C 150 56.912 56.912 58.803 -1.891 25567 2189 1 3 . 1 1 150 150 SER CB C 150 62.087 62.087 63.810 -1.723 25567 2190 1 3 . 1 1 150 150 SER H H 150 7.814 7.814 8.214 -0.400 25567 2191 1 4 . 1 1 2 2 MET HA H 2 4.416 4.416 4.823 -0.407 25567 2192 1 4 . 1 1 2 2 MET CA C 2 52.847 52.847 56.233 -3.385 25567 2193 1 4 . 1 1 2 2 MET CB C 2 30.672 30.672 33.513 -2.841 25567 2194 1 4 . 1 1 3 3 ALA N N 3 125.563 125.563 129.268 -3.705 25567 2195 1 4 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.462 -0.090 25567 2196 1 4 . 1 1 3 3 ALA C C 3 174.728 174.728 175.749 -1.021 25567 2197 1 4 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.376 -3.027 25567 2198 1 4 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.134 -3.199 25567 2199 1 4 . 1 1 3 3 ALA H H 3 8.342 8.342 8.349 -0.007 25567 2200 1 4 . 1 1 4 4 LYS N N 4 121.767 121.767 125.508 -3.741 25567 2201 1 4 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.506 -0.276 25567 2202 1 4 . 1 1 4 4 LYS C C 4 174.577 174.577 176.146 -1.569 25567 2203 1 4 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.406 -1.417 25567 2204 1 4 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.286 -0.731 25567 2205 1 4 . 1 1 4 4 LYS H H 4 8.500 8.500 8.557 -0.057 25567 2206 1 4 . 1 1 5 5 LYS N N 5 129.654 129.654 121.718 7.936 25567 2207 1 4 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.379 0.147 25567 2208 1 4 . 1 1 5 5 LYS C C 5 174.731 174.731 176.458 -1.727 25567 2209 1 4 . 1 1 5 5 LYS CA C 5 54.746 54.746 56.446 -1.700 25567 2210 1 4 . 1 1 5 5 LYS CB C 5 29.894 29.894 33.579 -3.685 25567 2211 1 4 . 1 1 5 5 LYS H H 5 10.035 10.035 8.153 1.882 25567 2212 1 4 . 1 1 6 6 THR N N 6 126.212 126.212 113.890 12.322 25567 2213 1 4 . 1 1 6 6 THR HA H 6 5.654 5.654 5.565 0.089 25567 2214 1 4 . 1 1 6 6 THR C C 6 169.897 169.897 173.722 -3.825 25567 2215 1 4 . 1 1 6 6 THR CA C 6 60.647 60.647 61.300 -0.653 25567 2216 1 4 . 1 1 6 6 THR CB C 6 68.152 68.152 72.305 -4.153 25567 2217 1 4 . 1 1 6 6 THR H H 6 8.557 8.557 8.363 0.194 25567 2218 1 4 . 1 1 7 7 LEU N N 7 130.776 130.776 123.617 7.159 25567 2219 1 4 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.980 -0.361 25567 2220 1 4 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.727 -3.631 25567 2221 1 4 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.723 -5.680 25567 2222 1 4 . 1 1 7 7 LEU H H 7 8.610 8.610 8.367 0.243 25567 2223 1 4 . 1 1 8 8 ILE N N 8 127.175 127.175 122.488 4.687 25567 2224 1 4 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.835 0.021 25567 2225 1 4 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.544 -3.151 25567 2226 1 4 . 1 1 8 8 ILE CB C 8 36.864 36.864 39.674 -2.810 25567 2227 1 4 . 1 1 8 8 ILE H H 8 9.263 9.263 8.362 0.901 25567 2228 1 4 . 1 1 9 9 LEU N N 9 127.117 127.117 129.666 -2.549 25567 2229 1 4 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.165 0.531 25567 2230 1 4 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.601 -3.649 25567 2231 1 4 . 1 1 9 9 LEU CB C 9 43.827 43.827 41.761 2.066 25567 2232 1 4 . 1 1 9 9 LEU H H 9 9.262 9.262 8.368 0.894 25567 2233 1 4 . 1 1 10 10 TYR N N 10 113.544 113.544 122.156 -8.612 25567 2234 1 4 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.072 0.459 25567 2235 1 4 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.017 -2.188 25567 2236 1 4 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.992 -2.377 25567 2237 1 4 . 1 1 10 10 TYR H H 10 7.425 7.425 7.775 -0.350 25567 2238 1 4 . 1 1 11 11 TYR N N 11 121.235 121.235 121.177 0.058 25567 2239 1 4 . 1 1 11 11 TYR HA H 11 4.810 4.810 5.186 -0.376 25567 2240 1 4 . 1 1 11 11 TYR CA C 11 53.889 53.889 54.951 -1.062 25567 2241 1 4 . 1 1 11 11 TYR CB C 11 40.467 40.467 40.546 -0.079 25567 2242 1 4 . 1 1 11 11 TYR H H 11 7.781 7.781 8.631 -0.850 25567 2243 1 4 . 1 1 14 14 SER CA C 14 54.675 54.675 57.029 -2.354 25567 2244 1 4 . 1 1 14 14 SER CB C 14 61.621 61.621 66.139 -4.518 25567 2245 1 4 . 1 1 15 15 GLY N N 15 110.420 110.420 109.792 0.628 25567 2246 1 4 . 1 1 15 15 GLY CA C 15 43.727 43.727 46.097 -2.370 25567 2247 1 4 . 1 1 15 15 GLY H H 15 7.757 7.757 8.583 -0.826 25567 2248 1 4 . 1 1 17 17 THR HA H 17 4.122 4.122 4.131 -0.009 25567 2249 1 4 . 1 1 17 17 THR CA C 17 64.748 64.748 64.874 -0.126 25567 2250 1 4 . 1 1 17 17 THR CB C 17 64.532 64.532 68.608 -4.076 25567 2251 1 4 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.497 -0.579 25567 2252 1 4 . 1 1 18 18 LYS C C 18 173.812 173.812 178.316 -4.504 25567 2253 1 4 . 1 1 18 18 LYS CA C 18 57.003 57.003 60.123 -3.120 25567 2254 1 4 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.263 -2.495 25567 2255 1 4 . 1 1 19 19 LYS N N 19 116.699 116.699 117.949 -1.250 25567 2256 1 4 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.987 -0.039 25567 2257 1 4 . 1 1 19 19 LYS C C 19 177.221 177.221 179.316 -2.095 25567 2258 1 4 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.866 -2.445 25567 2259 1 4 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.030 -2.396 25567 2260 1 4 . 1 1 19 19 LYS H H 19 7.476 7.476 7.501 -0.025 25567 2261 1 4 . 1 1 20 20 MET N N 20 118.946 118.946 114.442 4.504 25567 2262 1 4 . 1 1 20 20 MET HA H 20 4.474 4.474 4.527 -0.053 25567 2263 1 4 . 1 1 20 20 MET C C 20 173.826 173.826 176.492 -2.666 25567 2264 1 4 . 1 1 20 20 MET CA C 20 52.285 52.285 53.722 -1.437 25567 2265 1 4 . 1 1 20 20 MET CB C 20 26.921 26.921 30.935 -4.014 25567 2266 1 4 . 1 1 20 20 MET H H 20 7.457 7.457 7.501 -0.044 25567 2267 1 4 . 1 1 21 21 ALA N N 21 123.375 123.375 121.305 2.070 25567 2268 1 4 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.456 -0.904 25567 2269 1 4 . 1 1 21 21 ALA C C 21 176.542 176.542 178.900 -2.358 25567 2270 1 4 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.478 -0.827 25567 2271 1 4 . 1 1 21 21 ALA CB C 21 16.282 16.282 19.976 -3.694 25567 2272 1 4 . 1 1 21 21 ALA H H 21 8.549 8.549 7.603 0.946 25567 2273 1 4 . 1 1 22 22 GLU N N 22 116.906 116.906 119.394 -2.488 25567 2274 1 4 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.947 -0.275 25567 2275 1 4 . 1 1 22 22 GLU C C 22 176.658 176.658 179.028 -2.370 25567 2276 1 4 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.592 -2.987 25567 2277 1 4 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.477 -2.828 25567 2278 1 4 . 1 1 22 22 GLU H H 22 8.085 8.085 7.959 0.126 25567 2279 1 4 . 1 1 23 23 LYS N N 23 123.301 123.301 119.440 3.861 25567 2280 1 4 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.042 -0.222 25567 2281 1 4 . 1 1 23 23 LYS C C 23 177.363 177.363 178.950 -1.587 25567 2282 1 4 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.175 -2.204 25567 2283 1 4 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.080 -2.549 25567 2284 1 4 . 1 1 23 23 LYS H H 23 7.703 7.703 7.344 0.359 25567 2285 1 4 . 1 1 24 24 ILE N N 24 121.894 121.894 117.741 4.153 25567 2286 1 4 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.614 -0.318 25567 2287 1 4 . 1 1 24 24 ILE C C 24 174.944 174.944 177.891 -2.947 25567 2288 1 4 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.548 -1.315 25567 2289 1 4 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.471 -2.727 25567 2290 1 4 . 1 1 24 24 ILE H H 24 8.458 8.458 7.893 0.565 25567 2291 1 4 . 1 1 25 25 ASN N N 25 118.580 118.580 116.998 1.582 25567 2292 1 4 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.380 -0.146 25567 2293 1 4 . 1 1 25 25 ASN C C 25 173.567 173.567 176.546 -2.979 25567 2294 1 4 . 1 1 25 25 ASN CA C 25 52.324 52.324 55.976 -3.652 25567 2295 1 4 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.800 -0.617 25567 2296 1 4 . 1 1 25 25 ASN H H 25 8.273 8.273 8.052 0.221 25567 2297 1 4 . 1 1 26 26 SER N N 26 112.132 112.132 113.839 -1.707 25567 2298 1 4 . 1 1 26 26 SER HA H 26 4.148 4.148 4.390 -0.242 25567 2299 1 4 . 1 1 26 26 SER C C 26 172.083 172.083 175.200 -3.117 25567 2300 1 4 . 1 1 26 26 SER CA C 26 57.865 57.865 60.033 -2.168 25567 2301 1 4 . 1 1 26 26 SER CB C 26 60.816 60.816 63.541 -2.725 25567 2302 1 4 . 1 1 26 26 SER H H 26 7.444 7.444 7.742 -0.298 25567 2303 1 4 . 1 1 27 27 GLU N N 27 120.080 120.080 119.364 0.716 25567 2304 1 4 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.417 -0.317 25567 2305 1 4 . 1 1 27 27 GLU C C 27 173.647 173.647 175.483 -1.836 25567 2306 1 4 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.252 -2.050 25567 2307 1 4 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.023 -3.139 25567 2308 1 4 . 1 1 27 27 GLU H H 27 7.453 7.453 7.604 -0.151 25567 2309 1 4 . 1 1 28 28 ILE N N 28 118.759 118.759 119.137 -0.378 25567 2310 1 4 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.332 -0.128 25567 2311 1 4 . 1 1 28 28 ILE C C 28 172.474 172.474 174.998 -2.524 25567 2312 1 4 . 1 1 28 28 ILE CA C 28 57.747 57.747 59.842 -2.095 25567 2313 1 4 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.890 -5.092 25567 2314 1 4 . 1 1 28 28 ILE H H 28 7.258 7.258 7.165 0.093 25567 2315 1 4 . 1 1 29 29 LYS N N 29 130.618 130.618 127.187 3.431 25567 2316 1 4 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.239 -0.234 25567 2317 1 4 . 1 1 29 29 LYS C C 29 174.375 174.375 176.426 -2.051 25567 2318 1 4 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.666 -2.007 25567 2319 1 4 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.718 -3.158 25567 2320 1 4 . 1 1 29 29 LYS H H 29 8.588 8.588 8.689 -0.101 25567 2321 1 4 . 1 1 30 30 ASP N N 30 119.366 119.366 119.777 -0.411 25567 2322 1 4 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.390 0.012 25567 2323 1 4 . 1 1 30 30 ASP C C 30 172.580 172.580 175.673 -3.093 25567 2324 1 4 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.246 -1.622 25567 2325 1 4 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.785 -3.957 25567 2326 1 4 . 1 1 30 30 ASP H H 30 8.940 8.940 8.731 0.209 25567 2327 1 4 . 1 1 31 31 SER N N 31 114.035 114.035 114.109 -0.074 25567 2328 1 4 . 1 1 31 31 SER HA H 31 4.781 4.781 4.526 0.255 25567 2329 1 4 . 1 1 31 31 SER C C 31 171.136 171.136 173.767 -2.631 25567 2330 1 4 . 1 1 31 31 SER CA C 31 55.638 55.638 59.257 -3.619 25567 2331 1 4 . 1 1 31 31 SER CB C 31 62.388 62.388 64.229 -1.841 25567 2332 1 4 . 1 1 31 31 SER H H 31 8.030 8.030 7.847 0.183 25567 2333 1 4 . 1 1 32 32 GLU N N 32 121.406 121.406 117.980 3.426 25567 2334 1 4 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.684 0.051 25567 2335 1 4 . 1 1 32 32 GLU C C 32 171.205 171.205 174.796 -3.591 25567 2336 1 4 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.388 -3.319 25567 2337 1 4 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.117 -2.227 25567 2338 1 4 . 1 1 32 32 GLU H H 32 8.188 8.188 8.393 -0.205 25567 2339 1 4 . 1 1 33 33 LEU N N 33 126.143 126.143 117.435 8.708 25567 2340 1 4 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.441 -0.156 25567 2341 1 4 . 1 1 33 33 LEU C C 33 173.401 173.401 175.690 -2.289 25567 2342 1 4 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.197 -1.863 25567 2343 1 4 . 1 1 33 33 LEU CB C 33 43.623 43.623 45.110 -1.487 25567 2344 1 4 . 1 1 33 33 LEU H H 33 8.627 8.627 8.418 0.209 25567 2345 1 4 . 1 1 34 34 LYS N N 34 127.122 127.122 123.153 3.969 25567 2346 1 4 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.726 -0.127 25567 2347 1 4 . 1 1 34 34 LYS C C 34 169.644 169.644 174.622 -4.978 25567 2348 1 4 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.024 -1.671 25567 2349 1 4 . 1 1 34 34 LYS CB C 34 34.172 34.172 36.905 -2.733 25567 2350 1 4 . 1 1 34 34 LYS H H 34 9.399 9.399 9.009 0.390 25567 2351 1 4 . 1 1 35 35 GLU N N 35 122.766 122.766 121.201 1.565 25567 2352 1 4 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.615 -1.257 25567 2353 1 4 . 1 1 35 35 GLU C C 35 172.875 172.875 175.471 -2.596 25567 2354 1 4 . 1 1 35 35 GLU CA C 35 52.640 52.640 54.705 -2.065 25567 2355 1 4 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.983 -2.715 25567 2356 1 4 . 1 1 35 35 GLU H H 35 8.166 8.166 8.287 -0.121 25567 2357 1 4 . 1 1 36 36 VAL N N 36 126.674 126.674 120.658 6.016 25567 2358 1 4 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.378 -0.517 25567 2359 1 4 . 1 1 36 36 VAL C C 36 171.451 171.451 174.865 -3.414 25567 2360 1 4 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.681 -1.144 25567 2361 1 4 . 1 1 36 36 VAL CB C 36 29.689 29.689 33.224 -3.535 25567 2362 1 4 . 1 1 36 36 VAL H H 36 8.632 8.632 7.830 0.802 25567 2363 1 4 . 1 1 37 37 LYS N N 37 126.181 126.181 127.729 -1.548 25567 2364 1 4 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.789 0.150 25567 2365 1 4 . 1 1 37 37 LYS CA C 37 52.179 52.179 55.073 -2.894 25567 2366 1 4 . 1 1 37 37 LYS CB C 37 32.898 32.898 34.508 -1.610 25567 2367 1 4 . 1 1 37 37 LYS H H 37 7.867 7.867 8.918 -1.051 25567 2368 1 4 . 1 1 38 38 VAL N N 38 113.540 113.540 115.639 -2.099 25567 2369 1 4 . 1 1 38 38 VAL HA H 38 4.686 4.686 5.136 -0.450 25567 2370 1 4 . 1 1 38 38 VAL C C 38 173.633 173.633 175.228 -1.595 25567 2371 1 4 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.716 -2.432 25567 2372 1 4 . 1 1 38 38 VAL CB C 38 31.964 31.964 34.816 -2.853 25567 2373 1 4 . 1 1 38 38 VAL H H 38 8.389 8.389 8.212 0.177 25567 2374 1 4 . 1 1 39 39 SER N N 39 118.860 118.860 117.967 0.893 25567 2375 1 4 . 1 1 39 39 SER HA H 39 4.194 4.194 4.574 -0.380 25567 2376 1 4 . 1 1 39 39 SER C C 39 173.059 173.059 174.686 -1.627 25567 2377 1 4 . 1 1 39 39 SER CA C 39 56.227 56.227 57.755 -1.528 25567 2378 1 4 . 1 1 39 39 SER CB C 39 60.771 60.771 64.686 -3.915 25567 2379 1 4 . 1 1 39 39 SER H H 39 8.668 8.668 8.447 0.221 25567 2380 1 4 . 1 1 40 40 GLU N N 40 125.769 125.769 119.688 6.081 25567 2381 1 4 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.445 -0.288 25567 2382 1 4 . 1 1 40 40 GLU C C 40 174.484 174.484 177.710 -3.226 25567 2383 1 4 . 1 1 40 40 GLU CA C 40 55.550 55.550 57.046 -1.496 25567 2384 1 4 . 1 1 40 40 GLU CB C 40 27.054 27.054 31.422 -4.368 25567 2385 1 4 . 1 1 40 40 GLU H H 40 8.878 8.878 8.435 0.443 25567 2386 1 4 . 1 1 41 41 GLY N N 41 112.165 112.165 108.899 3.266 25567 2387 1 4 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.753 -3.046 25567 2388 1 4 . 1 1 41 41 GLY H H 41 8.743 8.743 8.682 0.061 25567 2389 1 4 . 1 1 44 44 ASP N N 44 122.324 122.324 117.991 4.333 25567 2390 1 4 . 1 1 44 44 ASP CB C 44 42.156 42.156 41.154 1.002 25567 2391 1 4 . 1 1 44 44 ASP H H 44 7.918 7.918 8.450 -0.532 25567 2392 1 4 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.362 -0.300 25567 2393 1 4 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.514 -1.105 25567 2394 1 4 . 1 1 45 45 ALA CB C 45 16.376 16.376 20.198 -3.822 25567 2395 1 4 . 1 1 47 47 MET CA C 47 54.118 54.118 54.550 -0.432 25567 2396 1 4 . 1 1 47 47 MET CB C 47 27.527 27.527 34.723 -7.196 25567 2397 1 4 . 1 1 48 48 TYR N N 48 120.075 120.075 119.423 0.652 25567 2398 1 4 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.894 -0.740 25567 2399 1 4 . 1 1 48 48 TYR C C 48 172.217 172.217 174.781 -2.564 25567 2400 1 4 . 1 1 48 48 TYR CA C 48 57.377 57.377 58.373 -0.996 25567 2401 1 4 . 1 1 48 48 TYR CB C 48 34.496 34.496 40.366 -5.870 25567 2402 1 4 . 1 1 48 48 TYR H H 48 7.810 7.810 8.512 -0.702 25567 2403 1 4 . 1 1 49 49 LYS N N 49 118.369 118.369 125.646 -7.277 25567 2404 1 4 . 1 1 49 49 LYS H H 49 8.116 8.116 8.374 -0.258 25567 2405 1 4 . 1 1 50 50 THR N N 50 116.979 116.979 114.224 2.755 25567 2406 1 4 . 1 1 50 50 THR CB C 50 66.373 66.373 69.072 -2.699 25567 2407 1 4 . 1 1 50 50 THR H H 50 7.741 7.741 7.747 -0.006 25567 2408 1 4 . 1 1 51 51 SER N N 51 116.155 116.155 111.088 5.067 25567 2409 1 4 . 1 1 51 51 SER HA H 51 3.771 3.771 4.623 -0.852 25567 2410 1 4 . 1 1 51 51 SER C C 51 170.563 170.563 172.610 -2.047 25567 2411 1 4 . 1 1 51 51 SER CA C 51 54.840 54.840 56.862 -2.022 25567 2412 1 4 . 1 1 51 51 SER CB C 51 60.318 60.318 65.089 -4.771 25567 2413 1 4 . 1 1 51 51 SER H H 51 7.853 7.853 7.271 0.582 25567 2414 1 4 . 1 1 54 54 ALA N N 54 123.234 123.234 123.073 0.161 25567 2415 1 4 . 1 1 54 54 ALA HA H 54 4.248 4.248 3.955 0.293 25567 2416 1 4 . 1 1 54 54 ALA CA C 54 51.268 51.268 53.674 -2.406 25567 2417 1 4 . 1 1 54 54 ALA CB C 54 16.434 16.434 17.746 -1.312 25567 2418 1 4 . 1 1 54 54 ALA H H 54 8.207 8.207 8.187 0.020 25567 2419 1 4 . 1 1 55 55 LEU N N 55 118.603 118.603 123.441 -4.838 25567 2420 1 4 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.209 -0.269 25567 2421 1 4 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.938 -1.227 25567 2422 1 4 . 1 1 55 55 LEU CB C 55 38.913 38.913 40.090 -1.177 25567 2423 1 4 . 1 1 55 55 LEU H H 55 7.960 7.960 8.164 -0.204 25567 2424 1 4 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.143 -0.467 25567 2425 1 4 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.376 0.118 25567 2426 1 4 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.728 -3.674 25567 2427 1 4 . 1 1 59 59 GLN N N 59 117.579 117.579 122.081 -4.502 25567 2428 1 4 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.181 -0.048 25567 2429 1 4 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.869 -2.860 25567 2430 1 4 . 1 1 59 59 GLN CB C 59 26.651 26.651 27.573 -0.922 25567 2431 1 4 . 1 1 59 59 GLN H H 59 8.268 8.268 8.500 -0.232 25567 2432 1 4 . 1 1 60 60 GLY N N 60 107.308 107.308 112.924 -5.616 25567 2433 1 4 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.364 -2.385 25567 2434 1 4 . 1 1 60 60 GLY H H 60 7.780 7.780 8.498 -0.718 25567 2435 1 4 . 1 1 61 61 ASN N N 61 117.747 117.747 119.563 -1.816 25567 2436 1 4 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.795 -0.261 25567 2437 1 4 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.984 -1.749 25567 2438 1 4 . 1 1 61 61 ASN CB C 61 36.424 36.424 40.160 -3.736 25567 2439 1 4 . 1 1 61 61 ASN H H 61 8.108 8.108 7.829 0.279 25567 2440 1 4 . 1 1 64 64 PHE N N 64 120.102 120.102 123.172 -3.070 25567 2441 1 4 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.563 -0.184 25567 2442 1 4 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.099 -2.351 25567 2443 1 4 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.165 -2.890 25567 2444 1 4 . 1 1 64 64 PHE H H 64 8.300 8.300 7.350 0.950 25567 2445 1 4 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.550 -0.215 25567 2446 1 4 . 1 1 65 65 PRO C C 65 173.870 173.870 176.155 -2.285 25567 2447 1 4 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.555 -2.538 25567 2448 1 4 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.656 -3.021 25567 2449 1 4 . 1 1 66 66 GLU N N 66 121.258 121.258 120.059 1.199 25567 2450 1 4 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.274 -0.040 25567 2451 1 4 . 1 1 66 66 GLU C C 66 173.981 173.981 176.453 -2.472 25567 2452 1 4 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.027 -2.240 25567 2453 1 4 . 1 1 66 66 GLU CB C 66 27.775 27.775 31.044 -3.268 25567 2454 1 4 . 1 1 66 66 GLU H H 66 8.316 8.316 8.424 -0.108 25567 2455 1 4 . 1 1 67 67 ILE N N 67 114.290 114.290 116.878 -2.588 25567 2456 1 4 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.870 0.260 25567 2457 1 4 . 1 1 67 67 ILE C C 67 172.700 172.700 175.486 -2.786 25567 2458 1 4 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.526 -3.087 25567 2459 1 4 . 1 1 67 67 ILE CB C 67 39.159 39.159 39.713 -0.554 25567 2460 1 4 . 1 1 67 67 ILE H H 67 8.366 8.366 8.190 0.176 25567 2461 1 4 . 1 1 68 68 GLN N N 68 121.422 121.422 123.292 -1.870 25567 2462 1 4 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.841 -0.340 25567 2463 1 4 . 1 1 68 68 GLN C C 68 171.675 171.675 174.318 -2.643 25567 2464 1 4 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.856 -2.583 25567 2465 1 4 . 1 1 68 68 GLN CB C 68 27.143 27.143 31.664 -4.521 25567 2466 1 4 . 1 1 68 68 GLN H H 68 8.737 8.737 8.230 0.507 25567 2467 1 4 . 1 1 69 69 LEU N N 69 125.311 125.311 119.136 6.175 25567 2468 1 4 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.747 -0.241 25567 2469 1 4 . 1 1 69 69 LEU C C 69 172.634 172.634 174.773 -2.139 25567 2470 1 4 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.833 -2.074 25567 2471 1 4 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.536 -1.132 25567 2472 1 4 . 1 1 69 69 LEU H H 69 8.051 8.051 8.280 -0.229 25567 2473 1 4 . 1 1 70 70 ASP N N 70 122.763 122.763 119.850 2.913 25567 2474 1 4 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.709 -0.286 25567 2475 1 4 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.090 -1.480 25567 2476 1 4 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.100 -3.383 25567 2477 1 4 . 1 1 70 70 ASP H H 70 8.313 8.313 8.535 -0.222 25567 2478 1 4 . 1 1 71 71 ASN N N 71 117.413 117.413 119.077 -1.664 25567 2479 1 4 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.632 -0.295 25567 2480 1 4 . 1 1 71 71 ASN C C 71 171.770 171.770 174.898 -3.128 25567 2481 1 4 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.088 -1.597 25567 2482 1 4 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.674 -2.348 25567 2483 1 4 . 1 1 71 71 ASN H H 71 8.407 8.407 8.451 -0.044 25567 2484 1 4 . 1 1 72 72 ILE N N 72 123.752 123.752 122.776 0.976 25567 2485 1 4 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.059 -0.119 25567 2486 1 4 . 1 1 72 72 ILE C C 72 171.621 171.621 174.911 -3.290 25567 2487 1 4 . 1 1 72 72 ILE CA C 72 57.332 57.332 61.443 -4.111 25567 2488 1 4 . 1 1 72 72 ILE CB C 72 38.489 38.489 38.662 -0.173 25567 2489 1 4 . 1 1 72 72 ILE H H 72 7.639 7.639 7.611 0.028 25567 2490 1 4 . 1 1 73 73 ASP N N 73 125.252 125.252 124.381 0.871 25567 2491 1 4 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.520 0.105 25567 2492 1 4 . 1 1 73 73 ASP C C 73 174.034 174.034 175.101 -1.067 25567 2493 1 4 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.541 -3.338 25567 2494 1 4 . 1 1 73 73 ASP CB C 73 37.024 37.024 43.380 -6.356 25567 2495 1 4 . 1 1 73 73 ASP H H 73 8.394 8.394 8.389 0.005 25567 2496 1 4 . 1 1 74 74 TYR N N 74 123.108 123.108 121.863 1.245 25567 2497 1 4 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.528 -0.650 25567 2498 1 4 . 1 1 74 74 TYR C C 74 173.637 173.637 177.469 -3.832 25567 2499 1 4 . 1 1 74 74 TYR CA C 74 59.474 59.474 59.477 -0.003 25567 2500 1 4 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.754 -4.032 25567 2501 1 4 . 1 1 74 74 TYR H H 74 7.392 7.392 8.467 -1.075 25567 2502 1 4 . 1 1 75 75 ASN N N 75 109.422 109.422 117.933 -8.511 25567 2503 1 4 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.523 0.403 25567 2504 1 4 . 1 1 75 75 ASN C C 75 172.574 172.574 176.267 -3.693 25567 2505 1 4 . 1 1 75 75 ASN CA C 75 52.761 52.761 56.127 -3.366 25567 2506 1 4 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.499 -2.882 25567 2507 1 4 . 1 1 75 75 ASN H H 75 8.058 8.058 8.965 -0.907 25567 2508 1 4 . 1 1 76 76 ASN N N 76 117.422 117.422 115.757 1.665 25567 2509 1 4 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.577 -0.122 25567 2510 1 4 . 1 1 76 76 ASN C C 76 171.132 171.132 175.033 -3.901 25567 2511 1 4 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.768 -2.601 25567 2512 1 4 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.472 -2.744 25567 2513 1 4 . 1 1 76 76 ASN H H 76 7.768 7.768 7.936 -0.168 25567 2514 1 4 . 1 1 77 77 TYR N N 77 116.873 116.873 117.340 -0.467 25567 2515 1 4 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.597 -0.234 25567 2516 1 4 . 1 1 77 77 TYR C C 77 172.175 172.175 174.599 -2.424 25567 2517 1 4 . 1 1 77 77 TYR CA C 77 55.364 55.364 58.489 -3.125 25567 2518 1 4 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.557 -3.392 25567 2519 1 4 . 1 1 77 77 TYR H H 77 7.825 7.825 7.608 0.217 25567 2520 1 4 . 1 1 78 78 ASP N N 78 121.271 121.271 118.065 3.206 25567 2521 1 4 . 1 1 78 78 ASP HA H 78 4.805 4.805 5.138 -0.333 25567 2522 1 4 . 1 1 78 78 ASP C C 78 172.641 172.641 175.173 -2.532 25567 2523 1 4 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.286 -0.031 25567 2524 1 4 . 1 1 78 78 ASP CB C 78 41.075 41.075 44.279 -3.204 25567 2525 1 4 . 1 1 78 78 ASP H H 78 9.058 9.058 8.654 0.404 25567 2526 1 4 . 1 1 79 79 LEU N N 79 122.985 122.985 120.124 2.861 25567 2527 1 4 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.102 0.012 25567 2528 1 4 . 1 1 79 79 LEU C C 79 170.721 170.721 174.557 -3.836 25567 2529 1 4 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.633 -3.317 25567 2530 1 4 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.728 -3.386 25567 2531 1 4 . 1 1 79 79 LEU H H 79 7.893 7.893 7.937 -0.044 25567 2532 1 4 . 1 1 80 80 ILE N N 80 126.364 126.364 124.009 2.355 25567 2533 1 4 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.874 0.215 25567 2534 1 4 . 1 1 80 80 ILE C C 80 171.580 171.580 173.839 -2.259 25567 2535 1 4 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.309 -2.892 25567 2536 1 4 . 1 1 80 80 ILE CB C 80 38.136 38.136 41.710 -3.574 25567 2537 1 4 . 1 1 80 80 ILE H H 80 8.717 8.717 9.071 -0.354 25567 2538 1 4 . 1 1 81 81 LEU N N 81 126.199 126.199 126.341 -0.142 25567 2539 1 4 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.330 -0.196 25567 2540 1 4 . 1 1 81 81 LEU C C 81 172.979 172.979 175.887 -2.908 25567 2541 1 4 . 1 1 81 81 LEU CA C 81 49.633 49.633 52.695 -3.062 25567 2542 1 4 . 1 1 81 81 LEU CB C 81 42.159 42.159 44.161 -2.002 25567 2543 1 4 . 1 1 81 81 LEU H H 81 9.230 9.230 9.009 0.221 25567 2544 1 4 . 1 1 82 82 ILE N N 82 120.505 120.505 119.110 1.395 25567 2545 1 4 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.011 -0.095 25567 2546 1 4 . 1 1 82 82 ILE C C 82 173.011 173.011 174.353 -1.342 25567 2547 1 4 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.488 -2.660 25567 2548 1 4 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.991 -3.923 25567 2549 1 4 . 1 1 82 82 ILE H H 82 8.796 8.796 8.419 0.377 25567 2550 1 4 . 1 1 83 83 GLY N N 83 120.857 120.857 110.217 10.640 25567 2551 1 4 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.397 -2.594 25567 2552 1 4 . 1 1 83 83 GLY H H 83 9.525 9.525 7.926 1.599 25567 2553 1 4 . 1 1 84 84 SER N N 84 116.007 116.007 115.535 0.472 25567 2554 1 4 . 1 1 84 84 SER HA H 84 5.476 5.476 5.113 0.363 25567 2555 1 4 . 1 1 84 84 SER CA C 84 51.937 51.937 56.312 -4.375 25567 2556 1 4 . 1 1 84 84 SER CB C 84 64.533 64.533 65.117 -0.584 25567 2557 1 4 . 1 1 84 84 SER H H 84 7.617 7.617 7.680 -0.063 25567 2558 1 4 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.583 0.618 25567 2559 1 4 . 1 1 85 85 PRO C C 85 173.574 173.574 175.982 -2.408 25567 2560 1 4 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.629 -3.141 25567 2561 1 4 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.686 -1.546 25567 2562 1 4 . 1 1 86 86 VAL N N 86 117.603 117.603 116.551 1.052 25567 2563 1 4 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.350 0.023 25567 2564 1 4 . 1 1 86 86 VAL C C 86 172.777 172.777 173.712 -0.935 25567 2565 1 4 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.599 -1.996 25567 2566 1 4 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.315 -5.742 25567 2567 1 4 . 1 1 86 86 VAL H H 86 8.194 8.194 8.036 0.158 25567 2568 1 4 . 1 1 87 87 TRP N N 87 131.187 131.187 126.374 4.813 25567 2569 1 4 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.924 0.274 25567 2570 1 4 . 1 1 87 87 TRP C C 87 173.295 173.295 174.074 -0.779 25567 2571 1 4 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.684 -6.900 25567 2572 1 4 . 1 1 87 87 TRP CB C 87 27.746 27.746 32.859 -5.113 25567 2573 1 4 . 1 1 87 87 TRP H H 87 9.637 9.637 8.482 1.155 25567 2574 1 4 . 1 1 88 88 SER N N 88 119.829 119.829 111.954 7.875 25567 2575 1 4 . 1 1 88 88 SER HA H 88 3.986 3.986 4.833 -0.847 25567 2576 1 4 . 1 1 88 88 SER C C 88 172.375 172.375 174.763 -2.388 25567 2577 1 4 . 1 1 88 88 SER CA C 88 55.932 55.932 56.816 -0.884 25567 2578 1 4 . 1 1 88 88 SER CB C 88 59.178 59.178 63.976 -4.798 25567 2579 1 4 . 1 1 88 88 SER H H 88 9.272 9.272 7.633 1.639 25567 2580 1 4 . 1 1 89 89 GLY N N 89 101.498 101.498 113.043 -11.545 25567 2581 1 4 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.997 -4.326 25567 2582 1 4 . 1 1 89 89 GLY H H 89 7.463 7.463 9.535 -2.072 25567 2583 1 4 . 1 1 90 90 TYR N N 90 121.064 121.064 115.099 5.965 25567 2584 1 4 . 1 1 90 90 TYR HA H 90 4.216 4.216 4.958 -0.742 25567 2585 1 4 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.282 -0.192 25567 2586 1 4 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.717 0.478 25567 2587 1 4 . 1 1 90 90 TYR H H 90 8.064 8.064 8.240 -0.176 25567 2588 1 4 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.693 0.239 25567 2589 1 4 . 1 1 91 91 PRO C C 91 171.019 171.019 175.042 -4.023 25567 2590 1 4 . 1 1 91 91 PRO CA C 91 58.994 58.994 62.665 -3.671 25567 2591 1 4 . 1 1 91 91 PRO CB C 91 26.493 26.493 29.787 -3.294 25567 2592 1 4 . 1 1 92 92 ALA N N 92 119.893 119.893 122.710 -2.817 25567 2593 1 4 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.510 -1.059 25567 2594 1 4 . 1 1 92 92 ALA C C 92 176.477 176.477 175.970 0.507 25567 2595 1 4 . 1 1 92 92 ALA CA C 92 49.567 49.567 52.177 -2.610 25567 2596 1 4 . 1 1 92 92 ALA CB C 92 15.801 15.801 20.695 -4.894 25567 2597 1 4 . 1 1 92 92 ALA H H 92 7.278 7.278 7.554 -0.276 25567 2598 1 4 . 1 1 93 93 THR N N 93 112.992 112.992 109.832 3.160 25567 2599 1 4 . 1 1 93 93 THR HA H 93 4.462 4.462 4.453 0.009 25567 2600 1 4 . 1 1 93 93 THR CA C 93 66.871 66.871 59.328 7.543 25567 2601 1 4 . 1 1 93 93 THR CB C 93 64.362 64.362 67.851 -3.489 25567 2602 1 4 . 1 1 93 93 THR H H 93 6.861 6.861 8.098 -1.237 25567 2603 1 4 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.429 -0.563 25567 2604 1 4 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.625 -0.604 25567 2605 1 4 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.206 -1.927 25567 2606 1 4 . 1 1 95 95 ILE N N 95 111.298 111.298 117.002 -5.704 25567 2607 1 4 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.161 -0.538 25567 2608 1 4 . 1 1 95 95 ILE C C 95 174.264 174.264 177.455 -3.191 25567 2609 1 4 . 1 1 95 95 ILE CA C 95 57.448 57.448 60.111 -2.663 25567 2610 1 4 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.526 -4.597 25567 2611 1 4 . 1 1 95 95 ILE H H 95 7.974 7.974 7.787 0.187 25567 2612 1 4 . 1 1 96 96 LYS N N 96 123.045 123.045 122.373 0.672 25567 2613 1 4 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.066 -0.954 25567 2614 1 4 . 1 1 96 96 LYS C C 96 174.590 174.590 178.695 -4.105 25567 2615 1 4 . 1 1 96 96 LYS CA C 96 57.145 57.145 59.192 -2.047 25567 2616 1 4 . 1 1 96 96 LYS CB C 96 28.845 28.845 31.824 -2.979 25567 2617 1 4 . 1 1 96 96 LYS H H 96 6.958 6.958 7.357 -0.399 25567 2618 1 4 . 1 1 97 97 THR N N 97 113.412 113.412 115.275 -1.863 25567 2619 1 4 . 1 1 97 97 THR HA H 97 3.461 3.461 4.078 -0.617 25567 2620 1 4 . 1 1 97 97 THR C C 97 173.247 173.247 176.970 -3.723 25567 2621 1 4 . 1 1 97 97 THR CA C 97 62.809 62.809 66.322 -3.513 25567 2622 1 4 . 1 1 97 97 THR CB C 97 65.654 65.654 68.555 -2.901 25567 2623 1 4 . 1 1 97 97 THR H H 97 6.366 6.366 8.051 -1.685 25567 2624 1 4 . 1 1 98 98 LEU N N 98 121.201 121.201 123.363 -2.162 25567 2625 1 4 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.014 -0.380 25567 2626 1 4 . 1 1 98 98 LEU C C 98 174.590 174.590 177.604 -3.014 25567 2627 1 4 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.316 -1.695 25567 2628 1 4 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.955 -1.060 25567 2629 1 4 . 1 1 98 98 LEU H H 98 7.554 7.554 8.042 -0.488 25567 2630 1 4 . 1 1 99 99 LEU N N 99 118.677 118.677 117.036 1.641 25567 2631 1 4 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.864 -0.162 25567 2632 1 4 . 1 1 99 99 LEU C C 99 177.457 177.457 178.141 -0.684 25567 2633 1 4 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.235 -2.056 25567 2634 1 4 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.547 -2.559 25567 2635 1 4 . 1 1 99 99 LEU H H 99 8.160 8.160 7.810 0.350 25567 2636 1 4 . 1 1 100 100 ASP N N 100 118.914 118.914 116.302 2.612 25567 2637 1 4 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.700 -0.471 25567 2638 1 4 . 1 1 100 100 ASP C C 100 176.585 176.585 178.350 -1.765 25567 2639 1 4 . 1 1 100 100 ASP CA C 100 54.516 54.516 55.242 -0.726 25567 2640 1 4 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.888 -4.309 25567 2641 1 4 . 1 1 100 100 ASP H H 100 7.872 7.872 7.872 0.000 25567 2642 1 4 . 1 1 101 101 GLN N N 101 118.135 118.135 119.795 -1.660 25567 2643 1 4 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.203 -0.043 25567 2644 1 4 . 1 1 101 101 GLN C C 101 174.601 174.601 178.591 -3.990 25567 2645 1 4 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.277 -3.317 25567 2646 1 4 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.183 -3.633 25567 2647 1 4 . 1 1 101 101 GLN H H 101 7.673 7.673 7.583 0.090 25567 2648 1 4 . 1 1 102 102 MET N N 102 118.420 118.420 118.260 0.160 25567 2649 1 4 . 1 1 102 102 MET HA H 102 3.826 3.826 4.269 -0.443 25567 2650 1 4 . 1 1 102 102 MET C C 102 172.780 172.780 176.781 -4.001 25567 2651 1 4 . 1 1 102 102 MET CA C 102 53.428 53.428 56.124 -2.696 25567 2652 1 4 . 1 1 102 102 MET CB C 102 31.221 31.221 30.679 0.542 25567 2653 1 4 . 1 1 102 102 MET H H 102 7.462 7.462 8.383 -0.921 25567 2654 1 4 . 1 1 103 103 LYS N N 103 116.066 116.066 119.379 -3.313 25567 2655 1 4 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.120 -0.200 25567 2656 1 4 . 1 1 103 103 LYS C C 103 173.922 173.922 177.844 -3.922 25567 2657 1 4 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.790 -2.508 25567 2658 1 4 . 1 1 103 103 LYS CB C 103 29.491 29.491 32.032 -2.541 25567 2659 1 4 . 1 1 103 103 LYS H H 103 6.875 6.875 7.891 -1.016 25567 2660 1 4 . 1 1 104 104 ASN N N 104 114.987 114.987 113.004 1.983 25567 2661 1 4 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.813 -0.072 25567 2662 1 4 . 1 1 104 104 ASN C C 104 172.587 172.587 175.491 -2.904 25567 2663 1 4 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.559 -2.090 25567 2664 1 4 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.250 -3.428 25567 2665 1 4 . 1 1 104 104 ASN H H 104 8.517 8.517 8.106 0.411 25567 2666 1 4 . 1 1 105 105 TYR N N 105 122.755 122.755 122.850 -0.095 25567 2667 1 4 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.346 0.229 25567 2668 1 4 . 1 1 105 105 TYR C C 105 174.260 174.260 175.016 -0.756 25567 2669 1 4 . 1 1 105 105 TYR CA C 105 55.493 55.493 60.288 -4.795 25567 2670 1 4 . 1 1 105 105 TYR CB C 105 36.064 36.064 38.981 -2.917 25567 2671 1 4 . 1 1 105 105 TYR H H 105 8.287 8.287 7.841 0.446 25567 2672 1 4 . 1 1 106 106 ARG N N 106 128.905 128.905 125.180 3.725 25567 2673 1 4 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.201 0.072 25567 2674 1 4 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.083 -2.062 25567 2675 1 4 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.826 -5.696 25567 2676 1 4 . 1 1 106 106 ARG H H 106 8.841 8.841 8.183 0.658 25567 2677 1 4 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.633 -2.136 25567 2678 1 4 . 1 1 108 108 GLU N N 108 116.989 116.989 121.394 -4.405 25567 2679 1 4 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.739 -0.108 25567 2680 1 4 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.737 -2.061 25567 2681 1 4 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.976 -3.574 25567 2682 1 4 . 1 1 108 108 GLU H H 108 7.536 7.536 8.433 -0.897 25567 2683 1 4 . 1 1 109 109 VAL N N 109 123.416 123.416 124.461 -1.045 25567 2684 1 4 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.052 0.269 25567 2685 1 4 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.776 -3.333 25567 2686 1 4 . 1 1 109 109 VAL CB C 109 32.661 32.661 34.230 -1.569 25567 2687 1 4 . 1 1 109 109 VAL H H 109 8.955 8.955 9.296 -0.341 25567 2688 1 4 . 1 1 110 110 ALA N N 110 127.975 127.975 128.275 -0.300 25567 2689 1 4 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.055 -0.378 25567 2690 1 4 . 1 1 110 110 ALA CA C 110 47.441 47.441 50.190 -2.749 25567 2691 1 4 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.161 -3.745 25567 2692 1 4 . 1 1 110 110 ALA H H 110 8.860 8.860 8.542 0.318 25567 2693 1 4 . 1 1 111 111 SER N N 111 110.482 110.482 116.722 -6.240 25567 2694 1 4 . 1 1 111 111 SER HA H 111 5.502 5.502 5.060 0.442 25567 2695 1 4 . 1 1 111 111 SER CA C 111 51.630 51.630 56.908 -5.278 25567 2696 1 4 . 1 1 111 111 SER CB C 111 62.267 62.267 63.523 -1.256 25567 2697 1 4 . 1 1 111 111 SER H H 111 7.484 7.484 8.121 -0.637 25567 2698 1 4 . 1 1 112 112 PHE N N 112 125.082 125.082 123.453 1.629 25567 2699 1 4 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.229 1.219 25567 2700 1 4 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.268 -4.834 25567 2701 1 4 . 1 1 112 112 PHE CB C 112 40.500 40.500 39.509 0.991 25567 2702 1 4 . 1 1 112 112 PHE H H 112 8.025 8.025 8.548 -0.523 25567 2703 1 4 . 1 1 113 113 PHE N N 113 115.872 115.872 118.031 -2.159 25567 2704 1 4 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.445 0.479 25567 2705 1 4 . 1 1 113 113 PHE C C 113 173.293 173.293 175.891 -2.598 25567 2706 1 4 . 1 1 113 113 PHE CA C 113 50.468 50.468 54.988 -4.520 25567 2707 1 4 . 1 1 113 113 PHE CB C 113 38.393 38.393 40.694 -2.301 25567 2708 1 4 . 1 1 113 113 PHE H H 113 7.391 7.391 7.839 -0.448 25567 2709 1 4 . 1 1 114 114 THR N N 114 108.721 108.721 112.483 -3.762 25567 2710 1 4 . 1 1 114 114 THR HA H 114 4.933 4.933 4.899 0.034 25567 2711 1 4 . 1 1 114 114 THR C C 114 171.891 171.891 174.166 -2.275 25567 2712 1 4 . 1 1 114 114 THR CA C 114 56.815 56.815 61.534 -4.719 25567 2713 1 4 . 1 1 114 114 THR CB C 114 67.899 67.899 69.427 -1.528 25567 2714 1 4 . 1 1 114 114 THR H H 114 7.951 7.951 8.290 -0.339 25567 2715 1 4 . 1 1 115 115 SER N N 115 115.159 115.159 116.798 -1.639 25567 2716 1 4 . 1 1 115 115 SER HA H 115 4.608 4.608 4.697 -0.089 25567 2717 1 4 . 1 1 115 115 SER C C 115 171.403 171.403 173.175 -1.772 25567 2718 1 4 . 1 1 115 115 SER CA C 115 55.570 55.570 58.219 -2.650 25567 2719 1 4 . 1 1 115 115 SER CB C 115 61.418 61.418 65.503 -4.085 25567 2720 1 4 . 1 1 115 115 SER H H 115 8.229 8.229 7.791 0.438 25567 2721 1 4 . 1 1 116 116 ALA N N 116 127.211 127.211 124.682 2.529 25567 2722 1 4 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.933 -0.477 25567 2723 1 4 . 1 1 116 116 ALA C C 116 175.758 175.758 179.001 -3.243 25567 2724 1 4 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.211 -2.395 25567 2725 1 4 . 1 1 116 116 ALA CB C 116 16.831 16.831 20.191 -3.360 25567 2726 1 4 . 1 1 116 116 ALA H H 116 8.813 8.813 8.332 0.481 25567 2727 1 4 . 1 1 117 117 GLY N N 117 108.099 108.099 109.459 -1.360 25567 2728 1 4 . 1 1 117 117 GLY C C 117 171.805 171.805 175.167 -3.362 25567 2729 1 4 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.257 -4.388 25567 2730 1 4 . 1 1 117 117 GLY H H 117 8.685 8.685 9.144 -0.459 25567 2731 1 4 . 1 1 118 118 THR N N 118 111.284 111.284 108.684 2.600 25567 2732 1 4 . 1 1 118 118 THR HA H 118 4.343 4.343 4.390 -0.047 25567 2733 1 4 . 1 1 118 118 THR C C 118 171.769 171.769 173.217 -1.448 25567 2734 1 4 . 1 1 118 118 THR CA C 118 58.933 58.933 61.313 -2.380 25567 2735 1 4 . 1 1 118 118 THR CB C 118 67.304 67.304 69.935 -2.631 25567 2736 1 4 . 1 1 118 118 THR H H 118 7.998 7.998 8.149 -0.151 25567 2737 1 4 . 1 1 119 119 ASN N N 119 120.253 120.253 120.006 0.247 25567 2738 1 4 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.938 -0.235 25567 2739 1 4 . 1 1 119 119 ASN C C 119 172.353 172.353 173.440 -1.087 25567 2740 1 4 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.327 -3.099 25567 2741 1 4 . 1 1 119 119 ASN CB C 119 35.376 35.376 41.044 -5.668 25567 2742 1 4 . 1 1 119 119 ASN H H 119 8.381 8.381 7.642 0.739 25567 2743 1 4 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.620 -0.534 25567 2744 1 4 . 1 1 120 120 HIS C C 120 173.395 173.395 175.733 -2.338 25567 2745 1 4 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.744 -2.605 25567 2746 1 4 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.629 -3.207 25567 2747 1 4 . 1 1 121 121 LYS N N 121 119.527 119.527 119.993 -0.466 25567 2748 1 4 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.825 -0.045 25567 2749 1 4 . 1 1 121 121 LYS C C 121 176.053 176.053 178.135 -2.082 25567 2750 1 4 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.799 -1.836 25567 2751 1 4 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.688 -2.028 25567 2752 1 4 . 1 1 121 121 LYS H H 121 8.106 8.106 8.603 -0.497 25567 2753 1 4 . 1 1 122 122 ALA N N 122 121.585 121.585 121.658 -0.073 25567 2754 1 4 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.573 0.148 25567 2755 1 4 . 1 1 122 122 ALA C C 122 175.128 175.128 178.827 -3.699 25567 2756 1 4 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.458 -2.867 25567 2757 1 4 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.511 -1.807 25567 2758 1 4 . 1 1 122 122 ALA H H 122 7.702 7.702 7.888 -0.186 25567 2759 1 4 . 1 1 123 123 TYR N N 123 118.803 118.803 120.238 -1.435 25567 2760 1 4 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.971 -0.605 25567 2761 1 4 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.355 -1.264 25567 2762 1 4 . 1 1 123 123 TYR CB C 123 35.102 35.102 37.925 -2.823 25567 2763 1 4 . 1 1 123 123 TYR H H 123 7.366 7.366 7.376 -0.010 25567 2764 1 4 . 1 1 124 124 VAL N N 124 117.530 117.530 115.697 1.833 25567 2765 1 4 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.682 -0.483 25567 2766 1 4 . 1 1 124 124 VAL C C 124 175.375 175.375 177.828 -2.453 25567 2767 1 4 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.309 -1.726 25567 2768 1 4 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.991 -1.788 25567 2769 1 4 . 1 1 124 124 VAL H H 124 7.757 7.757 7.547 0.210 25567 2770 1 4 . 1 1 125 125 SER N N 125 114.023 114.023 115.003 -0.980 25567 2771 1 4 . 1 1 125 125 SER HA H 125 4.035 4.035 4.335 -0.300 25567 2772 1 4 . 1 1 125 125 SER C C 125 174.636 174.636 176.068 -1.432 25567 2773 1 4 . 1 1 125 125 SER CA C 125 58.885 58.885 60.722 -1.837 25567 2774 1 4 . 1 1 125 125 SER CB C 125 59.666 59.666 63.337 -3.671 25567 2775 1 4 . 1 1 125 125 SER H H 125 7.622 7.622 7.582 0.040 25567 2776 1 4 . 1 1 126 126 HIS N N 126 119.457 119.457 121.141 -1.684 25567 2777 1 4 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.983 0.213 25567 2778 1 4 . 1 1 126 126 HIS C C 126 172.942 172.942 177.837 -4.895 25567 2779 1 4 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.506 -3.588 25567 2780 1 4 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.553 -3.474 25567 2781 1 4 . 1 1 126 126 HIS H H 126 8.067 8.067 8.306 -0.239 25567 2782 1 4 . 1 1 127 127 PHE N N 127 120.628 120.628 120.227 0.401 25567 2783 1 4 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.997 -0.798 25567 2784 1 4 . 1 1 127 127 PHE C C 127 173.515 173.515 177.303 -3.788 25567 2785 1 4 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.830 0.851 25567 2786 1 4 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.689 -2.322 25567 2787 1 4 . 1 1 127 127 PHE H H 127 9.083 9.083 8.493 0.590 25567 2788 1 4 . 1 1 128 128 ASN N N 128 114.858 114.858 118.017 -3.159 25567 2789 1 4 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.171 -0.093 25567 2790 1 4 . 1 1 128 128 ASN C C 128 175.338 175.338 177.410 -2.072 25567 2791 1 4 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.579 -2.329 25567 2792 1 4 . 1 1 128 128 ASN CB C 128 36.021 36.021 37.931 -1.909 25567 2793 1 4 . 1 1 128 128 ASN H H 128 7.858 7.858 7.537 0.321 25567 2794 1 4 . 1 1 129 129 GLU N N 129 119.811 119.811 118.623 1.188 25567 2795 1 4 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.158 -0.117 25567 2796 1 4 . 1 1 129 129 GLU C C 129 176.941 176.941 178.195 -1.254 25567 2797 1 4 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.625 -1.993 25567 2798 1 4 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.344 -2.406 25567 2799 1 4 . 1 1 129 129 GLU H H 129 7.569 7.569 8.171 -0.602 25567 2800 1 4 . 1 1 130 130 TRP N N 130 120.585 120.585 117.931 2.654 25567 2801 1 4 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.728 -0.256 25567 2802 1 4 . 1 1 130 130 TRP C C 130 174.262 174.262 175.412 -1.150 25567 2803 1 4 . 1 1 130 130 TRP CA C 130 54.673 54.673 55.634 -0.961 25567 2804 1 4 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.577 -2.621 25567 2805 1 4 . 1 1 130 130 TRP H H 130 7.964 7.964 7.382 0.582 25567 2806 1 4 . 1 1 131 131 ALA N N 131 120.522 120.522 119.384 1.138 25567 2807 1 4 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.361 -0.414 25567 2808 1 4 . 1 1 131 131 ALA C C 131 172.489 172.489 176.174 -3.685 25567 2809 1 4 . 1 1 131 131 ALA CA C 131 48.580 48.580 52.176 -3.596 25567 2810 1 4 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.778 -3.239 25567 2811 1 4 . 1 1 131 131 ALA H H 131 8.114 8.114 7.765 0.349 25567 2812 1 4 . 1 1 132 132 ASP N N 132 117.666 117.666 120.922 -3.256 25567 2813 1 4 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.449 -0.243 25567 2814 1 4 . 1 1 132 132 ASP C C 132 173.779 173.779 176.323 -2.544 25567 2815 1 4 . 1 1 132 132 ASP CA C 132 54.313 54.313 54.266 0.047 25567 2816 1 4 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.197 0.259 25567 2817 1 4 . 1 1 132 132 ASP H H 132 6.768 6.768 8.244 -1.476 25567 2818 1 4 . 1 1 133 133 GLY N N 133 114.922 114.922 108.610 6.312 25567 2819 1 4 . 1 1 133 133 GLY C C 133 172.101 172.101 174.619 -2.518 25567 2820 1 4 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.444 -2.936 25567 2821 1 4 . 1 1 133 133 GLY H H 133 8.645 8.645 8.141 0.504 25567 2822 1 4 . 1 1 134 134 LEU N N 134 120.101 120.101 122.166 -2.065 25567 2823 1 4 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.383 0.079 25567 2824 1 4 . 1 1 134 134 LEU C C 134 174.098 174.098 176.243 -2.145 25567 2825 1 4 . 1 1 134 134 LEU CA C 134 51.084 51.084 54.506 -3.422 25567 2826 1 4 . 1 1 134 134 LEU CB C 134 40.509 40.509 42.514 -2.006 25567 2827 1 4 . 1 1 134 134 LEU H H 134 8.049 8.049 7.454 0.595 25567 2828 1 4 . 1 1 135 135 ASN N N 135 119.258 119.258 120.735 -1.477 25567 2829 1 4 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.656 -0.017 25567 2830 1 4 . 1 1 135 135 ASN C C 135 170.564 170.564 174.317 -3.753 25567 2831 1 4 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.238 -3.985 25567 2832 1 4 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.096 -4.478 25567 2833 1 4 . 1 1 135 135 ASN H H 135 8.567 8.567 8.615 -0.048 25567 2834 1 4 . 1 1 136 136 VAL N N 136 125.460 125.460 125.402 0.058 25567 2835 1 4 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.823 -0.227 25567 2836 1 4 . 1 1 136 136 VAL C C 136 175.318 175.318 176.177 -0.859 25567 2837 1 4 . 1 1 136 136 VAL CA C 136 58.722 58.722 62.255 -3.533 25567 2838 1 4 . 1 1 136 136 VAL CB C 136 29.299 29.299 33.209 -3.910 25567 2839 1 4 . 1 1 136 136 VAL H H 136 7.660 7.660 8.168 -0.508 25567 2840 1 4 . 1 1 137 137 ILE N N 137 122.021 122.021 120.790 1.231 25567 2841 1 4 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.687 -0.259 25567 2842 1 4 . 1 1 137 137 ILE C C 137 173.943 173.943 174.564 -0.621 25567 2843 1 4 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.755 -0.797 25567 2844 1 4 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.933 -2.764 25567 2845 1 4 . 1 1 137 137 ILE H H 137 9.151 9.151 8.783 0.368 25567 2846 1 4 . 1 1 138 138 GLY N N 138 108.192 108.192 108.515 -0.323 25567 2847 1 4 . 1 1 138 138 GLY CA C 138 43.494 43.494 46.063 -2.569 25567 2848 1 4 . 1 1 138 138 GLY H H 138 6.675 6.675 7.518 -0.843 25567 2849 1 4 . 1 1 139 139 VAL N N 139 119.673 119.673 121.776 -2.103 25567 2850 1 4 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.748 0.572 25567 2851 1 4 . 1 1 139 139 VAL C C 139 172.291 172.291 175.507 -3.216 25567 2852 1 4 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.969 -3.760 25567 2853 1 4 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.514 -0.875 25567 2854 1 4 . 1 1 139 139 VAL H H 139 8.158 8.158 8.621 -0.463 25567 2855 1 4 . 1 1 140 140 ALA N N 140 127.104 127.104 129.009 -1.905 25567 2856 1 4 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.782 -0.186 25567 2857 1 4 . 1 1 140 140 ALA C C 140 171.057 171.057 175.195 -4.138 25567 2858 1 4 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.194 -1.311 25567 2859 1 4 . 1 1 140 140 ALA CB C 140 21.428 21.428 21.548 -0.120 25567 2860 1 4 . 1 1 140 140 ALA H H 140 9.145 9.145 8.135 1.010 25567 2861 1 4 . 1 1 141 141 ARG N N 141 118.828 118.828 120.029 -1.201 25567 2862 1 4 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.496 -0.756 25567 2863 1 4 . 1 1 141 141 ARG C C 141 173.524 173.524 176.385 -2.861 25567 2864 1 4 . 1 1 141 141 ARG CA C 141 51.886 51.886 56.012 -4.126 25567 2865 1 4 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.883 -2.429 25567 2866 1 4 . 1 1 141 141 ARG H H 141 7.759 7.759 8.503 -0.744 25567 2867 1 4 . 1 1 142 142 ASP N N 142 125.557 125.557 125.959 -0.402 25567 2868 1 4 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.303 -0.524 25567 2869 1 4 . 1 1 142 142 ASP C C 142 169.292 169.292 175.713 -6.421 25567 2870 1 4 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.002 -2.380 25567 2871 1 4 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.630 -3.550 25567 2872 1 4 . 1 1 142 142 ASP H H 142 9.087 9.087 8.804 0.283 25567 2873 1 4 . 1 1 143 143 ASP N N 143 119.094 119.094 117.929 1.165 25567 2874 1 4 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.356 -0.102 25567 2875 1 4 . 1 1 143 143 ASP C C 143 175.557 175.557 177.340 -1.783 25567 2876 1 4 . 1 1 143 143 ASP CA C 143 49.079 49.079 54.536 -5.457 25567 2877 1 4 . 1 1 143 143 ASP CB C 143 36.442 36.442 39.885 -3.443 25567 2878 1 4 . 1 1 143 143 ASP H H 143 8.175 8.175 8.584 -0.409 25567 2879 1 4 . 1 1 144 144 SER N N 144 115.438 115.438 114.922 0.516 25567 2880 1 4 . 1 1 144 144 SER HA H 144 3.745 3.745 4.225 -0.480 25567 2881 1 4 . 1 1 144 144 SER C C 144 172.820 172.820 174.456 -1.636 25567 2882 1 4 . 1 1 144 144 SER CA C 144 59.336 59.336 60.288 -0.953 25567 2883 1 4 . 1 1 144 144 SER CB C 144 60.839 60.839 62.955 -2.116 25567 2884 1 4 . 1 1 144 144 SER H H 144 7.742 7.742 7.532 0.210 25567 2885 1 4 . 1 1 145 145 GLU N N 145 119.631 119.631 119.337 0.294 25567 2886 1 4 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.144 0.175 25567 2887 1 4 . 1 1 145 145 GLU C C 145 171.927 171.927 175.755 -3.828 25567 2888 1 4 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.235 -3.151 25567 2889 1 4 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.884 -3.110 25567 2890 1 4 . 1 1 145 145 GLU H H 145 7.924 7.924 7.638 0.286 25567 2891 1 4 . 1 1 146 146 VAL N N 146 118.791 118.791 120.577 -1.786 25567 2892 1 4 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.089 -0.133 25567 2893 1 4 . 1 1 146 146 VAL C C 146 174.582 174.582 177.218 -2.636 25567 2894 1 4 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.526 -2.448 25567 2895 1 4 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.087 -1.947 25567 2896 1 4 . 1 1 146 146 VAL H H 146 6.393 6.393 7.164 -0.771 25567 2897 1 4 . 1 1 147 147 ASP N N 147 119.410 119.410 119.309 0.101 25567 2898 1 4 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.144 -0.074 25567 2899 1 4 . 1 1 147 147 ASP C C 147 174.774 174.774 177.491 -2.717 25567 2900 1 4 . 1 1 147 147 ASP CA C 147 54.322 54.322 57.540 -3.218 25567 2901 1 4 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.670 -3.466 25567 2902 1 4 . 1 1 147 147 ASP H H 147 8.393 8.393 8.591 -0.198 25567 2903 1 4 . 1 1 148 148 LYS N N 148 119.422 119.422 117.923 1.499 25567 2904 1 4 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.116 -0.165 25567 2905 1 4 . 1 1 148 148 LYS C C 148 176.410 176.410 178.367 -1.957 25567 2906 1 4 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.545 -2.809 25567 2907 1 4 . 1 1 148 148 LYS CB C 148 29.576 29.576 31.715 -2.139 25567 2908 1 4 . 1 1 148 148 LYS H H 148 7.078 7.078 7.412 -0.334 25567 2909 1 4 . 1 1 149 149 TRP N N 149 118.168 118.168 119.528 -1.360 25567 2910 1 4 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.842 -0.241 25567 2911 1 4 . 1 1 149 149 TRP C C 149 174.199 174.199 176.727 -2.528 25567 2912 1 4 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.373 -1.578 25567 2913 1 4 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.764 -1.753 25567 2914 1 4 . 1 1 149 149 TRP H H 149 7.914 7.914 7.508 0.406 25567 2915 1 4 . 1 1 150 150 SER N N 150 109.636 109.636 114.362 -4.726 25567 2916 1 4 . 1 1 150 150 SER HA H 150 4.242 4.242 4.652 -0.410 25567 2917 1 4 . 1 1 150 150 SER C C 150 170.173 170.173 174.529 -4.356 25567 2918 1 4 . 1 1 150 150 SER CA C 150 56.912 56.912 58.738 -1.826 25567 2919 1 4 . 1 1 150 150 SER CB C 150 62.087 62.087 65.562 -3.475 25567 2920 1 4 . 1 1 150 150 SER H H 150 7.814 7.814 7.891 -0.077 25567 2921 1 5 . 1 1 2 2 MET HA H 2 4.416 4.416 4.962 -0.546 25567 2922 1 5 . 1 1 2 2 MET CA C 2 52.847 52.847 54.807 -1.960 25567 2923 1 5 . 1 1 2 2 MET CB C 2 30.672 30.672 33.941 -3.269 25567 2924 1 5 . 1 1 3 3 ALA N N 3 125.563 125.563 124.789 0.774 25567 2925 1 5 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.619 -0.247 25567 2926 1 5 . 1 1 3 3 ALA C C 3 174.728 174.728 176.218 -1.490 25567 2927 1 5 . 1 1 3 3 ALA CA C 3 49.348 49.348 51.753 -2.405 25567 2928 1 5 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.916 -3.981 25567 2929 1 5 . 1 1 3 3 ALA H H 3 8.342 8.342 8.163 0.179 25567 2930 1 5 . 1 1 4 4 LYS N N 4 121.767 121.767 126.040 -4.273 25567 2931 1 5 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.469 -0.239 25567 2932 1 5 . 1 1 4 4 LYS C C 4 174.577 174.577 176.247 -1.670 25567 2933 1 5 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.396 -1.407 25567 2934 1 5 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.632 -1.077 25567 2935 1 5 . 1 1 4 4 LYS H H 4 8.500 8.500 8.607 -0.107 25567 2936 1 5 . 1 1 5 5 LYS N N 5 129.654 129.654 123.869 5.785 25567 2937 1 5 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.494 0.032 25567 2938 1 5 . 1 1 5 5 LYS C C 5 174.731 174.731 176.364 -1.633 25567 2939 1 5 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.845 -1.099 25567 2940 1 5 . 1 1 5 5 LYS CB C 5 29.894 29.894 33.855 -3.961 25567 2941 1 5 . 1 1 5 5 LYS H H 5 10.035 10.035 8.407 1.628 25567 2942 1 5 . 1 1 6 6 THR N N 6 126.212 126.212 114.222 11.990 25567 2943 1 5 . 1 1 6 6 THR HA H 6 5.654 5.654 4.980 0.674 25567 2944 1 5 . 1 1 6 6 THR C C 6 169.897 169.897 172.833 -2.936 25567 2945 1 5 . 1 1 6 6 THR CA C 6 60.647 60.647 61.626 -0.979 25567 2946 1 5 . 1 1 6 6 THR CB C 6 68.152 68.152 71.955 -3.803 25567 2947 1 5 . 1 1 6 6 THR H H 6 8.557 8.557 8.086 0.471 25567 2948 1 5 . 1 1 7 7 LEU N N 7 130.776 130.776 124.648 6.128 25567 2949 1 5 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.729 -0.110 25567 2950 1 5 . 1 1 7 7 LEU CA C 7 50.096 50.096 52.683 -2.587 25567 2951 1 5 . 1 1 7 7 LEU CB C 7 41.043 41.043 45.851 -4.808 25567 2952 1 5 . 1 1 7 7 LEU H H 7 8.610 8.610 8.612 -0.002 25567 2953 1 5 . 1 1 8 8 ILE N N 8 127.175 127.175 122.332 4.843 25567 2954 1 5 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.749 0.107 25567 2955 1 5 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.290 -2.898 25567 2956 1 5 . 1 1 8 8 ILE CB C 8 36.864 36.864 39.658 -2.794 25567 2957 1 5 . 1 1 8 8 ILE H H 8 9.263 9.263 7.722 1.541 25567 2958 1 5 . 1 1 9 9 LEU N N 9 127.117 127.117 127.405 -0.288 25567 2959 1 5 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.013 0.683 25567 2960 1 5 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.587 -3.635 25567 2961 1 5 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.413 0.414 25567 2962 1 5 . 1 1 9 9 LEU H H 9 9.262 9.262 8.984 0.278 25567 2963 1 5 . 1 1 10 10 TYR N N 10 113.544 113.544 124.553 -11.009 25567 2964 1 5 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.080 0.451 25567 2965 1 5 . 1 1 10 10 TYR CA C 10 52.829 52.829 56.390 -3.561 25567 2966 1 5 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.422 -1.807 25567 2967 1 5 . 1 1 10 10 TYR H H 10 7.425 7.425 8.386 -0.961 25567 2968 1 5 . 1 1 11 11 TYR N N 11 121.235 121.235 129.093 -7.858 25567 2969 1 5 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.672 0.138 25567 2970 1 5 . 1 1 11 11 TYR CA C 11 53.889 53.889 59.545 -5.656 25567 2971 1 5 . 1 1 11 11 TYR CB C 11 40.467 40.467 40.178 0.289 25567 2972 1 5 . 1 1 11 11 TYR H H 11 7.781 7.781 8.323 -0.542 25567 2973 1 5 . 1 1 14 14 SER CA C 14 54.675 54.675 58.090 -3.415 25567 2974 1 5 . 1 1 14 14 SER CB C 14 61.621 61.621 62.781 -1.160 25567 2975 1 5 . 1 1 15 15 GLY N N 15 110.420 110.420 114.916 -4.496 25567 2976 1 5 . 1 1 15 15 GLY CA C 15 43.727 43.727 46.104 -2.377 25567 2977 1 5 . 1 1 15 15 GLY H H 15 7.757 7.757 8.723 -0.966 25567 2978 1 5 . 1 1 17 17 THR HA H 17 4.122 4.122 3.696 0.426 25567 2979 1 5 . 1 1 17 17 THR CA C 17 64.748 64.748 64.177 0.571 25567 2980 1 5 . 1 1 17 17 THR CB C 17 64.532 64.532 67.761 -3.229 25567 2981 1 5 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.885 -0.967 25567 2982 1 5 . 1 1 18 18 LYS C C 18 173.812 173.812 178.103 -4.291 25567 2983 1 5 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.699 -2.696 25567 2984 1 5 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.041 -2.273 25567 2985 1 5 . 1 1 19 19 LYS N N 19 116.699 116.699 117.111 -0.412 25567 2986 1 5 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.137 -0.189 25567 2987 1 5 . 1 1 19 19 LYS C C 19 177.221 177.221 177.380 -0.159 25567 2988 1 5 . 1 1 19 19 LYS CA C 19 56.421 56.421 57.684 -1.264 25567 2989 1 5 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.240 -2.606 25567 2990 1 5 . 1 1 19 19 LYS H H 19 7.476 7.476 7.785 -0.309 25567 2991 1 5 . 1 1 20 20 MET N N 20 118.946 118.946 116.302 2.644 25567 2992 1 5 . 1 1 20 20 MET HA H 20 4.474 4.474 4.719 -0.245 25567 2993 1 5 . 1 1 20 20 MET C C 20 173.826 173.826 177.663 -3.837 25567 2994 1 5 . 1 1 20 20 MET CA C 20 52.285 52.285 55.175 -2.890 25567 2995 1 5 . 1 1 20 20 MET CB C 20 26.921 26.921 32.959 -6.038 25567 2996 1 5 . 1 1 20 20 MET H H 20 7.457 7.457 7.847 -0.390 25567 2997 1 5 . 1 1 21 21 ALA N N 21 123.375 123.375 124.430 -1.055 25567 2998 1 5 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.527 -0.975 25567 2999 1 5 . 1 1 21 21 ALA C C 21 176.542 176.542 179.759 -3.217 25567 3000 1 5 . 1 1 21 21 ALA CA C 21 52.651 52.651 56.003 -3.352 25567 3001 1 5 . 1 1 21 21 ALA CB C 21 16.282 16.282 18.410 -2.128 25567 3002 1 5 . 1 1 21 21 ALA H H 21 8.549 8.549 8.379 0.170 25567 3003 1 5 . 1 1 22 22 GLU N N 22 116.906 116.906 118.323 -1.417 25567 3004 1 5 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.046 -0.373 25567 3005 1 5 . 1 1 22 22 GLU C C 22 176.658 176.658 179.264 -2.606 25567 3006 1 5 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.505 -2.900 25567 3007 1 5 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.216 -2.567 25567 3008 1 5 . 1 1 22 22 GLU H H 22 8.085 8.085 8.009 0.076 25567 3009 1 5 . 1 1 23 23 LYS N N 23 123.301 123.301 120.273 3.028 25567 3010 1 5 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.074 -0.254 25567 3011 1 5 . 1 1 23 23 LYS C C 23 177.363 177.363 179.377 -2.014 25567 3012 1 5 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.312 -2.341 25567 3013 1 5 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.031 -2.500 25567 3014 1 5 . 1 1 23 23 LYS H H 23 7.703 7.703 8.198 -0.495 25567 3015 1 5 . 1 1 24 24 ILE N N 24 121.894 121.894 118.940 2.954 25567 3016 1 5 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.579 -0.283 25567 3017 1 5 . 1 1 24 24 ILE C C 24 174.944 174.944 177.199 -2.255 25567 3018 1 5 . 1 1 24 24 ILE CA C 24 63.233 63.233 65.223 -1.990 25567 3019 1 5 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.713 -2.969 25567 3020 1 5 . 1 1 24 24 ILE H H 24 8.458 8.458 7.435 1.023 25567 3021 1 5 . 1 1 25 25 ASN N N 25 118.580 118.580 118.855 -0.275 25567 3022 1 5 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.299 -0.065 25567 3023 1 5 . 1 1 25 25 ASN C C 25 173.567 173.567 177.790 -4.223 25567 3024 1 5 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.698 -4.374 25567 3025 1 5 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.560 -0.377 25567 3026 1 5 . 1 1 25 25 ASN H H 25 8.273 8.273 8.223 0.050 25567 3027 1 5 . 1 1 26 26 SER N N 26 112.132 112.132 113.844 -1.712 25567 3028 1 5 . 1 1 26 26 SER HA H 26 4.148 4.148 4.241 -0.093 25567 3029 1 5 . 1 1 26 26 SER C C 26 172.083 172.083 174.777 -2.694 25567 3030 1 5 . 1 1 26 26 SER CA C 26 57.865 57.865 61.429 -3.564 25567 3031 1 5 . 1 1 26 26 SER CB C 26 60.816 60.816 63.299 -2.483 25567 3032 1 5 . 1 1 26 26 SER H H 26 7.444 7.444 8.283 -0.839 25567 3033 1 5 . 1 1 27 27 GLU N N 27 120.080 120.080 118.591 1.489 25567 3034 1 5 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.455 -0.355 25567 3035 1 5 . 1 1 27 27 GLU C C 27 173.647 173.647 176.951 -3.304 25567 3036 1 5 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.659 -2.457 25567 3037 1 5 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.655 -3.771 25567 3038 1 5 . 1 1 27 27 GLU H H 27 7.453 7.453 7.704 -0.251 25567 3039 1 5 . 1 1 28 28 ILE N N 28 118.759 118.759 120.584 -1.825 25567 3040 1 5 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.136 0.068 25567 3041 1 5 . 1 1 28 28 ILE C C 28 172.474 172.474 175.279 -2.805 25567 3042 1 5 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.629 -2.882 25567 3043 1 5 . 1 1 28 28 ILE CB C 28 35.798 35.798 39.374 -3.576 25567 3044 1 5 . 1 1 28 28 ILE H H 28 7.258 7.258 7.504 -0.246 25567 3045 1 5 . 1 1 29 29 LYS N N 29 130.618 130.618 122.523 8.095 25567 3046 1 5 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.357 -0.352 25567 3047 1 5 . 1 1 29 29 LYS C C 29 174.375 174.375 176.733 -2.358 25567 3048 1 5 . 1 1 29 29 LYS CA C 29 55.659 55.659 56.084 -0.425 25567 3049 1 5 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.385 -3.825 25567 3050 1 5 . 1 1 29 29 LYS H H 29 8.588 8.588 8.473 0.115 25567 3051 1 5 . 1 1 30 30 ASP N N 30 119.366 119.366 121.237 -1.871 25567 3052 1 5 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.319 0.083 25567 3053 1 5 . 1 1 30 30 ASP C C 30 172.580 172.580 175.190 -2.610 25567 3054 1 5 . 1 1 30 30 ASP CA C 30 53.624 53.624 54.884 -1.260 25567 3055 1 5 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.409 -3.581 25567 3056 1 5 . 1 1 30 30 ASP H H 30 8.940 8.940 8.926 0.014 25567 3057 1 5 . 1 1 31 31 SER N N 31 114.035 114.035 113.086 0.949 25567 3058 1 5 . 1 1 31 31 SER HA H 31 4.781 4.781 4.684 0.097 25567 3059 1 5 . 1 1 31 31 SER C C 31 171.136 171.136 174.707 -3.571 25567 3060 1 5 . 1 1 31 31 SER CA C 31 55.638 55.638 58.457 -2.819 25567 3061 1 5 . 1 1 31 31 SER CB C 31 62.388 62.388 64.186 -1.798 25567 3062 1 5 . 1 1 31 31 SER H H 31 8.030 8.030 8.023 0.007 25567 3063 1 5 . 1 1 32 32 GLU N N 32 121.406 121.406 126.500 -5.094 25567 3064 1 5 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.476 0.259 25567 3065 1 5 . 1 1 32 32 GLU C C 32 171.205 171.205 175.112 -3.907 25567 3066 1 5 . 1 1 32 32 GLU CA C 32 52.069 52.069 56.115 -4.046 25567 3067 1 5 . 1 1 32 32 GLU CB C 32 30.890 30.890 32.190 -1.300 25567 3068 1 5 . 1 1 32 32 GLU H H 32 8.188 8.188 8.743 -0.555 25567 3069 1 5 . 1 1 33 33 LEU N N 33 126.143 126.143 115.444 10.699 25567 3070 1 5 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.384 -0.099 25567 3071 1 5 . 1 1 33 33 LEU C C 33 173.401 173.401 175.943 -2.542 25567 3072 1 5 . 1 1 33 33 LEU CA C 33 51.334 51.334 52.766 -1.432 25567 3073 1 5 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.739 -1.116 25567 3074 1 5 . 1 1 33 33 LEU H H 33 8.627 8.627 8.103 0.524 25567 3075 1 5 . 1 1 34 34 LYS N N 34 127.122 127.122 117.440 9.682 25567 3076 1 5 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.496 0.103 25567 3077 1 5 . 1 1 34 34 LYS C C 34 169.644 169.644 174.203 -4.559 25567 3078 1 5 . 1 1 34 34 LYS CA C 34 52.353 52.353 56.125 -3.772 25567 3079 1 5 . 1 1 34 34 LYS CB C 34 34.172 34.172 36.670 -2.498 25567 3080 1 5 . 1 1 34 34 LYS H H 34 9.399 9.399 8.461 0.938 25567 3081 1 5 . 1 1 35 35 GLU N N 35 122.766 122.766 121.714 1.052 25567 3082 1 5 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.973 -1.615 25567 3083 1 5 . 1 1 35 35 GLU C C 35 172.875 172.875 176.117 -3.242 25567 3084 1 5 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.278 -2.638 25567 3085 1 5 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.386 -2.118 25567 3086 1 5 . 1 1 35 35 GLU H H 35 8.166 8.166 8.474 -0.308 25567 3087 1 5 . 1 1 36 36 VAL N N 36 126.674 126.674 122.652 4.022 25567 3088 1 5 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.297 -0.436 25567 3089 1 5 . 1 1 36 36 VAL C C 36 171.451 171.451 176.159 -4.708 25567 3090 1 5 . 1 1 36 36 VAL CA C 36 59.537 59.537 62.250 -2.713 25567 3091 1 5 . 1 1 36 36 VAL CB C 36 29.689 29.689 32.678 -2.989 25567 3092 1 5 . 1 1 36 36 VAL H H 36 8.632 8.632 8.357 0.275 25567 3093 1 5 . 1 1 37 37 LYS N N 37 126.181 126.181 123.333 2.848 25567 3094 1 5 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.881 0.058 25567 3095 1 5 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.691 -2.512 25567 3096 1 5 . 1 1 37 37 LYS CB C 37 32.898 32.898 36.595 -3.697 25567 3097 1 5 . 1 1 37 37 LYS H H 37 7.867 7.867 8.507 -0.640 25567 3098 1 5 . 1 1 38 38 VAL N N 38 113.540 113.540 117.349 -3.809 25567 3099 1 5 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.670 0.016 25567 3100 1 5 . 1 1 38 38 VAL C C 38 173.633 173.633 175.988 -2.355 25567 3101 1 5 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.209 -1.925 25567 3102 1 5 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.261 -1.297 25567 3103 1 5 . 1 1 38 38 VAL H H 38 8.389 8.389 8.368 0.021 25567 3104 1 5 . 1 1 39 39 SER N N 39 118.860 118.860 116.977 1.883 25567 3105 1 5 . 1 1 39 39 SER HA H 39 4.194 4.194 4.405 -0.211 25567 3106 1 5 . 1 1 39 39 SER C C 39 173.059 173.059 174.180 -1.121 25567 3107 1 5 . 1 1 39 39 SER CA C 39 56.227 56.227 58.831 -2.604 25567 3108 1 5 . 1 1 39 39 SER CB C 39 60.771 60.771 63.837 -3.066 25567 3109 1 5 . 1 1 39 39 SER H H 39 8.668 8.668 8.531 0.137 25567 3110 1 5 . 1 1 40 40 GLU N N 40 125.769 125.769 122.805 2.964 25567 3111 1 5 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.193 -0.036 25567 3112 1 5 . 1 1 40 40 GLU C C 40 174.484 174.484 175.337 -0.853 25567 3113 1 5 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.651 -1.101 25567 3114 1 5 . 1 1 40 40 GLU CB C 40 27.054 27.054 29.890 -2.836 25567 3115 1 5 . 1 1 40 40 GLU H H 40 8.878 8.878 8.523 0.355 25567 3116 1 5 . 1 1 41 41 GLY N N 41 112.165 112.165 105.485 6.680 25567 3117 1 5 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.477 -2.770 25567 3118 1 5 . 1 1 41 41 GLY H H 41 8.743 8.743 8.416 0.327 25567 3119 1 5 . 1 1 44 44 ASP N N 44 122.324 122.324 121.873 0.451 25567 3120 1 5 . 1 1 44 44 ASP CB C 44 42.156 42.156 41.219 0.936 25567 3121 1 5 . 1 1 44 44 ASP H H 44 7.918 7.918 8.596 -0.678 25567 3122 1 5 . 1 1 45 45 ALA HA H 45 4.062 4.062 3.904 0.158 25567 3123 1 5 . 1 1 45 45 ALA CA C 45 51.410 51.410 54.463 -3.053 25567 3124 1 5 . 1 1 45 45 ALA CB C 45 16.376 16.376 18.347 -1.971 25567 3125 1 5 . 1 1 47 47 MET CA C 47 54.118 54.118 54.777 -0.659 25567 3126 1 5 . 1 1 47 47 MET CB C 47 27.527 27.527 34.304 -6.777 25567 3127 1 5 . 1 1 48 48 TYR N N 48 120.075 120.075 120.752 -0.677 25567 3128 1 5 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.401 -0.247 25567 3129 1 5 . 1 1 48 48 TYR C C 48 172.217 172.217 176.218 -4.001 25567 3130 1 5 . 1 1 48 48 TYR CA C 48 57.377 57.377 57.392 -0.015 25567 3131 1 5 . 1 1 48 48 TYR CB C 48 34.496 34.496 38.883 -4.387 25567 3132 1 5 . 1 1 48 48 TYR H H 48 7.810 7.810 8.541 -0.731 25567 3133 1 5 . 1 1 49 49 LYS N N 49 118.369 118.369 119.803 -1.434 25567 3134 1 5 . 1 1 49 49 LYS H H 49 8.116 8.116 8.673 -0.557 25567 3135 1 5 . 1 1 50 50 THR N N 50 116.979 116.979 113.943 3.036 25567 3136 1 5 . 1 1 50 50 THR CB C 50 66.373 66.373 68.250 -1.877 25567 3137 1 5 . 1 1 50 50 THR H H 50 7.741 7.741 7.925 -0.184 25567 3138 1 5 . 1 1 51 51 SER N N 51 116.155 116.155 112.090 4.065 25567 3139 1 5 . 1 1 51 51 SER HA H 51 3.771 3.771 4.492 -0.721 25567 3140 1 5 . 1 1 51 51 SER C C 51 170.563 170.563 174.307 -3.744 25567 3141 1 5 . 1 1 51 51 SER CA C 51 54.840 54.840 58.398 -3.558 25567 3142 1 5 . 1 1 51 51 SER CB C 51 60.318 60.318 63.256 -2.938 25567 3143 1 5 . 1 1 51 51 SER H H 51 7.853 7.853 8.000 -0.147 25567 3144 1 5 . 1 1 54 54 ALA N N 54 123.234 123.234 119.948 3.286 25567 3145 1 5 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.803 -0.555 25567 3146 1 5 . 1 1 54 54 ALA CA C 54 51.268 51.268 50.238 1.030 25567 3147 1 5 . 1 1 54 54 ALA CB C 54 16.434 16.434 21.480 -5.046 25567 3148 1 5 . 1 1 54 54 ALA H H 54 8.207 8.207 8.103 0.104 25567 3149 1 5 . 1 1 55 55 LEU N N 55 118.603 118.603 121.028 -2.425 25567 3150 1 5 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.215 -0.275 25567 3151 1 5 . 1 1 55 55 LEU CA C 55 54.711 54.711 56.092 -1.381 25567 3152 1 5 . 1 1 55 55 LEU CB C 55 38.913 38.913 40.276 -1.363 25567 3153 1 5 . 1 1 55 55 LEU H H 55 7.960 7.960 8.533 -0.573 25567 3154 1 5 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.035 -0.359 25567 3155 1 5 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.716 -0.222 25567 3156 1 5 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.843 -3.789 25567 3157 1 5 . 1 1 59 59 GLN N N 59 117.579 117.579 121.492 -3.913 25567 3158 1 5 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.254 -0.121 25567 3159 1 5 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.507 -2.498 25567 3160 1 5 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.805 -2.154 25567 3161 1 5 . 1 1 59 59 GLN H H 59 8.268 8.268 8.114 0.154 25567 3162 1 5 . 1 1 60 60 GLY N N 60 107.308 107.308 111.625 -4.317 25567 3163 1 5 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.183 -2.204 25567 3164 1 5 . 1 1 60 60 GLY H H 60 7.780 7.780 8.839 -1.059 25567 3165 1 5 . 1 1 61 61 ASN N N 61 117.747 117.747 120.252 -2.505 25567 3166 1 5 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.447 0.087 25567 3167 1 5 . 1 1 61 61 ASN CA C 61 51.235 51.235 53.355 -2.120 25567 3168 1 5 . 1 1 61 61 ASN CB C 61 36.424 36.424 38.577 -2.152 25567 3169 1 5 . 1 1 61 61 ASN H H 61 8.108 8.108 7.554 0.554 25567 3170 1 5 . 1 1 64 64 PHE N N 64 120.102 120.102 120.180 -0.078 25567 3171 1 5 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.485 -0.106 25567 3172 1 5 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.825 -3.077 25567 3173 1 5 . 1 1 64 64 PHE CB C 64 35.275 35.275 39.190 -3.915 25567 3174 1 5 . 1 1 64 64 PHE H H 64 8.300 8.300 8.414 -0.114 25567 3175 1 5 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.143 0.192 25567 3176 1 5 . 1 1 65 65 PRO C C 65 173.870 173.870 176.259 -2.389 25567 3177 1 5 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.444 -2.427 25567 3178 1 5 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.339 -2.704 25567 3179 1 5 . 1 1 66 66 GLU N N 66 121.258 121.258 119.047 2.211 25567 3180 1 5 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.407 -0.173 25567 3181 1 5 . 1 1 66 66 GLU C C 66 173.981 173.981 177.191 -3.210 25567 3182 1 5 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.285 -2.498 25567 3183 1 5 . 1 1 66 66 GLU CB C 66 27.775 27.775 31.302 -3.527 25567 3184 1 5 . 1 1 66 66 GLU H H 66 8.316 8.316 8.274 0.042 25567 3185 1 5 . 1 1 67 67 ILE N N 67 114.290 114.290 115.385 -1.095 25567 3186 1 5 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.822 0.307 25567 3187 1 5 . 1 1 67 67 ILE C C 67 172.700 172.700 175.342 -2.642 25567 3188 1 5 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.376 -2.937 25567 3189 1 5 . 1 1 67 67 ILE CB C 67 39.159 39.159 40.983 -1.824 25567 3190 1 5 . 1 1 67 67 ILE H H 67 8.366 8.366 8.276 0.090 25567 3191 1 5 . 1 1 68 68 GLN N N 68 121.422 121.422 120.358 1.064 25567 3192 1 5 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.794 -0.293 25567 3193 1 5 . 1 1 68 68 GLN C C 68 171.675 171.675 174.278 -2.603 25567 3194 1 5 . 1 1 68 68 GLN CA C 68 52.273 52.273 55.011 -2.739 25567 3195 1 5 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.287 -6.144 25567 3196 1 5 . 1 1 68 68 GLN H H 68 8.737 8.737 8.640 0.097 25567 3197 1 5 . 1 1 69 69 LEU N N 69 125.311 125.311 117.001 8.310 25567 3198 1 5 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.899 -0.393 25567 3199 1 5 . 1 1 69 69 LEU C C 69 172.634 172.634 174.944 -2.310 25567 3200 1 5 . 1 1 69 69 LEU CA C 69 51.759 51.759 54.156 -2.397 25567 3201 1 5 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.797 -1.393 25567 3202 1 5 . 1 1 69 69 LEU H H 69 8.051 8.051 8.232 -0.181 25567 3203 1 5 . 1 1 70 70 ASP N N 70 122.763 122.763 119.984 2.779 25567 3204 1 5 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.701 -0.278 25567 3205 1 5 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.526 -1.916 25567 3206 1 5 . 1 1 70 70 ASP CB C 70 38.717 38.717 41.877 -3.159 25567 3207 1 5 . 1 1 70 70 ASP H H 70 8.313 8.313 8.539 -0.226 25567 3208 1 5 . 1 1 71 71 ASN N N 71 117.413 117.413 118.314 -0.901 25567 3209 1 5 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.749 -0.412 25567 3210 1 5 . 1 1 71 71 ASN C C 71 171.770 171.770 174.712 -2.942 25567 3211 1 5 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.543 -2.052 25567 3212 1 5 . 1 1 71 71 ASN CB C 71 35.326 35.326 38.146 -2.820 25567 3213 1 5 . 1 1 71 71 ASN H H 71 8.407 8.407 8.493 -0.086 25567 3214 1 5 . 1 1 72 72 ILE N N 72 123.752 123.752 125.569 -1.817 25567 3215 1 5 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.333 -0.393 25567 3216 1 5 . 1 1 72 72 ILE C C 72 171.621 171.621 174.787 -3.166 25567 3217 1 5 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.673 -3.341 25567 3218 1 5 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.938 -1.449 25567 3219 1 5 . 1 1 72 72 ILE H H 72 7.639 7.639 7.632 0.007 25567 3220 1 5 . 1 1 73 73 ASP N N 73 125.252 125.252 127.400 -2.148 25567 3221 1 5 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.550 0.075 25567 3222 1 5 . 1 1 73 73 ASP C C 73 174.034 174.034 176.044 -2.010 25567 3223 1 5 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.811 -4.608 25567 3224 1 5 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.956 -4.933 25567 3225 1 5 . 1 1 73 73 ASP H H 73 8.394 8.394 8.595 -0.201 25567 3226 1 5 . 1 1 74 74 TYR N N 74 123.108 123.108 122.967 0.141 25567 3227 1 5 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.702 -0.824 25567 3228 1 5 . 1 1 74 74 TYR C C 74 173.637 173.637 177.079 -3.442 25567 3229 1 5 . 1 1 74 74 TYR CA C 74 59.474 59.474 57.852 1.622 25567 3230 1 5 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.232 -3.510 25567 3231 1 5 . 1 1 74 74 TYR H H 74 7.392 7.392 8.511 -1.119 25567 3232 1 5 . 1 1 75 75 ASN N N 75 109.422 109.422 116.810 -7.388 25567 3233 1 5 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.537 0.389 25567 3234 1 5 . 1 1 75 75 ASN C C 75 172.574 172.574 174.982 -2.408 25567 3235 1 5 . 1 1 75 75 ASN CA C 75 52.761 52.761 56.149 -3.388 25567 3236 1 5 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.735 -3.118 25567 3237 1 5 . 1 1 75 75 ASN H H 75 8.058 8.058 8.481 -0.423 25567 3238 1 5 . 1 1 76 76 ASN N N 76 117.422 117.422 114.557 2.865 25567 3239 1 5 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.648 -0.193 25567 3240 1 5 . 1 1 76 76 ASN C C 76 171.132 171.132 173.230 -2.098 25567 3241 1 5 . 1 1 76 76 ASN CA C 76 51.167 51.167 52.478 -1.312 25567 3242 1 5 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.308 -2.580 25567 3243 1 5 . 1 1 76 76 ASN H H 76 7.768 7.768 7.792 -0.024 25567 3244 1 5 . 1 1 77 77 TYR N N 77 116.873 116.873 119.088 -2.215 25567 3245 1 5 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.755 -0.392 25567 3246 1 5 . 1 1 77 77 TYR C C 77 172.175 172.175 174.265 -2.090 25567 3247 1 5 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.209 -1.845 25567 3248 1 5 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.420 -4.255 25567 3249 1 5 . 1 1 77 77 TYR H H 77 7.825 7.825 7.610 0.215 25567 3250 1 5 . 1 1 78 78 ASP N N 78 121.271 121.271 121.108 0.163 25567 3251 1 5 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.972 -0.167 25567 3252 1 5 . 1 1 78 78 ASP C C 78 172.641 172.641 175.507 -2.866 25567 3253 1 5 . 1 1 78 78 ASP CA C 78 53.255 53.255 54.576 -1.321 25567 3254 1 5 . 1 1 78 78 ASP CB C 78 41.075 41.075 42.734 -1.659 25567 3255 1 5 . 1 1 78 78 ASP H H 78 9.058 9.058 8.474 0.584 25567 3256 1 5 . 1 1 79 79 LEU N N 79 122.985 122.985 118.170 4.815 25567 3257 1 5 . 1 1 79 79 LEU HA H 79 5.114 5.114 4.742 0.372 25567 3258 1 5 . 1 1 79 79 LEU C C 79 170.721 170.721 174.413 -3.692 25567 3259 1 5 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.230 -2.914 25567 3260 1 5 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.807 -3.465 25567 3261 1 5 . 1 1 79 79 LEU H H 79 7.893 7.893 7.563 0.330 25567 3262 1 5 . 1 1 80 80 ILE N N 80 126.364 126.364 124.501 1.863 25567 3263 1 5 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.620 0.469 25567 3264 1 5 . 1 1 80 80 ILE C C 80 171.580 171.580 174.184 -2.604 25567 3265 1 5 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.606 -3.189 25567 3266 1 5 . 1 1 80 80 ILE CB C 80 38.136 38.136 40.005 -1.869 25567 3267 1 5 . 1 1 80 80 ILE H H 80 8.717 8.717 8.410 0.307 25567 3268 1 5 . 1 1 81 81 LEU N N 81 126.199 126.199 128.054 -1.855 25567 3269 1 5 . 1 1 81 81 LEU HA H 81 5.135 5.135 4.940 0.195 25567 3270 1 5 . 1 1 81 81 LEU C C 81 172.979 172.979 175.689 -2.710 25567 3271 1 5 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.583 -3.950 25567 3272 1 5 . 1 1 81 81 LEU CB C 81 42.159 42.159 44.174 -2.015 25567 3273 1 5 . 1 1 81 81 LEU H H 81 9.230 9.230 8.895 0.335 25567 3274 1 5 . 1 1 82 82 ILE N N 82 120.505 120.505 120.617 -0.112 25567 3275 1 5 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.050 -0.134 25567 3276 1 5 . 1 1 82 82 ILE C C 82 173.011 173.011 174.928 -1.917 25567 3277 1 5 . 1 1 82 82 ILE CA C 82 56.828 56.828 60.128 -3.300 25567 3278 1 5 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.656 -3.588 25567 3279 1 5 . 1 1 82 82 ILE H H 82 8.796 8.796 8.139 0.657 25567 3280 1 5 . 1 1 83 83 GLY N N 83 120.857 120.857 113.405 7.452 25567 3281 1 5 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.042 -2.239 25567 3282 1 5 . 1 1 83 83 GLY H H 83 9.525 9.525 8.366 1.159 25567 3283 1 5 . 1 1 84 84 SER N N 84 116.007 116.007 113.382 2.625 25567 3284 1 5 . 1 1 84 84 SER HA H 84 5.476 5.476 5.238 0.238 25567 3285 1 5 . 1 1 84 84 SER CA C 84 51.937 51.937 55.882 -3.945 25567 3286 1 5 . 1 1 84 84 SER CB C 84 64.533 64.533 64.942 -0.409 25567 3287 1 5 . 1 1 84 84 SER H H 84 7.617 7.617 8.193 -0.576 25567 3288 1 5 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.736 0.465 25567 3289 1 5 . 1 1 85 85 PRO C C 85 173.574 173.574 176.365 -2.791 25567 3290 1 5 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.763 -3.275 25567 3291 1 5 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.666 -1.526 25567 3292 1 5 . 1 1 86 86 VAL N N 86 117.603 117.603 117.775 -0.172 25567 3293 1 5 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.442 -0.069 25567 3294 1 5 . 1 1 86 86 VAL C C 86 172.777 172.777 174.304 -1.527 25567 3295 1 5 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.152 -1.549 25567 3296 1 5 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.033 -5.460 25567 3297 1 5 . 1 1 86 86 VAL H H 86 8.194 8.194 8.052 0.142 25567 3298 1 5 . 1 1 87 87 TRP N N 87 131.187 131.187 125.761 5.426 25567 3299 1 5 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.951 0.247 25567 3300 1 5 . 1 1 87 87 TRP C C 87 173.295 173.295 174.388 -1.093 25567 3301 1 5 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.571 -6.787 25567 3302 1 5 . 1 1 87 87 TRP CB C 87 27.746 27.746 32.121 -4.375 25567 3303 1 5 . 1 1 87 87 TRP H H 87 9.637 9.637 8.733 0.904 25567 3304 1 5 . 1 1 88 88 SER N N 88 119.829 119.829 115.076 4.753 25567 3305 1 5 . 1 1 88 88 SER HA H 88 3.986 3.986 4.685 -0.699 25567 3306 1 5 . 1 1 88 88 SER C C 88 172.375 172.375 174.119 -1.744 25567 3307 1 5 . 1 1 88 88 SER CA C 88 55.932 55.932 57.575 -1.643 25567 3308 1 5 . 1 1 88 88 SER CB C 88 59.178 59.178 63.237 -4.059 25567 3309 1 5 . 1 1 88 88 SER H H 88 9.272 9.272 7.724 1.548 25567 3310 1 5 . 1 1 89 89 GLY N N 89 101.498 101.498 112.665 -11.167 25567 3311 1 5 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.087 -3.416 25567 3312 1 5 . 1 1 89 89 GLY H H 89 7.463 7.463 8.655 -1.192 25567 3313 1 5 . 1 1 90 90 TYR N N 90 121.064 121.064 115.882 5.182 25567 3314 1 5 . 1 1 90 90 TYR HA H 90 4.216 4.216 4.955 -0.739 25567 3315 1 5 . 1 1 90 90 TYR CA C 90 54.090 54.090 53.720 0.370 25567 3316 1 5 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.910 0.285 25567 3317 1 5 . 1 1 90 90 TYR H H 90 8.064 8.064 7.633 0.431 25567 3318 1 5 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.528 0.404 25567 3319 1 5 . 1 1 91 91 PRO C C 91 171.019 171.019 176.734 -5.715 25567 3320 1 5 . 1 1 91 91 PRO CA C 91 58.994 58.994 64.318 -5.324 25567 3321 1 5 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.520 -6.027 25567 3322 1 5 . 1 1 92 92 ALA N N 92 119.893 119.893 120.932 -1.039 25567 3323 1 5 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.241 -0.790 25567 3324 1 5 . 1 1 92 92 ALA C C 92 176.477 176.477 177.038 -0.561 25567 3325 1 5 . 1 1 92 92 ALA CA C 92 49.567 49.567 52.205 -2.638 25567 3326 1 5 . 1 1 92 92 ALA CB C 92 15.801 15.801 19.925 -4.124 25567 3327 1 5 . 1 1 92 92 ALA H H 92 7.278 7.278 8.227 -0.949 25567 3328 1 5 . 1 1 93 93 THR N N 93 112.992 112.992 111.094 1.898 25567 3329 1 5 . 1 1 93 93 THR HA H 93 4.462 4.462 4.927 -0.465 25567 3330 1 5 . 1 1 93 93 THR CA C 93 66.871 66.871 60.087 6.784 25567 3331 1 5 . 1 1 93 93 THR CB C 93 64.362 64.362 68.570 -4.208 25567 3332 1 5 . 1 1 93 93 THR H H 93 6.861 6.861 8.471 -1.610 25567 3333 1 5 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.557 -0.691 25567 3334 1 5 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.059 -0.038 25567 3335 1 5 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.947 -2.668 25567 3336 1 5 . 1 1 95 95 ILE N N 95 111.298 111.298 119.375 -8.077 25567 3337 1 5 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.536 -0.913 25567 3338 1 5 . 1 1 95 95 ILE C C 95 174.264 174.264 175.618 -1.354 25567 3339 1 5 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.583 -2.135 25567 3340 1 5 . 1 1 95 95 ILE CB C 95 31.929 31.929 37.095 -5.166 25567 3341 1 5 . 1 1 95 95 ILE H H 95 7.974 7.974 8.037 -0.063 25567 3342 1 5 . 1 1 96 96 LYS N N 96 123.045 123.045 120.548 2.497 25567 3343 1 5 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.595 -1.483 25567 3344 1 5 . 1 1 96 96 LYS C C 96 174.590 174.590 177.770 -3.180 25567 3345 1 5 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.182 -0.037 25567 3346 1 5 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.880 -5.035 25567 3347 1 5 . 1 1 96 96 LYS H H 96 6.958 6.958 8.122 -1.164 25567 3348 1 5 . 1 1 97 97 THR N N 97 113.412 113.412 116.921 -3.509 25567 3349 1 5 . 1 1 97 97 THR HA H 97 3.461 3.461 4.043 -0.582 25567 3350 1 5 . 1 1 97 97 THR C C 97 173.247 173.247 176.143 -2.896 25567 3351 1 5 . 1 1 97 97 THR CA C 97 62.809 62.809 65.803 -2.994 25567 3352 1 5 . 1 1 97 97 THR CB C 97 65.654 65.654 68.818 -3.164 25567 3353 1 5 . 1 1 97 97 THR H H 97 6.366 6.366 8.286 -1.920 25567 3354 1 5 . 1 1 98 98 LEU N N 98 121.201 121.201 123.326 -2.125 25567 3355 1 5 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.190 -0.556 25567 3356 1 5 . 1 1 98 98 LEU C C 98 174.590 174.590 178.596 -4.006 25567 3357 1 5 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.793 -2.172 25567 3358 1 5 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.141 -1.246 25567 3359 1 5 . 1 1 98 98 LEU H H 98 7.554 7.554 8.145 -0.591 25567 3360 1 5 . 1 1 99 99 LEU N N 99 118.677 118.677 116.754 1.923 25567 3361 1 5 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.954 -0.252 25567 3362 1 5 . 1 1 99 99 LEU C C 99 177.457 177.457 179.861 -2.404 25567 3363 1 5 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.694 -2.515 25567 3364 1 5 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.072 -2.084 25567 3365 1 5 . 1 1 99 99 LEU H H 99 8.160 8.160 7.887 0.273 25567 3366 1 5 . 1 1 100 100 ASP N N 100 118.914 118.914 117.411 1.503 25567 3367 1 5 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.475 -0.246 25567 3368 1 5 . 1 1 100 100 ASP C C 100 176.585 176.585 177.645 -1.060 25567 3369 1 5 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.187 -1.671 25567 3370 1 5 . 1 1 100 100 ASP CB C 100 37.579 37.579 40.667 -3.088 25567 3371 1 5 . 1 1 100 100 ASP H H 100 7.872 7.872 7.772 0.100 25567 3372 1 5 . 1 1 101 101 GLN N N 101 118.135 118.135 117.283 0.852 25567 3373 1 5 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.346 -0.186 25567 3374 1 5 . 1 1 101 101 GLN C C 101 174.601 174.601 177.047 -2.446 25567 3375 1 5 . 1 1 101 101 GLN CA C 101 54.960 54.960 56.801 -1.841 25567 3376 1 5 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.302 -3.752 25567 3377 1 5 . 1 1 101 101 GLN H H 101 7.673 7.673 7.593 0.080 25567 3378 1 5 . 1 1 102 102 MET N N 102 118.420 118.420 118.484 -0.064 25567 3379 1 5 . 1 1 102 102 MET HA H 102 3.826 3.826 4.723 -0.897 25567 3380 1 5 . 1 1 102 102 MET C C 102 172.780 172.780 176.852 -4.072 25567 3381 1 5 . 1 1 102 102 MET CA C 102 53.428 53.428 55.761 -2.333 25567 3382 1 5 . 1 1 102 102 MET CB C 102 31.221 31.221 31.736 -0.515 25567 3383 1 5 . 1 1 102 102 MET H H 102 7.462 7.462 7.485 -0.023 25567 3384 1 5 . 1 1 103 103 LYS N N 103 116.066 116.066 119.398 -3.332 25567 3385 1 5 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.120 -0.200 25567 3386 1 5 . 1 1 103 103 LYS C C 103 173.922 173.922 177.466 -3.544 25567 3387 1 5 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.484 -2.202 25567 3388 1 5 . 1 1 103 103 LYS CB C 103 29.491 29.491 32.020 -2.529 25567 3389 1 5 . 1 1 103 103 LYS H H 103 6.875 6.875 8.426 -1.551 25567 3390 1 5 . 1 1 104 104 ASN N N 104 114.987 114.987 115.634 -0.647 25567 3391 1 5 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.988 -0.247 25567 3392 1 5 . 1 1 104 104 ASN C C 104 172.587 172.587 174.708 -2.121 25567 3393 1 5 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.636 -2.167 25567 3394 1 5 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.177 -3.355 25567 3395 1 5 . 1 1 104 104 ASN H H 104 8.517 8.517 8.223 0.294 25567 3396 1 5 . 1 1 105 105 TYR N N 105 122.755 122.755 118.835 3.920 25567 3397 1 5 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.394 0.181 25567 3398 1 5 . 1 1 105 105 TYR C C 105 174.260 174.260 176.038 -1.778 25567 3399 1 5 . 1 1 105 105 TYR CA C 105 55.493 55.493 57.553 -2.060 25567 3400 1 5 . 1 1 105 105 TYR CB C 105 36.064 36.064 38.773 -2.709 25567 3401 1 5 . 1 1 105 105 TYR H H 105 8.287 8.287 7.910 0.377 25567 3402 1 5 . 1 1 106 106 ARG N N 106 128.905 128.905 121.581 7.324 25567 3403 1 5 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.476 -0.203 25567 3404 1 5 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.199 -2.178 25567 3405 1 5 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.910 -3.780 25567 3406 1 5 . 1 1 106 106 ARG H H 106 8.841 8.841 9.014 -0.173 25567 3407 1 5 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.351 -1.854 25567 3408 1 5 . 1 1 108 108 GLU N N 108 116.989 116.989 119.054 -2.065 25567 3409 1 5 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.664 -0.033 25567 3410 1 5 . 1 1 108 108 GLU CA C 108 53.676 53.676 56.284 -2.608 25567 3411 1 5 . 1 1 108 108 GLU CB C 108 30.402 30.402 31.777 -1.375 25567 3412 1 5 . 1 1 108 108 GLU H H 108 7.536 7.536 8.125 -0.589 25567 3413 1 5 . 1 1 109 109 VAL N N 109 123.416 123.416 120.080 3.336 25567 3414 1 5 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.787 0.534 25567 3415 1 5 . 1 1 109 109 VAL CA C 109 57.443 57.443 61.171 -3.728 25567 3416 1 5 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.618 -0.957 25567 3417 1 5 . 1 1 109 109 VAL H H 109 8.955 8.955 8.610 0.345 25567 3418 1 5 . 1 1 110 110 ALA N N 110 127.975 127.975 128.369 -0.394 25567 3419 1 5 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.402 -0.725 25567 3420 1 5 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.953 -2.512 25567 3421 1 5 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.531 -4.115 25567 3422 1 5 . 1 1 110 110 ALA H H 110 8.860 8.860 8.719 0.141 25567 3423 1 5 . 1 1 111 111 SER N N 111 110.482 110.482 113.076 -2.594 25567 3424 1 5 . 1 1 111 111 SER HA H 111 5.502 5.502 5.279 0.223 25567 3425 1 5 . 1 1 111 111 SER CA C 111 51.630 51.630 56.269 -4.638 25567 3426 1 5 . 1 1 111 111 SER CB C 111 62.267 62.267 65.522 -3.255 25567 3427 1 5 . 1 1 111 111 SER H H 111 7.484 7.484 7.694 -0.210 25567 3428 1 5 . 1 1 112 112 PHE N N 112 125.082 125.082 122.129 2.953 25567 3429 1 5 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.659 0.789 25567 3430 1 5 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.864 -5.430 25567 3431 1 5 . 1 1 112 112 PHE CB C 112 40.500 40.500 40.344 0.156 25567 3432 1 5 . 1 1 112 112 PHE H H 112 8.025 8.025 8.391 -0.366 25567 3433 1 5 . 1 1 113 113 PHE N N 113 115.872 115.872 119.669 -3.797 25567 3434 1 5 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.094 0.830 25567 3435 1 5 . 1 1 113 113 PHE C C 113 173.293 173.293 174.902 -1.609 25567 3436 1 5 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.038 -4.570 25567 3437 1 5 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.108 -2.715 25567 3438 1 5 . 1 1 113 113 PHE H H 113 7.391 7.391 7.863 -0.472 25567 3439 1 5 . 1 1 114 114 THR N N 114 108.721 108.721 110.075 -1.354 25567 3440 1 5 . 1 1 114 114 THR HA H 114 4.933 4.933 4.436 0.497 25567 3441 1 5 . 1 1 114 114 THR C C 114 171.891 171.891 175.230 -3.339 25567 3442 1 5 . 1 1 114 114 THR CA C 114 56.815 56.815 61.633 -4.818 25567 3443 1 5 . 1 1 114 114 THR CB C 114 67.899 67.899 69.938 -2.039 25567 3444 1 5 . 1 1 114 114 THR H H 114 7.951 7.951 8.200 -0.249 25567 3445 1 5 . 1 1 115 115 SER N N 115 115.159 115.159 118.597 -3.438 25567 3446 1 5 . 1 1 115 115 SER HA H 115 4.608 4.608 4.753 -0.145 25567 3447 1 5 . 1 1 115 115 SER C C 115 171.403 171.403 174.116 -2.713 25567 3448 1 5 . 1 1 115 115 SER CA C 115 55.570 55.570 57.849 -2.279 25567 3449 1 5 . 1 1 115 115 SER CB C 115 61.418 61.418 63.214 -1.796 25567 3450 1 5 . 1 1 115 115 SER H H 115 8.229 8.229 8.324 -0.095 25567 3451 1 5 . 1 1 116 116 ALA N N 116 127.211 127.211 124.340 2.871 25567 3452 1 5 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.391 0.065 25567 3453 1 5 . 1 1 116 116 ALA C C 116 175.758 175.758 179.482 -3.724 25567 3454 1 5 . 1 1 116 116 ALA CA C 116 49.816 49.816 54.537 -4.721 25567 3455 1 5 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.028 -2.197 25567 3456 1 5 . 1 1 116 116 ALA H H 116 8.813 8.813 8.414 0.399 25567 3457 1 5 . 1 1 117 117 GLY N N 117 108.099 108.099 107.793 0.306 25567 3458 1 5 . 1 1 117 117 GLY C C 117 171.805 171.805 175.577 -3.772 25567 3459 1 5 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.369 -4.500 25567 3460 1 5 . 1 1 117 117 GLY H H 117 8.685 8.685 8.846 -0.161 25567 3461 1 5 . 1 1 118 118 THR N N 118 111.284 111.284 110.445 0.839 25567 3462 1 5 . 1 1 118 118 THR HA H 118 4.343 4.343 4.420 -0.077 25567 3463 1 5 . 1 1 118 118 THR C C 118 171.769 171.769 173.831 -2.062 25567 3464 1 5 . 1 1 118 118 THR CA C 118 58.933 58.933 61.356 -2.424 25567 3465 1 5 . 1 1 118 118 THR CB C 118 67.304 67.304 69.823 -2.519 25567 3466 1 5 . 1 1 118 118 THR H H 118 7.998 7.998 8.250 -0.252 25567 3467 1 5 . 1 1 119 119 ASN N N 119 120.253 120.253 119.278 0.975 25567 3468 1 5 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.923 -0.220 25567 3469 1 5 . 1 1 119 119 ASN C C 119 172.353 172.353 174.321 -1.968 25567 3470 1 5 . 1 1 119 119 ASN CA C 119 50.228 50.228 54.102 -3.874 25567 3471 1 5 . 1 1 119 119 ASN CB C 119 35.376 35.376 40.060 -4.684 25567 3472 1 5 . 1 1 119 119 ASN H H 119 8.381 8.381 7.758 0.623 25567 3473 1 5 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.821 -0.735 25567 3474 1 5 . 1 1 120 120 HIS C C 120 173.395 173.395 175.902 -2.507 25567 3475 1 5 . 1 1 120 120 HIS CA C 120 55.139 55.139 58.056 -2.917 25567 3476 1 5 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.041 -2.619 25567 3477 1 5 . 1 1 121 121 LYS N N 121 119.527 119.527 120.581 -1.054 25567 3478 1 5 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.715 0.065 25567 3479 1 5 . 1 1 121 121 LYS C C 121 176.053 176.053 177.747 -1.694 25567 3480 1 5 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.174 -2.211 25567 3481 1 5 . 1 1 121 121 LYS CB C 121 29.660 29.660 30.674 -1.014 25567 3482 1 5 . 1 1 121 121 LYS H H 121 8.106 8.106 8.587 -0.481 25567 3483 1 5 . 1 1 122 122 ALA N N 122 121.585 121.585 123.199 -1.614 25567 3484 1 5 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.720 0.001 25567 3485 1 5 . 1 1 122 122 ALA C C 122 175.128 175.128 179.027 -3.899 25567 3486 1 5 . 1 1 122 122 ALA CA C 122 51.591 51.591 53.853 -2.262 25567 3487 1 5 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.870 -2.166 25567 3488 1 5 . 1 1 122 122 ALA H H 122 7.702 7.702 7.665 0.037 25567 3489 1 5 . 1 1 123 123 TYR N N 123 118.803 118.803 120.446 -1.643 25567 3490 1 5 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.010 -0.644 25567 3491 1 5 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.435 -1.344 25567 3492 1 5 . 1 1 123 123 TYR CB C 123 35.102 35.102 37.945 -2.843 25567 3493 1 5 . 1 1 123 123 TYR H H 123 7.366 7.366 7.493 -0.127 25567 3494 1 5 . 1 1 124 124 VAL N N 124 117.530 117.530 117.302 0.228 25567 3495 1 5 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.764 -0.565 25567 3496 1 5 . 1 1 124 124 VAL C C 124 175.375 175.375 178.399 -3.024 25567 3497 1 5 . 1 1 124 124 VAL CA C 124 64.583 64.583 67.074 -2.491 25567 3498 1 5 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.776 -1.573 25567 3499 1 5 . 1 1 124 124 VAL H H 124 7.757 7.757 7.620 0.137 25567 3500 1 5 . 1 1 125 125 SER N N 125 114.023 114.023 114.854 -0.831 25567 3501 1 5 . 1 1 125 125 SER HA H 125 4.035 4.035 4.187 -0.152 25567 3502 1 5 . 1 1 125 125 SER C C 125 174.636 174.636 176.624 -1.988 25567 3503 1 5 . 1 1 125 125 SER CA C 125 58.885 58.885 61.074 -2.189 25567 3504 1 5 . 1 1 125 125 SER CB C 125 59.666 59.666 62.858 -3.192 25567 3505 1 5 . 1 1 125 125 SER H H 125 7.622 7.622 7.569 0.053 25567 3506 1 5 . 1 1 126 126 HIS N N 126 119.457 119.457 119.961 -0.504 25567 3507 1 5 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.087 0.109 25567 3508 1 5 . 1 1 126 126 HIS C C 126 172.942 172.942 177.689 -4.747 25567 3509 1 5 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.407 -3.489 25567 3510 1 5 . 1 1 126 126 HIS CB C 126 26.079 26.079 28.962 -2.884 25567 3511 1 5 . 1 1 126 126 HIS H H 126 8.067 8.067 8.174 -0.107 25567 3512 1 5 . 1 1 127 127 PHE N N 127 120.628 120.628 120.520 0.108 25567 3513 1 5 . 1 1 127 127 PHE HA H 127 3.199 3.199 4.092 -0.893 25567 3514 1 5 . 1 1 127 127 PHE C C 127 173.515 173.515 176.921 -3.406 25567 3515 1 5 . 1 1 127 127 PHE CA C 127 60.681 60.681 60.233 0.448 25567 3516 1 5 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.769 -2.402 25567 3517 1 5 . 1 1 127 127 PHE H H 127 9.083 9.083 8.585 0.498 25567 3518 1 5 . 1 1 128 128 ASN N N 128 114.858 114.858 116.226 -1.368 25567 3519 1 5 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.228 -0.150 25567 3520 1 5 . 1 1 128 128 ASN C C 128 175.338 175.338 176.495 -1.157 25567 3521 1 5 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.133 -1.883 25567 3522 1 5 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.297 -2.276 25567 3523 1 5 . 1 1 128 128 ASN H H 128 7.858 7.858 7.526 0.332 25567 3524 1 5 . 1 1 129 129 GLU N N 129 119.811 119.811 118.003 1.808 25567 3525 1 5 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.208 -0.167 25567 3526 1 5 . 1 1 129 129 GLU C C 129 176.941 176.941 179.365 -2.424 25567 3527 1 5 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.970 -2.338 25567 3528 1 5 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.995 -3.057 25567 3529 1 5 . 1 1 129 129 GLU H H 129 7.569 7.569 7.744 -0.175 25567 3530 1 5 . 1 1 130 130 TRP N N 130 120.585 120.585 119.255 1.330 25567 3531 1 5 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.451 0.021 25567 3532 1 5 . 1 1 130 130 TRP C C 130 174.262 174.262 177.108 -2.846 25567 3533 1 5 . 1 1 130 130 TRP CA C 130 54.673 54.673 57.733 -3.059 25567 3534 1 5 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.369 -1.413 25567 3535 1 5 . 1 1 130 130 TRP H H 130 7.964 7.964 8.796 -0.832 25567 3536 1 5 . 1 1 131 131 ALA N N 131 120.522 120.522 119.542 0.980 25567 3537 1 5 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.358 -0.411 25567 3538 1 5 . 1 1 131 131 ALA C C 131 172.489 172.489 175.295 -2.806 25567 3539 1 5 . 1 1 131 131 ALA CA C 131 48.580 48.580 50.407 -1.827 25567 3540 1 5 . 1 1 131 131 ALA CB C 131 16.539 16.539 18.665 -2.126 25567 3541 1 5 . 1 1 131 131 ALA H H 131 8.114 8.114 7.507 0.607 25567 3542 1 5 . 1 1 132 132 ASP N N 132 117.666 117.666 121.022 -3.356 25567 3543 1 5 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.306 -0.100 25567 3544 1 5 . 1 1 132 132 ASP C C 132 173.779 173.779 176.918 -3.139 25567 3545 1 5 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.826 -1.513 25567 3546 1 5 . 1 1 132 132 ASP CB C 132 39.456 39.456 40.401 -0.945 25567 3547 1 5 . 1 1 132 132 ASP H H 132 6.768 6.768 7.593 -0.825 25567 3548 1 5 . 1 1 133 133 GLY N N 133 114.922 114.922 112.563 2.359 25567 3549 1 5 . 1 1 133 133 GLY C C 133 172.101 172.101 173.435 -1.334 25567 3550 1 5 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.636 -2.127 25567 3551 1 5 . 1 1 133 133 GLY H H 133 8.645 8.645 8.240 0.405 25567 3552 1 5 . 1 1 134 134 LEU N N 134 120.101 120.101 118.941 1.160 25567 3553 1 5 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.308 0.154 25567 3554 1 5 . 1 1 134 134 LEU C C 134 174.098 174.098 175.510 -1.412 25567 3555 1 5 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.443 -2.359 25567 3556 1 5 . 1 1 134 134 LEU CB C 134 40.509 40.509 44.946 -4.437 25567 3557 1 5 . 1 1 134 134 LEU H H 134 8.049 8.049 7.331 0.718 25567 3558 1 5 . 1 1 135 135 ASN N N 135 119.258 119.258 121.546 -2.288 25567 3559 1 5 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.737 -0.098 25567 3560 1 5 . 1 1 135 135 ASN C C 135 170.564 170.564 174.442 -3.878 25567 3561 1 5 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.418 -4.165 25567 3562 1 5 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.160 -4.542 25567 3563 1 5 . 1 1 135 135 ASN H H 135 8.567 8.567 8.794 -0.227 25567 3564 1 5 . 1 1 136 136 VAL N N 136 125.460 125.460 124.156 1.304 25567 3565 1 5 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.540 0.056 25567 3566 1 5 . 1 1 136 136 VAL C C 136 175.318 175.318 176.106 -0.788 25567 3567 1 5 . 1 1 136 136 VAL CA C 136 58.722 58.722 61.976 -3.254 25567 3568 1 5 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.616 -3.317 25567 3569 1 5 . 1 1 136 136 VAL H H 136 7.660 7.660 7.847 -0.187 25567 3570 1 5 . 1 1 137 137 ILE N N 137 122.021 122.021 124.726 -2.705 25567 3571 1 5 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.766 -0.338 25567 3572 1 5 . 1 1 137 137 ILE C C 137 173.943 173.943 175.241 -1.298 25567 3573 1 5 . 1 1 137 137 ILE CA C 137 58.958 58.958 60.022 -1.064 25567 3574 1 5 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.823 -2.654 25567 3575 1 5 . 1 1 137 137 ILE H H 137 9.151 9.151 8.959 0.192 25567 3576 1 5 . 1 1 138 138 GLY N N 138 108.192 108.192 107.804 0.388 25567 3577 1 5 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.803 -2.309 25567 3578 1 5 . 1 1 138 138 GLY H H 138 6.675 6.675 7.442 -0.767 25567 3579 1 5 . 1 1 139 139 VAL N N 139 119.673 119.673 118.883 0.790 25567 3580 1 5 . 1 1 139 139 VAL HA H 139 5.320 5.320 5.234 0.086 25567 3581 1 5 . 1 1 139 139 VAL C C 139 172.291 172.291 173.842 -1.551 25567 3582 1 5 . 1 1 139 139 VAL CA C 139 58.209 58.209 60.593 -2.384 25567 3583 1 5 . 1 1 139 139 VAL CB C 139 32.639 32.639 35.511 -2.872 25567 3584 1 5 . 1 1 139 139 VAL H H 139 8.158 8.158 8.761 -0.603 25567 3585 1 5 . 1 1 140 140 ALA N N 140 127.104 127.104 128.501 -1.397 25567 3586 1 5 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.200 -0.604 25567 3587 1 5 . 1 1 140 140 ALA C C 140 171.057 171.057 175.347 -4.290 25567 3588 1 5 . 1 1 140 140 ALA CA C 140 48.883 48.883 51.358 -2.475 25567 3589 1 5 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.175 -0.747 25567 3590 1 5 . 1 1 140 140 ALA H H 140 9.145 9.145 8.899 0.246 25567 3591 1 5 . 1 1 141 141 ARG N N 141 118.828 118.828 119.594 -0.766 25567 3592 1 5 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.487 -0.747 25567 3593 1 5 . 1 1 141 141 ARG C C 141 173.524 173.524 176.282 -2.758 25567 3594 1 5 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.375 -2.489 25567 3595 1 5 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.078 -1.624 25567 3596 1 5 . 1 1 141 141 ARG H H 141 7.759 7.759 8.431 -0.672 25567 3597 1 5 . 1 1 142 142 ASP N N 142 125.557 125.557 122.093 3.464 25567 3598 1 5 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.216 -0.437 25567 3599 1 5 . 1 1 142 142 ASP C C 142 169.292 169.292 176.146 -6.854 25567 3600 1 5 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.888 -2.266 25567 3601 1 5 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.519 -3.439 25567 3602 1 5 . 1 1 142 142 ASP H H 142 9.087 9.087 8.271 0.816 25567 3603 1 5 . 1 1 143 143 ASP N N 143 119.094 119.094 118.162 0.932 25567 3604 1 5 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.707 -0.453 25567 3605 1 5 . 1 1 143 143 ASP C C 143 175.557 175.557 177.516 -1.959 25567 3606 1 5 . 1 1 143 143 ASP CA C 143 49.079 49.079 54.459 -5.380 25567 3607 1 5 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.636 -4.194 25567 3608 1 5 . 1 1 143 143 ASP H H 143 8.175 8.175 8.628 -0.453 25567 3609 1 5 . 1 1 144 144 SER N N 144 115.438 115.438 116.803 -1.365 25567 3610 1 5 . 1 1 144 144 SER HA H 144 3.745 3.745 4.161 -0.416 25567 3611 1 5 . 1 1 144 144 SER C C 144 172.820 172.820 175.060 -2.240 25567 3612 1 5 . 1 1 144 144 SER CA C 144 59.336 59.336 60.943 -1.607 25567 3613 1 5 . 1 1 144 144 SER CB C 144 60.839 60.839 63.067 -2.228 25567 3614 1 5 . 1 1 144 144 SER H H 144 7.742 7.742 7.858 -0.116 25567 3615 1 5 . 1 1 145 145 GLU N N 145 119.631 119.631 118.736 0.895 25567 3616 1 5 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.238 0.081 25567 3617 1 5 . 1 1 145 145 GLU C C 145 171.927 171.927 176.165 -4.238 25567 3618 1 5 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.206 -3.122 25567 3619 1 5 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.823 -3.049 25567 3620 1 5 . 1 1 145 145 GLU H H 145 7.924 7.924 8.128 -0.204 25567 3621 1 5 . 1 1 146 146 VAL N N 146 118.791 118.791 119.483 -0.692 25567 3622 1 5 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.518 -0.562 25567 3623 1 5 . 1 1 146 146 VAL C C 146 174.582 174.582 176.677 -2.095 25567 3624 1 5 . 1 1 146 146 VAL CA C 146 64.078 64.078 65.580 -1.502 25567 3625 1 5 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.438 -2.298 25567 3626 1 5 . 1 1 146 146 VAL H H 146 6.393 6.393 7.075 -0.682 25567 3627 1 5 . 1 1 147 147 ASP N N 147 119.410 119.410 117.408 2.002 25567 3628 1 5 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.238 -0.168 25567 3629 1 5 . 1 1 147 147 ASP C C 147 174.774 174.774 178.573 -3.799 25567 3630 1 5 . 1 1 147 147 ASP CA C 147 54.322 54.322 58.157 -3.835 25567 3631 1 5 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.779 -3.575 25567 3632 1 5 . 1 1 147 147 ASP H H 147 8.393 8.393 8.424 -0.031 25567 3633 1 5 . 1 1 148 148 LYS N N 148 119.422 119.422 119.466 -0.044 25567 3634 1 5 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.117 -0.166 25567 3635 1 5 . 1 1 148 148 LYS C C 148 176.410 176.410 179.092 -2.682 25567 3636 1 5 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.623 -2.887 25567 3637 1 5 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.004 -2.428 25567 3638 1 5 . 1 1 148 148 LYS H H 148 7.078 7.078 7.413 -0.335 25567 3639 1 5 . 1 1 149 149 TRP N N 149 118.168 118.168 120.108 -1.940 25567 3640 1 5 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.814 -0.213 25567 3641 1 5 . 1 1 149 149 TRP C C 149 174.199 174.199 176.476 -2.277 25567 3642 1 5 . 1 1 149 149 TRP CA C 149 53.795 53.795 56.709 -2.914 25567 3643 1 5 . 1 1 149 149 TRP CB C 149 27.011 27.011 27.888 -0.877 25567 3644 1 5 . 1 1 149 149 TRP H H 149 7.914 7.914 7.484 0.430 25567 3645 1 5 . 1 1 150 150 SER N N 150 109.636 109.636 112.401 -2.765 25567 3646 1 5 . 1 1 150 150 SER HA H 150 4.242 4.242 4.626 -0.384 25567 3647 1 5 . 1 1 150 150 SER C C 150 170.173 170.173 174.468 -4.295 25567 3648 1 5 . 1 1 150 150 SER CA C 150 56.912 56.912 57.845 -0.933 25567 3649 1 5 . 1 1 150 150 SER CB C 150 62.087 62.087 65.702 -3.615 25567 3650 1 5 . 1 1 150 150 SER H H 150 7.814 7.814 7.756 0.058 25567 3651 1 6 . 1 1 2 2 MET HA H 2 4.416 4.416 5.029 -0.613 25567 3652 1 6 . 1 1 2 2 MET CA C 2 52.847 52.847 55.281 -2.434 25567 3653 1 6 . 1 1 2 2 MET CB C 2 30.672 30.672 34.590 -3.918 25567 3654 1 6 . 1 1 3 3 ALA N N 3 125.563 125.563 123.685 1.878 25567 3655 1 6 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.490 -0.118 25567 3656 1 6 . 1 1 3 3 ALA C C 3 174.728 174.728 175.747 -1.019 25567 3657 1 6 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.216 -2.868 25567 3658 1 6 . 1 1 3 3 ALA CB C 3 16.935 16.935 19.697 -2.762 25567 3659 1 6 . 1 1 3 3 ALA H H 3 8.342 8.342 8.295 0.047 25567 3660 1 6 . 1 1 4 4 LYS N N 4 121.767 121.767 121.883 -0.116 25567 3661 1 6 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.405 -0.175 25567 3662 1 6 . 1 1 4 4 LYS C C 4 174.577 174.577 175.775 -1.198 25567 3663 1 6 . 1 1 4 4 LYS CA C 4 53.989 53.989 56.461 -2.472 25567 3664 1 6 . 1 1 4 4 LYS CB C 4 31.555 31.555 33.311 -1.756 25567 3665 1 6 . 1 1 4 4 LYS H H 4 8.500 8.500 8.412 0.088 25567 3666 1 6 . 1 1 5 5 LYS N N 5 129.654 129.654 121.214 8.440 25567 3667 1 6 . 1 1 5 5 LYS HA H 5 4.526 4.526 5.245 -0.719 25567 3668 1 6 . 1 1 5 5 LYS C C 5 174.731 174.731 175.188 -0.457 25567 3669 1 6 . 1 1 5 5 LYS CA C 5 54.746 54.746 54.740 0.006 25567 3670 1 6 . 1 1 5 5 LYS CB C 5 29.894 29.894 37.460 -7.566 25567 3671 1 6 . 1 1 5 5 LYS H H 5 10.035 10.035 8.383 1.652 25567 3672 1 6 . 1 1 6 6 THR N N 6 126.212 126.212 116.125 10.087 25567 3673 1 6 . 1 1 6 6 THR HA H 6 5.654 5.654 5.141 0.513 25567 3674 1 6 . 1 1 6 6 THR C C 6 169.897 169.897 172.275 -2.378 25567 3675 1 6 . 1 1 6 6 THR CA C 6 60.647 60.647 61.824 -1.177 25567 3676 1 6 . 1 1 6 6 THR CB C 6 68.152 68.152 71.386 -3.234 25567 3677 1 6 . 1 1 6 6 THR H H 6 8.557 8.557 8.403 0.154 25567 3678 1 6 . 1 1 7 7 LEU N N 7 130.776 130.776 129.517 1.259 25567 3679 1 6 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.763 -0.144 25567 3680 1 6 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.098 -3.002 25567 3681 1 6 . 1 1 7 7 LEU CB C 7 41.043 41.043 44.431 -3.388 25567 3682 1 6 . 1 1 7 7 LEU H H 7 8.610 8.610 8.594 0.016 25567 3683 1 6 . 1 1 8 8 ILE N N 8 127.175 127.175 128.399 -1.224 25567 3684 1 6 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.291 0.565 25567 3685 1 6 . 1 1 8 8 ILE CA C 8 57.392 57.392 61.715 -4.324 25567 3686 1 6 . 1 1 8 8 ILE CB C 8 36.864 36.864 37.712 -0.848 25567 3687 1 6 . 1 1 8 8 ILE H H 8 9.263 9.263 8.597 0.666 25567 3688 1 6 . 1 1 9 9 LEU N N 9 127.117 127.117 128.611 -1.494 25567 3689 1 6 . 1 1 9 9 LEU HA H 9 5.696 5.696 4.921 0.775 25567 3690 1 6 . 1 1 9 9 LEU CA C 9 49.952 49.952 54.049 -4.097 25567 3691 1 6 . 1 1 9 9 LEU CB C 9 43.827 43.827 42.706 1.121 25567 3692 1 6 . 1 1 9 9 LEU H H 9 9.262 9.262 8.669 0.593 25567 3693 1 6 . 1 1 10 10 TYR N N 10 113.544 113.544 123.826 -10.282 25567 3694 1 6 . 1 1 10 10 TYR HA H 10 5.531 5.531 4.940 0.591 25567 3695 1 6 . 1 1 10 10 TYR CA C 10 52.829 52.829 56.605 -3.776 25567 3696 1 6 . 1 1 10 10 TYR CB C 10 38.615 38.615 42.651 -4.036 25567 3697 1 6 . 1 1 10 10 TYR H H 10 7.425 7.425 8.552 -1.127 25567 3698 1 6 . 1 1 11 11 TYR N N 11 121.235 121.235 121.914 -0.679 25567 3699 1 6 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.974 -0.164 25567 3700 1 6 . 1 1 11 11 TYR CA C 11 53.889 53.889 55.819 -1.929 25567 3701 1 6 . 1 1 11 11 TYR CB C 11 40.467 40.467 36.458 4.009 25567 3702 1 6 . 1 1 11 11 TYR H H 11 7.781 7.781 9.446 -1.665 25567 3703 1 6 . 1 1 14 14 SER CA C 14 54.675 54.675 57.892 -3.217 25567 3704 1 6 . 1 1 14 14 SER CB C 14 61.621 61.621 63.638 -2.017 25567 3705 1 6 . 1 1 15 15 GLY N N 15 110.420 110.420 114.411 -3.991 25567 3706 1 6 . 1 1 15 15 GLY CA C 15 43.727 43.727 46.153 -2.426 25567 3707 1 6 . 1 1 15 15 GLY H H 15 7.757 7.757 8.904 -1.147 25567 3708 1 6 . 1 1 17 17 THR HA H 17 4.122 4.122 4.032 0.090 25567 3709 1 6 . 1 1 17 17 THR CA C 17 64.748 64.748 63.951 0.797 25567 3710 1 6 . 1 1 17 17 THR CB C 17 64.532 64.532 67.485 -2.953 25567 3711 1 6 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.954 -1.036 25567 3712 1 6 . 1 1 18 18 LYS C C 18 173.812 173.812 178.452 -4.640 25567 3713 1 6 . 1 1 18 18 LYS CA C 18 57.003 57.003 58.899 -1.896 25567 3714 1 6 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.072 -2.304 25567 3715 1 6 . 1 1 19 19 LYS N N 19 116.699 116.699 119.816 -3.117 25567 3716 1 6 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.055 -0.107 25567 3717 1 6 . 1 1 19 19 LYS C C 19 177.221 177.221 178.654 -1.433 25567 3718 1 6 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.907 -2.486 25567 3719 1 6 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.061 -2.427 25567 3720 1 6 . 1 1 19 19 LYS H H 19 7.476 7.476 7.420 0.056 25567 3721 1 6 . 1 1 20 20 MET N N 20 118.946 118.946 117.578 1.368 25567 3722 1 6 . 1 1 20 20 MET HA H 20 4.474 4.474 4.364 0.110 25567 3723 1 6 . 1 1 20 20 MET C C 20 173.826 173.826 178.985 -5.159 25567 3724 1 6 . 1 1 20 20 MET CA C 20 52.285 52.285 56.695 -4.410 25567 3725 1 6 . 1 1 20 20 MET CB C 20 26.921 26.921 31.149 -4.229 25567 3726 1 6 . 1 1 20 20 MET H H 20 7.457 7.457 8.306 -0.849 25567 3727 1 6 . 1 1 21 21 ALA N N 21 123.375 123.375 122.013 1.362 25567 3728 1 6 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.403 -0.851 25567 3729 1 6 . 1 1 21 21 ALA C C 21 176.542 176.542 179.982 -3.440 25567 3730 1 6 . 1 1 21 21 ALA CA C 21 52.651 52.651 55.875 -3.224 25567 3731 1 6 . 1 1 21 21 ALA CB C 21 16.282 16.282 18.188 -1.906 25567 3732 1 6 . 1 1 21 21 ALA H H 21 8.549 8.549 8.809 -0.260 25567 3733 1 6 . 1 1 22 22 GLU N N 22 116.906 116.906 118.339 -1.433 25567 3734 1 6 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.167 -0.493 25567 3735 1 6 . 1 1 22 22 GLU C C 22 176.658 176.658 179.248 -2.590 25567 3736 1 6 . 1 1 22 22 GLU CA C 22 56.605 56.605 58.858 -2.253 25567 3737 1 6 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.541 -2.893 25567 3738 1 6 . 1 1 22 22 GLU H H 22 8.085 8.085 7.802 0.283 25567 3739 1 6 . 1 1 23 23 LYS N N 23 123.301 123.301 120.767 2.534 25567 3740 1 6 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.033 -0.213 25567 3741 1 6 . 1 1 23 23 LYS C C 23 177.363 177.363 179.186 -1.823 25567 3742 1 6 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.730 -2.759 25567 3743 1 6 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.288 -2.756 25567 3744 1 6 . 1 1 23 23 LYS H H 23 7.703 7.703 7.827 -0.124 25567 3745 1 6 . 1 1 24 24 ILE N N 24 121.894 121.894 118.674 3.220 25567 3746 1 6 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.488 -0.192 25567 3747 1 6 . 1 1 24 24 ILE C C 24 174.944 174.944 177.173 -2.229 25567 3748 1 6 . 1 1 24 24 ILE CA C 24 63.233 63.233 65.383 -2.150 25567 3749 1 6 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.613 -2.869 25567 3750 1 6 . 1 1 24 24 ILE H H 24 8.458 8.458 7.709 0.749 25567 3751 1 6 . 1 1 25 25 ASN N N 25 118.580 118.580 117.034 1.546 25567 3752 1 6 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.288 -0.054 25567 3753 1 6 . 1 1 25 25 ASN C C 25 173.567 173.567 177.091 -3.524 25567 3754 1 6 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.390 -4.066 25567 3755 1 6 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.661 -0.478 25567 3756 1 6 . 1 1 25 25 ASN H H 25 8.273 8.273 7.875 0.398 25567 3757 1 6 . 1 1 26 26 SER N N 26 112.132 112.132 115.453 -3.321 25567 3758 1 6 . 1 1 26 26 SER HA H 26 4.148 4.148 4.259 -0.111 25567 3759 1 6 . 1 1 26 26 SER C C 26 172.083 172.083 175.607 -3.524 25567 3760 1 6 . 1 1 26 26 SER CA C 26 57.865 57.865 60.829 -2.964 25567 3761 1 6 . 1 1 26 26 SER CB C 26 60.816 60.816 63.025 -2.209 25567 3762 1 6 . 1 1 26 26 SER H H 26 7.444 7.444 7.746 -0.302 25567 3763 1 6 . 1 1 27 27 GLU N N 27 120.080 120.080 117.642 2.438 25567 3764 1 6 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.246 -0.146 25567 3765 1 6 . 1 1 27 27 GLU C C 27 173.647 173.647 176.613 -2.966 25567 3766 1 6 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.971 -2.769 25567 3767 1 6 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.010 -3.126 25567 3768 1 6 . 1 1 27 27 GLU H H 27 7.453 7.453 7.726 -0.273 25567 3769 1 6 . 1 1 28 28 ILE N N 28 118.759 118.759 118.642 0.117 25567 3770 1 6 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.179 0.025 25567 3771 1 6 . 1 1 28 28 ILE C C 28 172.474 172.474 175.012 -2.538 25567 3772 1 6 . 1 1 28 28 ILE CA C 28 57.747 57.747 59.963 -2.216 25567 3773 1 6 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.306 -4.508 25567 3774 1 6 . 1 1 28 28 ILE H H 28 7.258 7.258 7.150 0.108 25567 3775 1 6 . 1 1 29 29 LYS N N 29 130.618 130.618 122.682 7.936 25567 3776 1 6 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.409 -0.404 25567 3777 1 6 . 1 1 29 29 LYS C C 29 174.375 174.375 176.176 -1.801 25567 3778 1 6 . 1 1 29 29 LYS CA C 29 55.659 55.659 55.866 -0.207 25567 3779 1 6 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.255 -3.695 25567 3780 1 6 . 1 1 29 29 LYS H H 29 8.588 8.588 8.628 -0.040 25567 3781 1 6 . 1 1 30 30 ASP N N 30 119.366 119.366 121.738 -2.372 25567 3782 1 6 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.340 0.062 25567 3783 1 6 . 1 1 30 30 ASP C C 30 172.580 172.580 174.622 -2.042 25567 3784 1 6 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.105 -1.481 25567 3785 1 6 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.355 -3.527 25567 3786 1 6 . 1 1 30 30 ASP H H 30 8.940 8.940 8.805 0.135 25567 3787 1 6 . 1 1 31 31 SER N N 31 114.035 114.035 113.205 0.830 25567 3788 1 6 . 1 1 31 31 SER HA H 31 4.781 4.781 4.763 0.018 25567 3789 1 6 . 1 1 31 31 SER C C 31 171.136 171.136 173.873 -2.737 25567 3790 1 6 . 1 1 31 31 SER CA C 31 55.638 55.638 57.115 -1.477 25567 3791 1 6 . 1 1 31 31 SER CB C 31 62.388 62.388 66.211 -3.823 25567 3792 1 6 . 1 1 31 31 SER H H 31 8.030 8.030 8.028 0.002 25567 3793 1 6 . 1 1 32 32 GLU N N 32 121.406 121.406 123.068 -1.662 25567 3794 1 6 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.738 -0.003 25567 3795 1 6 . 1 1 32 32 GLU C C 32 171.205 171.205 174.770 -3.565 25567 3796 1 6 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.622 -3.553 25567 3797 1 6 . 1 1 32 32 GLU CB C 32 30.890 30.890 34.238 -3.348 25567 3798 1 6 . 1 1 32 32 GLU H H 32 8.188 8.188 8.968 -0.780 25567 3799 1 6 . 1 1 33 33 LEU N N 33 126.143 126.143 118.409 7.734 25567 3800 1 6 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.466 -0.181 25567 3801 1 6 . 1 1 33 33 LEU C C 33 173.401 173.401 175.661 -2.260 25567 3802 1 6 . 1 1 33 33 LEU CA C 33 51.334 51.334 52.817 -1.483 25567 3803 1 6 . 1 1 33 33 LEU CB C 33 43.623 43.623 45.636 -2.014 25567 3804 1 6 . 1 1 33 33 LEU H H 33 8.627 8.627 8.266 0.361 25567 3805 1 6 . 1 1 34 34 LYS N N 34 127.122 127.122 120.230 6.892 25567 3806 1 6 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.768 -0.169 25567 3807 1 6 . 1 1 34 34 LYS C C 34 169.644 169.644 174.626 -4.982 25567 3808 1 6 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.703 -2.350 25567 3809 1 6 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.513 -3.341 25567 3810 1 6 . 1 1 34 34 LYS H H 34 9.399 9.399 9.063 0.336 25567 3811 1 6 . 1 1 35 35 GLU N N 35 122.766 122.766 121.723 1.043 25567 3812 1 6 . 1 1 35 35 GLU HA H 35 3.358 3.358 5.238 -1.880 25567 3813 1 6 . 1 1 35 35 GLU C C 35 172.875 172.875 176.040 -3.165 25567 3814 1 6 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.168 -2.528 25567 3815 1 6 . 1 1 35 35 GLU CB C 35 29.268 29.268 30.917 -1.649 25567 3816 1 6 . 1 1 35 35 GLU H H 35 8.166 8.166 8.451 -0.285 25567 3817 1 6 . 1 1 36 36 VAL N N 36 126.674 126.674 121.621 5.053 25567 3818 1 6 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.346 -0.485 25567 3819 1 6 . 1 1 36 36 VAL C C 36 171.451 171.451 176.157 -4.706 25567 3820 1 6 . 1 1 36 36 VAL CA C 36 59.537 59.537 61.122 -1.585 25567 3821 1 6 . 1 1 36 36 VAL CB C 36 29.689 29.689 33.376 -3.687 25567 3822 1 6 . 1 1 36 36 VAL H H 36 8.632 8.632 8.183 0.449 25567 3823 1 6 . 1 1 37 37 LYS N N 37 126.181 126.181 124.045 2.136 25567 3824 1 6 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.625 0.314 25567 3825 1 6 . 1 1 37 37 LYS CA C 37 52.179 52.179 55.303 -3.124 25567 3826 1 6 . 1 1 37 37 LYS CB C 37 32.898 32.898 34.302 -1.404 25567 3827 1 6 . 1 1 37 37 LYS H H 37 7.867 7.867 8.991 -1.124 25567 3828 1 6 . 1 1 38 38 VAL N N 38 113.540 113.540 116.550 -3.010 25567 3829 1 6 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.829 -0.143 25567 3830 1 6 . 1 1 38 38 VAL C C 38 173.633 173.633 175.426 -1.793 25567 3831 1 6 . 1 1 38 38 VAL CA C 38 57.284 57.284 60.572 -3.288 25567 3832 1 6 . 1 1 38 38 VAL CB C 38 31.964 31.964 34.409 -2.445 25567 3833 1 6 . 1 1 38 38 VAL H H 38 8.389 8.389 8.332 0.057 25567 3834 1 6 . 1 1 39 39 SER N N 39 118.860 118.860 121.231 -2.371 25567 3835 1 6 . 1 1 39 39 SER HA H 39 4.194 4.194 4.671 -0.477 25567 3836 1 6 . 1 1 39 39 SER C C 39 173.059 173.059 174.161 -1.102 25567 3837 1 6 . 1 1 39 39 SER CA C 39 56.227 56.227 58.133 -1.906 25567 3838 1 6 . 1 1 39 39 SER CB C 39 60.771 60.771 65.045 -4.274 25567 3839 1 6 . 1 1 39 39 SER H H 39 8.668 8.668 8.595 0.073 25567 3840 1 6 . 1 1 40 40 GLU N N 40 125.769 125.769 122.304 3.465 25567 3841 1 6 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.410 -0.253 25567 3842 1 6 . 1 1 40 40 GLU C C 40 174.484 174.484 177.692 -3.208 25567 3843 1 6 . 1 1 40 40 GLU CA C 40 55.550 55.550 57.127 -1.577 25567 3844 1 6 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.101 -3.047 25567 3845 1 6 . 1 1 40 40 GLU H H 40 8.878 8.878 8.392 0.486 25567 3846 1 6 . 1 1 41 41 GLY N N 41 112.165 112.165 113.670 -1.505 25567 3847 1 6 . 1 1 41 41 GLY CA C 41 42.707 42.707 46.609 -3.902 25567 3848 1 6 . 1 1 41 41 GLY H H 41 8.743 8.743 8.822 -0.079 25567 3849 1 6 . 1 1 44 44 ASP N N 44 122.324 122.324 119.380 2.944 25567 3850 1 6 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.439 1.717 25567 3851 1 6 . 1 1 44 44 ASP H H 44 7.918 7.918 8.442 -0.524 25567 3852 1 6 . 1 1 45 45 ALA HA H 45 4.062 4.062 3.858 0.204 25567 3853 1 6 . 1 1 45 45 ALA CA C 45 51.410 51.410 54.313 -2.903 25567 3854 1 6 . 1 1 45 45 ALA CB C 45 16.376 16.376 17.855 -1.479 25567 3855 1 6 . 1 1 47 47 MET CA C 47 54.118 54.118 54.494 -0.376 25567 3856 1 6 . 1 1 47 47 MET CB C 47 27.527 27.527 34.751 -7.224 25567 3857 1 6 . 1 1 48 48 TYR N N 48 120.075 120.075 119.625 0.450 25567 3858 1 6 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.361 -0.206 25567 3859 1 6 . 1 1 48 48 TYR C C 48 172.217 172.217 175.685 -3.468 25567 3860 1 6 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.535 -2.158 25567 3861 1 6 . 1 1 48 48 TYR CB C 48 34.496 34.496 36.806 -2.310 25567 3862 1 6 . 1 1 48 48 TYR H H 48 7.810 7.810 8.109 -0.299 25567 3863 1 6 . 1 1 49 49 LYS N N 49 118.369 118.369 124.675 -6.306 25567 3864 1 6 . 1 1 49 49 LYS H H 49 8.116 8.116 8.562 -0.446 25567 3865 1 6 . 1 1 50 50 THR N N 50 116.979 116.979 116.377 0.602 25567 3866 1 6 . 1 1 50 50 THR CB C 50 66.373 66.373 69.395 -3.022 25567 3867 1 6 . 1 1 50 50 THR H H 50 7.741 7.741 8.139 -0.398 25567 3868 1 6 . 1 1 51 51 SER N N 51 116.155 116.155 111.181 4.974 25567 3869 1 6 . 1 1 51 51 SER HA H 51 3.771 3.771 4.887 -1.116 25567 3870 1 6 . 1 1 51 51 SER C C 51 170.563 170.563 172.795 -2.232 25567 3871 1 6 . 1 1 51 51 SER CA C 51 54.840 54.840 57.587 -2.747 25567 3872 1 6 . 1 1 51 51 SER CB C 51 60.318 60.318 65.838 -5.520 25567 3873 1 6 . 1 1 51 51 SER H H 51 7.853 7.853 7.631 0.222 25567 3874 1 6 . 1 1 54 54 ALA N N 54 123.234 123.234 121.490 1.744 25567 3875 1 6 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.771 -0.523 25567 3876 1 6 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.826 -1.558 25567 3877 1 6 . 1 1 54 54 ALA CB C 54 16.434 16.434 19.860 -3.426 25567 3878 1 6 . 1 1 54 54 ALA H H 54 8.207 8.207 8.100 0.107 25567 3879 1 6 . 1 1 55 55 LEU N N 55 118.603 118.603 122.669 -4.066 25567 3880 1 6 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.410 -0.470 25567 3881 1 6 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.311 -0.600 25567 3882 1 6 . 1 1 55 55 LEU CB C 55 38.913 38.913 40.257 -1.344 25567 3883 1 6 . 1 1 55 55 LEU H H 55 7.960 7.960 8.483 -0.523 25567 3884 1 6 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.199 -0.523 25567 3885 1 6 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.261 0.233 25567 3886 1 6 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.152 -3.098 25567 3887 1 6 . 1 1 59 59 GLN N N 59 117.579 117.579 121.509 -3.930 25567 3888 1 6 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.264 -0.131 25567 3889 1 6 . 1 1 59 59 GLN CA C 59 54.009 54.009 55.754 -1.745 25567 3890 1 6 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.549 -1.897 25567 3891 1 6 . 1 1 59 59 GLN H H 59 8.268 8.268 8.247 0.021 25567 3892 1 6 . 1 1 60 60 GLY N N 60 107.308 107.308 113.229 -5.921 25567 3893 1 6 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.036 -2.057 25567 3894 1 6 . 1 1 60 60 GLY H H 60 7.780 7.780 8.720 -0.940 25567 3895 1 6 . 1 1 61 61 ASN N N 61 117.747 117.747 120.765 -3.018 25567 3896 1 6 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.715 -0.181 25567 3897 1 6 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.675 -1.440 25567 3898 1 6 . 1 1 61 61 ASN CB C 61 36.424 36.424 37.864 -1.440 25567 3899 1 6 . 1 1 61 61 ASN H H 61 8.108 8.108 8.202 -0.094 25567 3900 1 6 . 1 1 64 64 PHE N N 64 120.102 120.102 119.988 0.114 25567 3901 1 6 . 1 1 64 64 PHE HA H 64 4.379 4.379 5.085 -0.706 25567 3902 1 6 . 1 1 64 64 PHE CA C 64 51.748 51.748 53.397 -1.649 25567 3903 1 6 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.855 -3.580 25567 3904 1 6 . 1 1 64 64 PHE H H 64 8.300 8.300 7.327 0.973 25567 3905 1 6 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.606 -0.271 25567 3906 1 6 . 1 1 65 65 PRO C C 65 173.870 173.870 176.100 -2.230 25567 3907 1 6 . 1 1 65 65 PRO CA C 65 60.017 60.017 63.072 -3.055 25567 3908 1 6 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.458 -2.823 25567 3909 1 6 . 1 1 66 66 GLU N N 66 121.258 121.258 119.966 1.292 25567 3910 1 6 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.666 -0.432 25567 3911 1 6 . 1 1 66 66 GLU C C 66 173.981 173.981 176.476 -2.495 25567 3912 1 6 . 1 1 66 66 GLU CA C 66 53.787 53.787 54.777 -0.990 25567 3913 1 6 . 1 1 66 66 GLU CB C 66 27.775 27.775 31.418 -3.643 25567 3914 1 6 . 1 1 66 66 GLU H H 66 8.316 8.316 8.329 -0.013 25567 3915 1 6 . 1 1 67 67 ILE N N 67 114.290 114.290 112.612 1.678 25567 3916 1 6 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.919 0.210 25567 3917 1 6 . 1 1 67 67 ILE C C 67 172.700 172.700 175.226 -2.526 25567 3918 1 6 . 1 1 67 67 ILE CA C 67 56.439 56.439 58.986 -2.547 25567 3919 1 6 . 1 1 67 67 ILE CB C 67 39.159 39.159 41.847 -2.688 25567 3920 1 6 . 1 1 67 67 ILE H H 67 8.366 8.366 8.353 0.013 25567 3921 1 6 . 1 1 68 68 GLN N N 68 121.422 121.422 119.399 2.023 25567 3922 1 6 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.699 -0.198 25567 3923 1 6 . 1 1 68 68 GLN C C 68 171.675 171.675 173.939 -2.264 25567 3924 1 6 . 1 1 68 68 GLN CA C 68 52.273 52.273 55.011 -2.738 25567 3925 1 6 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.014 -5.870 25567 3926 1 6 . 1 1 68 68 GLN H H 68 8.737 8.737 8.374 0.363 25567 3927 1 6 . 1 1 69 69 LEU N N 69 125.311 125.311 116.210 9.101 25567 3928 1 6 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.786 -0.280 25567 3929 1 6 . 1 1 69 69 LEU C C 69 172.634 172.634 175.088 -2.454 25567 3930 1 6 . 1 1 69 69 LEU CA C 69 51.759 51.759 54.093 -2.334 25567 3931 1 6 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.841 -1.437 25567 3932 1 6 . 1 1 69 69 LEU H H 69 8.051 8.051 8.151 -0.100 25567 3933 1 6 . 1 1 70 70 ASP N N 70 122.763 122.763 119.480 3.283 25567 3934 1 6 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.643 -0.220 25567 3935 1 6 . 1 1 70 70 ASP CA C 70 51.610 51.610 54.647 -3.037 25567 3936 1 6 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.486 -3.769 25567 3937 1 6 . 1 1 70 70 ASP H H 70 8.313 8.313 8.708 -0.395 25567 3938 1 6 . 1 1 71 71 ASN N N 71 117.413 117.413 118.274 -0.861 25567 3939 1 6 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.699 -0.362 25567 3940 1 6 . 1 1 71 71 ASN C C 71 171.770 171.770 174.477 -2.707 25567 3941 1 6 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.312 -1.821 25567 3942 1 6 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.806 -2.480 25567 3943 1 6 . 1 1 71 71 ASN H H 71 8.407 8.407 8.558 -0.151 25567 3944 1 6 . 1 1 72 72 ILE N N 72 123.752 123.752 123.318 0.434 25567 3945 1 6 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.280 -0.340 25567 3946 1 6 . 1 1 72 72 ILE C C 72 171.621 171.621 174.881 -3.260 25567 3947 1 6 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.759 -3.427 25567 3948 1 6 . 1 1 72 72 ILE CB C 72 38.489 38.489 40.007 -1.518 25567 3949 1 6 . 1 1 72 72 ILE H H 72 7.639 7.639 7.571 0.068 25567 3950 1 6 . 1 1 73 73 ASP N N 73 125.252 125.252 124.018 1.234 25567 3951 1 6 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.574 0.051 25567 3952 1 6 . 1 1 73 73 ASP C C 73 174.034 174.034 175.444 -1.410 25567 3953 1 6 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.955 -4.752 25567 3954 1 6 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.722 -4.698 25567 3955 1 6 . 1 1 73 73 ASP H H 73 8.394 8.394 8.468 -0.074 25567 3956 1 6 . 1 1 74 74 TYR N N 74 123.108 123.108 123.119 -0.011 25567 3957 1 6 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.436 -0.558 25567 3958 1 6 . 1 1 74 74 TYR C C 74 173.637 173.637 175.895 -2.258 25567 3959 1 6 . 1 1 74 74 TYR CA C 74 59.474 59.474 55.872 3.602 25567 3960 1 6 . 1 1 74 74 TYR CB C 74 34.722 34.722 37.654 -2.933 25567 3961 1 6 . 1 1 74 74 TYR H H 74 7.392 7.392 7.691 -0.299 25567 3962 1 6 . 1 1 75 75 ASN N N 75 109.422 109.422 118.326 -8.904 25567 3963 1 6 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.832 0.094 25567 3964 1 6 . 1 1 75 75 ASN C C 75 172.574 172.574 176.488 -3.914 25567 3965 1 6 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.104 -2.343 25567 3966 1 6 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.933 -3.316 25567 3967 1 6 . 1 1 75 75 ASN H H 75 8.058 8.058 8.131 -0.073 25567 3968 1 6 . 1 1 76 76 ASN N N 76 117.422 117.422 116.782 0.640 25567 3969 1 6 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.460 -0.005 25567 3970 1 6 . 1 1 76 76 ASN C C 76 171.132 171.132 173.213 -2.081 25567 3971 1 6 . 1 1 76 76 ASN CA C 76 51.167 51.167 52.976 -1.809 25567 3972 1 6 . 1 1 76 76 ASN CB C 76 35.728 35.728 37.046 -1.318 25567 3973 1 6 . 1 1 76 76 ASN H H 76 7.768 7.768 8.413 -0.645 25567 3974 1 6 . 1 1 77 77 TYR N N 77 116.873 116.873 117.112 -0.239 25567 3975 1 6 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.658 -0.295 25567 3976 1 6 . 1 1 77 77 TYR C C 77 172.175 172.175 174.660 -2.485 25567 3977 1 6 . 1 1 77 77 TYR CA C 77 55.364 55.364 56.908 -1.544 25567 3978 1 6 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.094 -3.929 25567 3979 1 6 . 1 1 77 77 TYR H H 77 7.825 7.825 7.517 0.308 25567 3980 1 6 . 1 1 78 78 ASP N N 78 121.271 121.271 120.456 0.815 25567 3981 1 6 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.824 -0.019 25567 3982 1 6 . 1 1 78 78 ASP C C 78 172.641 172.641 175.408 -2.767 25567 3983 1 6 . 1 1 78 78 ASP CA C 78 53.255 53.255 55.324 -2.069 25567 3984 1 6 . 1 1 78 78 ASP CB C 78 41.075 41.075 43.782 -2.707 25567 3985 1 6 . 1 1 78 78 ASP H H 78 9.058 9.058 8.459 0.599 25567 3986 1 6 . 1 1 79 79 LEU N N 79 122.985 122.985 119.850 3.135 25567 3987 1 6 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.267 -0.153 25567 3988 1 6 . 1 1 79 79 LEU C C 79 170.721 170.721 175.115 -4.394 25567 3989 1 6 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.028 -2.712 25567 3990 1 6 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.971 -3.629 25567 3991 1 6 . 1 1 79 79 LEU H H 79 7.893 7.893 8.414 -0.521 25567 3992 1 6 . 1 1 80 80 ILE N N 80 126.364 126.364 122.769 3.595 25567 3993 1 6 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.660 0.429 25567 3994 1 6 . 1 1 80 80 ILE C C 80 171.580 171.580 174.270 -2.690 25567 3995 1 6 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.264 -2.847 25567 3996 1 6 . 1 1 80 80 ILE CB C 80 38.136 38.136 40.708 -2.572 25567 3997 1 6 . 1 1 80 80 ILE H H 80 8.717 8.717 9.148 -0.431 25567 3998 1 6 . 1 1 81 81 LEU N N 81 126.199 126.199 126.958 -0.759 25567 3999 1 6 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.260 -0.125 25567 4000 1 6 . 1 1 81 81 LEU C C 81 172.979 172.979 175.583 -2.604 25567 4001 1 6 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.191 -3.558 25567 4002 1 6 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.528 -3.369 25567 4003 1 6 . 1 1 81 81 LEU H H 81 9.230 9.230 8.844 0.386 25567 4004 1 6 . 1 1 82 82 ILE N N 82 120.505 120.505 119.467 1.038 25567 4005 1 6 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.017 -0.101 25567 4006 1 6 . 1 1 82 82 ILE C C 82 173.011 173.011 174.789 -1.778 25567 4007 1 6 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.569 -2.741 25567 4008 1 6 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.073 -4.005 25567 4009 1 6 . 1 1 82 82 ILE H H 82 8.796 8.796 8.026 0.770 25567 4010 1 6 . 1 1 83 83 GLY N N 83 120.857 120.857 111.024 9.833 25567 4011 1 6 . 1 1 83 83 GLY CA C 83 40.803 40.803 42.276 -1.473 25567 4012 1 6 . 1 1 83 83 GLY H H 83 9.525 9.525 7.487 2.038 25567 4013 1 6 . 1 1 84 84 SER N N 84 116.007 116.007 114.296 1.711 25567 4014 1 6 . 1 1 84 84 SER HA H 84 5.476 5.476 5.227 0.249 25567 4015 1 6 . 1 1 84 84 SER CA C 84 51.937 51.937 55.358 -3.421 25567 4016 1 6 . 1 1 84 84 SER CB C 84 64.533 64.533 65.470 -0.937 25567 4017 1 6 . 1 1 84 84 SER H H 84 7.617 7.617 7.748 -0.131 25567 4018 1 6 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.701 0.500 25567 4019 1 6 . 1 1 85 85 PRO C C 85 173.574 173.574 175.846 -2.272 25567 4020 1 6 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.870 -3.382 25567 4021 1 6 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.607 -1.467 25567 4022 1 6 . 1 1 86 86 VAL N N 86 117.603 117.603 118.166 -0.563 25567 4023 1 6 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.485 -0.112 25567 4024 1 6 . 1 1 86 86 VAL C C 86 172.777 172.777 173.846 -1.069 25567 4025 1 6 . 1 1 86 86 VAL CA C 86 59.603 59.603 62.447 -2.844 25567 4026 1 6 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.699 -5.126 25567 4027 1 6 . 1 1 86 86 VAL H H 86 8.194 8.194 8.181 0.014 25567 4028 1 6 . 1 1 87 87 TRP N N 87 131.187 131.187 128.231 2.956 25567 4029 1 6 . 1 1 87 87 TRP HA H 87 5.198 5.198 5.038 0.160 25567 4030 1 6 . 1 1 87 87 TRP C C 87 173.295 173.295 174.900 -1.605 25567 4031 1 6 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.250 -6.466 25567 4032 1 6 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.888 -4.142 25567 4033 1 6 . 1 1 87 87 TRP H H 87 9.637 9.637 8.606 1.031 25567 4034 1 6 . 1 1 88 88 SER N N 88 119.829 119.829 113.659 6.170 25567 4035 1 6 . 1 1 88 88 SER HA H 88 3.986 3.986 4.660 -0.674 25567 4036 1 6 . 1 1 88 88 SER C C 88 172.375 172.375 175.019 -2.644 25567 4037 1 6 . 1 1 88 88 SER CA C 88 55.932 55.932 58.040 -2.108 25567 4038 1 6 . 1 1 88 88 SER CB C 88 59.178 59.178 63.315 -4.137 25567 4039 1 6 . 1 1 88 88 SER H H 88 9.272 9.272 7.745 1.527 25567 4040 1 6 . 1 1 89 89 GLY N N 89 101.498 101.498 109.330 -7.832 25567 4041 1 6 . 1 1 89 89 GLY CA C 89 42.671 42.671 45.501 -2.830 25567 4042 1 6 . 1 1 89 89 GLY H H 89 7.463 7.463 8.587 -1.124 25567 4043 1 6 . 1 1 90 90 TYR N N 90 121.064 121.064 117.896 3.168 25567 4044 1 6 . 1 1 90 90 TYR HA H 90 4.216 4.216 4.883 -0.667 25567 4045 1 6 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.896 -0.806 25567 4046 1 6 . 1 1 90 90 TYR CB C 90 37.195 37.195 38.471 -1.276 25567 4047 1 6 . 1 1 90 90 TYR H H 90 8.064 8.064 7.367 0.697 25567 4048 1 6 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.441 0.491 25567 4049 1 6 . 1 1 91 91 PRO C C 91 171.019 171.019 175.918 -4.899 25567 4050 1 6 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.570 -4.576 25567 4051 1 6 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.656 -6.163 25567 4052 1 6 . 1 1 92 92 ALA N N 92 119.893 119.893 120.387 -0.494 25567 4053 1 6 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.826 -1.375 25567 4054 1 6 . 1 1 92 92 ALA C C 92 176.477 176.477 175.752 0.725 25567 4055 1 6 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.088 -1.521 25567 4056 1 6 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.999 -6.198 25567 4057 1 6 . 1 1 92 92 ALA H H 92 7.278 7.278 7.681 -0.403 25567 4058 1 6 . 1 1 93 93 THR N N 93 112.992 112.992 111.087 1.905 25567 4059 1 6 . 1 1 93 93 THR HA H 93 4.462 4.462 4.749 -0.287 25567 4060 1 6 . 1 1 93 93 THR CA C 93 66.871 66.871 58.501 8.370 25567 4061 1 6 . 1 1 93 93 THR CB C 93 64.362 64.362 68.212 -3.850 25567 4062 1 6 . 1 1 93 93 THR H H 93 6.861 6.861 8.600 -1.739 25567 4063 1 6 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.449 -0.583 25567 4064 1 6 . 1 1 94 94 PRO CA C 94 63.021 63.021 64.340 -1.319 25567 4065 1 6 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.707 -2.428 25567 4066 1 6 . 1 1 95 95 ILE N N 95 111.298 111.298 119.722 -8.424 25567 4067 1 6 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.278 -0.655 25567 4068 1 6 . 1 1 95 95 ILE C C 95 174.264 174.264 175.243 -0.979 25567 4069 1 6 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.312 -1.864 25567 4070 1 6 . 1 1 95 95 ILE CB C 95 31.929 31.929 35.144 -3.215 25567 4071 1 6 . 1 1 95 95 ILE H H 95 7.974 7.974 8.178 -0.204 25567 4072 1 6 . 1 1 96 96 LYS N N 96 123.045 123.045 121.611 1.434 25567 4073 1 6 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.618 -1.506 25567 4074 1 6 . 1 1 96 96 LYS C C 96 174.590 174.590 177.691 -3.101 25567 4075 1 6 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.831 0.314 25567 4076 1 6 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.839 -4.994 25567 4077 1 6 . 1 1 96 96 LYS H H 96 6.958 6.958 7.773 -0.815 25567 4078 1 6 . 1 1 97 97 THR N N 97 113.412 113.412 117.523 -4.111 25567 4079 1 6 . 1 1 97 97 THR HA H 97 3.461 3.461 4.006 -0.545 25567 4080 1 6 . 1 1 97 97 THR C C 97 173.247 173.247 177.181 -3.934 25567 4081 1 6 . 1 1 97 97 THR CA C 97 62.809 62.809 66.264 -3.455 25567 4082 1 6 . 1 1 97 97 THR CB C 97 65.654 65.654 68.746 -3.092 25567 4083 1 6 . 1 1 97 97 THR H H 97 6.366 6.366 8.024 -1.658 25567 4084 1 6 . 1 1 98 98 LEU N N 98 121.201 121.201 122.294 -1.093 25567 4085 1 6 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.092 -0.458 25567 4086 1 6 . 1 1 98 98 LEU C C 98 174.590 174.590 178.709 -4.119 25567 4087 1 6 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.974 -2.353 25567 4088 1 6 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.940 -1.045 25567 4089 1 6 . 1 1 98 98 LEU H H 98 7.554 7.554 7.866 -0.312 25567 4090 1 6 . 1 1 99 99 LEU N N 99 118.677 118.677 118.024 0.653 25567 4091 1 6 . 1 1 99 99 LEU HA H 99 3.702 3.702 4.030 -0.328 25567 4092 1 6 . 1 1 99 99 LEU C C 99 177.457 177.457 179.532 -2.075 25567 4093 1 6 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.603 -2.424 25567 4094 1 6 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.398 -2.410 25567 4095 1 6 . 1 1 99 99 LEU H H 99 8.160 8.160 8.007 0.153 25567 4096 1 6 . 1 1 100 100 ASP N N 100 118.914 118.914 118.217 0.697 25567 4097 1 6 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.605 -0.376 25567 4098 1 6 . 1 1 100 100 ASP C C 100 176.585 176.585 178.154 -1.569 25567 4099 1 6 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.358 -1.842 25567 4100 1 6 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.083 -3.504 25567 4101 1 6 . 1 1 100 100 ASP H H 100 7.872 7.872 7.912 -0.040 25567 4102 1 6 . 1 1 101 101 GLN N N 101 118.135 118.135 118.032 0.103 25567 4103 1 6 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.330 -0.170 25567 4104 1 6 . 1 1 101 101 GLN C C 101 174.601 174.601 177.215 -2.614 25567 4105 1 6 . 1 1 101 101 GLN CA C 101 54.960 54.960 57.448 -2.488 25567 4106 1 6 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.232 -3.682 25567 4107 1 6 . 1 1 101 101 GLN H H 101 7.673 7.673 7.991 -0.318 25567 4108 1 6 . 1 1 102 102 MET N N 102 118.420 118.420 117.032 1.388 25567 4109 1 6 . 1 1 102 102 MET HA H 102 3.826 3.826 5.081 -1.255 25567 4110 1 6 . 1 1 102 102 MET C C 102 172.780 172.780 176.690 -3.910 25567 4111 1 6 . 1 1 102 102 MET CA C 102 53.428 53.428 56.199 -2.771 25567 4112 1 6 . 1 1 102 102 MET CB C 102 31.221 31.221 32.882 -1.661 25567 4113 1 6 . 1 1 102 102 MET H H 102 7.462 7.462 7.462 -0.000 25567 4114 1 6 . 1 1 103 103 LYS N N 103 116.066 116.066 118.947 -2.881 25567 4115 1 6 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.248 -0.328 25567 4116 1 6 . 1 1 103 103 LYS C C 103 173.922 173.922 176.709 -2.787 25567 4117 1 6 . 1 1 103 103 LYS CA C 103 56.282 56.282 57.983 -1.700 25567 4118 1 6 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.112 -1.621 25567 4119 1 6 . 1 1 103 103 LYS H H 103 6.875 6.875 8.301 -1.426 25567 4120 1 6 . 1 1 104 104 ASN N N 104 114.987 114.987 116.743 -1.756 25567 4121 1 6 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.797 -0.056 25567 4122 1 6 . 1 1 104 104 ASN C C 104 172.587 172.587 174.536 -1.949 25567 4123 1 6 . 1 1 104 104 ASN CA C 104 50.469 50.469 53.232 -2.763 25567 4124 1 6 . 1 1 104 104 ASN CB C 104 35.822 35.822 40.528 -4.705 25567 4125 1 6 . 1 1 104 104 ASN H H 104 8.517 8.517 7.778 0.739 25567 4126 1 6 . 1 1 105 105 TYR N N 105 122.755 122.755 121.035 1.720 25567 4127 1 6 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.511 0.064 25567 4128 1 6 . 1 1 105 105 TYR C C 105 174.260 174.260 175.353 -1.093 25567 4129 1 6 . 1 1 105 105 TYR CA C 105 55.493 55.493 59.666 -4.173 25567 4130 1 6 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.097 -3.033 25567 4131 1 6 . 1 1 105 105 TYR H H 105 8.287 8.287 8.067 0.220 25567 4132 1 6 . 1 1 106 106 ARG N N 106 128.905 128.905 118.473 10.432 25567 4133 1 6 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.545 -0.272 25567 4134 1 6 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.780 -2.759 25567 4135 1 6 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.168 -4.038 25567 4136 1 6 . 1 1 106 106 ARG H H 106 8.841 8.841 8.876 -0.035 25567 4137 1 6 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.654 -2.157 25567 4138 1 6 . 1 1 108 108 GLU N N 108 116.989 116.989 122.216 -5.227 25567 4139 1 6 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.654 -0.023 25567 4140 1 6 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.745 -2.069 25567 4141 1 6 . 1 1 108 108 GLU CB C 108 30.402 30.402 32.391 -1.988 25567 4142 1 6 . 1 1 108 108 GLU H H 108 7.536 7.536 8.409 -0.873 25567 4143 1 6 . 1 1 109 109 VAL N N 109 123.416 123.416 125.431 -2.015 25567 4144 1 6 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.004 0.317 25567 4145 1 6 . 1 1 109 109 VAL CA C 109 57.443 57.443 61.417 -3.974 25567 4146 1 6 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.282 -0.621 25567 4147 1 6 . 1 1 109 109 VAL H H 109 8.955 8.955 8.946 0.009 25567 4148 1 6 . 1 1 110 110 ALA N N 110 127.975 127.975 128.579 -0.604 25567 4149 1 6 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.102 -0.425 25567 4150 1 6 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.970 -2.529 25567 4151 1 6 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.599 -4.183 25567 4152 1 6 . 1 1 110 110 ALA H H 110 8.860 8.860 9.020 -0.160 25567 4153 1 6 . 1 1 111 111 SER N N 111 110.482 110.482 112.828 -2.346 25567 4154 1 6 . 1 1 111 111 SER HA H 111 5.502 5.502 5.381 0.121 25567 4155 1 6 . 1 1 111 111 SER CA C 111 51.630 51.630 56.514 -4.884 25567 4156 1 6 . 1 1 111 111 SER CB C 111 62.267 62.267 65.927 -3.660 25567 4157 1 6 . 1 1 111 111 SER H H 111 7.484 7.484 7.704 -0.220 25567 4158 1 6 . 1 1 112 112 PHE N N 112 125.082 125.082 117.413 7.669 25567 4159 1 6 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.456 0.992 25567 4160 1 6 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.794 -5.360 25567 4161 1 6 . 1 1 112 112 PHE CB C 112 40.500 40.500 41.277 -0.777 25567 4162 1 6 . 1 1 112 112 PHE H H 112 8.025 8.025 8.253 -0.228 25567 4163 1 6 . 1 1 113 113 PHE N N 113 115.872 115.872 121.659 -5.787 25567 4164 1 6 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.286 0.638 25567 4165 1 6 . 1 1 113 113 PHE C C 113 173.293 173.293 175.747 -2.454 25567 4166 1 6 . 1 1 113 113 PHE CA C 113 50.468 50.468 54.846 -4.378 25567 4167 1 6 . 1 1 113 113 PHE CB C 113 38.393 38.393 39.557 -1.165 25567 4168 1 6 . 1 1 113 113 PHE H H 113 7.391 7.391 7.922 -0.531 25567 4169 1 6 . 1 1 114 114 THR N N 114 108.721 108.721 116.909 -8.188 25567 4170 1 6 . 1 1 114 114 THR HA H 114 4.933 4.933 4.556 0.377 25567 4171 1 6 . 1 1 114 114 THR C C 114 171.891 171.891 174.601 -2.710 25567 4172 1 6 . 1 1 114 114 THR CA C 114 56.815 56.815 61.633 -4.818 25567 4173 1 6 . 1 1 114 114 THR CB C 114 67.899 67.899 67.467 0.432 25567 4174 1 6 . 1 1 114 114 THR H H 114 7.951 7.951 8.778 -0.827 25567 4175 1 6 . 1 1 115 115 SER N N 115 115.159 115.159 117.968 -2.809 25567 4176 1 6 . 1 1 115 115 SER HA H 115 4.608 4.608 4.633 -0.025 25567 4177 1 6 . 1 1 115 115 SER C C 115 171.403 171.403 174.046 -2.643 25567 4178 1 6 . 1 1 115 115 SER CA C 115 55.570 55.570 58.956 -3.386 25567 4179 1 6 . 1 1 115 115 SER CB C 115 61.418 61.418 64.413 -2.995 25567 4180 1 6 . 1 1 115 115 SER H H 115 8.229 8.229 8.040 0.189 25567 4181 1 6 . 1 1 116 116 ALA N N 116 127.211 127.211 125.226 1.985 25567 4182 1 6 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.696 -0.240 25567 4183 1 6 . 1 1 116 116 ALA C C 116 175.758 175.758 177.499 -1.741 25567 4184 1 6 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.575 -1.759 25567 4185 1 6 . 1 1 116 116 ALA CB C 116 16.831 16.831 17.518 -0.687 25567 4186 1 6 . 1 1 116 116 ALA H H 116 8.813 8.813 8.684 0.129 25567 4187 1 6 . 1 1 117 117 GLY N N 117 108.099 108.099 109.977 -1.878 25567 4188 1 6 . 1 1 117 117 GLY C C 117 171.805 171.805 175.784 -3.979 25567 4189 1 6 . 1 1 117 117 GLY CA C 117 42.869 42.869 45.668 -2.799 25567 4190 1 6 . 1 1 117 117 GLY H H 117 8.685 8.685 8.075 0.610 25567 4191 1 6 . 1 1 118 118 THR N N 118 111.284 111.284 114.700 -3.416 25567 4192 1 6 . 1 1 118 118 THR HA H 118 4.343 4.343 4.314 0.029 25567 4193 1 6 . 1 1 118 118 THR C C 118 171.769 171.769 174.969 -3.200 25567 4194 1 6 . 1 1 118 118 THR CA C 118 58.933 58.933 64.397 -5.465 25567 4195 1 6 . 1 1 118 118 THR CB C 118 67.304 67.304 68.872 -1.568 25567 4196 1 6 . 1 1 118 118 THR H H 118 7.998 7.998 8.247 -0.249 25567 4197 1 6 . 1 1 119 119 ASN N N 119 120.253 120.253 118.281 1.972 25567 4198 1 6 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.897 -0.194 25567 4199 1 6 . 1 1 119 119 ASN C C 119 172.353 172.353 174.746 -2.393 25567 4200 1 6 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.100 -2.872 25567 4201 1 6 . 1 1 119 119 ASN CB C 119 35.376 35.376 39.210 -3.834 25567 4202 1 6 . 1 1 119 119 ASN H H 119 8.381 8.381 7.988 0.393 25567 4203 1 6 . 1 1 120 120 HIS HA H 120 4.086 4.086 3.638 0.448 25567 4204 1 6 . 1 1 120 120 HIS C C 120 173.395 173.395 176.145 -2.750 25567 4205 1 6 . 1 1 120 120 HIS CA C 120 55.139 55.139 59.587 -4.447 25567 4206 1 6 . 1 1 120 120 HIS CB C 120 28.422 28.422 30.116 -1.694 25567 4207 1 6 . 1 1 121 121 LYS N N 121 119.527 119.527 118.840 0.687 25567 4208 1 6 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.573 0.207 25567 4209 1 6 . 1 1 121 121 LYS C C 121 176.053 176.053 177.771 -1.718 25567 4210 1 6 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.490 -1.527 25567 4211 1 6 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.264 -1.604 25567 4212 1 6 . 1 1 121 121 LYS H H 121 8.106 8.106 8.003 0.103 25567 4213 1 6 . 1 1 122 122 ALA N N 122 121.585 121.585 122.568 -0.983 25567 4214 1 6 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.868 -0.147 25567 4215 1 6 . 1 1 122 122 ALA C C 122 175.128 175.128 178.827 -3.699 25567 4216 1 6 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.300 -2.709 25567 4217 1 6 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.891 -2.187 25567 4218 1 6 . 1 1 122 122 ALA H H 122 7.702 7.702 7.436 0.266 25567 4219 1 6 . 1 1 123 123 TYR N N 123 118.803 118.803 119.248 -0.445 25567 4220 1 6 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.738 -0.372 25567 4221 1 6 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.562 -1.471 25567 4222 1 6 . 1 1 123 123 TYR CB C 123 35.102 35.102 37.983 -2.881 25567 4223 1 6 . 1 1 123 123 TYR H H 123 7.366 7.366 8.050 -0.684 25567 4224 1 6 . 1 1 124 124 VAL N N 124 117.530 117.530 117.866 -0.336 25567 4225 1 6 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.551 -0.352 25567 4226 1 6 . 1 1 124 124 VAL C C 124 175.375 175.375 177.801 -2.426 25567 4227 1 6 . 1 1 124 124 VAL CA C 124 64.583 64.583 67.088 -2.506 25567 4228 1 6 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.179 -1.976 25567 4229 1 6 . 1 1 124 124 VAL H H 124 7.757 7.757 7.546 0.211 25567 4230 1 6 . 1 1 125 125 SER N N 125 114.023 114.023 114.674 -0.651 25567 4231 1 6 . 1 1 125 125 SER HA H 125 4.035 4.035 4.146 -0.111 25567 4232 1 6 . 1 1 125 125 SER C C 125 174.636 174.636 176.304 -1.668 25567 4233 1 6 . 1 1 125 125 SER CA C 125 58.885 58.885 61.567 -2.682 25567 4234 1 6 . 1 1 125 125 SER CB C 125 59.666 59.666 63.084 -3.418 25567 4235 1 6 . 1 1 125 125 SER H H 125 7.622 7.622 7.645 -0.023 25567 4236 1 6 . 1 1 126 126 HIS N N 126 119.457 119.457 121.015 -1.558 25567 4237 1 6 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.001 0.195 25567 4238 1 6 . 1 1 126 126 HIS C C 126 172.942 172.942 176.674 -3.732 25567 4239 1 6 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.144 -3.226 25567 4240 1 6 . 1 1 126 126 HIS CB C 126 26.079 26.079 28.465 -2.386 25567 4241 1 6 . 1 1 126 126 HIS H H 126 8.067 8.067 7.690 0.377 25567 4242 1 6 . 1 1 127 127 PHE N N 127 120.628 120.628 120.819 -0.191 25567 4243 1 6 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.957 -0.758 25567 4244 1 6 . 1 1 127 127 PHE C C 127 173.515 173.515 176.799 -3.284 25567 4245 1 6 . 1 1 127 127 PHE CA C 127 60.681 60.681 60.417 0.264 25567 4246 1 6 . 1 1 127 127 PHE CB C 127 36.367 36.367 39.309 -2.942 25567 4247 1 6 . 1 1 127 127 PHE H H 127 9.083 9.083 7.928 1.155 25567 4248 1 6 . 1 1 128 128 ASN N N 128 114.858 114.858 117.469 -2.611 25567 4249 1 6 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.105 -0.027 25567 4250 1 6 . 1 1 128 128 ASN C C 128 175.338 175.338 177.454 -2.116 25567 4251 1 6 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.877 -2.627 25567 4252 1 6 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.190 -2.169 25567 4253 1 6 . 1 1 128 128 ASN H H 128 7.858 7.858 8.487 -0.629 25567 4254 1 6 . 1 1 129 129 GLU N N 129 119.811 119.811 119.051 0.760 25567 4255 1 6 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.136 -0.095 25567 4256 1 6 . 1 1 129 129 GLU C C 129 176.941 176.941 179.070 -2.129 25567 4257 1 6 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.896 -2.264 25567 4258 1 6 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.592 -2.654 25567 4259 1 6 . 1 1 129 129 GLU H H 129 7.569 7.569 7.521 0.048 25567 4260 1 6 . 1 1 130 130 TRP N N 130 120.585 120.585 118.212 2.373 25567 4261 1 6 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.645 -0.173 25567 4262 1 6 . 1 1 130 130 TRP C C 130 174.262 174.262 176.014 -1.752 25567 4263 1 6 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.029 -1.356 25567 4264 1 6 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.295 -1.339 25567 4265 1 6 . 1 1 130 130 TRP H H 130 7.964 7.964 8.114 -0.150 25567 4266 1 6 . 1 1 131 131 ALA N N 131 120.522 120.522 120.185 0.337 25567 4267 1 6 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.307 -0.360 25567 4268 1 6 . 1 1 131 131 ALA C C 131 172.489 172.489 175.844 -3.355 25567 4269 1 6 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.340 -2.760 25567 4270 1 6 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.699 -3.160 25567 4271 1 6 . 1 1 131 131 ALA H H 131 8.114 8.114 7.316 0.798 25567 4272 1 6 . 1 1 132 132 ASP N N 132 117.666 117.666 120.635 -2.969 25567 4273 1 6 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.334 -0.128 25567 4274 1 6 . 1 1 132 132 ASP C C 132 173.779 173.779 176.007 -2.228 25567 4275 1 6 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.109 -0.797 25567 4276 1 6 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.739 -0.283 25567 4277 1 6 . 1 1 132 132 ASP H H 132 6.768 6.768 7.669 -0.901 25567 4278 1 6 . 1 1 133 133 GLY N N 133 114.922 114.922 111.231 3.691 25567 4279 1 6 . 1 1 133 133 GLY C C 133 172.101 172.101 173.978 -1.877 25567 4280 1 6 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.364 -2.855 25567 4281 1 6 . 1 1 133 133 GLY H H 133 8.645 8.645 7.965 0.680 25567 4282 1 6 . 1 1 134 134 LEU N N 134 120.101 120.101 122.621 -2.520 25567 4283 1 6 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.664 -0.202 25567 4284 1 6 . 1 1 134 134 LEU C C 134 174.098 174.098 176.016 -1.918 25567 4285 1 6 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.843 -2.759 25567 4286 1 6 . 1 1 134 134 LEU CB C 134 40.509 40.509 43.246 -2.737 25567 4287 1 6 . 1 1 134 134 LEU H H 134 8.049 8.049 7.598 0.452 25567 4288 1 6 . 1 1 135 135 ASN N N 135 119.258 119.258 121.389 -2.131 25567 4289 1 6 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.602 0.037 25567 4290 1 6 . 1 1 135 135 ASN C C 135 170.564 170.564 174.226 -3.662 25567 4291 1 6 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.607 -4.354 25567 4292 1 6 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.733 -5.115 25567 4293 1 6 . 1 1 135 135 ASN H H 135 8.567 8.567 8.587 -0.020 25567 4294 1 6 . 1 1 136 136 VAL N N 136 125.460 125.460 125.201 0.259 25567 4295 1 6 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.858 -0.262 25567 4296 1 6 . 1 1 136 136 VAL C C 136 175.318 175.318 176.399 -1.081 25567 4297 1 6 . 1 1 136 136 VAL CA C 136 58.722 58.722 61.784 -3.062 25567 4298 1 6 . 1 1 136 136 VAL CB C 136 29.299 29.299 33.656 -4.357 25567 4299 1 6 . 1 1 136 136 VAL H H 136 7.660 7.660 8.262 -0.602 25567 4300 1 6 . 1 1 137 137 ILE N N 137 122.021 122.021 121.124 0.897 25567 4301 1 6 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.677 -0.249 25567 4302 1 6 . 1 1 137 137 ILE C C 137 173.943 173.943 175.300 -1.357 25567 4303 1 6 . 1 1 137 137 ILE CA C 137 58.958 58.958 60.677 -1.719 25567 4304 1 6 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.944 -2.775 25567 4305 1 6 . 1 1 137 137 ILE H H 137 9.151 9.151 8.898 0.253 25567 4306 1 6 . 1 1 138 138 GLY N N 138 108.192 108.192 107.691 0.501 25567 4307 1 6 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.429 -1.935 25567 4308 1 6 . 1 1 138 138 GLY H H 138 6.675 6.675 7.440 -0.765 25567 4309 1 6 . 1 1 139 139 VAL N N 139 119.673 119.673 119.776 -0.103 25567 4310 1 6 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.703 0.617 25567 4311 1 6 . 1 1 139 139 VAL C C 139 172.291 172.291 174.949 -2.658 25567 4312 1 6 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.361 -3.152 25567 4313 1 6 . 1 1 139 139 VAL CB C 139 32.639 32.639 32.541 0.097 25567 4314 1 6 . 1 1 139 139 VAL H H 139 8.158 8.158 8.541 -0.383 25567 4315 1 6 . 1 1 140 140 ALA N N 140 127.104 127.104 130.707 -3.603 25567 4316 1 6 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.916 -0.320 25567 4317 1 6 . 1 1 140 140 ALA C C 140 171.057 171.057 174.987 -3.930 25567 4318 1 6 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.065 -1.182 25567 4319 1 6 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.563 -1.135 25567 4320 1 6 . 1 1 140 140 ALA H H 140 9.145 9.145 8.567 0.578 25567 4321 1 6 . 1 1 141 141 ARG N N 141 118.828 118.828 117.334 1.494 25567 4322 1 6 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.907 -1.167 25567 4323 1 6 . 1 1 141 141 ARG C C 141 173.524 173.524 175.797 -2.273 25567 4324 1 6 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.198 -2.312 25567 4325 1 6 . 1 1 141 141 ARG CB C 141 28.454 28.454 31.661 -3.207 25567 4326 1 6 . 1 1 141 141 ARG H H 141 7.759 7.759 8.202 -0.443 25567 4327 1 6 . 1 1 142 142 ASP N N 142 125.557 125.557 120.153 5.404 25567 4328 1 6 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.269 -0.490 25567 4329 1 6 . 1 1 142 142 ASP C C 142 169.292 169.292 175.422 -6.130 25567 4330 1 6 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.025 -2.402 25567 4331 1 6 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.458 -3.378 25567 4332 1 6 . 1 1 142 142 ASP H H 142 9.087 9.087 8.145 0.942 25567 4333 1 6 . 1 1 143 143 ASP N N 143 119.094 119.094 118.329 0.765 25567 4334 1 6 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.548 -0.294 25567 4335 1 6 . 1 1 143 143 ASP C C 143 175.557 175.557 177.351 -1.794 25567 4336 1 6 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.796 -4.717 25567 4337 1 6 . 1 1 143 143 ASP CB C 143 36.442 36.442 41.157 -4.715 25567 4338 1 6 . 1 1 143 143 ASP H H 143 8.175 8.175 8.423 -0.248 25567 4339 1 6 . 1 1 144 144 SER N N 144 115.438 115.438 116.664 -1.226 25567 4340 1 6 . 1 1 144 144 SER HA H 144 3.745 3.745 4.133 -0.388 25567 4341 1 6 . 1 1 144 144 SER C C 144 172.820 172.820 175.166 -2.346 25567 4342 1 6 . 1 1 144 144 SER CA C 144 59.336 59.336 60.690 -1.354 25567 4343 1 6 . 1 1 144 144 SER CB C 144 60.839 60.839 62.833 -1.994 25567 4344 1 6 . 1 1 144 144 SER H H 144 7.742 7.742 8.227 -0.485 25567 4345 1 6 . 1 1 145 145 GLU N N 145 119.631 119.631 118.535 1.096 25567 4346 1 6 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.158 0.161 25567 4347 1 6 . 1 1 145 145 GLU C C 145 171.927 171.927 176.168 -4.241 25567 4348 1 6 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.651 -3.567 25567 4349 1 6 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.322 -2.548 25567 4350 1 6 . 1 1 145 145 GLU H H 145 7.924 7.924 7.989 -0.066 25567 4351 1 6 . 1 1 146 146 VAL N N 146 118.791 118.791 120.172 -1.381 25567 4352 1 6 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.523 -0.567 25567 4353 1 6 . 1 1 146 146 VAL C C 146 174.582 174.582 176.128 -1.546 25567 4354 1 6 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.613 -2.535 25567 4355 1 6 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.079 -1.939 25567 4356 1 6 . 1 1 146 146 VAL H H 146 6.393 6.393 6.997 -0.604 25567 4357 1 6 . 1 1 147 147 ASP N N 147 119.410 119.410 116.233 3.177 25567 4358 1 6 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.342 -0.272 25567 4359 1 6 . 1 1 147 147 ASP C C 147 174.774 174.774 176.973 -2.199 25567 4360 1 6 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.202 -1.879 25567 4361 1 6 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.768 -3.564 25567 4362 1 6 . 1 1 147 147 ASP H H 147 8.393 8.393 8.236 0.157 25567 4363 1 6 . 1 1 148 148 LYS N N 148 119.422 119.422 115.844 3.578 25567 4364 1 6 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.403 -0.452 25567 4365 1 6 . 1 1 148 148 LYS C C 148 176.410 176.410 179.062 -2.652 25567 4366 1 6 . 1 1 148 148 LYS CA C 148 55.736 55.736 56.757 -1.020 25567 4367 1 6 . 1 1 148 148 LYS CB C 148 29.576 29.576 33.051 -3.475 25567 4368 1 6 . 1 1 148 148 LYS H H 148 7.078 7.078 7.744 -0.666 25567 4369 1 6 . 1 1 149 149 TRP N N 149 118.168 118.168 121.070 -2.902 25567 4370 1 6 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.821 -0.220 25567 4371 1 6 . 1 1 149 149 TRP C C 149 174.199 174.199 175.727 -1.528 25567 4372 1 6 . 1 1 149 149 TRP CA C 149 53.795 53.795 56.135 -2.340 25567 4373 1 6 . 1 1 149 149 TRP CB C 149 27.011 27.011 26.768 0.243 25567 4374 1 6 . 1 1 149 149 TRP H H 149 7.914 7.914 7.192 0.722 25567 4375 1 6 . 1 1 150 150 SER N N 150 109.636 109.636 110.618 -0.982 25567 4376 1 6 . 1 1 150 150 SER HA H 150 4.242 4.242 4.701 -0.459 25567 4377 1 6 . 1 1 150 150 SER C C 150 170.173 170.173 174.059 -3.886 25567 4378 1 6 . 1 1 150 150 SER CA C 150 56.912 56.912 58.381 -1.469 25567 4379 1 6 . 1 1 150 150 SER CB C 150 62.087 62.087 64.330 -2.243 25567 4380 1 6 . 1 1 150 150 SER H H 150 7.814 7.814 7.969 -0.155 25567 4381 1 7 . 1 1 2 2 MET HA H 2 4.416 4.416 5.015 -0.599 25567 4382 1 7 . 1 1 2 2 MET CA C 2 52.847 52.847 55.117 -2.270 25567 4383 1 7 . 1 1 2 2 MET CB C 2 30.672 30.672 33.678 -3.006 25567 4384 1 7 . 1 1 3 3 ALA N N 3 125.563 125.563 124.248 1.315 25567 4385 1 7 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.603 -0.231 25567 4386 1 7 . 1 1 3 3 ALA C C 3 174.728 174.728 176.337 -1.609 25567 4387 1 7 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.082 -2.734 25567 4388 1 7 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.920 -3.985 25567 4389 1 7 . 1 1 3 3 ALA H H 3 8.342 8.342 7.997 0.345 25567 4390 1 7 . 1 1 4 4 LYS N N 4 121.767 121.767 126.338 -4.571 25567 4391 1 7 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.305 -0.075 25567 4392 1 7 . 1 1 4 4 LYS C C 4 174.577 174.577 175.886 -1.309 25567 4393 1 7 . 1 1 4 4 LYS CA C 4 53.989 53.989 56.061 -2.072 25567 4394 1 7 . 1 1 4 4 LYS CB C 4 31.555 31.555 31.829 -0.274 25567 4395 1 7 . 1 1 4 4 LYS H H 4 8.500 8.500 8.497 0.003 25567 4396 1 7 . 1 1 5 5 LYS N N 5 129.654 129.654 123.121 6.533 25567 4397 1 7 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.603 -0.077 25567 4398 1 7 . 1 1 5 5 LYS C C 5 174.731 174.731 176.462 -1.731 25567 4399 1 7 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.959 -1.213 25567 4400 1 7 . 1 1 5 5 LYS CB C 5 29.894 29.894 34.376 -4.482 25567 4401 1 7 . 1 1 5 5 LYS H H 5 10.035 10.035 8.029 2.006 25567 4402 1 7 . 1 1 6 6 THR N N 6 126.212 126.212 115.185 11.027 25567 4403 1 7 . 1 1 6 6 THR HA H 6 5.654 5.654 5.450 0.204 25567 4404 1 7 . 1 1 6 6 THR C C 6 169.897 169.897 173.376 -3.479 25567 4405 1 7 . 1 1 6 6 THR CA C 6 60.647 60.647 61.908 -1.261 25567 4406 1 7 . 1 1 6 6 THR CB C 6 68.152 68.152 71.772 -3.620 25567 4407 1 7 . 1 1 6 6 THR H H 6 8.557 8.557 8.363 0.194 25567 4408 1 7 . 1 1 7 7 LEU N N 7 130.776 130.776 125.693 5.083 25567 4409 1 7 . 1 1 7 7 LEU HA H 7 4.619 4.619 5.065 -0.446 25567 4410 1 7 . 1 1 7 7 LEU CA C 7 50.096 50.096 52.905 -2.809 25567 4411 1 7 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.414 -5.372 25567 4412 1 7 . 1 1 7 7 LEU H H 7 8.610 8.610 8.404 0.206 25567 4413 1 7 . 1 1 8 8 ILE N N 8 127.175 127.175 123.627 3.548 25567 4414 1 7 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.415 0.441 25567 4415 1 7 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.928 -3.536 25567 4416 1 7 . 1 1 8 8 ILE CB C 8 36.864 36.864 39.663 -2.799 25567 4417 1 7 . 1 1 8 8 ILE H H 8 9.263 9.263 7.989 1.274 25567 4418 1 7 . 1 1 9 9 LEU N N 9 127.117 127.117 127.826 -0.709 25567 4419 1 7 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.306 0.390 25567 4420 1 7 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.427 -3.475 25567 4421 1 7 . 1 1 9 9 LEU CB C 9 43.827 43.827 45.702 -1.875 25567 4422 1 7 . 1 1 9 9 LEU H H 9 9.262 9.262 8.060 1.202 25567 4423 1 7 . 1 1 10 10 TYR N N 10 113.544 113.544 117.772 -4.228 25567 4424 1 7 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.130 0.401 25567 4425 1 7 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.703 -2.874 25567 4426 1 7 . 1 1 10 10 TYR CB C 10 38.615 38.615 41.295 -2.680 25567 4427 1 7 . 1 1 10 10 TYR H H 10 7.425 7.425 8.032 -0.607 25567 4428 1 7 . 1 1 11 11 TYR N N 11 121.235 121.235 122.785 -1.550 25567 4429 1 7 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.856 -0.046 25567 4430 1 7 . 1 1 11 11 TYR CA C 11 53.889 53.889 58.083 -4.194 25567 4431 1 7 . 1 1 11 11 TYR CB C 11 40.467 40.467 39.966 0.501 25567 4432 1 7 . 1 1 11 11 TYR H H 11 7.781 7.781 8.129 -0.348 25567 4433 1 7 . 1 1 14 14 SER CA C 14 54.675 54.675 57.805 -3.130 25567 4434 1 7 . 1 1 14 14 SER CB C 14 61.621 61.621 62.968 -1.347 25567 4435 1 7 . 1 1 15 15 GLY N N 15 110.420 110.420 114.550 -4.130 25567 4436 1 7 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.903 -2.176 25567 4437 1 7 . 1 1 15 15 GLY H H 15 7.757 7.757 8.791 -1.034 25567 4438 1 7 . 1 1 17 17 THR HA H 17 4.122 4.122 4.404 -0.282 25567 4439 1 7 . 1 1 17 17 THR CA C 17 64.748 64.748 63.904 0.844 25567 4440 1 7 . 1 1 17 17 THR CB C 17 64.532 64.532 69.035 -4.503 25567 4441 1 7 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.236 -0.318 25567 4442 1 7 . 1 1 18 18 LYS C C 18 173.812 173.812 177.702 -3.890 25567 4443 1 7 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.922 -2.919 25567 4444 1 7 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.042 -2.274 25567 4445 1 7 . 1 1 19 19 LYS N N 19 116.699 116.699 118.944 -2.245 25567 4446 1 7 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.942 0.006 25567 4447 1 7 . 1 1 19 19 LYS C C 19 177.221 177.221 178.802 -1.581 25567 4448 1 7 . 1 1 19 19 LYS CA C 19 56.421 56.421 59.253 -2.832 25567 4449 1 7 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.111 -2.477 25567 4450 1 7 . 1 1 19 19 LYS H H 19 7.476 7.476 8.183 -0.707 25567 4451 1 7 . 1 1 20 20 MET N N 20 118.946 118.946 113.581 5.365 25567 4452 1 7 . 1 1 20 20 MET HA H 20 4.474 4.474 4.148 0.326 25567 4453 1 7 . 1 1 20 20 MET C C 20 173.826 173.826 176.045 -2.219 25567 4454 1 7 . 1 1 20 20 MET CA C 20 52.285 52.285 54.404 -2.119 25567 4455 1 7 . 1 1 20 20 MET CB C 20 26.921 26.921 30.163 -3.242 25567 4456 1 7 . 1 1 20 20 MET H H 20 7.457 7.457 7.802 -0.345 25567 4457 1 7 . 1 1 21 21 ALA N N 21 123.375 123.375 121.195 2.180 25567 4458 1 7 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.182 -0.630 25567 4459 1 7 . 1 1 21 21 ALA C C 21 176.542 176.542 178.769 -2.227 25567 4460 1 7 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.366 -0.715 25567 4461 1 7 . 1 1 21 21 ALA CB C 21 16.282 16.282 20.115 -3.833 25567 4462 1 7 . 1 1 21 21 ALA H H 21 8.549 8.549 7.652 0.897 25567 4463 1 7 . 1 1 22 22 GLU N N 22 116.906 116.906 119.191 -2.285 25567 4464 1 7 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.035 -0.362 25567 4465 1 7 . 1 1 22 22 GLU C C 22 176.658 176.658 179.338 -2.680 25567 4466 1 7 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.045 -2.440 25567 4467 1 7 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.470 -2.821 25567 4468 1 7 . 1 1 22 22 GLU H H 22 8.085 8.085 7.992 0.093 25567 4469 1 7 . 1 1 23 23 LYS N N 23 123.301 123.301 119.970 3.331 25567 4470 1 7 . 1 1 23 23 LYS HA H 23 3.820 3.820 3.989 -0.169 25567 4471 1 7 . 1 1 23 23 LYS C C 23 177.363 177.363 179.226 -1.863 25567 4472 1 7 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.366 -2.395 25567 4473 1 7 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.190 -2.659 25567 4474 1 7 . 1 1 23 23 LYS H H 23 7.703 7.703 8.290 -0.587 25567 4475 1 7 . 1 1 24 24 ILE N N 24 121.894 121.894 118.632 3.262 25567 4476 1 7 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.687 -0.391 25567 4477 1 7 . 1 1 24 24 ILE C C 24 174.944 174.944 178.038 -3.094 25567 4478 1 7 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.899 -1.666 25567 4479 1 7 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.591 -2.847 25567 4480 1 7 . 1 1 24 24 ILE H H 24 8.458 8.458 8.019 0.439 25567 4481 1 7 . 1 1 25 25 ASN N N 25 118.580 118.580 118.184 0.396 25567 4482 1 7 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.358 -0.124 25567 4483 1 7 . 1 1 25 25 ASN C C 25 173.567 173.567 176.672 -3.105 25567 4484 1 7 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.206 -3.882 25567 4485 1 7 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.548 -0.365 25567 4486 1 7 . 1 1 25 25 ASN H H 25 8.273 8.273 7.907 0.366 25567 4487 1 7 . 1 1 26 26 SER N N 26 112.132 112.132 112.416 -0.284 25567 4488 1 7 . 1 1 26 26 SER HA H 26 4.148 4.148 4.385 -0.237 25567 4489 1 7 . 1 1 26 26 SER C C 26 172.083 172.083 174.977 -2.894 25567 4490 1 7 . 1 1 26 26 SER CA C 26 57.865 57.865 60.061 -2.196 25567 4491 1 7 . 1 1 26 26 SER CB C 26 60.816 60.816 63.293 -2.477 25567 4492 1 7 . 1 1 26 26 SER H H 26 7.444 7.444 7.771 -0.327 25567 4493 1 7 . 1 1 27 27 GLU N N 27 120.080 120.080 118.514 1.566 25567 4494 1 7 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.474 -0.374 25567 4495 1 7 . 1 1 27 27 GLU C C 27 173.647 173.647 176.775 -3.128 25567 4496 1 7 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.789 -2.587 25567 4497 1 7 . 1 1 27 27 GLU CB C 27 26.884 26.884 31.528 -4.644 25567 4498 1 7 . 1 1 27 27 GLU H H 27 7.453 7.453 7.822 -0.369 25567 4499 1 7 . 1 1 28 28 ILE N N 28 118.759 118.759 120.436 -1.677 25567 4500 1 7 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.256 -0.052 25567 4501 1 7 . 1 1 28 28 ILE C C 28 172.474 172.474 175.694 -3.220 25567 4502 1 7 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.922 -3.175 25567 4503 1 7 . 1 1 28 28 ILE CB C 28 35.798 35.798 39.455 -3.657 25567 4504 1 7 . 1 1 28 28 ILE H H 28 7.258 7.258 7.502 -0.244 25567 4505 1 7 . 1 1 29 29 LYS N N 29 130.618 130.618 126.239 4.379 25567 4506 1 7 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.371 -0.366 25567 4507 1 7 . 1 1 29 29 LYS C C 29 174.375 174.375 176.794 -2.419 25567 4508 1 7 . 1 1 29 29 LYS CA C 29 55.659 55.659 56.543 -0.884 25567 4509 1 7 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.025 -3.465 25567 4510 1 7 . 1 1 29 29 LYS H H 29 8.588 8.588 8.854 -0.266 25567 4511 1 7 . 1 1 30 30 ASP N N 30 119.366 119.366 119.570 -0.204 25567 4512 1 7 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.356 0.046 25567 4513 1 7 . 1 1 30 30 ASP C C 30 172.580 172.580 176.071 -3.491 25567 4514 1 7 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.518 -1.894 25567 4515 1 7 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.742 -3.914 25567 4516 1 7 . 1 1 30 30 ASP H H 30 8.940 8.940 8.801 0.139 25567 4517 1 7 . 1 1 31 31 SER N N 31 114.035 114.035 114.226 -0.191 25567 4518 1 7 . 1 1 31 31 SER HA H 31 4.781 4.781 4.863 -0.082 25567 4519 1 7 . 1 1 31 31 SER C C 31 171.136 171.136 174.770 -3.634 25567 4520 1 7 . 1 1 31 31 SER CA C 31 55.638 55.638 59.617 -3.979 25567 4521 1 7 . 1 1 31 31 SER CB C 31 62.388 62.388 64.362 -1.974 25567 4522 1 7 . 1 1 31 31 SER H H 31 8.030 8.030 7.899 0.131 25567 4523 1 7 . 1 1 32 32 GLU N N 32 121.406 121.406 119.926 1.480 25567 4524 1 7 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.713 0.022 25567 4525 1 7 . 1 1 32 32 GLU C C 32 171.205 171.205 174.666 -3.461 25567 4526 1 7 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.087 -3.018 25567 4527 1 7 . 1 1 32 32 GLU CB C 32 30.890 30.890 34.127 -3.237 25567 4528 1 7 . 1 1 32 32 GLU H H 32 8.188 8.188 8.370 -0.182 25567 4529 1 7 . 1 1 33 33 LEU N N 33 126.143 126.143 118.857 7.286 25567 4530 1 7 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.389 -0.104 25567 4531 1 7 . 1 1 33 33 LEU C C 33 173.401 173.401 175.647 -2.246 25567 4532 1 7 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.400 -2.066 25567 4533 1 7 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.822 -1.199 25567 4534 1 7 . 1 1 33 33 LEU H H 33 8.627 8.627 8.516 0.111 25567 4535 1 7 . 1 1 34 34 LYS N N 34 127.122 127.122 120.546 6.576 25567 4536 1 7 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.720 -0.121 25567 4537 1 7 . 1 1 34 34 LYS C C 34 169.644 169.644 174.599 -4.955 25567 4538 1 7 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.553 -2.200 25567 4539 1 7 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.384 -3.212 25567 4540 1 7 . 1 1 34 34 LYS H H 34 9.399 9.399 9.110 0.289 25567 4541 1 7 . 1 1 35 35 GLU N N 35 122.766 122.766 119.591 3.175 25567 4542 1 7 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.376 -1.018 25567 4543 1 7 . 1 1 35 35 GLU C C 35 172.875 172.875 175.528 -2.653 25567 4544 1 7 . 1 1 35 35 GLU CA C 35 52.640 52.640 54.624 -1.984 25567 4545 1 7 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.868 -2.600 25567 4546 1 7 . 1 1 35 35 GLU H H 35 8.166 8.166 8.407 -0.241 25567 4547 1 7 . 1 1 36 36 VAL N N 36 126.674 126.674 117.181 9.493 25567 4548 1 7 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.589 -0.728 25567 4549 1 7 . 1 1 36 36 VAL C C 36 171.451 171.451 174.688 -3.237 25567 4550 1 7 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.219 -0.682 25567 4551 1 7 . 1 1 36 36 VAL CB C 36 29.689 29.689 34.285 -4.596 25567 4552 1 7 . 1 1 36 36 VAL H H 36 8.632 8.632 7.583 1.049 25567 4553 1 7 . 1 1 37 37 LYS N N 37 126.181 126.181 120.112 6.069 25567 4554 1 7 . 1 1 37 37 LYS HA H 37 4.939 4.939 3.924 1.015 25567 4555 1 7 . 1 1 37 37 LYS CA C 37 52.179 52.179 53.539 -1.360 25567 4556 1 7 . 1 1 37 37 LYS CB C 37 32.898 32.898 36.712 -3.814 25567 4557 1 7 . 1 1 37 37 LYS H H 37 7.867 7.867 8.645 -0.778 25567 4558 1 7 . 1 1 38 38 VAL N N 38 113.540 113.540 116.552 -3.012 25567 4559 1 7 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.165 0.521 25567 4560 1 7 . 1 1 38 38 VAL C C 38 173.633 173.633 175.814 -2.181 25567 4561 1 7 . 1 1 38 38 VAL CA C 38 57.284 57.284 61.554 -4.270 25567 4562 1 7 . 1 1 38 38 VAL CB C 38 31.964 31.964 32.384 -0.420 25567 4563 1 7 . 1 1 38 38 VAL H H 38 8.389 8.389 8.000 0.389 25567 4564 1 7 . 1 1 39 39 SER N N 39 118.860 118.860 116.713 2.147 25567 4565 1 7 . 1 1 39 39 SER HA H 39 4.194 4.194 4.591 -0.397 25567 4566 1 7 . 1 1 39 39 SER C C 39 173.059 173.059 173.701 -0.642 25567 4567 1 7 . 1 1 39 39 SER CA C 39 56.227 56.227 56.981 -0.754 25567 4568 1 7 . 1 1 39 39 SER CB C 39 60.771 60.771 64.170 -3.399 25567 4569 1 7 . 1 1 39 39 SER H H 39 8.668 8.668 8.341 0.327 25567 4570 1 7 . 1 1 40 40 GLU N N 40 125.769 125.769 120.978 4.791 25567 4571 1 7 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.522 -0.365 25567 4572 1 7 . 1 1 40 40 GLU C C 40 174.484 174.484 175.280 -0.796 25567 4573 1 7 . 1 1 40 40 GLU CA C 40 55.550 55.550 55.609 -0.059 25567 4574 1 7 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.206 -3.152 25567 4575 1 7 . 1 1 40 40 GLU H H 40 8.878 8.878 8.606 0.272 25567 4576 1 7 . 1 1 41 41 GLY N N 41 112.165 112.165 108.836 3.329 25567 4577 1 7 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.189 -1.482 25567 4578 1 7 . 1 1 41 41 GLY H H 41 8.743 8.743 7.887 0.856 25567 4579 1 7 . 1 1 44 44 ASP N N 44 122.324 122.324 121.551 0.773 25567 4580 1 7 . 1 1 44 44 ASP CB C 44 42.156 42.156 41.532 0.624 25567 4581 1 7 . 1 1 44 44 ASP H H 44 7.918 7.918 8.570 -0.652 25567 4582 1 7 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.082 -0.020 25567 4583 1 7 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.663 -1.253 25567 4584 1 7 . 1 1 45 45 ALA CB C 45 16.376 16.376 18.147 -1.771 25567 4585 1 7 . 1 1 47 47 MET CA C 47 54.118 54.118 55.871 -1.753 25567 4586 1 7 . 1 1 47 47 MET CB C 47 27.527 27.527 30.989 -3.462 25567 4587 1 7 . 1 1 48 48 TYR N N 48 120.075 120.075 113.129 6.946 25567 4588 1 7 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.256 -0.102 25567 4589 1 7 . 1 1 48 48 TYR C C 48 172.217 172.217 174.211 -1.994 25567 4590 1 7 . 1 1 48 48 TYR CA C 48 57.377 57.377 58.743 -1.366 25567 4591 1 7 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.512 -3.016 25567 4592 1 7 . 1 1 48 48 TYR H H 48 7.810 7.810 7.657 0.153 25567 4593 1 7 . 1 1 49 49 LYS N N 49 118.369 118.369 122.477 -4.108 25567 4594 1 7 . 1 1 49 49 LYS H H 49 8.116 8.116 8.441 -0.325 25567 4595 1 7 . 1 1 50 50 THR N N 50 116.979 116.979 115.592 1.387 25567 4596 1 7 . 1 1 50 50 THR CB C 50 66.373 66.373 69.898 -3.525 25567 4597 1 7 . 1 1 50 50 THR H H 50 7.741 7.741 9.254 -1.513 25567 4598 1 7 . 1 1 51 51 SER N N 51 116.155 116.155 117.271 -1.116 25567 4599 1 7 . 1 1 51 51 SER HA H 51 3.771 3.771 4.592 -0.821 25567 4600 1 7 . 1 1 51 51 SER C C 51 170.563 170.563 173.430 -2.867 25567 4601 1 7 . 1 1 51 51 SER CA C 51 54.840 54.840 58.721 -3.881 25567 4602 1 7 . 1 1 51 51 SER CB C 51 60.318 60.318 63.397 -3.079 25567 4603 1 7 . 1 1 51 51 SER H H 51 7.853 7.853 8.110 -0.257 25567 4604 1 7 . 1 1 54 54 ALA N N 54 123.234 123.234 131.150 -7.916 25567 4605 1 7 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.181 0.067 25567 4606 1 7 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.653 -1.385 25567 4607 1 7 . 1 1 54 54 ALA CB C 54 16.434 16.434 18.101 -1.667 25567 4608 1 7 . 1 1 54 54 ALA H H 54 8.207 8.207 8.974 -0.767 25567 4609 1 7 . 1 1 55 55 LEU N N 55 118.603 118.603 117.419 1.184 25567 4610 1 7 . 1 1 55 55 LEU HA H 55 3.940 3.940 3.962 -0.022 25567 4611 1 7 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.634 -0.923 25567 4612 1 7 . 1 1 55 55 LEU CB C 55 38.913 38.913 40.330 -1.417 25567 4613 1 7 . 1 1 55 55 LEU H H 55 7.960 7.960 8.888 -0.928 25567 4614 1 7 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.079 -0.403 25567 4615 1 7 . 1 1 58 58 ILE CA C 58 61.494 61.494 62.149 -0.655 25567 4616 1 7 . 1 1 58 58 ILE CB C 58 36.054 36.054 38.706 -2.652 25567 4617 1 7 . 1 1 59 59 GLN N N 59 117.579 117.579 119.743 -2.164 25567 4618 1 7 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.295 -0.162 25567 4619 1 7 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.293 -2.284 25567 4620 1 7 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.711 -2.060 25567 4621 1 7 . 1 1 59 59 GLN H H 59 8.268 8.268 8.272 -0.004 25567 4622 1 7 . 1 1 60 60 GLY N N 60 107.308 107.308 115.939 -8.631 25567 4623 1 7 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.910 -2.931 25567 4624 1 7 . 1 1 60 60 GLY H H 60 7.780 7.780 9.026 -1.246 25567 4625 1 7 . 1 1 61 61 ASN N N 61 117.747 117.747 121.416 -3.669 25567 4626 1 7 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.940 -0.406 25567 4627 1 7 . 1 1 61 61 ASN CA C 61 51.235 51.235 53.331 -2.095 25567 4628 1 7 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.543 -3.119 25567 4629 1 7 . 1 1 61 61 ASN H H 61 8.108 8.108 8.145 -0.037 25567 4630 1 7 . 1 1 64 64 PHE N N 64 120.102 120.102 114.827 5.275 25567 4631 1 7 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.814 -0.435 25567 4632 1 7 . 1 1 64 64 PHE CA C 64 51.748 51.748 55.971 -4.223 25567 4633 1 7 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.837 -3.562 25567 4634 1 7 . 1 1 64 64 PHE H H 64 8.300 8.300 7.516 0.784 25567 4635 1 7 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.554 -0.219 25567 4636 1 7 . 1 1 65 65 PRO C C 65 173.870 173.870 176.333 -2.463 25567 4637 1 7 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.695 -2.678 25567 4638 1 7 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.915 -3.280 25567 4639 1 7 . 1 1 66 66 GLU N N 66 121.258 121.258 118.519 2.739 25567 4640 1 7 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.344 -0.110 25567 4641 1 7 . 1 1 66 66 GLU C C 66 173.981 173.981 176.846 -2.865 25567 4642 1 7 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.089 -2.302 25567 4643 1 7 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.974 -3.199 25567 4644 1 7 . 1 1 66 66 GLU H H 66 8.316 8.316 8.530 -0.214 25567 4645 1 7 . 1 1 67 67 ILE N N 67 114.290 114.290 113.450 0.840 25567 4646 1 7 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.668 0.461 25567 4647 1 7 . 1 1 67 67 ILE C C 67 172.700 172.700 174.879 -2.179 25567 4648 1 7 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.189 -2.750 25567 4649 1 7 . 1 1 67 67 ILE CB C 67 39.159 39.159 40.969 -1.810 25567 4650 1 7 . 1 1 67 67 ILE H H 67 8.366 8.366 8.029 0.337 25567 4651 1 7 . 1 1 68 68 GLN N N 68 121.422 121.422 118.618 2.804 25567 4652 1 7 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.782 -0.281 25567 4653 1 7 . 1 1 68 68 GLN C C 68 171.675 171.675 173.962 -2.287 25567 4654 1 7 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.512 -2.239 25567 4655 1 7 . 1 1 68 68 GLN CB C 68 27.143 27.143 32.885 -5.742 25567 4656 1 7 . 1 1 68 68 GLN H H 68 8.737 8.737 8.477 0.260 25567 4657 1 7 . 1 1 69 69 LEU N N 69 125.311 125.311 117.850 7.461 25567 4658 1 7 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.778 -0.272 25567 4659 1 7 . 1 1 69 69 LEU C C 69 172.634 172.634 175.154 -2.520 25567 4660 1 7 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.735 -1.976 25567 4661 1 7 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.644 -1.240 25567 4662 1 7 . 1 1 69 69 LEU H H 69 8.051 8.051 8.048 0.003 25567 4663 1 7 . 1 1 70 70 ASP N N 70 122.763 122.763 119.145 3.618 25567 4664 1 7 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.686 -0.263 25567 4665 1 7 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.764 -2.154 25567 4666 1 7 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.588 -3.871 25567 4667 1 7 . 1 1 70 70 ASP H H 70 8.313 8.313 8.528 -0.215 25567 4668 1 7 . 1 1 71 71 ASN N N 71 117.413 117.413 118.342 -0.929 25567 4669 1 7 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.594 -0.257 25567 4670 1 7 . 1 1 71 71 ASN C C 71 171.770 171.770 174.808 -3.038 25567 4671 1 7 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.594 -2.103 25567 4672 1 7 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.403 -2.077 25567 4673 1 7 . 1 1 71 71 ASN H H 71 8.407 8.407 8.500 -0.093 25567 4674 1 7 . 1 1 72 72 ILE N N 72 123.752 123.752 123.620 0.132 25567 4675 1 7 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.185 -0.245 25567 4676 1 7 . 1 1 72 72 ILE C C 72 171.621 171.621 175.081 -3.460 25567 4677 1 7 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.545 -3.213 25567 4678 1 7 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.330 -0.841 25567 4679 1 7 . 1 1 72 72 ILE H H 72 7.639 7.639 7.824 -0.185 25567 4680 1 7 . 1 1 73 73 ASP N N 73 125.252 125.252 120.756 4.496 25567 4681 1 7 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.711 -0.086 25567 4682 1 7 . 1 1 73 73 ASP C C 73 174.034 174.034 175.896 -1.862 25567 4683 1 7 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.110 -3.907 25567 4684 1 7 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.297 -5.273 25567 4685 1 7 . 1 1 73 73 ASP H H 73 8.394 8.394 8.307 0.087 25567 4686 1 7 . 1 1 74 74 TYR N N 74 123.108 123.108 122.838 0.270 25567 4687 1 7 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.343 -0.465 25567 4688 1 7 . 1 1 74 74 TYR C C 74 173.637 173.637 177.581 -3.944 25567 4689 1 7 . 1 1 74 74 TYR CA C 74 59.474 59.474 61.314 -1.840 25567 4690 1 7 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.231 -3.509 25567 4691 1 7 . 1 1 74 74 TYR H H 74 7.392 7.392 8.209 -0.817 25567 4692 1 7 . 1 1 75 75 ASN N N 75 109.422 109.422 115.576 -6.154 25567 4693 1 7 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.738 0.188 25567 4694 1 7 . 1 1 75 75 ASN C C 75 172.574 172.574 176.534 -3.960 25567 4695 1 7 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.772 -3.011 25567 4696 1 7 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.057 -2.440 25567 4697 1 7 . 1 1 75 75 ASN H H 75 8.058 8.058 8.986 -0.928 25567 4698 1 7 . 1 1 76 76 ASN N N 76 117.422 117.422 116.459 0.963 25567 4699 1 7 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.586 -0.131 25567 4700 1 7 . 1 1 76 76 ASN C C 76 171.132 171.132 174.892 -3.760 25567 4701 1 7 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.936 -2.769 25567 4702 1 7 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.377 -2.649 25567 4703 1 7 . 1 1 76 76 ASN H H 76 7.768 7.768 8.288 -0.520 25567 4704 1 7 . 1 1 77 77 TYR N N 77 116.873 116.873 117.444 -0.571 25567 4705 1 7 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.465 -0.102 25567 4706 1 7 . 1 1 77 77 TYR C C 77 172.175 172.175 175.234 -3.059 25567 4707 1 7 . 1 1 77 77 TYR CA C 77 55.364 55.364 59.325 -3.961 25567 4708 1 7 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.530 -3.365 25567 4709 1 7 . 1 1 77 77 TYR H H 77 7.825 7.825 7.777 0.048 25567 4710 1 7 . 1 1 78 78 ASP N N 78 121.271 121.271 117.799 3.472 25567 4711 1 7 . 1 1 78 78 ASP HA H 78 4.805 4.805 5.046 -0.241 25567 4712 1 7 . 1 1 78 78 ASP C C 78 172.641 172.641 175.583 -2.942 25567 4713 1 7 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.767 -0.513 25567 4714 1 7 . 1 1 78 78 ASP CB C 78 41.075 41.075 44.523 -3.448 25567 4715 1 7 . 1 1 78 78 ASP H H 78 9.058 9.058 8.757 0.301 25567 4716 1 7 . 1 1 79 79 LEU N N 79 122.985 122.985 119.307 3.678 25567 4717 1 7 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.246 -0.132 25567 4718 1 7 . 1 1 79 79 LEU C C 79 170.721 170.721 174.665 -3.944 25567 4719 1 7 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.426 -3.110 25567 4720 1 7 . 1 1 79 79 LEU CB C 79 42.342 42.342 47.217 -4.875 25567 4721 1 7 . 1 1 79 79 LEU H H 79 7.893 7.893 8.262 -0.369 25567 4722 1 7 . 1 1 80 80 ILE N N 80 126.364 126.364 120.491 5.873 25567 4723 1 7 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.742 0.347 25567 4724 1 7 . 1 1 80 80 ILE C C 80 171.580 171.580 173.953 -2.373 25567 4725 1 7 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.193 -2.776 25567 4726 1 7 . 1 1 80 80 ILE CB C 80 38.136 38.136 42.271 -4.135 25567 4727 1 7 . 1 1 80 80 ILE H H 80 8.717 8.717 8.835 -0.118 25567 4728 1 7 . 1 1 81 81 LEU N N 81 126.199 126.199 124.932 1.267 25567 4729 1 7 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.245 -0.110 25567 4730 1 7 . 1 1 81 81 LEU C C 81 172.979 172.979 175.950 -2.971 25567 4731 1 7 . 1 1 81 81 LEU CA C 81 49.633 49.633 52.689 -3.056 25567 4732 1 7 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.661 -3.502 25567 4733 1 7 . 1 1 81 81 LEU H H 81 9.230 9.230 8.934 0.296 25567 4734 1 7 . 1 1 82 82 ILE N N 82 120.505 120.505 119.418 1.087 25567 4735 1 7 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.602 0.314 25567 4736 1 7 . 1 1 82 82 ILE C C 82 173.011 173.011 173.919 -0.908 25567 4737 1 7 . 1 1 82 82 ILE CA C 82 56.828 56.828 60.409 -3.581 25567 4738 1 7 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.175 -4.107 25567 4739 1 7 . 1 1 82 82 ILE H H 82 8.796 8.796 7.984 0.812 25567 4740 1 7 . 1 1 83 83 GLY N N 83 120.857 120.857 112.131 8.726 25567 4741 1 7 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.030 -2.227 25567 4742 1 7 . 1 1 83 83 GLY H H 83 9.525 9.525 8.029 1.496 25567 4743 1 7 . 1 1 84 84 SER N N 84 116.007 116.007 116.072 -0.065 25567 4744 1 7 . 1 1 84 84 SER HA H 84 5.476 5.476 5.062 0.414 25567 4745 1 7 . 1 1 84 84 SER CA C 84 51.937 51.937 55.926 -3.989 25567 4746 1 7 . 1 1 84 84 SER CB C 84 64.533 64.533 65.860 -1.327 25567 4747 1 7 . 1 1 84 84 SER H H 84 7.617 7.617 7.708 -0.091 25567 4748 1 7 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.250 0.951 25567 4749 1 7 . 1 1 85 85 PRO C C 85 173.574 173.574 174.559 -0.985 25567 4750 1 7 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.287 -2.799 25567 4751 1 7 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.092 -0.952 25567 4752 1 7 . 1 1 86 86 VAL N N 86 117.603 117.603 117.024 0.579 25567 4753 1 7 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.186 0.187 25567 4754 1 7 . 1 1 86 86 VAL C C 86 172.777 172.777 173.378 -0.601 25567 4755 1 7 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.007 -1.404 25567 4756 1 7 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.413 -4.840 25567 4757 1 7 . 1 1 86 86 VAL H H 86 8.194 8.194 7.183 1.011 25567 4758 1 7 . 1 1 87 87 TRP N N 87 131.187 131.187 125.676 5.511 25567 4759 1 7 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.956 0.242 25567 4760 1 7 . 1 1 87 87 TRP C C 87 173.295 173.295 175.168 -1.873 25567 4761 1 7 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.410 -6.626 25567 4762 1 7 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.205 -3.459 25567 4763 1 7 . 1 1 87 87 TRP H H 87 9.637 9.637 8.475 1.162 25567 4764 1 7 . 1 1 88 88 SER N N 88 119.829 119.829 112.198 7.631 25567 4765 1 7 . 1 1 88 88 SER HA H 88 3.986 3.986 4.839 -0.853 25567 4766 1 7 . 1 1 88 88 SER C C 88 172.375 172.375 175.425 -3.050 25567 4767 1 7 . 1 1 88 88 SER CA C 88 55.932 55.932 58.347 -2.415 25567 4768 1 7 . 1 1 88 88 SER CB C 88 59.178 59.178 64.759 -5.581 25567 4769 1 7 . 1 1 88 88 SER H H 88 9.272 9.272 7.904 1.368 25567 4770 1 7 . 1 1 89 89 GLY N N 89 101.498 101.498 108.854 -7.356 25567 4771 1 7 . 1 1 89 89 GLY CA C 89 42.671 42.671 45.225 -2.554 25567 4772 1 7 . 1 1 89 89 GLY H H 89 7.463 7.463 8.499 -1.036 25567 4773 1 7 . 1 1 90 90 TYR N N 90 121.064 121.064 117.434 3.630 25567 4774 1 7 . 1 1 90 90 TYR HA H 90 4.216 4.216 4.847 -0.631 25567 4775 1 7 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.698 -0.608 25567 4776 1 7 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.878 -0.683 25567 4777 1 7 . 1 1 90 90 TYR H H 90 8.064 8.064 7.476 0.588 25567 4778 1 7 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.461 0.471 25567 4779 1 7 . 1 1 91 91 PRO C C 91 171.019 171.019 175.761 -4.742 25567 4780 1 7 . 1 1 91 91 PRO CA C 91 58.994 58.994 64.160 -5.166 25567 4781 1 7 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.392 -5.899 25567 4782 1 7 . 1 1 92 92 ALA N N 92 119.893 119.893 119.979 -0.086 25567 4783 1 7 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.838 -1.387 25567 4784 1 7 . 1 1 92 92 ALA C C 92 176.477 176.477 175.714 0.763 25567 4785 1 7 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.470 -1.903 25567 4786 1 7 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.718 -5.917 25567 4787 1 7 . 1 1 92 92 ALA H H 92 7.278 7.278 7.908 -0.630 25567 4788 1 7 . 1 1 93 93 THR N N 93 112.992 112.992 108.885 4.107 25567 4789 1 7 . 1 1 93 93 THR HA H 93 4.462 4.462 4.718 -0.256 25567 4790 1 7 . 1 1 93 93 THR CA C 93 66.871 66.871 59.375 7.496 25567 4791 1 7 . 1 1 93 93 THR CB C 93 64.362 64.362 68.888 -4.526 25567 4792 1 7 . 1 1 93 93 THR H H 93 6.861 6.861 8.317 -1.456 25567 4793 1 7 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.415 -0.549 25567 4794 1 7 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.434 -0.413 25567 4795 1 7 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.320 -3.041 25567 4796 1 7 . 1 1 95 95 ILE N N 95 111.298 111.298 119.200 -7.902 25567 4797 1 7 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.373 -0.750 25567 4798 1 7 . 1 1 95 95 ILE C C 95 174.264 174.264 175.483 -1.219 25567 4799 1 7 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.134 -1.686 25567 4800 1 7 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.239 -4.310 25567 4801 1 7 . 1 1 95 95 ILE H H 95 7.974 7.974 7.926 0.048 25567 4802 1 7 . 1 1 96 96 LYS N N 96 123.045 123.045 120.537 2.508 25567 4803 1 7 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.469 -1.357 25567 4804 1 7 . 1 1 96 96 LYS C C 96 174.590 174.590 177.708 -3.118 25567 4805 1 7 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.981 0.164 25567 4806 1 7 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.214 -4.369 25567 4807 1 7 . 1 1 96 96 LYS H H 96 6.958 6.958 7.561 -0.603 25567 4808 1 7 . 1 1 97 97 THR N N 97 113.412 113.412 116.485 -3.073 25567 4809 1 7 . 1 1 97 97 THR HA H 97 3.461 3.461 3.918 -0.457 25567 4810 1 7 . 1 1 97 97 THR C C 97 173.247 173.247 175.894 -2.647 25567 4811 1 7 . 1 1 97 97 THR CA C 97 62.809 62.809 66.088 -3.279 25567 4812 1 7 . 1 1 97 97 THR CB C 97 65.654 65.654 68.639 -2.985 25567 4813 1 7 . 1 1 97 97 THR H H 97 6.366 6.366 8.167 -1.801 25567 4814 1 7 . 1 1 98 98 LEU N N 98 121.201 121.201 121.776 -0.575 25567 4815 1 7 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.049 -0.415 25567 4816 1 7 . 1 1 98 98 LEU C C 98 174.590 174.590 179.079 -4.489 25567 4817 1 7 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.717 -2.096 25567 4818 1 7 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.758 -0.863 25567 4819 1 7 . 1 1 98 98 LEU H H 98 7.554 7.554 7.895 -0.341 25567 4820 1 7 . 1 1 99 99 LEU N N 99 118.677 118.677 120.152 -1.475 25567 4821 1 7 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.773 -0.071 25567 4822 1 7 . 1 1 99 99 LEU C C 99 177.457 177.457 179.533 -2.076 25567 4823 1 7 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.829 -2.650 25567 4824 1 7 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.431 -2.443 25567 4825 1 7 . 1 1 99 99 LEU H H 99 8.160 8.160 7.781 0.379 25567 4826 1 7 . 1 1 100 100 ASP N N 100 118.914 118.914 116.041 2.873 25567 4827 1 7 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.481 -0.252 25567 4828 1 7 . 1 1 100 100 ASP C C 100 176.585 176.585 177.442 -0.857 25567 4829 1 7 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.370 -1.854 25567 4830 1 7 . 1 1 100 100 ASP CB C 100 37.579 37.579 40.366 -2.787 25567 4831 1 7 . 1 1 100 100 ASP H H 100 7.872 7.872 7.966 -0.094 25567 4832 1 7 . 1 1 101 101 GLN N N 101 118.135 118.135 117.002 1.133 25567 4833 1 7 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.353 -0.193 25567 4834 1 7 . 1 1 101 101 GLN C C 101 174.601 174.601 177.674 -3.073 25567 4835 1 7 . 1 1 101 101 GLN CA C 101 54.960 54.960 56.959 -2.000 25567 4836 1 7 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.780 -4.230 25567 4837 1 7 . 1 1 101 101 GLN H H 101 7.673 7.673 7.991 -0.318 25567 4838 1 7 . 1 1 102 102 MET N N 102 118.420 118.420 120.145 -1.725 25567 4839 1 7 . 1 1 102 102 MET HA H 102 3.826 3.826 4.313 -0.487 25567 4840 1 7 . 1 1 102 102 MET C C 102 172.780 172.780 176.314 -3.534 25567 4841 1 7 . 1 1 102 102 MET CA C 102 53.428 53.428 56.176 -2.748 25567 4842 1 7 . 1 1 102 102 MET CB C 102 31.221 31.221 30.999 0.222 25567 4843 1 7 . 1 1 102 102 MET H H 102 7.462 7.462 7.647 -0.185 25567 4844 1 7 . 1 1 103 103 LYS N N 103 116.066 116.066 120.123 -4.057 25567 4845 1 7 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.215 -0.295 25567 4846 1 7 . 1 1 103 103 LYS C C 103 173.922 173.922 177.240 -3.318 25567 4847 1 7 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.167 -1.885 25567 4848 1 7 . 1 1 103 103 LYS CB C 103 29.491 29.491 32.222 -2.731 25567 4849 1 7 . 1 1 103 103 LYS H H 103 6.875 6.875 8.006 -1.131 25567 4850 1 7 . 1 1 104 104 ASN N N 104 114.987 114.987 116.008 -1.021 25567 4851 1 7 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.920 -0.179 25567 4852 1 7 . 1 1 104 104 ASN C C 104 172.587 172.587 174.153 -1.566 25567 4853 1 7 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.757 -2.288 25567 4854 1 7 . 1 1 104 104 ASN CB C 104 35.822 35.822 40.198 -4.376 25567 4855 1 7 . 1 1 104 104 ASN H H 104 8.517 8.517 8.163 0.354 25567 4856 1 7 . 1 1 105 105 TYR N N 105 122.755 122.755 123.312 -0.557 25567 4857 1 7 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.489 0.086 25567 4858 1 7 . 1 1 105 105 TYR C C 105 174.260 174.260 174.904 -0.644 25567 4859 1 7 . 1 1 105 105 TYR CA C 105 55.493 55.493 59.229 -3.736 25567 4860 1 7 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.261 -3.197 25567 4861 1 7 . 1 1 105 105 TYR H H 105 8.287 8.287 7.795 0.492 25567 4862 1 7 . 1 1 106 106 ARG N N 106 128.905 128.905 125.769 3.136 25567 4863 1 7 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.315 -0.042 25567 4864 1 7 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.069 -2.048 25567 4865 1 7 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.057 -3.927 25567 4866 1 7 . 1 1 106 106 ARG H H 106 8.841 8.841 8.248 0.593 25567 4867 1 7 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.792 -2.295 25567 4868 1 7 . 1 1 108 108 GLU N N 108 116.989 116.989 118.631 -1.642 25567 4869 1 7 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.930 -0.299 25567 4870 1 7 . 1 1 108 108 GLU CA C 108 53.676 53.676 54.988 -1.312 25567 4871 1 7 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.840 -3.438 25567 4872 1 7 . 1 1 108 108 GLU H H 108 7.536 7.536 8.258 -0.722 25567 4873 1 7 . 1 1 109 109 VAL N N 109 123.416 123.416 119.613 3.803 25567 4874 1 7 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.006 0.315 25567 4875 1 7 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.819 -3.376 25567 4876 1 7 . 1 1 109 109 VAL CB C 109 32.661 32.661 35.813 -3.152 25567 4877 1 7 . 1 1 109 109 VAL H H 109 8.955 8.955 8.764 0.191 25567 4878 1 7 . 1 1 110 110 ALA N N 110 127.975 127.975 126.784 1.191 25567 4879 1 7 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.145 -0.468 25567 4880 1 7 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.799 -2.358 25567 4881 1 7 . 1 1 110 110 ALA CB C 110 18.416 18.416 21.933 -3.517 25567 4882 1 7 . 1 1 110 110 ALA H H 110 8.860 8.860 8.753 0.107 25567 4883 1 7 . 1 1 111 111 SER N N 111 110.482 110.482 112.739 -2.257 25567 4884 1 7 . 1 1 111 111 SER HA H 111 5.502 5.502 5.307 0.195 25567 4885 1 7 . 1 1 111 111 SER CA C 111 51.630 51.630 56.160 -4.530 25567 4886 1 7 . 1 1 111 111 SER CB C 111 62.267 62.267 65.396 -3.129 25567 4887 1 7 . 1 1 111 111 SER H H 111 7.484 7.484 7.905 -0.421 25567 4888 1 7 . 1 1 112 112 PHE N N 112 125.082 125.082 118.965 6.117 25567 4889 1 7 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.879 0.569 25567 4890 1 7 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.053 -4.620 25567 4891 1 7 . 1 1 112 112 PHE CB C 112 40.500 40.500 42.666 -2.166 25567 4892 1 7 . 1 1 112 112 PHE H H 112 8.025 8.025 8.590 -0.565 25567 4893 1 7 . 1 1 113 113 PHE N N 113 115.872 115.872 118.007 -2.135 25567 4894 1 7 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.073 0.851 25567 4895 1 7 . 1 1 113 113 PHE C C 113 173.293 173.293 175.405 -2.112 25567 4896 1 7 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.480 -5.012 25567 4897 1 7 . 1 1 113 113 PHE CB C 113 38.393 38.393 40.858 -2.465 25567 4898 1 7 . 1 1 113 113 PHE H H 113 7.391 7.391 7.832 -0.441 25567 4899 1 7 . 1 1 114 114 THR N N 114 108.721 108.721 113.421 -4.700 25567 4900 1 7 . 1 1 114 114 THR HA H 114 4.933 4.933 4.235 0.698 25567 4901 1 7 . 1 1 114 114 THR C C 114 171.891 171.891 174.987 -3.096 25567 4902 1 7 . 1 1 114 114 THR CA C 114 56.815 56.815 62.396 -5.581 25567 4903 1 7 . 1 1 114 114 THR CB C 114 67.899 67.899 69.203 -1.304 25567 4904 1 7 . 1 1 114 114 THR H H 114 7.951 7.951 8.565 -0.614 25567 4905 1 7 . 1 1 115 115 SER N N 115 115.159 115.159 117.553 -2.394 25567 4906 1 7 . 1 1 115 115 SER HA H 115 4.608 4.608 4.502 0.106 25567 4907 1 7 . 1 1 115 115 SER C C 115 171.403 171.403 173.863 -2.460 25567 4908 1 7 . 1 1 115 115 SER CA C 115 55.570 55.570 58.461 -2.891 25567 4909 1 7 . 1 1 115 115 SER CB C 115 61.418 61.418 64.059 -2.641 25567 4910 1 7 . 1 1 115 115 SER H H 115 8.229 8.229 7.938 0.291 25567 4911 1 7 . 1 1 116 116 ALA N N 116 127.211 127.211 123.051 4.160 25567 4912 1 7 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.442 0.014 25567 4913 1 7 . 1 1 116 116 ALA C C 116 175.758 175.758 178.479 -2.721 25567 4914 1 7 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.047 -2.231 25567 4915 1 7 . 1 1 116 116 ALA CB C 116 16.831 16.831 20.404 -3.573 25567 4916 1 7 . 1 1 116 116 ALA H H 116 8.813 8.813 8.331 0.482 25567 4917 1 7 . 1 1 117 117 GLY N N 117 108.099 108.099 110.543 -2.444 25567 4918 1 7 . 1 1 117 117 GLY C C 117 171.805 171.805 175.139 -3.334 25567 4919 1 7 . 1 1 117 117 GLY CA C 117 42.869 42.869 48.030 -5.161 25567 4920 1 7 . 1 1 117 117 GLY H H 117 8.685 8.685 8.964 -0.279 25567 4921 1 7 . 1 1 118 118 THR N N 118 111.284 111.284 109.950 1.334 25567 4922 1 7 . 1 1 118 118 THR HA H 118 4.343 4.343 4.370 -0.027 25567 4923 1 7 . 1 1 118 118 THR C C 118 171.769 171.769 173.629 -1.860 25567 4924 1 7 . 1 1 118 118 THR CA C 118 58.933 58.933 61.574 -2.641 25567 4925 1 7 . 1 1 118 118 THR CB C 118 67.304 67.304 70.256 -2.952 25567 4926 1 7 . 1 1 118 118 THR H H 118 7.998 7.998 8.179 -0.181 25567 4927 1 7 . 1 1 119 119 ASN N N 119 120.253 120.253 120.985 -0.732 25567 4928 1 7 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.938 -0.235 25567 4929 1 7 . 1 1 119 119 ASN C C 119 172.353 172.353 174.051 -1.698 25567 4930 1 7 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.011 -2.783 25567 4931 1 7 . 1 1 119 119 ASN CB C 119 35.376 35.376 39.631 -4.255 25567 4932 1 7 . 1 1 119 119 ASN H H 119 8.381 8.381 7.748 0.633 25567 4933 1 7 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.228 -0.142 25567 4934 1 7 . 1 1 120 120 HIS C C 120 173.395 173.395 176.418 -3.023 25567 4935 1 7 . 1 1 120 120 HIS CA C 120 55.139 55.139 58.614 -3.475 25567 4936 1 7 . 1 1 120 120 HIS CB C 120 28.422 28.422 30.680 -2.258 25567 4937 1 7 . 1 1 121 121 LYS N N 121 119.527 119.527 118.650 0.877 25567 4938 1 7 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.566 0.214 25567 4939 1 7 . 1 1 121 121 LYS C C 121 176.053 176.053 178.295 -2.242 25567 4940 1 7 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.443 -2.480 25567 4941 1 7 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.971 -2.311 25567 4942 1 7 . 1 1 121 121 LYS H H 121 8.106 8.106 8.419 -0.313 25567 4943 1 7 . 1 1 122 122 ALA N N 122 121.585 121.585 120.820 0.765 25567 4944 1 7 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.957 -0.236 25567 4945 1 7 . 1 1 122 122 ALA C C 122 175.128 175.128 179.035 -3.907 25567 4946 1 7 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.376 -2.785 25567 4947 1 7 . 1 1 122 122 ALA CB C 122 15.704 15.704 18.066 -2.362 25567 4948 1 7 . 1 1 122 122 ALA H H 122 7.702 7.702 7.923 -0.221 25567 4949 1 7 . 1 1 123 123 TYR N N 123 118.803 118.803 119.640 -0.837 25567 4950 1 7 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.980 -0.614 25567 4951 1 7 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.549 -1.458 25567 4952 1 7 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.465 -3.363 25567 4953 1 7 . 1 1 123 123 TYR H H 123 7.366 7.366 7.928 -0.562 25567 4954 1 7 . 1 1 124 124 VAL N N 124 117.530 117.530 118.360 -0.830 25567 4955 1 7 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.466 -0.267 25567 4956 1 7 . 1 1 124 124 VAL C C 124 175.375 175.375 178.033 -2.658 25567 4957 1 7 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.840 -2.257 25567 4958 1 7 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.032 -1.829 25567 4959 1 7 . 1 1 124 124 VAL H H 124 7.757 7.757 7.516 0.241 25567 4960 1 7 . 1 1 125 125 SER N N 125 114.023 114.023 114.411 -0.388 25567 4961 1 7 . 1 1 125 125 SER HA H 125 4.035 4.035 4.095 -0.060 25567 4962 1 7 . 1 1 125 125 SER C C 125 174.636 174.636 176.173 -1.537 25567 4963 1 7 . 1 1 125 125 SER CA C 125 58.885 58.885 61.312 -2.427 25567 4964 1 7 . 1 1 125 125 SER CB C 125 59.666 59.666 62.975 -3.309 25567 4965 1 7 . 1 1 125 125 SER H H 125 7.622 7.622 7.547 0.075 25567 4966 1 7 . 1 1 126 126 HIS N N 126 119.457 119.457 121.128 -1.671 25567 4967 1 7 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.942 0.254 25567 4968 1 7 . 1 1 126 126 HIS C C 126 172.942 172.942 176.775 -3.833 25567 4969 1 7 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.614 -3.696 25567 4970 1 7 . 1 1 126 126 HIS CB C 126 26.079 26.079 28.521 -2.442 25567 4971 1 7 . 1 1 126 126 HIS H H 126 8.067 8.067 7.638 0.429 25567 4972 1 7 . 1 1 127 127 PHE N N 127 120.628 120.628 119.910 0.718 25567 4973 1 7 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.576 -0.377 25567 4974 1 7 . 1 1 127 127 PHE C C 127 173.515 173.515 176.856 -3.341 25567 4975 1 7 . 1 1 127 127 PHE CA C 127 60.681 60.681 60.205 0.476 25567 4976 1 7 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.846 -2.479 25567 4977 1 7 . 1 1 127 127 PHE H H 127 9.083 9.083 7.765 1.318 25567 4978 1 7 . 1 1 128 128 ASN N N 128 114.858 114.858 117.332 -2.474 25567 4979 1 7 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.099 -0.021 25567 4980 1 7 . 1 1 128 128 ASN C C 128 175.338 175.338 177.401 -2.063 25567 4981 1 7 . 1 1 128 128 ASN CA C 128 54.250 54.250 57.276 -3.026 25567 4982 1 7 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.143 -2.122 25567 4983 1 7 . 1 1 128 128 ASN H H 128 7.858 7.858 8.029 -0.171 25567 4984 1 7 . 1 1 129 129 GLU N N 129 119.811 119.811 118.740 1.071 25567 4985 1 7 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.184 -0.143 25567 4986 1 7 . 1 1 129 129 GLU C C 129 176.941 176.941 178.049 -1.108 25567 4987 1 7 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.481 -1.849 25567 4988 1 7 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.426 -2.488 25567 4989 1 7 . 1 1 129 129 GLU H H 129 7.569 7.569 7.637 -0.068 25567 4990 1 7 . 1 1 130 130 TRP N N 130 120.585 120.585 118.409 2.176 25567 4991 1 7 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.585 -0.113 25567 4992 1 7 . 1 1 130 130 TRP C C 130 174.262 174.262 176.495 -2.233 25567 4993 1 7 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.691 -2.018 25567 4994 1 7 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.677 -1.720 25567 4995 1 7 . 1 1 130 130 TRP H H 130 7.964 7.964 8.233 -0.269 25567 4996 1 7 . 1 1 131 131 ALA N N 131 120.522 120.522 119.096 1.426 25567 4997 1 7 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.312 -0.365 25567 4998 1 7 . 1 1 131 131 ALA C C 131 172.489 172.489 176.039 -3.550 25567 4999 1 7 . 1 1 131 131 ALA CA C 131 48.580 48.580 50.833 -2.253 25567 5000 1 7 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.781 -3.242 25567 5001 1 7 . 1 1 131 131 ALA H H 131 8.114 8.114 7.684 0.430 25567 5002 1 7 . 1 1 132 132 ASP N N 132 117.666 117.666 119.936 -2.270 25567 5003 1 7 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.269 -0.063 25567 5004 1 7 . 1 1 132 132 ASP C C 132 173.779 173.779 177.131 -3.352 25567 5005 1 7 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.924 -1.611 25567 5006 1 7 . 1 1 132 132 ASP CB C 132 39.456 39.456 40.703 -1.247 25567 5007 1 7 . 1 1 132 132 ASP H H 132 6.768 6.768 7.520 -0.752 25567 5008 1 7 . 1 1 133 133 GLY N N 133 114.922 114.922 113.420 1.502 25567 5009 1 7 . 1 1 133 133 GLY C C 133 172.101 172.101 173.583 -1.482 25567 5010 1 7 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.789 -2.280 25567 5011 1 7 . 1 1 133 133 GLY H H 133 8.645 8.645 8.369 0.276 25567 5012 1 7 . 1 1 134 134 LEU N N 134 120.101 120.101 121.951 -1.850 25567 5013 1 7 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.626 -0.164 25567 5014 1 7 . 1 1 134 134 LEU C C 134 174.098 174.098 175.378 -1.280 25567 5015 1 7 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.527 -2.443 25567 5016 1 7 . 1 1 134 134 LEU CB C 134 40.509 40.509 45.038 -4.529 25567 5017 1 7 . 1 1 134 134 LEU H H 134 8.049 8.049 7.966 0.083 25567 5018 1 7 . 1 1 135 135 ASN N N 135 119.258 119.258 122.312 -3.054 25567 5019 1 7 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.668 -0.029 25567 5020 1 7 . 1 1 135 135 ASN C C 135 170.564 170.564 174.115 -3.551 25567 5021 1 7 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.313 -4.060 25567 5022 1 7 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.253 -4.635 25567 5023 1 7 . 1 1 135 135 ASN H H 135 8.567 8.567 8.664 -0.097 25567 5024 1 7 . 1 1 136 136 VAL N N 136 125.460 125.460 126.511 -1.051 25567 5025 1 7 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.822 -0.226 25567 5026 1 7 . 1 1 136 136 VAL C C 136 175.318 175.318 176.413 -1.095 25567 5027 1 7 . 1 1 136 136 VAL CA C 136 58.722 58.722 61.608 -2.886 25567 5028 1 7 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.504 -3.204 25567 5029 1 7 . 1 1 136 136 VAL H H 136 7.660 7.660 8.288 -0.628 25567 5030 1 7 . 1 1 137 137 ILE N N 137 122.021 122.021 123.729 -1.708 25567 5031 1 7 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.679 -0.251 25567 5032 1 7 . 1 1 137 137 ILE C C 137 173.943 173.943 174.787 -0.844 25567 5033 1 7 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.501 -0.543 25567 5034 1 7 . 1 1 137 137 ILE CB C 137 36.169 36.169 37.995 -1.826 25567 5035 1 7 . 1 1 137 137 ILE H H 137 9.151 9.151 8.740 0.411 25567 5036 1 7 . 1 1 138 138 GLY N N 138 108.192 108.192 108.404 -0.212 25567 5037 1 7 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.935 -2.441 25567 5038 1 7 . 1 1 138 138 GLY H H 138 6.675 6.675 7.415 -0.740 25567 5039 1 7 . 1 1 139 139 VAL N N 139 119.673 119.673 119.397 0.276 25567 5040 1 7 . 1 1 139 139 VAL HA H 139 5.320 5.320 5.079 0.241 25567 5041 1 7 . 1 1 139 139 VAL C C 139 172.291 172.291 175.515 -3.224 25567 5042 1 7 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.832 -3.623 25567 5043 1 7 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.318 -0.679 25567 5044 1 7 . 1 1 139 139 VAL H H 139 8.158 8.158 8.599 -0.441 25567 5045 1 7 . 1 1 140 140 ALA N N 140 127.104 127.104 131.378 -4.274 25567 5046 1 7 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.982 -0.386 25567 5047 1 7 . 1 1 140 140 ALA C C 140 171.057 171.057 174.429 -3.372 25567 5048 1 7 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.482 -1.599 25567 5049 1 7 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.634 -1.206 25567 5050 1 7 . 1 1 140 140 ALA H H 140 9.145 9.145 8.866 0.279 25567 5051 1 7 . 1 1 141 141 ARG N N 141 118.828 118.828 117.626 1.202 25567 5052 1 7 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.253 -1.513 25567 5053 1 7 . 1 1 141 141 ARG C C 141 173.524 173.524 175.605 -2.081 25567 5054 1 7 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.320 -2.434 25567 5055 1 7 . 1 1 141 141 ARG CB C 141 28.454 28.454 32.538 -4.084 25567 5056 1 7 . 1 1 141 141 ARG H H 141 7.759 7.759 8.197 -0.438 25567 5057 1 7 . 1 1 142 142 ASP N N 142 125.557 125.557 120.379 5.178 25567 5058 1 7 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.148 -0.369 25567 5059 1 7 . 1 1 142 142 ASP C C 142 169.292 169.292 175.745 -6.453 25567 5060 1 7 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.842 -2.220 25567 5061 1 7 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.566 -3.486 25567 5062 1 7 . 1 1 142 142 ASP H H 142 9.087 9.087 8.565 0.522 25567 5063 1 7 . 1 1 143 143 ASP N N 143 119.094 119.094 119.102 -0.008 25567 5064 1 7 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.454 -0.200 25567 5065 1 7 . 1 1 143 143 ASP C C 143 175.557 175.557 177.098 -1.541 25567 5066 1 7 . 1 1 143 143 ASP CA C 143 49.079 49.079 54.895 -5.816 25567 5067 1 7 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.013 -3.571 25567 5068 1 7 . 1 1 143 143 ASP H H 143 8.175 8.175 8.586 -0.411 25567 5069 1 7 . 1 1 144 144 SER N N 144 115.438 115.438 115.032 0.406 25567 5070 1 7 . 1 1 144 144 SER HA H 144 3.745 3.745 4.253 -0.508 25567 5071 1 7 . 1 1 144 144 SER C C 144 172.820 172.820 174.879 -2.059 25567 5072 1 7 . 1 1 144 144 SER CA C 144 59.336 59.336 60.036 -0.700 25567 5073 1 7 . 1 1 144 144 SER CB C 144 60.839 60.839 63.021 -2.182 25567 5074 1 7 . 1 1 144 144 SER H H 144 7.742 7.742 7.761 -0.019 25567 5075 1 7 . 1 1 145 145 GLU N N 145 119.631 119.631 119.405 0.226 25567 5076 1 7 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.141 0.178 25567 5077 1 7 . 1 1 145 145 GLU C C 145 171.927 171.927 176.383 -4.456 25567 5078 1 7 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.425 -3.341 25567 5079 1 7 . 1 1 145 145 GLU CB C 145 26.774 26.774 30.071 -3.297 25567 5080 1 7 . 1 1 145 145 GLU H H 145 7.924 7.924 7.986 -0.062 25567 5081 1 7 . 1 1 146 146 VAL N N 146 118.791 118.791 120.549 -1.758 25567 5082 1 7 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.505 -0.549 25567 5083 1 7 . 1 1 146 146 VAL C C 146 174.582 174.582 177.307 -2.725 25567 5084 1 7 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.215 -2.137 25567 5085 1 7 . 1 1 146 146 VAL CB C 146 29.140 29.140 30.996 -1.856 25567 5086 1 7 . 1 1 146 146 VAL H H 146 6.393 6.393 7.099 -0.706 25567 5087 1 7 . 1 1 147 147 ASP N N 147 119.410 119.410 119.836 -0.426 25567 5088 1 7 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.240 -0.170 25567 5089 1 7 . 1 1 147 147 ASP C C 147 174.774 174.774 177.505 -2.731 25567 5090 1 7 . 1 1 147 147 ASP CA C 147 54.322 54.322 57.427 -3.105 25567 5091 1 7 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.739 -3.535 25567 5092 1 7 . 1 1 147 147 ASP H H 147 8.393 8.393 8.445 -0.052 25567 5093 1 7 . 1 1 148 148 LYS N N 148 119.422 119.422 117.783 1.639 25567 5094 1 7 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.103 -0.152 25567 5095 1 7 . 1 1 148 148 LYS C C 148 176.410 176.410 178.319 -1.909 25567 5096 1 7 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.489 -2.753 25567 5097 1 7 . 1 1 148 148 LYS CB C 148 29.576 29.576 31.748 -2.172 25567 5098 1 7 . 1 1 148 148 LYS H H 148 7.078 7.078 7.409 -0.331 25567 5099 1 7 . 1 1 149 149 TRP N N 149 118.168 118.168 119.230 -1.062 25567 5100 1 7 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.965 -0.364 25567 5101 1 7 . 1 1 149 149 TRP C C 149 174.199 174.199 177.015 -2.816 25567 5102 1 7 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.897 -2.102 25567 5103 1 7 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.788 -1.777 25567 5104 1 7 . 1 1 149 149 TRP H H 149 7.914 7.914 7.476 0.439 25567 5105 1 7 . 1 1 150 150 SER N N 150 109.636 109.636 113.710 -4.074 25567 5106 1 7 . 1 1 150 150 SER HA H 150 4.242 4.242 4.680 -0.438 25567 5107 1 7 . 1 1 150 150 SER C C 150 170.173 170.173 174.196 -4.023 25567 5108 1 7 . 1 1 150 150 SER CA C 150 56.912 56.912 58.297 -1.385 25567 5109 1 7 . 1 1 150 150 SER CB C 150 62.087 62.087 64.247 -2.160 25567 5110 1 7 . 1 1 150 150 SER H H 150 7.814 7.814 8.162 -0.348 25567 5111 1 8 . 1 1 2 2 MET HA H 2 4.416 4.416 5.220 -0.804 25567 5112 1 8 . 1 1 2 2 MET CA C 2 52.847 52.847 54.835 -1.988 25567 5113 1 8 . 1 1 2 2 MET CB C 2 30.672 30.672 34.635 -3.963 25567 5114 1 8 . 1 1 3 3 ALA N N 3 125.563 125.563 129.339 -3.776 25567 5115 1 8 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.665 -0.293 25567 5116 1 8 . 1 1 3 3 ALA C C 3 174.728 174.728 175.746 -1.018 25567 5117 1 8 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.012 -2.664 25567 5118 1 8 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.781 -3.846 25567 5119 1 8 . 1 1 3 3 ALA H H 3 8.342 8.342 8.701 -0.359 25567 5120 1 8 . 1 1 4 4 LYS N N 4 121.767 121.767 125.213 -3.446 25567 5121 1 8 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.434 -0.204 25567 5122 1 8 . 1 1 4 4 LYS C C 4 174.577 174.577 176.085 -1.508 25567 5123 1 8 . 1 1 4 4 LYS CA C 4 53.989 53.989 56.022 -2.033 25567 5124 1 8 . 1 1 4 4 LYS CB C 4 31.555 31.555 33.293 -1.738 25567 5125 1 8 . 1 1 4 4 LYS H H 4 8.500 8.500 8.611 -0.111 25567 5126 1 8 . 1 1 5 5 LYS N N 5 129.654 129.654 123.241 6.413 25567 5127 1 8 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.936 -0.410 25567 5128 1 8 . 1 1 5 5 LYS C C 5 174.731 174.731 175.992 -1.261 25567 5129 1 8 . 1 1 5 5 LYS CA C 5 54.746 54.746 54.956 -0.210 25567 5130 1 8 . 1 1 5 5 LYS CB C 5 29.894 29.894 35.984 -6.090 25567 5131 1 8 . 1 1 5 5 LYS H H 5 10.035 10.035 8.647 1.388 25567 5132 1 8 . 1 1 6 6 THR N N 6 126.212 126.212 115.463 10.749 25567 5133 1 8 . 1 1 6 6 THR HA H 6 5.654 5.654 5.318 0.336 25567 5134 1 8 . 1 1 6 6 THR C C 6 169.897 169.897 173.448 -3.551 25567 5135 1 8 . 1 1 6 6 THR CA C 6 60.647 60.647 61.128 -0.481 25567 5136 1 8 . 1 1 6 6 THR CB C 6 68.152 68.152 71.597 -3.445 25567 5137 1 8 . 1 1 6 6 THR H H 6 8.557 8.557 8.370 0.187 25567 5138 1 8 . 1 1 7 7 LEU N N 7 130.776 130.776 123.075 7.701 25567 5139 1 8 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.686 -0.067 25567 5140 1 8 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.443 -3.347 25567 5141 1 8 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.288 -5.245 25567 5142 1 8 . 1 1 7 7 LEU H H 7 8.610 8.610 8.301 0.309 25567 5143 1 8 . 1 1 8 8 ILE N N 8 127.175 127.175 122.141 5.034 25567 5144 1 8 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.681 0.175 25567 5145 1 8 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.751 -3.359 25567 5146 1 8 . 1 1 8 8 ILE CB C 8 36.864 36.864 39.962 -3.098 25567 5147 1 8 . 1 1 8 8 ILE H H 8 9.263 9.263 8.404 0.859 25567 5148 1 8 . 1 1 9 9 LEU N N 9 127.117 127.117 128.910 -1.793 25567 5149 1 8 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.160 0.536 25567 5150 1 8 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.951 -3.999 25567 5151 1 8 . 1 1 9 9 LEU CB C 9 43.827 43.827 44.360 -0.533 25567 5152 1 8 . 1 1 9 9 LEU H H 9 9.262 9.262 9.240 0.022 25567 5153 1 8 . 1 1 10 10 TYR N N 10 113.544 113.544 121.616 -8.072 25567 5154 1 8 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.093 0.438 25567 5155 1 8 . 1 1 10 10 TYR CA C 10 52.829 52.829 54.898 -2.069 25567 5156 1 8 . 1 1 10 10 TYR CB C 10 38.615 38.615 38.555 0.060 25567 5157 1 8 . 1 1 10 10 TYR H H 10 7.425 7.425 8.089 -0.664 25567 5158 1 8 . 1 1 11 11 TYR N N 11 121.235 121.235 126.464 -5.229 25567 5159 1 8 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.650 0.160 25567 5160 1 8 . 1 1 11 11 TYR CA C 11 53.889 53.889 58.956 -5.067 25567 5161 1 8 . 1 1 11 11 TYR CB C 11 40.467 40.467 39.593 0.874 25567 5162 1 8 . 1 1 11 11 TYR H H 11 7.781 7.781 7.707 0.074 25567 5163 1 8 . 1 1 14 14 SER CA C 14 54.675 54.675 58.033 -3.358 25567 5164 1 8 . 1 1 14 14 SER CB C 14 61.621 61.621 63.956 -2.335 25567 5165 1 8 . 1 1 15 15 GLY N N 15 110.420 110.420 112.965 -2.545 25567 5166 1 8 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.566 -1.839 25567 5167 1 8 . 1 1 15 15 GLY H H 15 7.757 7.757 8.718 -0.961 25567 5168 1 8 . 1 1 17 17 THR HA H 17 4.122 4.122 4.131 -0.009 25567 5169 1 8 . 1 1 17 17 THR CA C 17 64.748 64.748 64.711 0.037 25567 5170 1 8 . 1 1 17 17 THR CB C 17 64.532 64.532 69.072 -4.540 25567 5171 1 8 . 1 1 18 18 LYS HA H 18 2.918 2.918 4.072 -1.154 25567 5172 1 8 . 1 1 18 18 LYS C C 18 173.812 173.812 178.557 -4.745 25567 5173 1 8 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.483 -2.480 25567 5174 1 8 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.103 -2.335 25567 5175 1 8 . 1 1 19 19 LYS N N 19 116.699 116.699 117.198 -0.499 25567 5176 1 8 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.056 -0.108 25567 5177 1 8 . 1 1 19 19 LYS C C 19 177.221 177.221 178.474 -1.253 25567 5178 1 8 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.801 -2.381 25567 5179 1 8 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.768 -2.134 25567 5180 1 8 . 1 1 19 19 LYS H H 19 7.476 7.476 7.964 -0.488 25567 5181 1 8 . 1 1 20 20 MET N N 20 118.946 118.946 116.140 2.806 25567 5182 1 8 . 1 1 20 20 MET HA H 20 4.474 4.474 4.499 -0.025 25567 5183 1 8 . 1 1 20 20 MET C C 20 173.826 173.826 176.690 -2.864 25567 5184 1 8 . 1 1 20 20 MET CA C 20 52.285 52.285 56.219 -3.934 25567 5185 1 8 . 1 1 20 20 MET CB C 20 26.921 26.921 32.335 -5.414 25567 5186 1 8 . 1 1 20 20 MET H H 20 7.457 7.457 7.702 -0.245 25567 5187 1 8 . 1 1 21 21 ALA N N 21 123.375 123.375 121.414 1.961 25567 5188 1 8 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.316 -0.764 25567 5189 1 8 . 1 1 21 21 ALA C C 21 176.542 176.542 178.577 -2.035 25567 5190 1 8 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.536 -0.885 25567 5191 1 8 . 1 1 21 21 ALA CB C 21 16.282 16.282 19.576 -3.293 25567 5192 1 8 . 1 1 21 21 ALA H H 21 8.549 8.549 8.035 0.514 25567 5193 1 8 . 1 1 22 22 GLU N N 22 116.906 116.906 118.645 -1.739 25567 5194 1 8 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.955 -0.282 25567 5195 1 8 . 1 1 22 22 GLU C C 22 176.658 176.658 179.009 -2.351 25567 5196 1 8 . 1 1 22 22 GLU CA C 22 56.605 56.605 58.985 -2.380 25567 5197 1 8 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.439 -2.791 25567 5198 1 8 . 1 1 22 22 GLU H H 22 8.085 8.085 7.826 0.259 25567 5199 1 8 . 1 1 23 23 LYS N N 23 123.301 123.301 119.651 3.650 25567 5200 1 8 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.029 -0.209 25567 5201 1 8 . 1 1 23 23 LYS C C 23 177.363 177.363 178.963 -1.600 25567 5202 1 8 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.234 -2.263 25567 5203 1 8 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.137 -2.606 25567 5204 1 8 . 1 1 23 23 LYS H H 23 7.703 7.703 7.376 0.327 25567 5205 1 8 . 1 1 24 24 ILE N N 24 121.894 121.894 119.721 2.173 25567 5206 1 8 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.708 -0.412 25567 5207 1 8 . 1 1 24 24 ILE C C 24 174.944 174.944 177.572 -2.628 25567 5208 1 8 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.631 -1.398 25567 5209 1 8 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.477 -2.733 25567 5210 1 8 . 1 1 24 24 ILE H H 24 8.458 8.458 7.832 0.626 25567 5211 1 8 . 1 1 25 25 ASN N N 25 118.580 118.580 116.818 1.762 25567 5212 1 8 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.276 -0.042 25567 5213 1 8 . 1 1 25 25 ASN C C 25 173.567 173.567 176.898 -3.331 25567 5214 1 8 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.075 -3.751 25567 5215 1 8 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.669 -0.486 25567 5216 1 8 . 1 1 25 25 ASN H H 25 8.273 8.273 7.911 0.362 25567 5217 1 8 . 1 1 26 26 SER N N 26 112.132 112.132 113.130 -0.998 25567 5218 1 8 . 1 1 26 26 SER HA H 26 4.148 4.148 4.364 -0.216 25567 5219 1 8 . 1 1 26 26 SER C C 26 172.083 172.083 175.434 -3.351 25567 5220 1 8 . 1 1 26 26 SER CA C 26 57.865 57.865 60.069 -2.204 25567 5221 1 8 . 1 1 26 26 SER CB C 26 60.816 60.816 63.647 -2.831 25567 5222 1 8 . 1 1 26 26 SER H H 26 7.444 7.444 7.868 -0.424 25567 5223 1 8 . 1 1 27 27 GLU N N 27 120.080 120.080 118.856 1.224 25567 5224 1 8 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.316 -0.216 25567 5225 1 8 . 1 1 27 27 GLU C C 27 173.647 173.647 177.121 -3.474 25567 5226 1 8 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.643 -2.441 25567 5227 1 8 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.123 -3.240 25567 5228 1 8 . 1 1 27 27 GLU H H 27 7.453 7.453 7.749 -0.296 25567 5229 1 8 . 1 1 28 28 ILE N N 28 118.759 118.759 122.330 -3.571 25567 5230 1 8 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.258 -0.054 25567 5231 1 8 . 1 1 28 28 ILE C C 28 172.474 172.474 175.059 -2.585 25567 5232 1 8 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.393 -2.646 25567 5233 1 8 . 1 1 28 28 ILE CB C 28 35.798 35.798 39.162 -3.364 25567 5234 1 8 . 1 1 28 28 ILE H H 28 7.258 7.258 7.636 -0.378 25567 5235 1 8 . 1 1 29 29 LYS N N 29 130.618 130.618 128.725 1.893 25567 5236 1 8 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.190 -0.185 25567 5237 1 8 . 1 1 29 29 LYS C C 29 174.375 174.375 176.613 -2.238 25567 5238 1 8 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.157 -1.498 25567 5239 1 8 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.908 -3.348 25567 5240 1 8 . 1 1 29 29 LYS H H 29 8.588 8.588 8.691 -0.103 25567 5241 1 8 . 1 1 30 30 ASP N N 30 119.366 119.366 122.111 -2.745 25567 5242 1 8 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.384 0.018 25567 5243 1 8 . 1 1 30 30 ASP C C 30 172.580 172.580 175.433 -2.853 25567 5244 1 8 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.304 -1.681 25567 5245 1 8 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.419 -3.591 25567 5246 1 8 . 1 1 30 30 ASP H H 30 8.940 8.940 8.749 0.191 25567 5247 1 8 . 1 1 31 31 SER N N 31 114.035 114.035 113.265 0.770 25567 5248 1 8 . 1 1 31 31 SER HA H 31 4.781 4.781 4.646 0.135 25567 5249 1 8 . 1 1 31 31 SER C C 31 171.136 171.136 173.919 -2.783 25567 5250 1 8 . 1 1 31 31 SER CA C 31 55.638 55.638 57.876 -2.238 25567 5251 1 8 . 1 1 31 31 SER CB C 31 62.388 62.388 64.609 -2.221 25567 5252 1 8 . 1 1 31 31 SER H H 31 8.030 8.030 7.667 0.363 25567 5253 1 8 . 1 1 32 32 GLU N N 32 121.406 121.406 119.304 2.102 25567 5254 1 8 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.662 0.073 25567 5255 1 8 . 1 1 32 32 GLU C C 32 171.205 171.205 174.379 -3.174 25567 5256 1 8 . 1 1 32 32 GLU CA C 32 52.069 52.069 54.817 -2.748 25567 5257 1 8 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.429 -2.539 25567 5258 1 8 . 1 1 32 32 GLU H H 32 8.188 8.188 7.823 0.365 25567 5259 1 8 . 1 1 33 33 LEU N N 33 126.143 126.143 117.835 8.308 25567 5260 1 8 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.422 -0.137 25567 5261 1 8 . 1 1 33 33 LEU C C 33 173.401 173.401 175.447 -2.046 25567 5262 1 8 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.162 -1.828 25567 5263 1 8 . 1 1 33 33 LEU CB C 33 43.623 43.623 45.315 -1.692 25567 5264 1 8 . 1 1 33 33 LEU H H 33 8.627 8.627 8.281 0.346 25567 5265 1 8 . 1 1 34 34 LYS N N 34 127.122 127.122 121.185 5.937 25567 5266 1 8 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.769 -0.170 25567 5267 1 8 . 1 1 34 34 LYS C C 34 169.644 169.644 174.719 -5.075 25567 5268 1 8 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.246 -1.893 25567 5269 1 8 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.600 -3.428 25567 5270 1 8 . 1 1 34 34 LYS H H 34 9.399 9.399 9.229 0.170 25567 5271 1 8 . 1 1 35 35 GLU N N 35 122.766 122.766 121.805 0.961 25567 5272 1 8 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.168 -0.810 25567 5273 1 8 . 1 1 35 35 GLU C C 35 172.875 172.875 174.750 -1.875 25567 5274 1 8 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.104 -2.464 25567 5275 1 8 . 1 1 35 35 GLU CB C 35 29.268 29.268 30.739 -1.471 25567 5276 1 8 . 1 1 35 35 GLU H H 35 8.166 8.166 8.530 -0.364 25567 5277 1 8 . 1 1 36 36 VAL N N 36 126.674 126.674 126.378 0.296 25567 5278 1 8 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.227 -0.366 25567 5279 1 8 . 1 1 36 36 VAL C C 36 171.451 171.451 175.070 -3.619 25567 5280 1 8 . 1 1 36 36 VAL CA C 36 59.537 59.537 62.020 -2.483 25567 5281 1 8 . 1 1 36 36 VAL CB C 36 29.689 29.689 32.946 -3.257 25567 5282 1 8 . 1 1 36 36 VAL H H 36 8.632 8.632 8.403 0.229 25567 5283 1 8 . 1 1 37 37 LYS N N 37 126.181 126.181 126.661 -0.480 25567 5284 1 8 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.749 0.190 25567 5285 1 8 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.075 -1.896 25567 5286 1 8 . 1 1 37 37 LYS CB C 37 32.898 32.898 35.412 -2.514 25567 5287 1 8 . 1 1 37 37 LYS H H 37 7.867 7.867 8.860 -0.993 25567 5288 1 8 . 1 1 38 38 VAL N N 38 113.540 113.540 114.840 -1.300 25567 5289 1 8 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.564 0.122 25567 5290 1 8 . 1 1 38 38 VAL C C 38 173.633 173.633 175.224 -1.591 25567 5291 1 8 . 1 1 38 38 VAL CA C 38 57.284 57.284 58.986 -1.702 25567 5292 1 8 . 1 1 38 38 VAL CB C 38 31.964 31.964 34.346 -2.382 25567 5293 1 8 . 1 1 38 38 VAL H H 38 8.389 8.389 8.010 0.379 25567 5294 1 8 . 1 1 39 39 SER N N 39 118.860 118.860 116.140 2.720 25567 5295 1 8 . 1 1 39 39 SER HA H 39 4.194 4.194 4.723 -0.529 25567 5296 1 8 . 1 1 39 39 SER C C 39 173.059 173.059 174.661 -1.602 25567 5297 1 8 . 1 1 39 39 SER CA C 39 56.227 56.227 58.506 -2.279 25567 5298 1 8 . 1 1 39 39 SER CB C 39 60.771 60.771 64.073 -3.302 25567 5299 1 8 . 1 1 39 39 SER H H 39 8.668 8.668 8.463 0.205 25567 5300 1 8 . 1 1 40 40 GLU N N 40 125.769 125.769 119.725 6.044 25567 5301 1 8 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.191 -0.034 25567 5302 1 8 . 1 1 40 40 GLU C C 40 174.484 174.484 175.924 -1.440 25567 5303 1 8 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.443 -0.893 25567 5304 1 8 . 1 1 40 40 GLU CB C 40 27.054 27.054 29.955 -2.901 25567 5305 1 8 . 1 1 40 40 GLU H H 40 8.878 8.878 8.491 0.387 25567 5306 1 8 . 1 1 41 41 GLY N N 41 112.165 112.165 107.125 5.040 25567 5307 1 8 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.719 -2.012 25567 5308 1 8 . 1 1 41 41 GLY H H 41 8.743 8.743 8.504 0.239 25567 5309 1 8 . 1 1 44 44 ASP N N 44 122.324 122.324 122.143 0.181 25567 5310 1 8 . 1 1 44 44 ASP CB C 44 42.156 42.156 44.215 -2.059 25567 5311 1 8 . 1 1 44 44 ASP H H 44 7.918 7.918 7.640 0.278 25567 5312 1 8 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.152 -0.090 25567 5313 1 8 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.139 -0.729 25567 5314 1 8 . 1 1 45 45 ALA CB C 45 16.376 16.376 17.620 -1.244 25567 5315 1 8 . 1 1 47 47 MET CA C 47 54.118 54.118 55.361 -1.243 25567 5316 1 8 . 1 1 47 47 MET CB C 47 27.527 27.527 33.595 -6.068 25567 5317 1 8 . 1 1 48 48 TYR N N 48 120.075 120.075 117.052 3.023 25567 5318 1 8 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.257 -0.103 25567 5319 1 8 . 1 1 48 48 TYR C C 48 172.217 172.217 175.663 -3.446 25567 5320 1 8 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.201 -1.824 25567 5321 1 8 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.139 -2.643 25567 5322 1 8 . 1 1 48 48 TYR H H 48 7.810 7.810 7.727 0.083 25567 5323 1 8 . 1 1 49 49 LYS N N 49 118.369 118.369 120.316 -1.947 25567 5324 1 8 . 1 1 49 49 LYS H H 49 8.116 8.116 8.884 -0.768 25567 5325 1 8 . 1 1 50 50 THR N N 50 116.979 116.979 117.593 -0.614 25567 5326 1 8 . 1 1 50 50 THR CB C 50 66.373 66.373 68.991 -2.618 25567 5327 1 8 . 1 1 50 50 THR H H 50 7.741 7.741 8.338 -0.597 25567 5328 1 8 . 1 1 51 51 SER N N 51 116.155 116.155 121.039 -4.884 25567 5329 1 8 . 1 1 51 51 SER HA H 51 3.771 3.771 4.835 -1.064 25567 5330 1 8 . 1 1 51 51 SER C C 51 170.563 170.563 173.410 -2.847 25567 5331 1 8 . 1 1 51 51 SER CA C 51 54.840 54.840 57.387 -2.547 25567 5332 1 8 . 1 1 51 51 SER CB C 51 60.318 60.318 65.607 -5.289 25567 5333 1 8 . 1 1 51 51 SER H H 51 7.853 7.853 8.320 -0.467 25567 5334 1 8 . 1 1 54 54 ALA N N 54 123.234 123.234 119.999 3.235 25567 5335 1 8 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.092 0.156 25567 5336 1 8 . 1 1 54 54 ALA CA C 54 51.268 51.268 51.835 -0.567 25567 5337 1 8 . 1 1 54 54 ALA CB C 54 16.434 16.434 18.550 -2.116 25567 5338 1 8 . 1 1 54 54 ALA H H 54 8.207 8.207 7.820 0.387 25567 5339 1 8 . 1 1 55 55 LEU N N 55 118.603 118.603 122.308 -3.705 25567 5340 1 8 . 1 1 55 55 LEU HA H 55 3.940 3.940 3.941 -0.001 25567 5341 1 8 . 1 1 55 55 LEU CA C 55 54.711 54.711 56.355 -1.644 25567 5342 1 8 . 1 1 55 55 LEU CB C 55 38.913 38.913 42.005 -3.092 25567 5343 1 8 . 1 1 55 55 LEU H H 55 7.960 7.960 8.569 -0.609 25567 5344 1 8 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.133 -0.457 25567 5345 1 8 . 1 1 58 58 ILE CA C 58 61.494 61.494 60.742 0.752 25567 5346 1 8 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.207 -3.153 25567 5347 1 8 . 1 1 59 59 GLN N N 59 117.579 117.579 121.951 -4.372 25567 5348 1 8 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.267 -0.134 25567 5349 1 8 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.430 -2.421 25567 5350 1 8 . 1 1 59 59 GLN CB C 59 26.651 26.651 27.790 -1.139 25567 5351 1 8 . 1 1 59 59 GLN H H 59 8.268 8.268 8.447 -0.179 25567 5352 1 8 . 1 1 60 60 GLY N N 60 107.308 107.308 113.726 -6.418 25567 5353 1 8 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.128 -2.149 25567 5354 1 8 . 1 1 60 60 GLY H H 60 7.780 7.780 8.433 -0.653 25567 5355 1 8 . 1 1 61 61 ASN N N 61 117.747 117.747 120.550 -2.803 25567 5356 1 8 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.858 -0.324 25567 5357 1 8 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.038 -0.803 25567 5358 1 8 . 1 1 61 61 ASN CB C 61 36.424 36.424 38.540 -2.116 25567 5359 1 8 . 1 1 61 61 ASN H H 61 8.108 8.108 7.816 0.292 25567 5360 1 8 . 1 1 64 64 PHE N N 64 120.102 120.102 119.050 1.052 25567 5361 1 8 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.905 -0.526 25567 5362 1 8 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.762 -3.014 25567 5363 1 8 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.785 -3.510 25567 5364 1 8 . 1 1 64 64 PHE H H 64 8.300 8.300 7.610 0.690 25567 5365 1 8 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.568 -0.233 25567 5366 1 8 . 1 1 65 65 PRO C C 65 173.870 173.870 176.641 -2.771 25567 5367 1 8 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.810 -2.793 25567 5368 1 8 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.784 -3.149 25567 5369 1 8 . 1 1 66 66 GLU N N 66 121.258 121.258 119.081 2.177 25567 5370 1 8 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.348 -0.114 25567 5371 1 8 . 1 1 66 66 GLU C C 66 173.981 173.981 176.772 -2.791 25567 5372 1 8 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.870 -3.083 25567 5373 1 8 . 1 1 66 66 GLU CB C 66 27.775 27.775 31.021 -3.247 25567 5374 1 8 . 1 1 66 66 GLU H H 66 8.316 8.316 8.648 -0.332 25567 5375 1 8 . 1 1 67 67 ILE N N 67 114.290 114.290 114.932 -0.642 25567 5376 1 8 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.749 0.380 25567 5377 1 8 . 1 1 67 67 ILE C C 67 172.700 172.700 175.489 -2.789 25567 5378 1 8 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.301 -2.862 25567 5379 1 8 . 1 1 67 67 ILE CB C 67 39.159 39.159 41.618 -2.459 25567 5380 1 8 . 1 1 67 67 ILE H H 67 8.366 8.366 8.248 0.118 25567 5381 1 8 . 1 1 68 68 GLN N N 68 121.422 121.422 120.321 1.101 25567 5382 1 8 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.733 -0.232 25567 5383 1 8 . 1 1 68 68 GLN C C 68 171.675 171.675 173.725 -2.050 25567 5384 1 8 . 1 1 68 68 GLN CA C 68 52.273 52.273 55.089 -2.816 25567 5385 1 8 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.249 -6.106 25567 5386 1 8 . 1 1 68 68 GLN H H 68 8.737 8.737 8.834 -0.097 25567 5387 1 8 . 1 1 69 69 LEU N N 69 125.311 125.311 117.718 7.593 25567 5388 1 8 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.957 -0.451 25567 5389 1 8 . 1 1 69 69 LEU C C 69 172.634 172.634 174.963 -2.329 25567 5390 1 8 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.974 -2.216 25567 5391 1 8 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.338 -0.934 25567 5392 1 8 . 1 1 69 69 LEU H H 69 8.051 8.051 8.329 -0.278 25567 5393 1 8 . 1 1 70 70 ASP N N 70 122.763 122.763 118.787 3.976 25567 5394 1 8 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.852 -0.429 25567 5395 1 8 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.223 -1.613 25567 5396 1 8 . 1 1 70 70 ASP CB C 70 38.717 38.717 44.001 -5.284 25567 5397 1 8 . 1 1 70 70 ASP H H 70 8.313 8.313 8.466 -0.153 25567 5398 1 8 . 1 1 71 71 ASN N N 71 117.413 117.413 118.850 -1.437 25567 5399 1 8 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.712 -0.375 25567 5400 1 8 . 1 1 71 71 ASN C C 71 171.770 171.770 174.748 -2.978 25567 5401 1 8 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.223 -1.732 25567 5402 1 8 . 1 1 71 71 ASN CB C 71 35.326 35.326 38.408 -3.082 25567 5403 1 8 . 1 1 71 71 ASN H H 71 8.407 8.407 8.396 0.011 25567 5404 1 8 . 1 1 72 72 ILE N N 72 123.752 123.752 124.320 -0.568 25567 5405 1 8 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.234 -0.294 25567 5406 1 8 . 1 1 72 72 ILE C C 72 171.621 171.621 174.370 -2.749 25567 5407 1 8 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.950 -3.618 25567 5408 1 8 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.227 -0.738 25567 5409 1 8 . 1 1 72 72 ILE H H 72 7.639 7.639 7.506 0.133 25567 5410 1 8 . 1 1 73 73 ASP N N 73 125.252 125.252 124.613 0.639 25567 5411 1 8 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.543 0.082 25567 5412 1 8 . 1 1 73 73 ASP C C 73 174.034 174.034 175.877 -1.843 25567 5413 1 8 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.623 -3.420 25567 5414 1 8 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.684 -4.660 25567 5415 1 8 . 1 1 73 73 ASP H H 73 8.394 8.394 8.549 -0.155 25567 5416 1 8 . 1 1 74 74 TYR N N 74 123.108 123.108 126.657 -3.549 25567 5417 1 8 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.660 -0.782 25567 5418 1 8 . 1 1 74 74 TYR C C 74 173.637 173.637 175.100 -1.463 25567 5419 1 8 . 1 1 74 74 TYR CA C 74 59.474 59.474 55.988 3.486 25567 5420 1 8 . 1 1 74 74 TYR CB C 74 34.722 34.722 36.071 -1.349 25567 5421 1 8 . 1 1 74 74 TYR H H 74 7.392 7.392 8.615 -1.223 25567 5422 1 8 . 1 1 75 75 ASN N N 75 109.422 109.422 116.851 -7.429 25567 5423 1 8 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.987 -0.061 25567 5424 1 8 . 1 1 75 75 ASN C C 75 172.574 172.574 175.190 -2.616 25567 5425 1 8 . 1 1 75 75 ASN CA C 75 52.761 52.761 53.715 -0.954 25567 5426 1 8 . 1 1 75 75 ASN CB C 75 35.617 35.617 41.162 -5.545 25567 5427 1 8 . 1 1 75 75 ASN H H 75 8.058 8.058 7.976 0.082 25567 5428 1 8 . 1 1 76 76 ASN N N 76 117.422 117.422 116.992 0.430 25567 5429 1 8 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.695 -0.240 25567 5430 1 8 . 1 1 76 76 ASN C C 76 171.132 171.132 173.865 -2.733 25567 5431 1 8 . 1 1 76 76 ASN CA C 76 51.167 51.167 52.901 -1.734 25567 5432 1 8 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.819 -3.091 25567 5433 1 8 . 1 1 76 76 ASN H H 76 7.768 7.768 7.447 0.321 25567 5434 1 8 . 1 1 77 77 TYR N N 77 116.873 116.873 117.734 -0.861 25567 5435 1 8 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.703 -0.340 25567 5436 1 8 . 1 1 77 77 TYR C C 77 172.175 172.175 174.955 -2.780 25567 5437 1 8 . 1 1 77 77 TYR CA C 77 55.364 55.364 56.781 -1.417 25567 5438 1 8 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.079 -3.914 25567 5439 1 8 . 1 1 77 77 TYR H H 77 7.825 7.825 7.284 0.541 25567 5440 1 8 . 1 1 78 78 ASP N N 78 121.271 121.271 119.747 1.524 25567 5441 1 8 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.975 -0.170 25567 5442 1 8 . 1 1 78 78 ASP C C 78 172.641 172.641 175.547 -2.906 25567 5443 1 8 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.528 -0.273 25567 5444 1 8 . 1 1 78 78 ASP CB C 78 41.075 41.075 43.724 -2.648 25567 5445 1 8 . 1 1 78 78 ASP H H 78 9.058 9.058 8.760 0.298 25567 5446 1 8 . 1 1 79 79 LEU N N 79 122.985 122.985 119.376 3.609 25567 5447 1 8 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.112 0.003 25567 5448 1 8 . 1 1 79 79 LEU C C 79 170.721 170.721 174.598 -3.877 25567 5449 1 8 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.370 -3.054 25567 5450 1 8 . 1 1 79 79 LEU CB C 79 42.342 42.342 46.437 -4.095 25567 5451 1 8 . 1 1 79 79 LEU H H 79 7.893 7.893 8.029 -0.136 25567 5452 1 8 . 1 1 80 80 ILE N N 80 126.364 126.364 122.620 3.744 25567 5453 1 8 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.542 0.547 25567 5454 1 8 . 1 1 80 80 ILE C C 80 171.580 171.580 174.222 -2.642 25567 5455 1 8 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.528 -3.111 25567 5456 1 8 . 1 1 80 80 ILE CB C 80 38.136 38.136 40.661 -2.525 25567 5457 1 8 . 1 1 80 80 ILE H H 80 8.717 8.717 9.020 -0.303 25567 5458 1 8 . 1 1 81 81 LEU N N 81 126.199 126.199 128.113 -1.914 25567 5459 1 8 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.085 0.050 25567 5460 1 8 . 1 1 81 81 LEU C C 81 172.979 172.979 175.932 -2.953 25567 5461 1 8 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.693 -4.059 25567 5462 1 8 . 1 1 81 81 LEU CB C 81 42.159 42.159 44.394 -2.235 25567 5463 1 8 . 1 1 81 81 LEU H H 81 9.230 9.230 8.931 0.299 25567 5464 1 8 . 1 1 82 82 ILE N N 82 120.505 120.505 121.169 -0.664 25567 5465 1 8 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.095 -0.179 25567 5466 1 8 . 1 1 82 82 ILE C C 82 173.011 173.011 175.269 -2.258 25567 5467 1 8 . 1 1 82 82 ILE CA C 82 56.828 56.828 60.050 -3.222 25567 5468 1 8 . 1 1 82 82 ILE CB C 82 38.068 38.068 40.778 -2.710 25567 5469 1 8 . 1 1 82 82 ILE H H 82 8.796 8.796 8.593 0.203 25567 5470 1 8 . 1 1 83 83 GLY N N 83 120.857 120.857 113.332 7.525 25567 5471 1 8 . 1 1 83 83 GLY CA C 83 40.803 40.803 42.616 -1.813 25567 5472 1 8 . 1 1 83 83 GLY H H 83 9.525 9.525 8.915 0.610 25567 5473 1 8 . 1 1 84 84 SER N N 84 116.007 116.007 114.991 1.016 25567 5474 1 8 . 1 1 84 84 SER HA H 84 5.476 5.476 4.954 0.522 25567 5475 1 8 . 1 1 84 84 SER CA C 84 51.937 51.937 55.475 -3.538 25567 5476 1 8 . 1 1 84 84 SER CB C 84 64.533 64.533 65.251 -0.718 25567 5477 1 8 . 1 1 84 84 SER H H 84 7.617 7.617 7.826 -0.209 25567 5478 1 8 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.695 0.506 25567 5479 1 8 . 1 1 85 85 PRO C C 85 173.574 173.574 175.776 -2.202 25567 5480 1 8 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.766 -3.278 25567 5481 1 8 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.339 -1.199 25567 5482 1 8 . 1 1 86 86 VAL N N 86 117.603 117.603 115.834 1.769 25567 5483 1 8 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.308 0.065 25567 5484 1 8 . 1 1 86 86 VAL C C 86 172.777 172.777 174.709 -1.932 25567 5485 1 8 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.868 -2.265 25567 5486 1 8 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.148 -5.575 25567 5487 1 8 . 1 1 86 86 VAL H H 86 8.194 8.194 8.028 0.166 25567 5488 1 8 . 1 1 87 87 TRP N N 87 131.187 131.187 123.964 7.223 25567 5489 1 8 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.750 0.448 25567 5490 1 8 . 1 1 87 87 TRP C C 87 173.295 173.295 175.138 -1.843 25567 5491 1 8 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.569 -7.785 25567 5492 1 8 . 1 1 87 87 TRP CB C 87 27.746 27.746 32.934 -5.188 25567 5493 1 8 . 1 1 87 87 TRP H H 87 9.637 9.637 8.537 1.100 25567 5494 1 8 . 1 1 88 88 SER N N 88 119.829 119.829 114.343 5.486 25567 5495 1 8 . 1 1 88 88 SER HA H 88 3.986 3.986 5.175 -1.189 25567 5496 1 8 . 1 1 88 88 SER C C 88 172.375 172.375 175.287 -2.912 25567 5497 1 8 . 1 1 88 88 SER CA C 88 55.932 55.932 58.350 -2.418 25567 5498 1 8 . 1 1 88 88 SER CB C 88 59.178 59.178 63.554 -4.376 25567 5499 1 8 . 1 1 88 88 SER H H 88 9.272 9.272 8.492 0.780 25567 5500 1 8 . 1 1 89 89 GLY N N 89 101.498 101.498 110.821 -9.323 25567 5501 1 8 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.334 -3.663 25567 5502 1 8 . 1 1 89 89 GLY H H 89 7.463 7.463 8.855 -1.392 25567 5503 1 8 . 1 1 90 90 TYR N N 90 121.064 121.064 117.104 3.960 25567 5504 1 8 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.065 -0.849 25567 5505 1 8 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.478 -0.389 25567 5506 1 8 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.508 0.687 25567 5507 1 8 . 1 1 90 90 TYR H H 90 8.064 8.064 7.807 0.257 25567 5508 1 8 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.461 0.471 25567 5509 1 8 . 1 1 91 91 PRO C C 91 171.019 171.019 175.514 -4.495 25567 5510 1 8 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.633 -4.639 25567 5511 1 8 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.015 -5.522 25567 5512 1 8 . 1 1 92 92 ALA N N 92 119.893 119.893 120.666 -0.773 25567 5513 1 8 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.622 -1.171 25567 5514 1 8 . 1 1 92 92 ALA C C 92 176.477 176.477 175.347 1.130 25567 5515 1 8 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.366 -1.799 25567 5516 1 8 . 1 1 92 92 ALA CB C 92 15.801 15.801 22.059 -6.258 25567 5517 1 8 . 1 1 92 92 ALA H H 92 7.278 7.278 7.679 -0.401 25567 5518 1 8 . 1 1 93 93 THR N N 93 112.992 112.992 109.616 3.376 25567 5519 1 8 . 1 1 93 93 THR HA H 93 4.462 4.462 4.766 -0.304 25567 5520 1 8 . 1 1 93 93 THR CA C 93 66.871 66.871 59.860 7.011 25567 5521 1 8 . 1 1 93 93 THR CB C 93 64.362 64.362 67.843 -3.481 25567 5522 1 8 . 1 1 93 93 THR H H 93 6.861 6.861 7.988 -1.127 25567 5523 1 8 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.187 -0.321 25567 5524 1 8 . 1 1 94 94 PRO CA C 94 63.021 63.021 64.240 -1.219 25567 5525 1 8 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.480 -2.201 25567 5526 1 8 . 1 1 95 95 ILE N N 95 111.298 111.298 118.282 -6.984 25567 5527 1 8 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.336 -0.713 25567 5528 1 8 . 1 1 95 95 ILE C C 95 174.264 174.264 175.556 -1.292 25567 5529 1 8 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.408 -1.960 25567 5530 1 8 . 1 1 95 95 ILE CB C 95 31.929 31.929 35.063 -3.134 25567 5531 1 8 . 1 1 95 95 ILE H H 95 7.974 7.974 8.119 -0.145 25567 5532 1 8 . 1 1 96 96 LYS N N 96 123.045 123.045 122.912 0.133 25567 5533 1 8 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.587 -1.474 25567 5534 1 8 . 1 1 96 96 LYS C C 96 174.590 174.590 177.090 -2.500 25567 5535 1 8 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.375 -0.230 25567 5536 1 8 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.593 -4.748 25567 5537 1 8 . 1 1 96 96 LYS H H 96 6.958 6.958 8.106 -1.148 25567 5538 1 8 . 1 1 97 97 THR N N 97 113.412 113.412 118.375 -4.963 25567 5539 1 8 . 1 1 97 97 THR HA H 97 3.461 3.461 4.092 -0.631 25567 5540 1 8 . 1 1 97 97 THR C C 97 173.247 173.247 176.659 -3.412 25567 5541 1 8 . 1 1 97 97 THR CA C 97 62.809 62.809 66.352 -3.543 25567 5542 1 8 . 1 1 97 97 THR CB C 97 65.654 65.654 68.370 -2.716 25567 5543 1 8 . 1 1 97 97 THR H H 97 6.366 6.366 7.731 -1.365 25567 5544 1 8 . 1 1 98 98 LEU N N 98 121.201 121.201 121.764 -0.563 25567 5545 1 8 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.102 -0.468 25567 5546 1 8 . 1 1 98 98 LEU C C 98 174.590 174.590 178.656 -4.066 25567 5547 1 8 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.883 -2.262 25567 5548 1 8 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.977 -1.082 25567 5549 1 8 . 1 1 98 98 LEU H H 98 7.554 7.554 7.357 0.197 25567 5550 1 8 . 1 1 99 99 LEU N N 99 118.677 118.677 118.040 0.637 25567 5551 1 8 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.973 -0.271 25567 5552 1 8 . 1 1 99 99 LEU C C 99 177.457 177.457 179.917 -2.460 25567 5553 1 8 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.569 -2.390 25567 5554 1 8 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.252 -1.264 25567 5555 1 8 . 1 1 99 99 LEU H H 99 8.160 8.160 7.798 0.362 25567 5556 1 8 . 1 1 100 100 ASP N N 100 118.914 118.914 117.710 1.204 25567 5557 1 8 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.481 -0.252 25567 5558 1 8 . 1 1 100 100 ASP C C 100 176.585 176.585 178.060 -1.475 25567 5559 1 8 . 1 1 100 100 ASP CA C 100 54.516 54.516 57.027 -2.511 25567 5560 1 8 . 1 1 100 100 ASP CB C 100 37.579 37.579 40.998 -3.420 25567 5561 1 8 . 1 1 100 100 ASP H H 100 7.872 7.872 7.874 -0.002 25567 5562 1 8 . 1 1 101 101 GLN N N 101 118.135 118.135 117.833 0.302 25567 5563 1 8 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.318 -0.158 25567 5564 1 8 . 1 1 101 101 GLN C C 101 174.601 174.601 177.283 -2.682 25567 5565 1 8 . 1 1 101 101 GLN CA C 101 54.960 54.960 57.477 -2.517 25567 5566 1 8 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.119 -3.569 25567 5567 1 8 . 1 1 101 101 GLN H H 101 7.673 7.673 7.765 -0.092 25567 5568 1 8 . 1 1 102 102 MET N N 102 118.420 118.420 117.377 1.043 25567 5569 1 8 . 1 1 102 102 MET HA H 102 3.826 3.826 4.783 -0.957 25567 5570 1 8 . 1 1 102 102 MET C C 102 172.780 172.780 176.685 -3.905 25567 5571 1 8 . 1 1 102 102 MET CA C 102 53.428 53.428 54.598 -1.170 25567 5572 1 8 . 1 1 102 102 MET CB C 102 31.221 31.221 32.029 -0.808 25567 5573 1 8 . 1 1 102 102 MET H H 102 7.462 7.462 7.612 -0.150 25567 5574 1 8 . 1 1 103 103 LYS N N 103 116.066 116.066 120.285 -4.219 25567 5575 1 8 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.237 -0.317 25567 5576 1 8 . 1 1 103 103 LYS C C 103 173.922 173.922 177.654 -3.732 25567 5577 1 8 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.105 -1.823 25567 5578 1 8 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.411 -1.920 25567 5579 1 8 . 1 1 103 103 LYS H H 103 6.875 6.875 8.073 -1.198 25567 5580 1 8 . 1 1 104 104 ASN N N 104 114.987 114.987 115.783 -0.796 25567 5581 1 8 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.821 -0.080 25567 5582 1 8 . 1 1 104 104 ASN C C 104 172.587 172.587 174.423 -1.836 25567 5583 1 8 . 1 1 104 104 ASN CA C 104 50.469 50.469 53.120 -2.651 25567 5584 1 8 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.996 -4.174 25567 5585 1 8 . 1 1 104 104 ASN H H 104 8.517 8.517 8.076 0.441 25567 5586 1 8 . 1 1 105 105 TYR N N 105 122.755 122.755 123.550 -0.795 25567 5587 1 8 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.721 -0.146 25567 5588 1 8 . 1 1 105 105 TYR C C 105 174.260 174.260 175.600 -1.340 25567 5589 1 8 . 1 1 105 105 TYR CA C 105 55.493 55.493 59.097 -3.604 25567 5590 1 8 . 1 1 105 105 TYR CB C 105 36.064 36.064 38.700 -2.636 25567 5591 1 8 . 1 1 105 105 TYR H H 105 8.287 8.287 7.849 0.438 25567 5592 1 8 . 1 1 106 106 ARG N N 106 128.905 128.905 127.581 1.324 25567 5593 1 8 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.355 -0.082 25567 5594 1 8 . 1 1 106 106 ARG CA C 106 53.021 53.021 54.817 -1.796 25567 5595 1 8 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.466 -3.336 25567 5596 1 8 . 1 1 106 106 ARG H H 106 8.841 8.841 8.402 0.439 25567 5597 1 8 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.769 -2.272 25567 5598 1 8 . 1 1 108 108 GLU N N 108 116.989 116.989 119.070 -2.081 25567 5599 1 8 . 1 1 108 108 GLU HA H 108 4.631 4.631 5.155 -0.524 25567 5600 1 8 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.138 -1.462 25567 5601 1 8 . 1 1 108 108 GLU CB C 108 30.402 30.402 34.231 -3.829 25567 5602 1 8 . 1 1 108 108 GLU H H 108 7.536 7.536 8.291 -0.755 25567 5603 1 8 . 1 1 109 109 VAL N N 109 123.416 123.416 121.061 2.355 25567 5604 1 8 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.239 0.082 25567 5605 1 8 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.361 -2.918 25567 5606 1 8 . 1 1 109 109 VAL CB C 109 32.661 32.661 35.297 -2.635 25567 5607 1 8 . 1 1 109 109 VAL H H 109 8.955 8.955 9.156 -0.201 25567 5608 1 8 . 1 1 110 110 ALA N N 110 127.975 127.975 127.209 0.766 25567 5609 1 8 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.304 -0.627 25567 5610 1 8 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.691 -2.251 25567 5611 1 8 . 1 1 110 110 ALA CB C 110 18.416 18.416 21.977 -3.561 25567 5612 1 8 . 1 1 110 110 ALA H H 110 8.860 8.860 8.373 0.487 25567 5613 1 8 . 1 1 111 111 SER N N 111 110.482 110.482 113.671 -3.189 25567 5614 1 8 . 1 1 111 111 SER HA H 111 5.502 5.502 5.338 0.164 25567 5615 1 8 . 1 1 111 111 SER CA C 111 51.630 51.630 56.663 -5.033 25567 5616 1 8 . 1 1 111 111 SER CB C 111 62.267 62.267 66.023 -3.756 25567 5617 1 8 . 1 1 111 111 SER H H 111 7.484 7.484 8.218 -0.734 25567 5618 1 8 . 1 1 112 112 PHE N N 112 125.082 125.082 121.016 4.066 25567 5619 1 8 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.629 0.819 25567 5620 1 8 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.218 -4.784 25567 5621 1 8 . 1 1 112 112 PHE CB C 112 40.500 40.500 39.602 0.898 25567 5622 1 8 . 1 1 112 112 PHE H H 112 8.025 8.025 8.431 -0.406 25567 5623 1 8 . 1 1 113 113 PHE N N 113 115.872 115.872 119.989 -4.117 25567 5624 1 8 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.026 0.898 25567 5625 1 8 . 1 1 113 113 PHE C C 113 173.293 173.293 175.955 -2.662 25567 5626 1 8 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.870 -5.402 25567 5627 1 8 . 1 1 113 113 PHE CB C 113 38.393 38.393 39.799 -1.406 25567 5628 1 8 . 1 1 113 113 PHE H H 113 7.391 7.391 8.193 -0.802 25567 5629 1 8 . 1 1 114 114 THR N N 114 108.721 108.721 109.843 -1.122 25567 5630 1 8 . 1 1 114 114 THR HA H 114 4.933 4.933 4.521 0.412 25567 5631 1 8 . 1 1 114 114 THR C C 114 171.891 171.891 175.023 -3.132 25567 5632 1 8 . 1 1 114 114 THR CA C 114 56.815 56.815 61.728 -4.913 25567 5633 1 8 . 1 1 114 114 THR CB C 114 67.899 67.899 70.384 -2.485 25567 5634 1 8 . 1 1 114 114 THR H H 114 7.951 7.951 8.064 -0.113 25567 5635 1 8 . 1 1 115 115 SER N N 115 115.159 115.159 116.277 -1.118 25567 5636 1 8 . 1 1 115 115 SER HA H 115 4.608 4.608 4.659 -0.051 25567 5637 1 8 . 1 1 115 115 SER C C 115 171.403 171.403 172.916 -1.513 25567 5638 1 8 . 1 1 115 115 SER CA C 115 55.570 55.570 58.131 -2.561 25567 5639 1 8 . 1 1 115 115 SER CB C 115 61.418 61.418 65.654 -4.236 25567 5640 1 8 . 1 1 115 115 SER H H 115 8.229 8.229 7.992 0.237 25567 5641 1 8 . 1 1 116 116 ALA N N 116 127.211 127.211 123.445 3.766 25567 5642 1 8 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.638 -0.182 25567 5643 1 8 . 1 1 116 116 ALA C C 116 175.758 175.758 178.183 -2.425 25567 5644 1 8 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.747 -1.931 25567 5645 1 8 . 1 1 116 116 ALA CB C 116 16.831 16.831 20.007 -3.176 25567 5646 1 8 . 1 1 116 116 ALA H H 116 8.813 8.813 8.267 0.546 25567 5647 1 8 . 1 1 117 117 GLY N N 117 108.099 108.099 110.126 -2.027 25567 5648 1 8 . 1 1 117 117 GLY C C 117 171.805 171.805 175.087 -3.282 25567 5649 1 8 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.130 -4.261 25567 5650 1 8 . 1 1 117 117 GLY H H 117 8.685 8.685 8.697 -0.012 25567 5651 1 8 . 1 1 118 118 THR N N 118 111.284 111.284 109.014 2.270 25567 5652 1 8 . 1 1 118 118 THR HA H 118 4.343 4.343 4.163 0.180 25567 5653 1 8 . 1 1 118 118 THR C C 118 171.769 171.769 173.519 -1.750 25567 5654 1 8 . 1 1 118 118 THR CA C 118 58.933 58.933 60.902 -1.969 25567 5655 1 8 . 1 1 118 118 THR CB C 118 67.304 67.304 69.960 -2.656 25567 5656 1 8 . 1 1 118 118 THR H H 118 7.998 7.998 7.144 0.854 25567 5657 1 8 . 1 1 119 119 ASN N N 119 120.253 120.253 119.817 0.436 25567 5658 1 8 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.888 -0.185 25567 5659 1 8 . 1 1 119 119 ASN C C 119 172.353 172.353 173.227 -0.874 25567 5660 1 8 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.722 -3.494 25567 5661 1 8 . 1 1 119 119 ASN CB C 119 35.376 35.376 40.950 -5.574 25567 5662 1 8 . 1 1 119 119 ASN H H 119 8.381 8.381 7.635 0.746 25567 5663 1 8 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.471 -0.385 25567 5664 1 8 . 1 1 120 120 HIS C C 120 173.395 173.395 176.018 -2.623 25567 5665 1 8 . 1 1 120 120 HIS CA C 120 55.139 55.139 56.462 -1.323 25567 5666 1 8 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.297 -2.875 25567 5667 1 8 . 1 1 121 121 LYS N N 121 119.527 119.527 122.472 -2.945 25567 5668 1 8 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.741 0.039 25567 5669 1 8 . 1 1 121 121 LYS C C 121 176.053 176.053 177.870 -1.817 25567 5670 1 8 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.379 -2.416 25567 5671 1 8 . 1 1 121 121 LYS CB C 121 29.660 29.660 32.048 -2.388 25567 5672 1 8 . 1 1 121 121 LYS H H 121 8.106 8.106 8.746 -0.640 25567 5673 1 8 . 1 1 122 122 ALA N N 122 121.585 121.585 121.072 0.513 25567 5674 1 8 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.741 -0.020 25567 5675 1 8 . 1 1 122 122 ALA C C 122 175.128 175.128 178.597 -3.469 25567 5676 1 8 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.227 -2.636 25567 5677 1 8 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.542 -1.838 25567 5678 1 8 . 1 1 122 122 ALA H H 122 7.702 7.702 7.805 -0.103 25567 5679 1 8 . 1 1 123 123 TYR N N 123 118.803 118.803 119.939 -1.136 25567 5680 1 8 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.854 -0.488 25567 5681 1 8 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.400 -1.309 25567 5682 1 8 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.130 -3.028 25567 5683 1 8 . 1 1 123 123 TYR H H 123 7.366 7.366 7.605 -0.239 25567 5684 1 8 . 1 1 124 124 VAL N N 124 117.530 117.530 115.920 1.610 25567 5685 1 8 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.616 -0.417 25567 5686 1 8 . 1 1 124 124 VAL C C 124 175.375 175.375 177.800 -2.425 25567 5687 1 8 . 1 1 124 124 VAL CA C 124 64.583 64.583 65.892 -1.309 25567 5688 1 8 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.344 -2.141 25567 5689 1 8 . 1 1 124 124 VAL H H 124 7.757 7.757 7.718 0.039 25567 5690 1 8 . 1 1 125 125 SER N N 125 114.023 114.023 114.735 -0.712 25567 5691 1 8 . 1 1 125 125 SER HA H 125 4.035 4.035 4.190 -0.155 25567 5692 1 8 . 1 1 125 125 SER C C 125 174.636 174.636 176.014 -1.378 25567 5693 1 8 . 1 1 125 125 SER CA C 125 58.885 58.885 60.676 -1.791 25567 5694 1 8 . 1 1 125 125 SER CB C 125 59.666 59.666 63.219 -3.554 25567 5695 1 8 . 1 1 125 125 SER H H 125 7.622 7.622 7.481 0.141 25567 5696 1 8 . 1 1 126 126 HIS N N 126 119.457 119.457 120.868 -1.411 25567 5697 1 8 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.944 0.252 25567 5698 1 8 . 1 1 126 126 HIS C C 126 172.942 172.942 177.556 -4.614 25567 5699 1 8 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.362 -3.444 25567 5700 1 8 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.517 -3.438 25567 5701 1 8 . 1 1 126 126 HIS H H 126 8.067 8.067 8.042 0.025 25567 5702 1 8 . 1 1 127 127 PHE N N 127 120.628 120.628 118.656 1.972 25567 5703 1 8 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.874 -0.675 25567 5704 1 8 . 1 1 127 127 PHE C C 127 173.515 173.515 176.729 -3.214 25567 5705 1 8 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.526 1.155 25567 5706 1 8 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.674 -2.307 25567 5707 1 8 . 1 1 127 127 PHE H H 127 9.083 9.083 8.329 0.754 25567 5708 1 8 . 1 1 128 128 ASN N N 128 114.858 114.858 115.174 -0.316 25567 5709 1 8 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.140 -0.062 25567 5710 1 8 . 1 1 128 128 ASN C C 128 175.338 175.338 176.488 -1.150 25567 5711 1 8 . 1 1 128 128 ASN CA C 128 54.250 54.250 55.776 -1.526 25567 5712 1 8 . 1 1 128 128 ASN CB C 128 36.021 36.021 37.842 -1.821 25567 5713 1 8 . 1 1 128 128 ASN H H 128 7.858 7.858 7.695 0.163 25567 5714 1 8 . 1 1 129 129 GLU N N 129 119.811 119.811 117.939 1.872 25567 5715 1 8 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.252 -0.211 25567 5716 1 8 . 1 1 129 129 GLU C C 129 176.941 176.941 179.244 -2.303 25567 5717 1 8 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.023 -1.391 25567 5718 1 8 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.640 -2.702 25567 5719 1 8 . 1 1 129 129 GLU H H 129 7.569 7.569 7.585 -0.016 25567 5720 1 8 . 1 1 130 130 TRP N N 130 120.585 120.585 119.795 0.790 25567 5721 1 8 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.634 -0.162 25567 5722 1 8 . 1 1 130 130 TRP C C 130 174.262 174.262 176.512 -2.250 25567 5723 1 8 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.903 -2.230 25567 5724 1 8 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.253 -2.297 25567 5725 1 8 . 1 1 130 130 TRP H H 130 7.964 7.964 7.592 0.372 25567 5726 1 8 . 1 1 131 131 ALA N N 131 120.522 120.522 118.742 1.780 25567 5727 1 8 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.525 -0.578 25567 5728 1 8 . 1 1 131 131 ALA C C 131 172.489 172.489 175.480 -2.991 25567 5729 1 8 . 1 1 131 131 ALA CA C 131 48.580 48.580 50.831 -2.251 25567 5730 1 8 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.295 -2.756 25567 5731 1 8 . 1 1 131 131 ALA H H 131 8.114 8.114 7.203 0.911 25567 5732 1 8 . 1 1 132 132 ASP N N 132 117.666 117.666 120.575 -2.909 25567 5733 1 8 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.471 -0.265 25567 5734 1 8 . 1 1 132 132 ASP C C 132 173.779 173.779 177.182 -3.403 25567 5735 1 8 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.394 -1.081 25567 5736 1 8 . 1 1 132 132 ASP CB C 132 39.456 39.456 40.681 -1.225 25567 5737 1 8 . 1 1 132 132 ASP H H 132 6.768 6.768 7.826 -1.058 25567 5738 1 8 . 1 1 133 133 GLY N N 133 114.922 114.922 112.591 2.331 25567 5739 1 8 . 1 1 133 133 GLY C C 133 172.101 172.101 173.816 -1.715 25567 5740 1 8 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.797 -2.288 25567 5741 1 8 . 1 1 133 133 GLY H H 133 8.645 8.645 8.433 0.212 25567 5742 1 8 . 1 1 134 134 LEU N N 134 120.101 120.101 120.597 -0.496 25567 5743 1 8 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.590 -0.128 25567 5744 1 8 . 1 1 134 134 LEU C C 134 174.098 174.098 175.232 -1.134 25567 5745 1 8 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.612 -2.528 25567 5746 1 8 . 1 1 134 134 LEU CB C 134 40.509 40.509 44.214 -3.705 25567 5747 1 8 . 1 1 134 134 LEU H H 134 8.049 8.049 7.380 0.669 25567 5748 1 8 . 1 1 135 135 ASN N N 135 119.258 119.258 121.619 -2.361 25567 5749 1 8 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.801 -0.162 25567 5750 1 8 . 1 1 135 135 ASN C C 135 170.564 170.564 174.230 -3.666 25567 5751 1 8 . 1 1 135 135 ASN CA C 135 49.253 49.253 52.907 -3.654 25567 5752 1 8 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.511 -4.893 25567 5753 1 8 . 1 1 135 135 ASN H H 135 8.567 8.567 8.891 -0.324 25567 5754 1 8 . 1 1 136 136 VAL N N 136 125.460 125.460 125.604 -0.144 25567 5755 1 8 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.585 0.011 25567 5756 1 8 . 1 1 136 136 VAL C C 136 175.318 175.318 176.566 -1.248 25567 5757 1 8 . 1 1 136 136 VAL CA C 136 58.722 58.722 62.519 -3.797 25567 5758 1 8 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.155 -2.856 25567 5759 1 8 . 1 1 136 136 VAL H H 136 7.660 7.660 8.402 -0.742 25567 5760 1 8 . 1 1 137 137 ILE N N 137 122.021 122.021 121.165 0.856 25567 5761 1 8 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.738 -0.310 25567 5762 1 8 . 1 1 137 137 ILE C C 137 173.943 173.943 175.012 -1.069 25567 5763 1 8 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.732 -0.774 25567 5764 1 8 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.520 -2.351 25567 5765 1 8 . 1 1 137 137 ILE H H 137 9.151 9.151 9.082 0.069 25567 5766 1 8 . 1 1 138 138 GLY N N 138 108.192 108.192 107.645 0.547 25567 5767 1 8 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.963 -2.469 25567 5768 1 8 . 1 1 138 138 GLY H H 138 6.675 6.675 7.370 -0.695 25567 5769 1 8 . 1 1 139 139 VAL N N 139 119.673 119.673 121.702 -2.029 25567 5770 1 8 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.837 0.483 25567 5771 1 8 . 1 1 139 139 VAL C C 139 172.291 172.291 174.359 -2.068 25567 5772 1 8 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.672 -3.463 25567 5773 1 8 . 1 1 139 139 VAL CB C 139 32.639 32.639 34.485 -1.846 25567 5774 1 8 . 1 1 139 139 VAL H H 139 8.158 8.158 8.740 -0.582 25567 5775 1 8 . 1 1 140 140 ALA N N 140 127.104 127.104 129.702 -2.598 25567 5776 1 8 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.883 -0.287 25567 5777 1 8 . 1 1 140 140 ALA C C 140 171.057 171.057 174.448 -3.391 25567 5778 1 8 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.734 -1.851 25567 5779 1 8 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.410 -0.982 25567 5780 1 8 . 1 1 140 140 ALA H H 140 9.145 9.145 9.184 -0.039 25567 5781 1 8 . 1 1 141 141 ARG N N 141 118.828 118.828 118.411 0.417 25567 5782 1 8 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.900 -1.160 25567 5783 1 8 . 1 1 141 141 ARG C C 141 173.524 173.524 176.400 -2.876 25567 5784 1 8 . 1 1 141 141 ARG CA C 141 51.886 51.886 55.244 -3.358 25567 5785 1 8 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.950 -2.496 25567 5786 1 8 . 1 1 141 141 ARG H H 141 7.759 7.759 8.338 -0.579 25567 5787 1 8 . 1 1 142 142 ASP N N 142 125.557 125.557 119.858 5.699 25567 5788 1 8 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.272 -0.493 25567 5789 1 8 . 1 1 142 142 ASP C C 142 169.292 169.292 175.854 -6.562 25567 5790 1 8 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.136 -2.514 25567 5791 1 8 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.202 -3.122 25567 5792 1 8 . 1 1 142 142 ASP H H 142 9.087 9.087 8.766 0.321 25567 5793 1 8 . 1 1 143 143 ASP N N 143 119.094 119.094 117.738 1.356 25567 5794 1 8 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.672 -0.418 25567 5795 1 8 . 1 1 143 143 ASP C C 143 175.557 175.557 177.691 -2.134 25567 5796 1 8 . 1 1 143 143 ASP CA C 143 49.079 49.079 54.053 -4.973 25567 5797 1 8 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.578 -4.136 25567 5798 1 8 . 1 1 143 143 ASP H H 143 8.175 8.175 8.587 -0.412 25567 5799 1 8 . 1 1 144 144 SER N N 144 115.438 115.438 116.114 -0.676 25567 5800 1 8 . 1 1 144 144 SER HA H 144 3.745 3.745 4.135 -0.390 25567 5801 1 8 . 1 1 144 144 SER C C 144 172.820 172.820 174.572 -1.752 25567 5802 1 8 . 1 1 144 144 SER CA C 144 59.336 59.336 60.794 -1.458 25567 5803 1 8 . 1 1 144 144 SER CB C 144 60.839 60.839 63.069 -2.230 25567 5804 1 8 . 1 1 144 144 SER H H 144 7.742 7.742 8.018 -0.276 25567 5805 1 8 . 1 1 145 145 GLU N N 145 119.631 119.631 119.085 0.546 25567 5806 1 8 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.080 0.239 25567 5807 1 8 . 1 1 145 145 GLU C C 145 171.927 171.927 176.020 -4.093 25567 5808 1 8 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.386 -3.301 25567 5809 1 8 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.642 -2.868 25567 5810 1 8 . 1 1 145 145 GLU H H 145 7.924 7.924 7.801 0.123 25567 5811 1 8 . 1 1 146 146 VAL N N 146 118.791 118.791 120.742 -1.951 25567 5812 1 8 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.501 -0.545 25567 5813 1 8 . 1 1 146 146 VAL C C 146 174.582 174.582 176.405 -1.823 25567 5814 1 8 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.152 -2.074 25567 5815 1 8 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.643 -2.503 25567 5816 1 8 . 1 1 146 146 VAL H H 146 6.393 6.393 7.027 -0.634 25567 5817 1 8 . 1 1 147 147 ASP N N 147 119.410 119.410 115.802 3.608 25567 5818 1 8 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.422 -0.352 25567 5819 1 8 . 1 1 147 147 ASP C C 147 174.774 174.774 176.368 -1.594 25567 5820 1 8 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.047 -1.725 25567 5821 1 8 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.806 -3.602 25567 5822 1 8 . 1 1 147 147 ASP H H 147 8.393 8.393 8.349 0.044 25567 5823 1 8 . 1 1 148 148 LYS N N 148 119.422 119.422 117.031 2.391 25567 5824 1 8 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.461 -0.510 25567 5825 1 8 . 1 1 148 148 LYS C C 148 176.410 176.410 178.848 -2.438 25567 5826 1 8 . 1 1 148 148 LYS CA C 148 55.736 55.736 57.311 -1.575 25567 5827 1 8 . 1 1 148 148 LYS CB C 148 29.576 29.576 33.026 -3.450 25567 5828 1 8 . 1 1 148 148 LYS H H 148 7.078 7.078 7.133 -0.055 25567 5829 1 8 . 1 1 149 149 TRP N N 149 118.168 118.168 122.172 -4.004 25567 5830 1 8 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.819 -0.218 25567 5831 1 8 . 1 1 149 149 TRP C C 149 174.199 174.199 176.431 -2.232 25567 5832 1 8 . 1 1 149 149 TRP CA C 149 53.795 53.795 56.115 -2.320 25567 5833 1 8 . 1 1 149 149 TRP CB C 149 27.011 27.011 26.843 0.168 25567 5834 1 8 . 1 1 149 149 TRP H H 149 7.914 7.914 7.632 0.282 25567 5835 1 8 . 1 1 150 150 SER N N 150 109.636 109.636 112.090 -2.454 25567 5836 1 8 . 1 1 150 150 SER HA H 150 4.242 4.242 4.574 -0.332 25567 5837 1 8 . 1 1 150 150 SER C C 150 170.173 170.173 173.472 -3.299 25567 5838 1 8 . 1 1 150 150 SER CA C 150 56.912 56.912 58.696 -1.784 25567 5839 1 8 . 1 1 150 150 SER CB C 150 62.087 62.087 64.706 -2.619 25567 5840 1 8 . 1 1 150 150 SER H H 150 7.814 7.814 8.210 -0.396 25567 5841 1 9 . 1 1 2 2 MET HA H 2 4.416 4.416 4.813 -0.397 25567 5842 1 9 . 1 1 2 2 MET CA C 2 52.847 52.847 55.885 -3.038 25567 5843 1 9 . 1 1 2 2 MET CB C 2 30.672 30.672 33.650 -2.978 25567 5844 1 9 . 1 1 3 3 ALA N N 3 125.563 125.563 127.045 -1.482 25567 5845 1 9 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.507 -0.135 25567 5846 1 9 . 1 1 3 3 ALA C C 3 174.728 174.728 176.055 -1.327 25567 5847 1 9 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.102 -2.754 25567 5848 1 9 . 1 1 3 3 ALA CB C 3 16.935 16.935 19.934 -2.999 25567 5849 1 9 . 1 1 3 3 ALA H H 3 8.342 8.342 8.242 0.100 25567 5850 1 9 . 1 1 4 4 LYS N N 4 121.767 121.767 125.243 -3.476 25567 5851 1 9 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.234 -0.004 25567 5852 1 9 . 1 1 4 4 LYS C C 4 174.577 174.577 176.270 -1.693 25567 5853 1 9 . 1 1 4 4 LYS CA C 4 53.989 53.989 56.262 -2.273 25567 5854 1 9 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.089 -0.534 25567 5855 1 9 . 1 1 4 4 LYS H H 4 8.500 8.500 8.531 -0.031 25567 5856 1 9 . 1 1 5 5 LYS N N 5 129.654 129.654 124.449 5.205 25567 5857 1 9 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.847 -0.321 25567 5858 1 9 . 1 1 5 5 LYS C C 5 174.731 174.731 176.615 -1.884 25567 5859 1 9 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.411 -0.665 25567 5860 1 9 . 1 1 5 5 LYS CB C 5 29.894 29.894 34.995 -5.101 25567 5861 1 9 . 1 1 5 5 LYS H H 5 10.035 10.035 7.998 2.037 25567 5862 1 9 . 1 1 6 6 THR N N 6 126.212 126.212 115.721 10.491 25567 5863 1 9 . 1 1 6 6 THR HA H 6 5.654 5.654 5.208 0.446 25567 5864 1 9 . 1 1 6 6 THR C C 6 169.897 169.897 173.043 -3.146 25567 5865 1 9 . 1 1 6 6 THR CA C 6 60.647 60.647 61.588 -0.941 25567 5866 1 9 . 1 1 6 6 THR CB C 6 68.152 68.152 71.644 -3.492 25567 5867 1 9 . 1 1 6 6 THR H H 6 8.557 8.557 8.294 0.263 25567 5868 1 9 . 1 1 7 7 LEU N N 7 130.776 130.776 126.406 4.370 25567 5869 1 9 . 1 1 7 7 LEU HA H 7 4.619 4.619 5.055 -0.436 25567 5870 1 9 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.400 -3.304 25567 5871 1 9 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.211 -5.168 25567 5872 1 9 . 1 1 7 7 LEU H H 7 8.610 8.610 8.686 -0.076 25567 5873 1 9 . 1 1 8 8 ILE N N 8 127.175 127.175 126.068 1.107 25567 5874 1 9 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.723 0.133 25567 5875 1 9 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.598 -3.206 25567 5876 1 9 . 1 1 8 8 ILE CB C 8 36.864 36.864 39.059 -2.195 25567 5877 1 9 . 1 1 8 8 ILE H H 8 9.263 9.263 8.899 0.364 25567 5878 1 9 . 1 1 9 9 LEU N N 9 127.117 127.117 129.383 -2.266 25567 5879 1 9 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.577 0.119 25567 5880 1 9 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.496 -3.544 25567 5881 1 9 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.479 0.348 25567 5882 1 9 . 1 1 9 9 LEU H H 9 9.262 9.262 9.114 0.148 25567 5883 1 9 . 1 1 10 10 TYR N N 10 113.544 113.544 120.470 -6.926 25567 5884 1 9 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.391 0.140 25567 5885 1 9 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.066 -2.237 25567 5886 1 9 . 1 1 10 10 TYR CB C 10 38.615 38.615 41.013 -2.398 25567 5887 1 9 . 1 1 10 10 TYR H H 10 7.425 7.425 8.368 -0.943 25567 5888 1 9 . 1 1 11 11 TYR N N 11 121.235 121.235 125.492 -4.257 25567 5889 1 9 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.717 0.093 25567 5890 1 9 . 1 1 11 11 TYR CA C 11 53.889 53.889 57.428 -3.539 25567 5891 1 9 . 1 1 11 11 TYR CB C 11 40.467 40.467 40.380 0.087 25567 5892 1 9 . 1 1 11 11 TYR H H 11 7.781 7.781 8.137 -0.356 25567 5893 1 9 . 1 1 14 14 SER CA C 14 54.675 54.675 58.590 -3.915 25567 5894 1 9 . 1 1 14 14 SER CB C 14 61.621 61.621 64.582 -2.961 25567 5895 1 9 . 1 1 15 15 GLY N N 15 110.420 110.420 111.397 -0.977 25567 5896 1 9 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.145 -1.418 25567 5897 1 9 . 1 1 15 15 GLY H H 15 7.757 7.757 8.853 -1.096 25567 5898 1 9 . 1 1 17 17 THR HA H 17 4.122 4.122 4.184 -0.062 25567 5899 1 9 . 1 1 17 17 THR CA C 17 64.748 64.748 65.178 -0.430 25567 5900 1 9 . 1 1 17 17 THR CB C 17 64.532 64.532 68.624 -4.092 25567 5901 1 9 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.952 -1.034 25567 5902 1 9 . 1 1 18 18 LYS C C 18 173.812 173.812 178.471 -4.659 25567 5903 1 9 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.913 -2.909 25567 5904 1 9 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.276 -2.508 25567 5905 1 9 . 1 1 19 19 LYS N N 19 116.699 116.699 118.313 -1.614 25567 5906 1 9 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.915 0.033 25567 5907 1 9 . 1 1 19 19 LYS C C 19 177.221 177.221 179.084 -1.863 25567 5908 1 9 . 1 1 19 19 LYS CA C 19 56.421 56.421 59.178 -2.757 25567 5909 1 9 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.654 -2.020 25567 5910 1 9 . 1 1 19 19 LYS H H 19 7.476 7.476 8.302 -0.826 25567 5911 1 9 . 1 1 20 20 MET N N 20 118.946 118.946 116.389 2.557 25567 5912 1 9 . 1 1 20 20 MET HA H 20 4.474 4.474 4.275 0.199 25567 5913 1 9 . 1 1 20 20 MET C C 20 173.826 173.826 176.136 -2.310 25567 5914 1 9 . 1 1 20 20 MET CA C 20 52.285 52.285 56.653 -4.368 25567 5915 1 9 . 1 1 20 20 MET CB C 20 26.921 26.921 32.359 -5.438 25567 5916 1 9 . 1 1 20 20 MET H H 20 7.457 7.457 7.891 -0.434 25567 5917 1 9 . 1 1 21 21 ALA N N 21 123.375 123.375 120.167 3.208 25567 5918 1 9 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.066 -0.514 25567 5919 1 9 . 1 1 21 21 ALA C C 21 176.542 176.542 179.200 -2.658 25567 5920 1 9 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.400 -0.749 25567 5921 1 9 . 1 1 21 21 ALA CB C 21 16.282 16.282 19.255 -2.973 25567 5922 1 9 . 1 1 21 21 ALA H H 21 8.549 8.549 7.534 1.015 25567 5923 1 9 . 1 1 22 22 GLU N N 22 116.906 116.906 119.254 -2.348 25567 5924 1 9 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.933 -0.260 25567 5925 1 9 . 1 1 22 22 GLU C C 22 176.658 176.658 179.092 -2.434 25567 5926 1 9 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.284 -2.679 25567 5927 1 9 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.561 -2.912 25567 5928 1 9 . 1 1 22 22 GLU H H 22 8.085 8.085 8.282 -0.197 25567 5929 1 9 . 1 1 23 23 LYS N N 23 123.301 123.301 119.938 3.363 25567 5930 1 9 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.006 -0.186 25567 5931 1 9 . 1 1 23 23 LYS C C 23 177.363 177.363 179.083 -1.720 25567 5932 1 9 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.228 -2.257 25567 5933 1 9 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.065 -2.534 25567 5934 1 9 . 1 1 23 23 LYS H H 23 7.703 7.703 8.186 -0.483 25567 5935 1 9 . 1 1 24 24 ILE N N 24 121.894 121.894 117.808 4.086 25567 5936 1 9 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.738 -0.442 25567 5937 1 9 . 1 1 24 24 ILE C C 24 174.944 174.944 178.109 -3.165 25567 5938 1 9 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.349 -1.116 25567 5939 1 9 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.293 -2.549 25567 5940 1 9 . 1 1 24 24 ILE H H 24 8.458 8.458 7.782 0.676 25567 5941 1 9 . 1 1 25 25 ASN N N 25 118.580 118.580 118.363 0.217 25567 5942 1 9 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.327 -0.093 25567 5943 1 9 . 1 1 25 25 ASN C C 25 173.567 173.567 177.871 -4.304 25567 5944 1 9 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.266 -3.942 25567 5945 1 9 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.419 -0.236 25567 5946 1 9 . 1 1 25 25 ASN H H 25 8.273 8.273 8.462 -0.189 25567 5947 1 9 . 1 1 26 26 SER N N 26 112.132 112.132 114.132 -2.000 25567 5948 1 9 . 1 1 26 26 SER HA H 26 4.148 4.148 4.390 -0.242 25567 5949 1 9 . 1 1 26 26 SER C C 26 172.083 172.083 175.122 -3.039 25567 5950 1 9 . 1 1 26 26 SER CA C 26 57.865 57.865 60.359 -2.494 25567 5951 1 9 . 1 1 26 26 SER CB C 26 60.816 60.816 62.900 -2.084 25567 5952 1 9 . 1 1 26 26 SER H H 26 7.444 7.444 7.918 -0.474 25567 5953 1 9 . 1 1 27 27 GLU N N 27 120.080 120.080 118.507 1.573 25567 5954 1 9 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.436 -0.336 25567 5955 1 9 . 1 1 27 27 GLU C C 27 173.647 173.647 176.131 -2.484 25567 5956 1 9 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.013 -1.811 25567 5957 1 9 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.404 -3.520 25567 5958 1 9 . 1 1 27 27 GLU H H 27 7.453 7.453 7.668 -0.215 25567 5959 1 9 . 1 1 28 28 ILE N N 28 118.759 118.759 122.127 -3.368 25567 5960 1 9 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.364 -0.160 25567 5961 1 9 . 1 1 28 28 ILE C C 28 172.474 172.474 174.980 -2.506 25567 5962 1 9 . 1 1 28 28 ILE CA C 28 57.747 57.747 59.992 -2.245 25567 5963 1 9 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.881 -5.083 25567 5964 1 9 . 1 1 28 28 ILE H H 28 7.258 7.258 7.483 -0.225 25567 5965 1 9 . 1 1 29 29 LYS N N 29 130.618 130.618 129.066 1.552 25567 5966 1 9 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.100 -0.095 25567 5967 1 9 . 1 1 29 29 LYS C C 29 174.375 174.375 176.376 -2.001 25567 5968 1 9 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.988 -2.329 25567 5969 1 9 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.645 -3.086 25567 5970 1 9 . 1 1 29 29 LYS H H 29 8.588 8.588 8.954 -0.366 25567 5971 1 9 . 1 1 30 30 ASP N N 30 119.366 119.366 120.706 -1.340 25567 5972 1 9 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.316 0.086 25567 5973 1 9 . 1 1 30 30 ASP C C 30 172.580 172.580 175.628 -3.048 25567 5974 1 9 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.458 -1.834 25567 5975 1 9 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.419 -3.591 25567 5976 1 9 . 1 1 30 30 ASP H H 30 8.940 8.940 8.802 0.138 25567 5977 1 9 . 1 1 31 31 SER N N 31 114.035 114.035 113.131 0.904 25567 5978 1 9 . 1 1 31 31 SER HA H 31 4.781 4.781 4.744 0.037 25567 5979 1 9 . 1 1 31 31 SER C C 31 171.136 171.136 174.703 -3.567 25567 5980 1 9 . 1 1 31 31 SER CA C 31 55.638 55.638 58.975 -3.337 25567 5981 1 9 . 1 1 31 31 SER CB C 31 62.388 62.388 64.491 -2.103 25567 5982 1 9 . 1 1 31 31 SER H H 31 8.030 8.030 7.773 0.257 25567 5983 1 9 . 1 1 32 32 GLU N N 32 121.406 121.406 118.983 2.423 25567 5984 1 9 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.585 0.150 25567 5985 1 9 . 1 1 32 32 GLU C C 32 171.205 171.205 174.318 -3.113 25567 5986 1 9 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.825 -3.756 25567 5987 1 9 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.902 -3.012 25567 5988 1 9 . 1 1 32 32 GLU H H 32 8.188 8.188 8.483 -0.295 25567 5989 1 9 . 1 1 33 33 LEU N N 33 126.143 126.143 122.161 3.982 25567 5990 1 9 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.051 0.234 25567 5991 1 9 . 1 1 33 33 LEU C C 33 173.401 173.401 175.819 -2.418 25567 5992 1 9 . 1 1 33 33 LEU CA C 33 51.334 51.334 54.389 -3.055 25567 5993 1 9 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.788 -1.165 25567 5994 1 9 . 1 1 33 33 LEU H H 33 8.627 8.627 8.601 0.026 25567 5995 1 9 . 1 1 34 34 LYS N N 34 127.122 127.122 126.280 0.842 25567 5996 1 9 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.758 -0.159 25567 5997 1 9 . 1 1 34 34 LYS C C 34 169.644 169.644 175.257 -5.613 25567 5998 1 9 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.766 -2.413 25567 5999 1 9 . 1 1 34 34 LYS CB C 34 34.172 34.172 35.801 -1.629 25567 6000 1 9 . 1 1 34 34 LYS H H 34 9.399 9.399 8.901 0.498 25567 6001 1 9 . 1 1 35 35 GLU N N 35 122.766 122.766 124.822 -2.056 25567 6002 1 9 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.158 -0.800 25567 6003 1 9 . 1 1 35 35 GLU C C 35 172.875 172.875 175.988 -3.113 25567 6004 1 9 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.677 -3.037 25567 6005 1 9 . 1 1 35 35 GLU CB C 35 29.268 29.268 30.014 -0.746 25567 6006 1 9 . 1 1 35 35 GLU H H 35 8.166 8.166 8.555 -0.389 25567 6007 1 9 . 1 1 36 36 VAL N N 36 126.674 126.674 121.569 5.105 25567 6008 1 9 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.148 -0.287 25567 6009 1 9 . 1 1 36 36 VAL C C 36 171.451 171.451 176.166 -4.715 25567 6010 1 9 . 1 1 36 36 VAL CA C 36 59.537 59.537 61.300 -1.763 25567 6011 1 9 . 1 1 36 36 VAL CB C 36 29.689 29.689 32.892 -3.203 25567 6012 1 9 . 1 1 36 36 VAL H H 36 8.632 8.632 7.674 0.958 25567 6013 1 9 . 1 1 37 37 LYS N N 37 126.181 126.181 121.642 4.539 25567 6014 1 9 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.736 0.203 25567 6015 1 9 . 1 1 37 37 LYS CA C 37 52.179 52.179 53.675 -1.496 25567 6016 1 9 . 1 1 37 37 LYS CB C 37 32.898 32.898 36.615 -3.717 25567 6017 1 9 . 1 1 37 37 LYS H H 37 7.867 7.867 8.408 -0.541 25567 6018 1 9 . 1 1 38 38 VAL N N 38 113.540 113.540 116.427 -2.887 25567 6019 1 9 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.762 -0.076 25567 6020 1 9 . 1 1 38 38 VAL C C 38 173.633 173.633 175.739 -2.106 25567 6021 1 9 . 1 1 38 38 VAL CA C 38 57.284 57.284 60.141 -2.857 25567 6022 1 9 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.926 -1.962 25567 6023 1 9 . 1 1 38 38 VAL H H 38 8.389 8.389 8.535 -0.146 25567 6024 1 9 . 1 1 39 39 SER N N 39 118.860 118.860 117.358 1.502 25567 6025 1 9 . 1 1 39 39 SER HA H 39 4.194 4.194 4.736 -0.542 25567 6026 1 9 . 1 1 39 39 SER C C 39 173.059 173.059 173.797 -0.738 25567 6027 1 9 . 1 1 39 39 SER CA C 39 56.227 56.227 57.732 -1.505 25567 6028 1 9 . 1 1 39 39 SER CB C 39 60.771 60.771 64.565 -3.794 25567 6029 1 9 . 1 1 39 39 SER H H 39 8.668 8.668 8.288 0.380 25567 6030 1 9 . 1 1 40 40 GLU N N 40 125.769 125.769 119.616 6.153 25567 6031 1 9 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.588 -0.431 25567 6032 1 9 . 1 1 40 40 GLU C C 40 174.484 174.484 174.752 -0.268 25567 6033 1 9 . 1 1 40 40 GLU CA C 40 55.550 55.550 55.247 0.303 25567 6034 1 9 . 1 1 40 40 GLU CB C 40 27.054 27.054 31.796 -4.742 25567 6035 1 9 . 1 1 40 40 GLU H H 40 8.878 8.878 8.235 0.643 25567 6036 1 9 . 1 1 41 41 GLY N N 41 112.165 112.165 106.350 5.815 25567 6037 1 9 . 1 1 41 41 GLY CA C 41 42.707 42.707 46.142 -3.435 25567 6038 1 9 . 1 1 41 41 GLY H H 41 8.743 8.743 8.468 0.275 25567 6039 1 9 . 1 1 44 44 ASP N N 44 122.324 122.324 118.096 4.228 25567 6040 1 9 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.050 2.106 25567 6041 1 9 . 1 1 44 44 ASP H H 44 7.918 7.918 8.237 -0.319 25567 6042 1 9 . 1 1 45 45 ALA HA H 45 4.062 4.062 3.923 0.139 25567 6043 1 9 . 1 1 45 45 ALA CA C 45 51.410 51.410 53.058 -1.648 25567 6044 1 9 . 1 1 45 45 ALA CB C 45 16.376 16.376 17.948 -1.572 25567 6045 1 9 . 1 1 47 47 MET CA C 47 54.118 54.118 57.404 -3.286 25567 6046 1 9 . 1 1 47 47 MET CB C 47 27.527 27.527 34.273 -6.746 25567 6047 1 9 . 1 1 48 48 TYR N N 48 120.075 120.075 116.418 3.657 25567 6048 1 9 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.681 -0.527 25567 6049 1 9 . 1 1 48 48 TYR C C 48 172.217 172.217 175.597 -3.380 25567 6050 1 9 . 1 1 48 48 TYR CA C 48 57.377 57.377 58.686 -1.309 25567 6051 1 9 . 1 1 48 48 TYR CB C 48 34.496 34.496 39.877 -5.381 25567 6052 1 9 . 1 1 48 48 TYR H H 48 7.810 7.810 8.142 -0.332 25567 6053 1 9 . 1 1 49 49 LYS N N 49 118.369 118.369 120.336 -1.967 25567 6054 1 9 . 1 1 49 49 LYS H H 49 8.116 8.116 8.310 -0.194 25567 6055 1 9 . 1 1 50 50 THR N N 50 116.979 116.979 115.992 0.987 25567 6056 1 9 . 1 1 50 50 THR CB C 50 66.373 66.373 67.521 -1.148 25567 6057 1 9 . 1 1 50 50 THR H H 50 7.741 7.741 8.036 -0.295 25567 6058 1 9 . 1 1 51 51 SER N N 51 116.155 116.155 118.859 -2.704 25567 6059 1 9 . 1 1 51 51 SER HA H 51 3.771 3.771 4.735 -0.964 25567 6060 1 9 . 1 1 51 51 SER C C 51 170.563 170.563 173.745 -3.182 25567 6061 1 9 . 1 1 51 51 SER CA C 51 54.840 54.840 57.814 -2.974 25567 6062 1 9 . 1 1 51 51 SER CB C 51 60.318 60.318 65.069 -4.751 25567 6063 1 9 . 1 1 51 51 SER H H 51 7.853 7.853 7.753 0.100 25567 6064 1 9 . 1 1 54 54 ALA N N 54 123.234 123.234 121.376 1.858 25567 6065 1 9 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.642 -0.394 25567 6066 1 9 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.228 -0.960 25567 6067 1 9 . 1 1 54 54 ALA CB C 54 16.434 16.434 20.112 -3.678 25567 6068 1 9 . 1 1 54 54 ALA H H 54 8.207 8.207 8.153 0.054 25567 6069 1 9 . 1 1 55 55 LEU N N 55 118.603 118.603 119.799 -1.196 25567 6070 1 9 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.588 -0.648 25567 6071 1 9 . 1 1 55 55 LEU CA C 55 54.711 54.711 54.715 -0.005 25567 6072 1 9 . 1 1 55 55 LEU CB C 55 38.913 38.913 42.379 -3.466 25567 6073 1 9 . 1 1 55 55 LEU H H 55 7.960 7.960 8.087 -0.127 25567 6074 1 9 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.055 -0.379 25567 6075 1 9 . 1 1 58 58 ILE CA C 58 61.494 61.494 62.307 -0.813 25567 6076 1 9 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.595 -3.541 25567 6077 1 9 . 1 1 59 59 GLN N N 59 117.579 117.579 120.208 -2.629 25567 6078 1 9 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.477 -0.344 25567 6079 1 9 . 1 1 59 59 GLN CA C 59 54.009 54.009 54.995 -0.986 25567 6080 1 9 . 1 1 59 59 GLN CB C 59 26.651 26.651 29.171 -2.520 25567 6081 1 9 . 1 1 59 59 GLN H H 59 8.268 8.268 8.368 -0.100 25567 6082 1 9 . 1 1 60 60 GLY N N 60 107.308 107.308 112.439 -5.131 25567 6083 1 9 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.065 -2.086 25567 6084 1 9 . 1 1 60 60 GLY H H 60 7.780 7.780 8.833 -1.053 25567 6085 1 9 . 1 1 61 61 ASN N N 61 117.747 117.747 121.537 -3.790 25567 6086 1 9 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.826 -0.292 25567 6087 1 9 . 1 1 61 61 ASN CA C 61 51.235 51.235 53.002 -1.767 25567 6088 1 9 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.261 -2.837 25567 6089 1 9 . 1 1 61 61 ASN H H 61 8.108 8.108 8.295 -0.187 25567 6090 1 9 . 1 1 64 64 PHE N N 64 120.102 120.102 114.179 5.923 25567 6091 1 9 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.890 -0.511 25567 6092 1 9 . 1 1 64 64 PHE CA C 64 51.748 51.748 55.526 -3.777 25567 6093 1 9 . 1 1 64 64 PHE CB C 64 35.275 35.275 39.469 -4.194 25567 6094 1 9 . 1 1 64 64 PHE H H 64 8.300 8.300 7.403 0.897 25567 6095 1 9 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.598 -0.263 25567 6096 1 9 . 1 1 65 65 PRO C C 65 173.870 173.870 176.622 -2.752 25567 6097 1 9 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.688 -2.671 25567 6098 1 9 . 1 1 65 65 PRO CB C 65 29.635 29.635 33.078 -3.443 25567 6099 1 9 . 1 1 66 66 GLU N N 66 121.258 121.258 118.773 2.485 25567 6100 1 9 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.320 -0.086 25567 6101 1 9 . 1 1 66 66 GLU C C 66 173.981 173.981 176.146 -2.165 25567 6102 1 9 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.543 -2.756 25567 6103 1 9 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.801 -3.026 25567 6104 1 9 . 1 1 66 66 GLU H H 66 8.316 8.316 8.659 -0.343 25567 6105 1 9 . 1 1 67 67 ILE N N 67 114.290 114.290 114.162 0.128 25567 6106 1 9 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.860 0.269 25567 6107 1 9 . 1 1 67 67 ILE C C 67 172.700 172.700 174.896 -2.196 25567 6108 1 9 . 1 1 67 67 ILE CA C 67 56.439 56.439 58.953 -2.514 25567 6109 1 9 . 1 1 67 67 ILE CB C 67 39.159 39.159 41.382 -2.223 25567 6110 1 9 . 1 1 67 67 ILE H H 67 8.366 8.366 8.209 0.157 25567 6111 1 9 . 1 1 68 68 GLN N N 68 121.422 121.422 119.125 2.297 25567 6112 1 9 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.674 -0.173 25567 6113 1 9 . 1 1 68 68 GLN C C 68 171.675 171.675 174.362 -2.687 25567 6114 1 9 . 1 1 68 68 GLN CA C 68 52.273 52.273 55.141 -2.868 25567 6115 1 9 . 1 1 68 68 GLN CB C 68 27.143 27.143 32.273 -5.130 25567 6116 1 9 . 1 1 68 68 GLN H H 68 8.737 8.737 8.349 0.388 25567 6117 1 9 . 1 1 69 69 LEU N N 69 125.311 125.311 117.637 7.674 25567 6118 1 9 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.799 -0.293 25567 6119 1 9 . 1 1 69 69 LEU C C 69 172.634 172.634 174.923 -2.289 25567 6120 1 9 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.973 -2.214 25567 6121 1 9 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.562 -1.158 25567 6122 1 9 . 1 1 69 69 LEU H H 69 8.051 8.051 8.166 -0.115 25567 6123 1 9 . 1 1 70 70 ASP N N 70 122.763 122.763 120.142 2.621 25567 6124 1 9 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.598 -0.175 25567 6125 1 9 . 1 1 70 70 ASP CA C 70 51.610 51.610 54.318 -2.708 25567 6126 1 9 . 1 1 70 70 ASP CB C 70 38.717 38.717 41.930 -3.213 25567 6127 1 9 . 1 1 70 70 ASP H H 70 8.313 8.313 8.380 -0.067 25567 6128 1 9 . 1 1 71 71 ASN N N 71 117.413 117.413 118.593 -1.180 25567 6129 1 9 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.654 -0.317 25567 6130 1 9 . 1 1 71 71 ASN C C 71 171.770 171.770 174.441 -2.671 25567 6131 1 9 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.156 -1.665 25567 6132 1 9 . 1 1 71 71 ASN CB C 71 35.326 35.326 38.082 -2.756 25567 6133 1 9 . 1 1 71 71 ASN H H 71 8.407 8.407 8.486 -0.079 25567 6134 1 9 . 1 1 72 72 ILE N N 72 123.752 123.752 124.810 -1.058 25567 6135 1 9 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.151 -0.211 25567 6136 1 9 . 1 1 72 72 ILE C C 72 171.621 171.621 174.806 -3.185 25567 6137 1 9 . 1 1 72 72 ILE CA C 72 57.332 57.332 61.107 -3.775 25567 6138 1 9 . 1 1 72 72 ILE CB C 72 38.489 38.489 38.590 -0.101 25567 6139 1 9 . 1 1 72 72 ILE H H 72 7.639 7.639 7.583 0.056 25567 6140 1 9 . 1 1 73 73 ASP N N 73 125.252 125.252 126.806 -1.554 25567 6141 1 9 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.599 0.026 25567 6142 1 9 . 1 1 73 73 ASP C C 73 174.034 174.034 176.549 -2.515 25567 6143 1 9 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.757 -3.554 25567 6144 1 9 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.191 -5.167 25567 6145 1 9 . 1 1 73 73 ASP H H 73 8.394 8.394 8.691 -0.297 25567 6146 1 9 . 1 1 74 74 TYR N N 74 123.108 123.108 125.373 -2.265 25567 6147 1 9 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.362 -0.484 25567 6148 1 9 . 1 1 74 74 TYR C C 74 173.637 173.637 177.519 -3.882 25567 6149 1 9 . 1 1 74 74 TYR CA C 74 59.474 59.474 59.922 -0.449 25567 6150 1 9 . 1 1 74 74 TYR CB C 74 34.722 34.722 37.916 -3.193 25567 6151 1 9 . 1 1 74 74 TYR H H 74 7.392 7.392 8.549 -1.157 25567 6152 1 9 . 1 1 75 75 ASN N N 75 109.422 109.422 116.838 -7.416 25567 6153 1 9 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.690 0.236 25567 6154 1 9 . 1 1 75 75 ASN C C 75 172.574 172.574 176.140 -3.566 25567 6155 1 9 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.434 -2.673 25567 6156 1 9 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.317 -2.700 25567 6157 1 9 . 1 1 75 75 ASN H H 75 8.058 8.058 8.131 -0.073 25567 6158 1 9 . 1 1 76 76 ASN N N 76 117.422 117.422 116.125 1.297 25567 6159 1 9 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.502 -0.047 25567 6160 1 9 . 1 1 76 76 ASN C C 76 171.132 171.132 174.243 -3.111 25567 6161 1 9 . 1 1 76 76 ASN CA C 76 51.167 51.167 54.576 -3.409 25567 6162 1 9 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.714 -2.986 25567 6163 1 9 . 1 1 76 76 ASN H H 76 7.768 7.768 7.843 -0.075 25567 6164 1 9 . 1 1 77 77 TYR N N 77 116.873 116.873 115.008 1.865 25567 6165 1 9 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.568 -0.205 25567 6166 1 9 . 1 1 77 77 TYR C C 77 172.175 172.175 174.477 -2.302 25567 6167 1 9 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.955 -2.591 25567 6168 1 9 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.195 -4.030 25567 6169 1 9 . 1 1 77 77 TYR H H 77 7.825 7.825 7.705 0.120 25567 6170 1 9 . 1 1 78 78 ASP N N 78 121.271 121.271 118.816 2.455 25567 6171 1 9 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.940 -0.135 25567 6172 1 9 . 1 1 78 78 ASP C C 78 172.641 172.641 175.270 -2.629 25567 6173 1 9 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.946 -0.691 25567 6174 1 9 . 1 1 78 78 ASP CB C 78 41.075 41.075 44.309 -3.234 25567 6175 1 9 . 1 1 78 78 ASP H H 78 9.058 9.058 8.716 0.342 25567 6176 1 9 . 1 1 79 79 LEU N N 79 122.985 122.985 120.282 2.703 25567 6177 1 9 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.212 -0.098 25567 6178 1 9 . 1 1 79 79 LEU C C 79 170.721 170.721 174.993 -4.272 25567 6179 1 9 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.011 -2.695 25567 6180 1 9 . 1 1 79 79 LEU CB C 79 42.342 42.342 46.392 -4.051 25567 6181 1 9 . 1 1 79 79 LEU H H 79 7.893 7.893 8.183 -0.290 25567 6182 1 9 . 1 1 80 80 ILE N N 80 126.364 126.364 122.655 3.709 25567 6183 1 9 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.754 0.335 25567 6184 1 9 . 1 1 80 80 ILE C C 80 171.580 171.580 174.439 -2.859 25567 6185 1 9 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.345 -2.928 25567 6186 1 9 . 1 1 80 80 ILE CB C 80 38.136 38.136 40.393 -2.257 25567 6187 1 9 . 1 1 80 80 ILE H H 80 8.717 8.717 8.792 -0.075 25567 6188 1 9 . 1 1 81 81 LEU N N 81 126.199 126.199 128.068 -1.869 25567 6189 1 9 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.144 -0.009 25567 6190 1 9 . 1 1 81 81 LEU C C 81 172.979 172.979 175.783 -2.804 25567 6191 1 9 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.766 -4.133 25567 6192 1 9 . 1 1 81 81 LEU CB C 81 42.159 42.159 43.790 -1.631 25567 6193 1 9 . 1 1 81 81 LEU H H 81 9.230 9.230 9.085 0.145 25567 6194 1 9 . 1 1 82 82 ILE N N 82 120.505 120.505 122.169 -1.664 25567 6195 1 9 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.068 -0.152 25567 6196 1 9 . 1 1 82 82 ILE C C 82 173.011 173.011 174.527 -1.516 25567 6197 1 9 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.891 -3.063 25567 6198 1 9 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.560 -3.492 25567 6199 1 9 . 1 1 82 82 ILE H H 82 8.796 8.796 8.965 -0.169 25567 6200 1 9 . 1 1 83 83 GLY N N 83 120.857 120.857 113.394 7.463 25567 6201 1 9 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.382 -2.579 25567 6202 1 9 . 1 1 83 83 GLY H H 83 9.525 9.525 8.916 0.609 25567 6203 1 9 . 1 1 84 84 SER N N 84 116.007 116.007 117.359 -1.352 25567 6204 1 9 . 1 1 84 84 SER HA H 84 5.476 5.476 5.159 0.317 25567 6205 1 9 . 1 1 84 84 SER CA C 84 51.937 51.937 55.845 -3.908 25567 6206 1 9 . 1 1 84 84 SER CB C 84 64.533 64.533 64.715 -0.182 25567 6207 1 9 . 1 1 84 84 SER H H 84 7.617 7.617 7.640 -0.023 25567 6208 1 9 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.733 0.468 25567 6209 1 9 . 1 1 85 85 PRO C C 85 173.574 173.574 175.736 -2.162 25567 6210 1 9 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.416 -2.928 25567 6211 1 9 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.840 -1.700 25567 6212 1 9 . 1 1 86 86 VAL N N 86 117.603 117.603 116.557 1.046 25567 6213 1 9 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.514 -0.141 25567 6214 1 9 . 1 1 86 86 VAL C C 86 172.777 172.777 174.974 -2.197 25567 6215 1 9 . 1 1 86 86 VAL CA C 86 59.603 59.603 62.142 -2.539 25567 6216 1 9 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.247 -5.674 25567 6217 1 9 . 1 1 86 86 VAL H H 86 8.194 8.194 8.290 -0.096 25567 6218 1 9 . 1 1 87 87 TRP N N 87 131.187 131.187 123.337 7.850 25567 6219 1 9 . 1 1 87 87 TRP HA H 87 5.198 5.198 5.049 0.149 25567 6220 1 9 . 1 1 87 87 TRP C C 87 173.295 173.295 174.861 -1.566 25567 6221 1 9 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.149 -7.365 25567 6222 1 9 . 1 1 87 87 TRP CB C 87 27.746 27.746 32.493 -4.747 25567 6223 1 9 . 1 1 87 87 TRP H H 87 9.637 9.637 8.503 1.134 25567 6224 1 9 . 1 1 88 88 SER N N 88 119.829 119.829 110.868 8.961 25567 6225 1 9 . 1 1 88 88 SER HA H 88 3.986 3.986 4.782 -0.796 25567 6226 1 9 . 1 1 88 88 SER C C 88 172.375 172.375 174.275 -1.900 25567 6227 1 9 . 1 1 88 88 SER CA C 88 55.932 55.932 57.869 -1.937 25567 6228 1 9 . 1 1 88 88 SER CB C 88 59.178 59.178 65.707 -6.529 25567 6229 1 9 . 1 1 88 88 SER H H 88 9.272 9.272 7.971 1.301 25567 6230 1 9 . 1 1 89 89 GLY N N 89 101.498 101.498 110.614 -9.116 25567 6231 1 9 . 1 1 89 89 GLY CA C 89 42.671 42.671 45.736 -3.065 25567 6232 1 9 . 1 1 89 89 GLY H H 89 7.463 7.463 8.562 -1.099 25567 6233 1 9 . 1 1 90 90 TYR N N 90 121.064 121.064 117.492 3.572 25567 6234 1 9 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.082 -0.866 25567 6235 1 9 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.354 -0.264 25567 6236 1 9 . 1 1 90 90 TYR CB C 90 37.195 37.195 35.945 1.250 25567 6237 1 9 . 1 1 90 90 TYR H H 90 8.064 8.064 8.215 -0.151 25567 6238 1 9 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.567 0.365 25567 6239 1 9 . 1 1 91 91 PRO C C 91 171.019 171.019 177.038 -6.019 25567 6240 1 9 . 1 1 91 91 PRO CA C 91 58.994 58.994 64.587 -5.593 25567 6241 1 9 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.835 -6.342 25567 6242 1 9 . 1 1 92 92 ALA N N 92 119.893 119.893 122.368 -2.475 25567 6243 1 9 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.585 -1.134 25567 6244 1 9 . 1 1 92 92 ALA C C 92 176.477 176.477 177.358 -0.881 25567 6245 1 9 . 1 1 92 92 ALA CA C 92 49.567 49.567 52.104 -2.537 25567 6246 1 9 . 1 1 92 92 ALA CB C 92 15.801 15.801 20.090 -4.288 25567 6247 1 9 . 1 1 92 92 ALA H H 92 7.278 7.278 8.372 -1.094 25567 6248 1 9 . 1 1 93 93 THR N N 93 112.992 112.992 110.859 2.133 25567 6249 1 9 . 1 1 93 93 THR HA H 93 4.462 4.462 4.718 -0.256 25567 6250 1 9 . 1 1 93 93 THR CA C 93 66.871 66.871 59.713 7.158 25567 6251 1 9 . 1 1 93 93 THR CB C 93 64.362 64.362 68.281 -3.919 25567 6252 1 9 . 1 1 93 93 THR H H 93 6.861 6.861 8.178 -1.317 25567 6253 1 9 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.118 -0.252 25567 6254 1 9 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.450 -0.429 25567 6255 1 9 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.728 -2.449 25567 6256 1 9 . 1 1 95 95 ILE N N 95 111.298 111.298 119.134 -7.836 25567 6257 1 9 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.362 -0.739 25567 6258 1 9 . 1 1 95 95 ILE C C 95 174.264 174.264 175.143 -0.879 25567 6259 1 9 . 1 1 95 95 ILE CA C 95 57.448 57.448 58.857 -1.409 25567 6260 1 9 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.408 -4.479 25567 6261 1 9 . 1 1 95 95 ILE H H 95 7.974 7.974 8.006 -0.032 25567 6262 1 9 . 1 1 96 96 LYS N N 96 123.045 123.045 120.858 2.187 25567 6263 1 9 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.559 -1.447 25567 6264 1 9 . 1 1 96 96 LYS C C 96 174.590 174.590 177.690 -3.100 25567 6265 1 9 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.182 -0.037 25567 6266 1 9 . 1 1 96 96 LYS CB C 96 28.845 28.845 34.457 -5.612 25567 6267 1 9 . 1 1 96 96 LYS H H 96 6.958 6.958 7.420 -0.462 25567 6268 1 9 . 1 1 97 97 THR N N 97 113.412 113.412 116.360 -2.948 25567 6269 1 9 . 1 1 97 97 THR HA H 97 3.461 3.461 4.061 -0.600 25567 6270 1 9 . 1 1 97 97 THR C C 97 173.247 173.247 175.803 -2.556 25567 6271 1 9 . 1 1 97 97 THR CA C 97 62.809 62.809 65.870 -3.061 25567 6272 1 9 . 1 1 97 97 THR CB C 97 65.654 65.654 68.437 -2.783 25567 6273 1 9 . 1 1 97 97 THR H H 97 6.366 6.366 7.807 -1.441 25567 6274 1 9 . 1 1 98 98 LEU N N 98 121.201 121.201 121.729 -0.528 25567 6275 1 9 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.042 -0.408 25567 6276 1 9 . 1 1 98 98 LEU C C 98 174.590 174.590 178.922 -4.332 25567 6277 1 9 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.472 -1.851 25567 6278 1 9 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.954 -1.059 25567 6279 1 9 . 1 1 98 98 LEU H H 98 7.554 7.554 7.828 -0.274 25567 6280 1 9 . 1 1 99 99 LEU N N 99 118.677 118.677 118.603 0.074 25567 6281 1 9 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.916 -0.214 25567 6282 1 9 . 1 1 99 99 LEU C C 99 177.457 177.457 179.386 -1.929 25567 6283 1 9 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.337 -2.158 25567 6284 1 9 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.101 -1.113 25567 6285 1 9 . 1 1 99 99 LEU H H 99 8.160 8.160 7.894 0.266 25567 6286 1 9 . 1 1 100 100 ASP N N 100 118.914 118.914 118.228 0.686 25567 6287 1 9 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.393 -0.164 25567 6288 1 9 . 1 1 100 100 ASP C C 100 176.585 176.585 177.823 -1.238 25567 6289 1 9 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.956 -2.439 25567 6290 1 9 . 1 1 100 100 ASP CB C 100 37.579 37.579 40.971 -3.392 25567 6291 1 9 . 1 1 100 100 ASP H H 100 7.872 7.872 7.777 0.095 25567 6292 1 9 . 1 1 101 101 GLN N N 101 118.135 118.135 115.781 2.354 25567 6293 1 9 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.428 -0.268 25567 6294 1 9 . 1 1 101 101 GLN C C 101 174.601 174.601 176.647 -2.046 25567 6295 1 9 . 1 1 101 101 GLN CA C 101 54.960 54.960 56.383 -1.423 25567 6296 1 9 . 1 1 101 101 GLN CB C 101 25.550 25.550 30.176 -4.626 25567 6297 1 9 . 1 1 101 101 GLN H H 101 7.673 7.673 7.799 -0.126 25567 6298 1 9 . 1 1 102 102 MET N N 102 118.420 118.420 118.483 -0.063 25567 6299 1 9 . 1 1 102 102 MET HA H 102 3.826 3.826 4.595 -0.769 25567 6300 1 9 . 1 1 102 102 MET C C 102 172.780 172.780 176.241 -3.461 25567 6301 1 9 . 1 1 102 102 MET CA C 102 53.428 53.428 54.490 -1.062 25567 6302 1 9 . 1 1 102 102 MET CB C 102 31.221 31.221 32.429 -1.208 25567 6303 1 9 . 1 1 102 102 MET H H 102 7.462 7.462 7.569 -0.107 25567 6304 1 9 . 1 1 103 103 LYS N N 103 116.066 116.066 120.473 -4.407 25567 6305 1 9 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.271 -0.351 25567 6306 1 9 . 1 1 103 103 LYS C C 103 173.922 173.922 176.914 -2.992 25567 6307 1 9 . 1 1 103 103 LYS CA C 103 56.282 56.282 57.651 -1.369 25567 6308 1 9 . 1 1 103 103 LYS CB C 103 29.491 29.491 32.204 -2.713 25567 6309 1 9 . 1 1 103 103 LYS H H 103 6.875 6.875 8.568 -1.693 25567 6310 1 9 . 1 1 104 104 ASN N N 104 114.987 114.987 116.651 -1.664 25567 6311 1 9 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.910 -0.169 25567 6312 1 9 . 1 1 104 104 ASN C C 104 172.587 172.587 174.343 -1.756 25567 6313 1 9 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.599 -2.130 25567 6314 1 9 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.443 -3.621 25567 6315 1 9 . 1 1 104 104 ASN H H 104 8.517 8.517 8.413 0.104 25567 6316 1 9 . 1 1 105 105 TYR N N 105 122.755 122.755 120.037 2.718 25567 6317 1 9 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.707 -0.132 25567 6318 1 9 . 1 1 105 105 TYR C C 105 174.260 174.260 175.463 -1.203 25567 6319 1 9 . 1 1 105 105 TYR CA C 105 55.493 55.493 57.949 -2.456 25567 6320 1 9 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.727 -3.663 25567 6321 1 9 . 1 1 105 105 TYR H H 105 8.287 8.287 7.611 0.676 25567 6322 1 9 . 1 1 106 106 ARG N N 106 128.905 128.905 119.762 9.143 25567 6323 1 9 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.540 -0.267 25567 6324 1 9 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.817 -2.796 25567 6325 1 9 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.984 -3.854 25567 6326 1 9 . 1 1 106 106 ARG H H 106 8.841 8.841 8.784 0.057 25567 6327 1 9 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.575 -2.078 25567 6328 1 9 . 1 1 108 108 GLU N N 108 116.989 116.989 122.186 -5.197 25567 6329 1 9 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.624 0.007 25567 6330 1 9 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.321 -1.645 25567 6331 1 9 . 1 1 108 108 GLU CB C 108 30.402 30.402 32.095 -1.693 25567 6332 1 9 . 1 1 108 108 GLU H H 108 7.536 7.536 8.378 -0.842 25567 6333 1 9 . 1 1 109 109 VAL N N 109 123.416 123.416 127.786 -4.370 25567 6334 1 9 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.838 0.483 25567 6335 1 9 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.696 -3.253 25567 6336 1 9 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.292 -0.631 25567 6337 1 9 . 1 1 109 109 VAL H H 109 8.955 8.955 8.933 0.022 25567 6338 1 9 . 1 1 110 110 ALA N N 110 127.975 127.975 130.121 -2.146 25567 6339 1 9 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.045 -0.368 25567 6340 1 9 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.010 -1.569 25567 6341 1 9 . 1 1 110 110 ALA CB C 110 18.416 18.416 21.956 -3.541 25567 6342 1 9 . 1 1 110 110 ALA H H 110 8.860 8.860 8.434 0.426 25567 6343 1 9 . 1 1 111 111 SER N N 111 110.482 110.482 115.261 -4.779 25567 6344 1 9 . 1 1 111 111 SER HA H 111 5.502 5.502 5.539 -0.037 25567 6345 1 9 . 1 1 111 111 SER CA C 111 51.630 51.630 57.373 -5.743 25567 6346 1 9 . 1 1 111 111 SER CB C 111 62.267 62.267 65.450 -3.183 25567 6347 1 9 . 1 1 111 111 SER H H 111 7.484 7.484 7.878 -0.394 25567 6348 1 9 . 1 1 112 112 PHE N N 112 125.082 125.082 122.253 2.829 25567 6349 1 9 . 1 1 112 112 PHE HA H 112 6.448 6.448 6.067 0.381 25567 6350 1 9 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.456 -5.022 25567 6351 1 9 . 1 1 112 112 PHE CB C 112 40.500 40.500 41.707 -1.207 25567 6352 1 9 . 1 1 112 112 PHE H H 112 8.025 8.025 8.769 -0.744 25567 6353 1 9 . 1 1 113 113 PHE N N 113 115.872 115.872 119.635 -3.763 25567 6354 1 9 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.134 0.790 25567 6355 1 9 . 1 1 113 113 PHE C C 113 173.293 173.293 174.375 -1.082 25567 6356 1 9 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.348 -4.880 25567 6357 1 9 . 1 1 113 113 PHE CB C 113 38.393 38.393 42.381 -3.988 25567 6358 1 9 . 1 1 113 113 PHE H H 113 7.391 7.391 8.366 -0.975 25567 6359 1 9 . 1 1 114 114 THR N N 114 108.721 108.721 109.500 -0.779 25567 6360 1 9 . 1 1 114 114 THR HA H 114 4.933 4.933 4.363 0.570 25567 6361 1 9 . 1 1 114 114 THR C C 114 171.891 171.891 174.441 -2.550 25567 6362 1 9 . 1 1 114 114 THR CA C 114 56.815 56.815 61.843 -5.028 25567 6363 1 9 . 1 1 114 114 THR CB C 114 67.899 67.899 69.488 -1.589 25567 6364 1 9 . 1 1 114 114 THR H H 114 7.951 7.951 8.749 -0.798 25567 6365 1 9 . 1 1 115 115 SER N N 115 115.159 115.159 117.164 -2.005 25567 6366 1 9 . 1 1 115 115 SER HA H 115 4.608 4.608 4.687 -0.079 25567 6367 1 9 . 1 1 115 115 SER C C 115 171.403 171.403 174.037 -2.634 25567 6368 1 9 . 1 1 115 115 SER CA C 115 55.570 55.570 58.092 -2.522 25567 6369 1 9 . 1 1 115 115 SER CB C 115 61.418 61.418 63.539 -2.121 25567 6370 1 9 . 1 1 115 115 SER H H 115 8.229 8.229 8.148 0.081 25567 6371 1 9 . 1 1 116 116 ALA N N 116 127.211 127.211 124.246 2.965 25567 6372 1 9 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.915 -0.459 25567 6373 1 9 . 1 1 116 116 ALA C C 116 175.758 175.758 178.450 -2.692 25567 6374 1 9 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.653 -1.837 25567 6375 1 9 . 1 1 116 116 ALA CB C 116 16.831 16.831 17.420 -0.589 25567 6376 1 9 . 1 1 116 116 ALA H H 116 8.813 8.813 7.704 1.109 25567 6377 1 9 . 1 1 117 117 GLY N N 117 108.099 108.099 108.491 -0.392 25567 6378 1 9 . 1 1 117 117 GLY C C 117 171.805 171.805 175.415 -3.610 25567 6379 1 9 . 1 1 117 117 GLY CA C 117 42.869 42.869 46.843 -3.974 25567 6380 1 9 . 1 1 117 117 GLY H H 117 8.685 8.685 7.791 0.894 25567 6381 1 9 . 1 1 118 118 THR N N 118 111.284 111.284 112.307 -1.023 25567 6382 1 9 . 1 1 118 118 THR HA H 118 4.343 4.343 4.264 0.079 25567 6383 1 9 . 1 1 118 118 THR C C 118 171.769 171.769 172.948 -1.179 25567 6384 1 9 . 1 1 118 118 THR CA C 118 58.933 58.933 61.410 -2.477 25567 6385 1 9 . 1 1 118 118 THR CB C 118 67.304 67.304 69.708 -2.404 25567 6386 1 9 . 1 1 118 118 THR H H 118 7.998 7.998 8.075 -0.077 25567 6387 1 9 . 1 1 119 119 ASN N N 119 120.253 120.253 119.011 1.242 25567 6388 1 9 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.992 -0.289 25567 6389 1 9 . 1 1 119 119 ASN C C 119 172.353 172.353 173.516 -1.163 25567 6390 1 9 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.142 -2.914 25567 6391 1 9 . 1 1 119 119 ASN CB C 119 35.376 35.376 41.331 -5.955 25567 6392 1 9 . 1 1 119 119 ASN H H 119 8.381 8.381 7.832 0.549 25567 6393 1 9 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.645 -0.559 25567 6394 1 9 . 1 1 120 120 HIS C C 120 173.395 173.395 176.071 -2.676 25567 6395 1 9 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.265 -2.126 25567 6396 1 9 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.514 -3.092 25567 6397 1 9 . 1 1 121 121 LYS N N 121 119.527 119.527 119.637 -0.110 25567 6398 1 9 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.707 0.073 25567 6399 1 9 . 1 1 121 121 LYS C C 121 176.053 176.053 178.279 -2.226 25567 6400 1 9 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.837 -2.874 25567 6401 1 9 . 1 1 121 121 LYS CB C 121 29.660 29.660 32.272 -2.612 25567 6402 1 9 . 1 1 121 121 LYS H H 121 8.106 8.106 8.545 -0.439 25567 6403 1 9 . 1 1 122 122 ALA N N 122 121.585 121.585 121.001 0.584 25567 6404 1 9 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.657 0.064 25567 6405 1 9 . 1 1 122 122 ALA C C 122 175.128 175.128 178.632 -3.504 25567 6406 1 9 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.349 -2.758 25567 6407 1 9 . 1 1 122 122 ALA CB C 122 15.704 15.704 18.083 -2.379 25567 6408 1 9 . 1 1 122 122 ALA H H 122 7.702 7.702 8.166 -0.464 25567 6409 1 9 . 1 1 123 123 TYR N N 123 118.803 118.803 120.194 -1.391 25567 6410 1 9 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.159 -0.793 25567 6411 1 9 . 1 1 123 123 TYR CA C 123 60.091 60.091 60.912 -0.821 25567 6412 1 9 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.323 -3.221 25567 6413 1 9 . 1 1 123 123 TYR H H 123 7.366 7.366 7.625 -0.259 25567 6414 1 9 . 1 1 124 124 VAL N N 124 117.530 117.530 119.080 -1.550 25567 6415 1 9 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.530 -0.331 25567 6416 1 9 . 1 1 124 124 VAL C C 124 175.375 175.375 178.309 -2.934 25567 6417 1 9 . 1 1 124 124 VAL CA C 124 64.583 64.583 67.184 -2.601 25567 6418 1 9 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.392 -1.189 25567 6419 1 9 . 1 1 124 124 VAL H H 124 7.757 7.757 7.560 0.197 25567 6420 1 9 . 1 1 125 125 SER N N 125 114.023 114.023 115.501 -1.478 25567 6421 1 9 . 1 1 125 125 SER HA H 125 4.035 4.035 4.034 0.001 25567 6422 1 9 . 1 1 125 125 SER C C 125 174.636 174.636 176.843 -2.207 25567 6423 1 9 . 1 1 125 125 SER CA C 125 58.885 58.885 61.985 -3.100 25567 6424 1 9 . 1 1 125 125 SER CB C 125 59.666 59.666 62.785 -3.119 25567 6425 1 9 . 1 1 125 125 SER H H 125 7.622 7.622 7.788 -0.166 25567 6426 1 9 . 1 1 126 126 HIS N N 126 119.457 119.457 121.107 -1.650 25567 6427 1 9 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.169 0.027 25567 6428 1 9 . 1 1 126 126 HIS C C 126 172.942 172.942 177.513 -4.571 25567 6429 1 9 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.123 -3.205 25567 6430 1 9 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.543 -3.464 25567 6431 1 9 . 1 1 126 126 HIS H H 126 8.067 8.067 8.029 0.038 25567 6432 1 9 . 1 1 127 127 PHE N N 127 120.628 120.628 119.917 0.711 25567 6433 1 9 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.861 -0.662 25567 6434 1 9 . 1 1 127 127 PHE C C 127 173.515 173.515 177.638 -4.123 25567 6435 1 9 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.945 0.736 25567 6436 1 9 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.640 -2.273 25567 6437 1 9 . 1 1 127 127 PHE H H 127 9.083 9.083 8.269 0.814 25567 6438 1 9 . 1 1 128 128 ASN N N 128 114.858 114.858 118.737 -3.879 25567 6439 1 9 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.045 0.033 25567 6440 1 9 . 1 1 128 128 ASN C C 128 175.338 175.338 177.645 -2.307 25567 6441 1 9 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.204 -1.954 25567 6442 1 9 . 1 1 128 128 ASN CB C 128 36.021 36.021 37.944 -1.923 25567 6443 1 9 . 1 1 128 128 ASN H H 128 7.858 7.858 8.437 -0.579 25567 6444 1 9 . 1 1 129 129 GLU N N 129 119.811 119.811 118.895 0.916 25567 6445 1 9 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.097 -0.056 25567 6446 1 9 . 1 1 129 129 GLU C C 129 176.941 176.941 177.548 -0.607 25567 6447 1 9 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.841 -2.209 25567 6448 1 9 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.614 -2.676 25567 6449 1 9 . 1 1 129 129 GLU H H 129 7.569 7.569 8.166 -0.597 25567 6450 1 9 . 1 1 130 130 TRP N N 130 120.585 120.585 115.728 4.857 25567 6451 1 9 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.711 -0.239 25567 6452 1 9 . 1 1 130 130 TRP C C 130 174.262 174.262 175.606 -1.344 25567 6453 1 9 . 1 1 130 130 TRP CA C 130 54.673 54.673 55.521 -0.848 25567 6454 1 9 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.805 -2.849 25567 6455 1 9 . 1 1 130 130 TRP H H 130 7.964 7.964 7.360 0.604 25567 6456 1 9 . 1 1 131 131 ALA N N 131 120.522 120.522 118.866 1.656 25567 6457 1 9 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.378 -0.431 25567 6458 1 9 . 1 1 131 131 ALA C C 131 172.489 172.489 175.748 -3.259 25567 6459 1 9 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.922 -3.341 25567 6460 1 9 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.956 -3.417 25567 6461 1 9 . 1 1 131 131 ALA H H 131 8.114 8.114 7.608 0.506 25567 6462 1 9 . 1 1 132 132 ASP N N 132 117.666 117.666 120.708 -3.042 25567 6463 1 9 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.392 -0.186 25567 6464 1 9 . 1 1 132 132 ASP C C 132 173.779 173.779 176.337 -2.558 25567 6465 1 9 . 1 1 132 132 ASP CA C 132 54.313 54.313 54.798 -0.485 25567 6466 1 9 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.410 0.046 25567 6467 1 9 . 1 1 132 132 ASP H H 132 6.768 6.768 7.904 -1.136 25567 6468 1 9 . 1 1 133 133 GLY N N 133 114.922 114.922 111.599 3.323 25567 6469 1 9 . 1 1 133 133 GLY C C 133 172.101 172.101 174.286 -2.185 25567 6470 1 9 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.526 -3.017 25567 6471 1 9 . 1 1 133 133 GLY H H 133 8.645 8.645 8.211 0.434 25567 6472 1 9 . 1 1 134 134 LEU N N 134 120.101 120.101 122.995 -2.894 25567 6473 1 9 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.481 -0.019 25567 6474 1 9 . 1 1 134 134 LEU C C 134 174.098 174.098 176.685 -2.587 25567 6475 1 9 . 1 1 134 134 LEU CA C 134 51.084 51.084 54.115 -3.031 25567 6476 1 9 . 1 1 134 134 LEU CB C 134 40.509 40.509 41.993 -1.484 25567 6477 1 9 . 1 1 134 134 LEU H H 134 8.049 8.049 7.587 0.462 25567 6478 1 9 . 1 1 135 135 ASN N N 135 119.258 119.258 120.996 -1.738 25567 6479 1 9 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.598 0.041 25567 6480 1 9 . 1 1 135 135 ASN C C 135 170.564 170.564 174.741 -4.177 25567 6481 1 9 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.181 -3.928 25567 6482 1 9 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.079 -4.461 25567 6483 1 9 . 1 1 135 135 ASN H H 135 8.567 8.567 8.660 -0.093 25567 6484 1 9 . 1 1 136 136 VAL N N 136 125.460 125.460 126.140 -0.680 25567 6485 1 9 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.604 -0.008 25567 6486 1 9 . 1 1 136 136 VAL C C 136 175.318 175.318 176.514 -1.196 25567 6487 1 9 . 1 1 136 136 VAL CA C 136 58.722 58.722 62.880 -4.159 25567 6488 1 9 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.740 -3.441 25567 6489 1 9 . 1 1 136 136 VAL H H 136 7.660 7.660 8.279 -0.619 25567 6490 1 9 . 1 1 137 137 ILE N N 137 122.021 122.021 120.140 1.881 25567 6491 1 9 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.678 -0.250 25567 6492 1 9 . 1 1 137 137 ILE C C 137 173.943 173.943 174.841 -0.898 25567 6493 1 9 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.481 -0.523 25567 6494 1 9 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.834 -2.665 25567 6495 1 9 . 1 1 137 137 ILE H H 137 9.151 9.151 8.179 0.972 25567 6496 1 9 . 1 1 138 138 GLY N N 138 108.192 108.192 108.518 -0.326 25567 6497 1 9 . 1 1 138 138 GLY CA C 138 43.494 43.494 46.029 -2.535 25567 6498 1 9 . 1 1 138 138 GLY H H 138 6.675 6.675 7.359 -0.684 25567 6499 1 9 . 1 1 139 139 VAL N N 139 119.673 119.673 119.826 -0.153 25567 6500 1 9 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.739 0.581 25567 6501 1 9 . 1 1 139 139 VAL C C 139 172.291 172.291 175.490 -3.199 25567 6502 1 9 . 1 1 139 139 VAL CA C 139 58.209 58.209 62.142 -3.933 25567 6503 1 9 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.420 -0.781 25567 6504 1 9 . 1 1 139 139 VAL H H 139 8.158 8.158 8.634 -0.476 25567 6505 1 9 . 1 1 140 140 ALA N N 140 127.104 127.104 129.149 -2.045 25567 6506 1 9 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.202 -0.607 25567 6507 1 9 . 1 1 140 140 ALA C C 140 171.057 171.057 175.526 -4.469 25567 6508 1 9 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.070 -1.187 25567 6509 1 9 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.893 -1.465 25567 6510 1 9 . 1 1 140 140 ALA H H 140 9.145 9.145 9.052 0.093 25567 6511 1 9 . 1 1 141 141 ARG N N 141 118.828 118.828 120.590 -1.762 25567 6512 1 9 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.240 -1.500 25567 6513 1 9 . 1 1 141 141 ARG C C 141 173.524 173.524 177.022 -3.498 25567 6514 1 9 . 1 1 141 141 ARG CA C 141 51.886 51.886 56.102 -4.216 25567 6515 1 9 . 1 1 141 141 ARG CB C 141 28.454 28.454 31.085 -2.631 25567 6516 1 9 . 1 1 141 141 ARG H H 141 7.759 7.759 8.756 -0.997 25567 6517 1 9 . 1 1 142 142 ASP N N 142 125.557 125.557 122.956 2.601 25567 6518 1 9 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.171 -0.392 25567 6519 1 9 . 1 1 142 142 ASP C C 142 169.292 169.292 175.316 -6.024 25567 6520 1 9 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.766 -2.144 25567 6521 1 9 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.158 -3.079 25567 6522 1 9 . 1 1 142 142 ASP H H 142 9.087 9.087 8.903 0.184 25567 6523 1 9 . 1 1 143 143 ASP N N 143 119.094 119.094 118.266 0.828 25567 6524 1 9 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.572 -0.318 25567 6525 1 9 . 1 1 143 143 ASP C C 143 175.557 175.557 177.026 -1.469 25567 6526 1 9 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.267 -4.188 25567 6527 1 9 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.640 -4.198 25567 6528 1 9 . 1 1 143 143 ASP H H 143 8.175 8.175 8.505 -0.330 25567 6529 1 9 . 1 1 144 144 SER N N 144 115.438 115.438 116.312 -0.874 25567 6530 1 9 . 1 1 144 144 SER HA H 144 3.745 3.745 4.133 -0.388 25567 6531 1 9 . 1 1 144 144 SER C C 144 172.820 172.820 174.144 -1.324 25567 6532 1 9 . 1 1 144 144 SER CA C 144 59.336 59.336 59.916 -0.580 25567 6533 1 9 . 1 1 144 144 SER CB C 144 60.839 60.839 62.851 -2.012 25567 6534 1 9 . 1 1 144 144 SER H H 144 7.742 7.742 7.824 -0.082 25567 6535 1 9 . 1 1 145 145 GLU N N 145 119.631 119.631 117.844 1.787 25567 6536 1 9 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.130 0.189 25567 6537 1 9 . 1 1 145 145 GLU C C 145 171.927 171.927 176.746 -4.819 25567 6538 1 9 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.379 -3.295 25567 6539 1 9 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.588 -2.814 25567 6540 1 9 . 1 1 145 145 GLU H H 145 7.924 7.924 7.905 0.019 25567 6541 1 9 . 1 1 146 146 VAL N N 146 118.791 118.791 121.597 -2.806 25567 6542 1 9 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.606 -0.650 25567 6543 1 9 . 1 1 146 146 VAL C C 146 174.582 174.582 177.420 -2.838 25567 6544 1 9 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.556 -2.478 25567 6545 1 9 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.587 -2.447 25567 6546 1 9 . 1 1 146 146 VAL H H 146 6.393 6.393 7.214 -0.821 25567 6547 1 9 . 1 1 147 147 ASP N N 147 119.410 119.410 116.281 3.129 25567 6548 1 9 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.420 -0.350 25567 6549 1 9 . 1 1 147 147 ASP C C 147 174.774 174.774 176.172 -1.398 25567 6550 1 9 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.046 -1.724 25567 6551 1 9 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.115 -2.911 25567 6552 1 9 . 1 1 147 147 ASP H H 147 8.393 8.393 8.647 -0.254 25567 6553 1 9 . 1 1 148 148 LYS N N 148 119.422 119.422 114.557 4.865 25567 6554 1 9 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.570 -0.619 25567 6555 1 9 . 1 1 148 148 LYS C C 148 176.410 176.410 177.099 -0.689 25567 6556 1 9 . 1 1 148 148 LYS CA C 148 55.736 55.736 55.957 -0.221 25567 6557 1 9 . 1 1 148 148 LYS CB C 148 29.576 29.576 33.450 -3.874 25567 6558 1 9 . 1 1 148 148 LYS H H 148 7.078 7.078 7.379 -0.301 25567 6559 1 9 . 1 1 149 149 TRP N N 149 118.168 118.168 120.501 -2.333 25567 6560 1 9 . 1 1 149 149 TRP HA H 149 4.601 4.601 5.225 -0.624 25567 6561 1 9 . 1 1 149 149 TRP C C 149 174.199 174.199 176.470 -2.271 25567 6562 1 9 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.527 -1.732 25567 6563 1 9 . 1 1 149 149 TRP CB C 149 27.011 27.011 27.856 -0.845 25567 6564 1 9 . 1 1 149 149 TRP H H 149 7.914 7.914 7.784 0.130 25567 6565 1 9 . 1 1 150 150 SER N N 150 109.636 109.636 114.666 -5.030 25567 6566 1 9 . 1 1 150 150 SER HA H 150 4.242 4.242 4.521 -0.279 25567 6567 1 9 . 1 1 150 150 SER C C 150 170.173 170.173 173.710 -3.537 25567 6568 1 9 . 1 1 150 150 SER CA C 150 56.912 56.912 58.858 -1.946 25567 6569 1 9 . 1 1 150 150 SER CB C 150 62.087 62.087 64.060 -1.973 25567 6570 1 9 . 1 1 150 150 SER H H 150 7.814 7.814 7.805 0.009 25567 6571 1 10 . 1 1 2 2 MET HA H 2 4.416 4.416 4.849 -0.433 25567 6572 1 10 . 1 1 2 2 MET CA C 2 52.847 52.847 55.817 -2.970 25567 6573 1 10 . 1 1 2 2 MET CB C 2 30.672 30.672 32.587 -1.915 25567 6574 1 10 . 1 1 3 3 ALA N N 3 125.563 125.563 126.533 -0.970 25567 6575 1 10 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.488 -0.116 25567 6576 1 10 . 1 1 3 3 ALA C C 3 174.728 174.728 175.850 -1.122 25567 6577 1 10 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.789 -3.441 25567 6578 1 10 . 1 1 3 3 ALA CB C 3 16.935 16.935 19.963 -3.028 25567 6579 1 10 . 1 1 3 3 ALA H H 3 8.342 8.342 8.364 -0.022 25567 6580 1 10 . 1 1 4 4 LYS N N 4 121.767 121.767 122.273 -0.506 25567 6581 1 10 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.578 -0.348 25567 6582 1 10 . 1 1 4 4 LYS C C 4 174.577 174.577 176.101 -1.524 25567 6583 1 10 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.690 -1.701 25567 6584 1 10 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.466 -0.911 25567 6585 1 10 . 1 1 4 4 LYS H H 4 8.500 8.500 8.313 0.187 25567 6586 1 10 . 1 1 5 5 LYS N N 5 129.654 129.654 124.055 5.599 25567 6587 1 10 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.453 0.073 25567 6588 1 10 . 1 1 5 5 LYS C C 5 174.731 174.731 176.466 -1.735 25567 6589 1 10 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.963 -1.217 25567 6590 1 10 . 1 1 5 5 LYS CB C 5 29.894 29.894 34.030 -4.136 25567 6591 1 10 . 1 1 5 5 LYS H H 5 10.035 10.035 8.442 1.593 25567 6592 1 10 . 1 1 6 6 THR N N 6 126.212 126.212 115.037 11.175 25567 6593 1 10 . 1 1 6 6 THR HA H 6 5.654 5.654 5.326 0.328 25567 6594 1 10 . 1 1 6 6 THR C C 6 169.897 169.897 172.960 -3.063 25567 6595 1 10 . 1 1 6 6 THR CA C 6 60.647 60.647 61.605 -0.958 25567 6596 1 10 . 1 1 6 6 THR CB C 6 68.152 68.152 71.922 -3.770 25567 6597 1 10 . 1 1 6 6 THR H H 6 8.557 8.557 8.583 -0.026 25567 6598 1 10 . 1 1 7 7 LEU N N 7 130.776 130.776 126.557 4.219 25567 6599 1 10 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.759 -0.140 25567 6600 1 10 . 1 1 7 7 LEU CA C 7 50.096 50.096 52.709 -2.612 25567 6601 1 10 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.034 -4.991 25567 6602 1 10 . 1 1 7 7 LEU H H 7 8.610 8.610 8.591 0.019 25567 6603 1 10 . 1 1 8 8 ILE N N 8 127.175 127.175 124.030 3.145 25567 6604 1 10 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.881 -0.025 25567 6605 1 10 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.434 -3.042 25567 6606 1 10 . 1 1 8 8 ILE CB C 8 36.864 36.864 40.437 -3.572 25567 6607 1 10 . 1 1 8 8 ILE H H 8 9.263 9.263 8.027 1.236 25567 6608 1 10 . 1 1 9 9 LEU N N 9 127.117 127.117 128.669 -1.552 25567 6609 1 10 . 1 1 9 9 LEU HA H 9 5.696 5.696 4.940 0.756 25567 6610 1 10 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.382 -3.430 25567 6611 1 10 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.413 0.414 25567 6612 1 10 . 1 1 9 9 LEU H H 9 9.262 9.262 8.625 0.637 25567 6613 1 10 . 1 1 10 10 TYR N N 10 113.544 113.544 120.964 -7.420 25567 6614 1 10 . 1 1 10 10 TYR HA H 10 5.531 5.531 4.910 0.621 25567 6615 1 10 . 1 1 10 10 TYR CA C 10 52.829 52.829 54.973 -2.144 25567 6616 1 10 . 1 1 10 10 TYR CB C 10 38.615 38.615 38.532 0.083 25567 6617 1 10 . 1 1 10 10 TYR H H 10 7.425 7.425 8.139 -0.714 25567 6618 1 10 . 1 1 11 11 TYR N N 11 121.235 121.235 127.129 -5.894 25567 6619 1 10 . 1 1 11 11 TYR HA H 11 4.810 4.810 5.035 -0.225 25567 6620 1 10 . 1 1 11 11 TYR CA C 11 53.889 53.889 57.808 -3.919 25567 6621 1 10 . 1 1 11 11 TYR CB C 11 40.467 40.467 39.838 0.629 25567 6622 1 10 . 1 1 11 11 TYR H H 11 7.781 7.781 8.111 -0.330 25567 6623 1 10 . 1 1 14 14 SER CA C 14 54.675 54.675 58.313 -3.638 25567 6624 1 10 . 1 1 14 14 SER CB C 14 61.621 61.621 63.917 -2.296 25567 6625 1 10 . 1 1 15 15 GLY N N 15 110.420 110.420 108.266 2.154 25567 6626 1 10 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.578 -1.851 25567 6627 1 10 . 1 1 15 15 GLY H H 15 7.757 7.757 8.350 -0.593 25567 6628 1 10 . 1 1 17 17 THR HA H 17 4.122 4.122 4.281 -0.159 25567 6629 1 10 . 1 1 17 17 THR CA C 17 64.748 64.748 63.574 1.174 25567 6630 1 10 . 1 1 17 17 THR CB C 17 64.532 64.532 68.839 -4.307 25567 6631 1 10 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.881 -0.963 25567 6632 1 10 . 1 1 18 18 LYS C C 18 173.812 173.812 178.300 -4.488 25567 6633 1 10 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.113 -2.110 25567 6634 1 10 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.535 -2.767 25567 6635 1 10 . 1 1 19 19 LYS N N 19 116.699 116.699 118.528 -1.829 25567 6636 1 10 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.022 -0.074 25567 6637 1 10 . 1 1 19 19 LYS C C 19 177.221 177.221 178.471 -1.250 25567 6638 1 10 . 1 1 19 19 LYS CA C 19 56.421 56.421 59.032 -2.611 25567 6639 1 10 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.470 -2.836 25567 6640 1 10 . 1 1 19 19 LYS H H 19 7.476 7.476 7.417 0.059 25567 6641 1 10 . 1 1 20 20 MET N N 20 118.946 118.946 114.978 3.968 25567 6642 1 10 . 1 1 20 20 MET HA H 20 4.474 4.474 4.261 0.213 25567 6643 1 10 . 1 1 20 20 MET C C 20 173.826 173.826 175.564 -1.738 25567 6644 1 10 . 1 1 20 20 MET CA C 20 52.285 52.285 55.864 -3.579 25567 6645 1 10 . 1 1 20 20 MET CB C 20 26.921 26.921 30.662 -3.741 25567 6646 1 10 . 1 1 20 20 MET H H 20 7.457 7.457 8.421 -0.964 25567 6647 1 10 . 1 1 21 21 ALA N N 21 123.375 123.375 119.886 3.489 25567 6648 1 10 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.728 -1.176 25567 6649 1 10 . 1 1 21 21 ALA C C 21 176.542 176.542 178.680 -2.138 25567 6650 1 10 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.270 -0.619 25567 6651 1 10 . 1 1 21 21 ALA CB C 21 16.282 16.282 20.044 -3.762 25567 6652 1 10 . 1 1 21 21 ALA H H 21 8.549 8.549 8.051 0.498 25567 6653 1 10 . 1 1 22 22 GLU N N 22 116.906 116.906 119.909 -3.003 25567 6654 1 10 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.160 -0.487 25567 6655 1 10 . 1 1 22 22 GLU C C 22 176.658 176.658 179.318 -2.660 25567 6656 1 10 . 1 1 22 22 GLU CA C 22 56.605 56.605 58.877 -2.272 25567 6657 1 10 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.826 -3.177 25567 6658 1 10 . 1 1 22 22 GLU H H 22 8.085 8.085 7.919 0.166 25567 6659 1 10 . 1 1 23 23 LYS N N 23 123.301 123.301 120.233 3.068 25567 6660 1 10 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.045 -0.225 25567 6661 1 10 . 1 1 23 23 LYS C C 23 177.363 177.363 179.140 -1.777 25567 6662 1 10 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.349 -2.378 25567 6663 1 10 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.336 -2.805 25567 6664 1 10 . 1 1 23 23 LYS H H 23 7.703 7.703 8.128 -0.425 25567 6665 1 10 . 1 1 24 24 ILE N N 24 121.894 121.894 120.108 1.786 25567 6666 1 10 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.500 -0.204 25567 6667 1 10 . 1 1 24 24 ILE C C 24 174.944 174.944 177.481 -2.537 25567 6668 1 10 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.829 -1.596 25567 6669 1 10 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.360 -2.616 25567 6670 1 10 . 1 1 24 24 ILE H H 24 8.458 8.458 7.744 0.714 25567 6671 1 10 . 1 1 25 25 ASN N N 25 118.580 118.580 116.651 1.929 25567 6672 1 10 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.371 -0.137 25567 6673 1 10 . 1 1 25 25 ASN C C 25 173.567 173.567 176.610 -3.043 25567 6674 1 10 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.124 -3.800 25567 6675 1 10 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.870 -0.687 25567 6676 1 10 . 1 1 25 25 ASN H H 25 8.273 8.273 8.466 -0.193 25567 6677 1 10 . 1 1 26 26 SER N N 26 112.132 112.132 112.230 -0.098 25567 6678 1 10 . 1 1 26 26 SER HA H 26 4.148 4.148 4.416 -0.268 25567 6679 1 10 . 1 1 26 26 SER C C 26 172.083 172.083 175.214 -3.131 25567 6680 1 10 . 1 1 26 26 SER CA C 26 57.865 57.865 59.543 -1.678 25567 6681 1 10 . 1 1 26 26 SER CB C 26 60.816 60.816 63.578 -2.762 25567 6682 1 10 . 1 1 26 26 SER H H 26 7.444 7.444 7.752 -0.308 25567 6683 1 10 . 1 1 27 27 GLU N N 27 120.080 120.080 118.911 1.169 25567 6684 1 10 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.225 -0.125 25567 6685 1 10 . 1 1 27 27 GLU C C 27 173.647 173.647 177.103 -3.456 25567 6686 1 10 . 1 1 27 27 GLU CA C 27 54.202 54.202 57.190 -2.988 25567 6687 1 10 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.369 -3.485 25567 6688 1 10 . 1 1 27 27 GLU H H 27 7.453 7.453 7.648 -0.195 25567 6689 1 10 . 1 1 28 28 ILE N N 28 118.759 118.759 119.889 -1.130 25567 6690 1 10 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.261 -0.057 25567 6691 1 10 . 1 1 28 28 ILE C C 28 172.474 172.474 175.269 -2.795 25567 6692 1 10 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.234 -2.487 25567 6693 1 10 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.232 -4.434 25567 6694 1 10 . 1 1 28 28 ILE H H 28 7.258 7.258 7.324 -0.066 25567 6695 1 10 . 1 1 29 29 LYS N N 29 130.618 130.618 126.511 4.107 25567 6696 1 10 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.343 -0.338 25567 6697 1 10 . 1 1 29 29 LYS C C 29 174.375 174.375 177.100 -2.725 25567 6698 1 10 . 1 1 29 29 LYS CA C 29 55.659 55.659 56.903 -1.244 25567 6699 1 10 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.999 -3.439 25567 6700 1 10 . 1 1 29 29 LYS H H 29 8.588 8.588 8.640 -0.052 25567 6701 1 10 . 1 1 30 30 ASP N N 30 119.366 119.366 119.764 -0.398 25567 6702 1 10 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.391 0.011 25567 6703 1 10 . 1 1 30 30 ASP C C 30 172.580 172.580 176.365 -3.785 25567 6704 1 10 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.585 -1.961 25567 6705 1 10 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.848 -4.020 25567 6706 1 10 . 1 1 30 30 ASP H H 30 8.940 8.940 8.812 0.128 25567 6707 1 10 . 1 1 31 31 SER N N 31 114.035 114.035 114.196 -0.161 25567 6708 1 10 . 1 1 31 31 SER HA H 31 4.781 4.781 4.835 -0.054 25567 6709 1 10 . 1 1 31 31 SER C C 31 171.136 171.136 174.840 -3.704 25567 6710 1 10 . 1 1 31 31 SER CA C 31 55.638 55.638 59.825 -4.186 25567 6711 1 10 . 1 1 31 31 SER CB C 31 62.388 62.388 64.159 -1.771 25567 6712 1 10 . 1 1 31 31 SER H H 31 8.030 8.030 7.828 0.202 25567 6713 1 10 . 1 1 32 32 GLU N N 32 121.406 121.406 120.041 1.365 25567 6714 1 10 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.702 0.033 25567 6715 1 10 . 1 1 32 32 GLU C C 32 171.205 171.205 174.416 -3.211 25567 6716 1 10 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.005 -2.936 25567 6717 1 10 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.691 -2.801 25567 6718 1 10 . 1 1 32 32 GLU H H 32 8.188 8.188 8.256 -0.068 25567 6719 1 10 . 1 1 33 33 LEU N N 33 126.143 126.143 118.495 7.648 25567 6720 1 10 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.348 -0.063 25567 6721 1 10 . 1 1 33 33 LEU C C 33 173.401 173.401 175.258 -1.857 25567 6722 1 10 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.077 -1.743 25567 6723 1 10 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.918 -1.295 25567 6724 1 10 . 1 1 33 33 LEU H H 33 8.627 8.627 8.381 0.246 25567 6725 1 10 . 1 1 34 34 LYS N N 34 127.122 127.122 122.997 4.125 25567 6726 1 10 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.492 0.107 25567 6727 1 10 . 1 1 34 34 LYS C C 34 169.644 169.644 173.810 -4.166 25567 6728 1 10 . 1 1 34 34 LYS CA C 34 52.353 52.353 53.938 -1.585 25567 6729 1 10 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.141 -2.969 25567 6730 1 10 . 1 1 34 34 LYS H H 34 9.399 9.399 8.992 0.407 25567 6731 1 10 . 1 1 35 35 GLU N N 35 122.766 122.766 122.400 0.366 25567 6732 1 10 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.179 -0.821 25567 6733 1 10 . 1 1 35 35 GLU C C 35 172.875 172.875 175.560 -2.685 25567 6734 1 10 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.656 -3.016 25567 6735 1 10 . 1 1 35 35 GLU CB C 35 29.268 29.268 30.967 -1.699 25567 6736 1 10 . 1 1 35 35 GLU H H 35 8.166 8.166 8.119 0.047 25567 6737 1 10 . 1 1 36 36 VAL N N 36 126.674 126.674 120.143 6.531 25567 6738 1 10 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.649 -0.788 25567 6739 1 10 . 1 1 36 36 VAL C C 36 171.451 171.451 175.447 -3.996 25567 6740 1 10 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.426 -0.889 25567 6741 1 10 . 1 1 36 36 VAL CB C 36 29.689 29.689 34.709 -5.019 25567 6742 1 10 . 1 1 36 36 VAL H H 36 8.632 8.632 8.390 0.242 25567 6743 1 10 . 1 1 37 37 LYS N N 37 126.181 126.181 124.334 1.847 25567 6744 1 10 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.944 -0.005 25567 6745 1 10 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.890 -2.711 25567 6746 1 10 . 1 1 37 37 LYS CB C 37 32.898 32.898 34.982 -2.084 25567 6747 1 10 . 1 1 37 37 LYS H H 37 7.867 7.867 9.263 -1.396 25567 6748 1 10 . 1 1 38 38 VAL N N 38 113.540 113.540 116.305 -2.765 25567 6749 1 10 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.522 0.164 25567 6750 1 10 . 1 1 38 38 VAL C C 38 173.633 173.633 175.060 -1.427 25567 6751 1 10 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.012 -1.728 25567 6752 1 10 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.931 -1.967 25567 6753 1 10 . 1 1 38 38 VAL H H 38 8.389 8.389 8.269 0.120 25567 6754 1 10 . 1 1 39 39 SER N N 39 118.860 118.860 118.490 0.370 25567 6755 1 10 . 1 1 39 39 SER HA H 39 4.194 4.194 4.731 -0.537 25567 6756 1 10 . 1 1 39 39 SER C C 39 173.059 173.059 174.339 -1.280 25567 6757 1 10 . 1 1 39 39 SER CA C 39 56.227 56.227 58.001 -1.774 25567 6758 1 10 . 1 1 39 39 SER CB C 39 60.771 60.771 64.190 -3.419 25567 6759 1 10 . 1 1 39 39 SER H H 39 8.668 8.668 8.266 0.402 25567 6760 1 10 . 1 1 40 40 GLU N N 40 125.769 125.769 122.558 3.211 25567 6761 1 10 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.417 -0.260 25567 6762 1 10 . 1 1 40 40 GLU C C 40 174.484 174.484 176.556 -2.072 25567 6763 1 10 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.787 -1.237 25567 6764 1 10 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.473 -3.419 25567 6765 1 10 . 1 1 40 40 GLU H H 40 8.878 8.878 8.607 0.271 25567 6766 1 10 . 1 1 41 41 GLY N N 41 112.165 112.165 108.626 3.539 25567 6767 1 10 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.156 -1.449 25567 6768 1 10 . 1 1 41 41 GLY H H 41 8.743 8.743 8.391 0.352 25567 6769 1 10 . 1 1 44 44 ASP N N 44 122.324 122.324 118.570 3.754 25567 6770 1 10 . 1 1 44 44 ASP CB C 44 42.156 42.156 43.175 -1.019 25567 6771 1 10 . 1 1 44 44 ASP H H 44 7.918 7.918 8.354 -0.436 25567 6772 1 10 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.651 -0.589 25567 6773 1 10 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.473 -1.063 25567 6774 1 10 . 1 1 45 45 ALA CB C 45 16.376 16.376 21.274 -4.898 25567 6775 1 10 . 1 1 47 47 MET CA C 47 54.118 54.118 54.590 -0.472 25567 6776 1 10 . 1 1 47 47 MET CB C 47 27.527 27.527 35.163 -7.636 25567 6777 1 10 . 1 1 48 48 TYR N N 48 120.075 120.075 119.413 0.662 25567 6778 1 10 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.423 -0.269 25567 6779 1 10 . 1 1 48 48 TYR C C 48 172.217 172.217 176.522 -4.305 25567 6780 1 10 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.637 -2.260 25567 6781 1 10 . 1 1 48 48 TYR CB C 48 34.496 34.496 38.488 -3.992 25567 6782 1 10 . 1 1 48 48 TYR H H 48 7.810 7.810 8.429 -0.619 25567 6783 1 10 . 1 1 49 49 LYS N N 49 118.369 118.369 119.849 -1.480 25567 6784 1 10 . 1 1 49 49 LYS H H 49 8.116 8.116 8.710 -0.594 25567 6785 1 10 . 1 1 50 50 THR N N 50 116.979 116.979 116.848 0.131 25567 6786 1 10 . 1 1 50 50 THR CB C 50 66.373 66.373 68.813 -2.440 25567 6787 1 10 . 1 1 50 50 THR H H 50 7.741 7.741 8.025 -0.284 25567 6788 1 10 . 1 1 51 51 SER N N 51 116.155 116.155 117.162 -1.007 25567 6789 1 10 . 1 1 51 51 SER HA H 51 3.771 3.771 4.813 -1.042 25567 6790 1 10 . 1 1 51 51 SER C C 51 170.563 170.563 174.047 -3.484 25567 6791 1 10 . 1 1 51 51 SER CA C 51 54.840 54.840 57.966 -3.126 25567 6792 1 10 . 1 1 51 51 SER CB C 51 60.318 60.318 64.480 -4.162 25567 6793 1 10 . 1 1 51 51 SER H H 51 7.853 7.853 7.815 0.038 25567 6794 1 10 . 1 1 54 54 ALA N N 54 123.234 123.234 120.156 3.078 25567 6795 1 10 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.053 0.195 25567 6796 1 10 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.363 -1.095 25567 6797 1 10 . 1 1 54 54 ALA CB C 54 16.434 16.434 18.454 -2.020 25567 6798 1 10 . 1 1 54 54 ALA H H 54 8.207 8.207 8.243 -0.036 25567 6799 1 10 . 1 1 55 55 LEU N N 55 118.603 118.603 123.267 -4.664 25567 6800 1 10 . 1 1 55 55 LEU HA H 55 3.940 3.940 3.911 0.029 25567 6801 1 10 . 1 1 55 55 LEU CA C 55 54.711 54.711 56.199 -1.488 25567 6802 1 10 . 1 1 55 55 LEU CB C 55 38.913 38.913 42.093 -3.179 25567 6803 1 10 . 1 1 55 55 LEU H H 55 7.960 7.960 8.555 -0.595 25567 6804 1 10 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.111 -0.435 25567 6805 1 10 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.536 -0.042 25567 6806 1 10 . 1 1 58 58 ILE CB C 58 36.054 36.054 40.030 -3.976 25567 6807 1 10 . 1 1 59 59 GLN N N 59 117.579 117.579 120.111 -2.532 25567 6808 1 10 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.518 -0.385 25567 6809 1 10 . 1 1 59 59 GLN CA C 59 54.009 54.009 54.790 -0.781 25567 6810 1 10 . 1 1 59 59 GLN CB C 59 26.651 26.651 29.313 -2.662 25567 6811 1 10 . 1 1 59 59 GLN H H 59 8.268 8.268 7.915 0.353 25567 6812 1 10 . 1 1 60 60 GLY N N 60 107.308 107.308 112.162 -4.854 25567 6813 1 10 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.421 -2.442 25567 6814 1 10 . 1 1 60 60 GLY H H 60 7.780 7.780 8.674 -0.894 25567 6815 1 10 . 1 1 61 61 ASN N N 61 117.747 117.747 118.961 -1.214 25567 6816 1 10 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.859 -0.325 25567 6817 1 10 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.515 -1.280 25567 6818 1 10 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.655 -3.231 25567 6819 1 10 . 1 1 61 61 ASN H H 61 8.108 8.108 8.119 -0.011 25567 6820 1 10 . 1 1 64 64 PHE N N 64 120.102 120.102 119.695 0.407 25567 6821 1 10 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.393 -0.014 25567 6822 1 10 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.000 -2.252 25567 6823 1 10 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.259 -2.984 25567 6824 1 10 . 1 1 64 64 PHE H H 64 8.300 8.300 7.768 0.532 25567 6825 1 10 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.422 -0.087 25567 6826 1 10 . 1 1 65 65 PRO C C 65 173.870 173.870 176.271 -2.401 25567 6827 1 10 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.859 -2.842 25567 6828 1 10 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.300 -2.664 25567 6829 1 10 . 1 1 66 66 GLU N N 66 121.258 121.258 120.455 0.803 25567 6830 1 10 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.292 -0.058 25567 6831 1 10 . 1 1 66 66 GLU C C 66 173.981 173.981 176.289 -2.308 25567 6832 1 10 . 1 1 66 66 GLU CA C 66 53.787 53.787 57.066 -3.279 25567 6833 1 10 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.659 -2.884 25567 6834 1 10 . 1 1 66 66 GLU H H 66 8.316 8.316 8.565 -0.249 25567 6835 1 10 . 1 1 67 67 ILE N N 67 114.290 114.290 115.606 -1.316 25567 6836 1 10 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.584 0.545 25567 6837 1 10 . 1 1 67 67 ILE C C 67 172.700 172.700 175.301 -2.601 25567 6838 1 10 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.285 -2.846 25567 6839 1 10 . 1 1 67 67 ILE CB C 67 39.159 39.159 40.966 -1.807 25567 6840 1 10 . 1 1 67 67 ILE H H 67 8.366 8.366 8.002 0.364 25567 6841 1 10 . 1 1 68 68 GLN N N 68 121.422 121.422 118.436 2.986 25567 6842 1 10 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.833 -0.332 25567 6843 1 10 . 1 1 68 68 GLN C C 68 171.675 171.675 173.897 -2.222 25567 6844 1 10 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.827 -2.554 25567 6845 1 10 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.108 -5.965 25567 6846 1 10 . 1 1 68 68 GLN H H 68 8.737 8.737 8.425 0.312 25567 6847 1 10 . 1 1 69 69 LEU N N 69 125.311 125.311 118.109 7.202 25567 6848 1 10 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.910 -0.404 25567 6849 1 10 . 1 1 69 69 LEU C C 69 172.634 172.634 175.309 -2.675 25567 6850 1 10 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.558 -1.799 25567 6851 1 10 . 1 1 69 69 LEU CB C 69 42.404 42.404 44.021 -1.617 25567 6852 1 10 . 1 1 69 69 LEU H H 69 8.051 8.051 8.126 -0.075 25567 6853 1 10 . 1 1 70 70 ASP N N 70 122.763 122.763 119.186 3.577 25567 6854 1 10 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.569 -0.146 25567 6855 1 10 . 1 1 70 70 ASP CA C 70 51.610 51.610 54.287 -2.677 25567 6856 1 10 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.018 -3.301 25567 6857 1 10 . 1 1 70 70 ASP H H 70 8.313 8.313 8.627 -0.314 25567 6858 1 10 . 1 1 71 71 ASN N N 71 117.413 117.413 118.874 -1.461 25567 6859 1 10 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.689 -0.352 25567 6860 1 10 . 1 1 71 71 ASN C C 71 171.770 171.770 174.703 -2.933 25567 6861 1 10 . 1 1 71 71 ASN CA C 71 51.491 51.491 52.964 -1.473 25567 6862 1 10 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.580 -2.254 25567 6863 1 10 . 1 1 71 71 ASN H H 71 8.407 8.407 8.480 -0.073 25567 6864 1 10 . 1 1 72 72 ILE N N 72 123.752 123.752 123.290 0.462 25567 6865 1 10 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.133 -0.193 25567 6866 1 10 . 1 1 72 72 ILE C C 72 171.621 171.621 175.848 -4.227 25567 6867 1 10 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.958 -3.626 25567 6868 1 10 . 1 1 72 72 ILE CB C 72 38.489 38.489 38.896 -0.407 25567 6869 1 10 . 1 1 72 72 ILE H H 72 7.639 7.639 7.487 0.152 25567 6870 1 10 . 1 1 73 73 ASP N N 73 125.252 125.252 121.442 3.810 25567 6871 1 10 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.578 0.047 25567 6872 1 10 . 1 1 73 73 ASP C C 73 174.034 174.034 175.869 -1.835 25567 6873 1 10 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.735 -3.532 25567 6874 1 10 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.997 -4.973 25567 6875 1 10 . 1 1 73 73 ASP H H 73 8.394 8.394 8.288 0.106 25567 6876 1 10 . 1 1 74 74 TYR N N 74 123.108 123.108 124.695 -1.587 25567 6877 1 10 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.687 -0.809 25567 6878 1 10 . 1 1 74 74 TYR C C 74 173.637 173.637 177.189 -3.552 25567 6879 1 10 . 1 1 74 74 TYR CA C 74 59.474 59.474 58.783 0.691 25567 6880 1 10 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.451 -3.729 25567 6881 1 10 . 1 1 74 74 TYR H H 74 7.392 7.392 8.527 -1.135 25567 6882 1 10 . 1 1 75 75 ASN N N 75 109.422 109.422 115.834 -6.412 25567 6883 1 10 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.736 0.190 25567 6884 1 10 . 1 1 75 75 ASN C C 75 172.574 172.574 175.596 -3.022 25567 6885 1 10 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.315 -2.554 25567 6886 1 10 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.915 -3.298 25567 6887 1 10 . 1 1 75 75 ASN H H 75 8.058 8.058 8.698 -0.640 25567 6888 1 10 . 1 1 76 76 ASN N N 76 117.422 117.422 116.266 1.156 25567 6889 1 10 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.525 -0.070 25567 6890 1 10 . 1 1 76 76 ASN C C 76 171.132 171.132 175.013 -3.881 25567 6891 1 10 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.767 -2.600 25567 6892 1 10 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.412 -2.684 25567 6893 1 10 . 1 1 76 76 ASN H H 76 7.768 7.768 7.924 -0.156 25567 6894 1 10 . 1 1 77 77 TYR N N 77 116.873 116.873 117.294 -0.421 25567 6895 1 10 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.562 -0.199 25567 6896 1 10 . 1 1 77 77 TYR C C 77 172.175 172.175 174.363 -2.188 25567 6897 1 10 . 1 1 77 77 TYR CA C 77 55.364 55.364 58.520 -3.156 25567 6898 1 10 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.529 -3.364 25567 6899 1 10 . 1 1 77 77 TYR H H 77 7.825 7.825 7.541 0.284 25567 6900 1 10 . 1 1 78 78 ASP N N 78 121.271 121.271 118.797 2.474 25567 6901 1 10 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.938 -0.133 25567 6902 1 10 . 1 1 78 78 ASP C C 78 172.641 172.641 175.587 -2.946 25567 6903 1 10 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.362 -0.107 25567 6904 1 10 . 1 1 78 78 ASP CB C 78 41.075 41.075 43.766 -2.691 25567 6905 1 10 . 1 1 78 78 ASP H H 78 9.058 9.058 8.634 0.424 25567 6906 1 10 . 1 1 79 79 LEU N N 79 122.985 122.985 119.082 3.903 25567 6907 1 10 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.203 -0.089 25567 6908 1 10 . 1 1 79 79 LEU C C 79 170.721 170.721 174.409 -3.688 25567 6909 1 10 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.472 -3.156 25567 6910 1 10 . 1 1 79 79 LEU CB C 79 42.342 42.342 46.526 -4.184 25567 6911 1 10 . 1 1 79 79 LEU H H 79 7.893 7.893 7.848 0.045 25567 6912 1 10 . 1 1 80 80 ILE N N 80 126.364 126.364 121.301 5.063 25567 6913 1 10 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.823 0.266 25567 6914 1 10 . 1 1 80 80 ILE C C 80 171.580 171.580 174.171 -2.591 25567 6915 1 10 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.031 -2.614 25567 6916 1 10 . 1 1 80 80 ILE CB C 80 38.136 38.136 41.792 -3.656 25567 6917 1 10 . 1 1 80 80 ILE H H 80 8.717 8.717 8.508 0.209 25567 6918 1 10 . 1 1 81 81 LEU N N 81 126.199 126.199 125.205 0.994 25567 6919 1 10 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.347 -0.212 25567 6920 1 10 . 1 1 81 81 LEU C C 81 172.979 172.979 175.566 -2.587 25567 6921 1 10 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.709 -4.075 25567 6922 1 10 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.325 -3.166 25567 6923 1 10 . 1 1 81 81 LEU H H 81 9.230 9.230 8.971 0.259 25567 6924 1 10 . 1 1 82 82 ILE N N 82 120.505 120.505 119.713 0.792 25567 6925 1 10 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.885 0.031 25567 6926 1 10 . 1 1 82 82 ILE C C 82 173.011 173.011 174.606 -1.595 25567 6927 1 10 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.936 -3.108 25567 6928 1 10 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.277 -4.209 25567 6929 1 10 . 1 1 82 82 ILE H H 82 8.796 8.796 8.174 0.622 25567 6930 1 10 . 1 1 83 83 GLY N N 83 120.857 120.857 110.821 10.036 25567 6931 1 10 . 1 1 83 83 GLY CA C 83 40.803 40.803 42.937 -2.134 25567 6932 1 10 . 1 1 83 83 GLY H H 83 9.525 9.525 7.843 1.682 25567 6933 1 10 . 1 1 84 84 SER N N 84 116.007 116.007 114.358 1.649 25567 6934 1 10 . 1 1 84 84 SER HA H 84 5.476 5.476 4.982 0.494 25567 6935 1 10 . 1 1 84 84 SER CA C 84 51.937 51.937 55.602 -3.665 25567 6936 1 10 . 1 1 84 84 SER CB C 84 64.533 64.533 65.681 -1.148 25567 6937 1 10 . 1 1 84 84 SER H H 84 7.617 7.617 7.922 -0.305 25567 6938 1 10 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.558 0.643 25567 6939 1 10 . 1 1 85 85 PRO C C 85 173.574 173.574 175.374 -1.800 25567 6940 1 10 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.840 -3.352 25567 6941 1 10 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.495 -1.355 25567 6942 1 10 . 1 1 86 86 VAL N N 86 117.603 117.603 117.888 -0.285 25567 6943 1 10 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.308 0.065 25567 6944 1 10 . 1 1 86 86 VAL C C 86 172.777 172.777 173.472 -0.695 25567 6945 1 10 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.898 -2.296 25567 6946 1 10 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.935 -5.362 25567 6947 1 10 . 1 1 86 86 VAL H H 86 8.194 8.194 7.965 0.229 25567 6948 1 10 . 1 1 87 87 TRP N N 87 131.187 131.187 130.010 1.177 25567 6949 1 10 . 1 1 87 87 TRP HA H 87 5.198 5.198 5.019 0.179 25567 6950 1 10 . 1 1 87 87 TRP C C 87 173.295 173.295 174.687 -1.392 25567 6951 1 10 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.084 -7.300 25567 6952 1 10 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.479 -3.733 25567 6953 1 10 . 1 1 87 87 TRP H H 87 9.637 9.637 8.457 1.180 25567 6954 1 10 . 1 1 88 88 SER N N 88 119.829 119.829 114.851 4.978 25567 6955 1 10 . 1 1 88 88 SER HA H 88 3.986 3.986 4.705 -0.719 25567 6956 1 10 . 1 1 88 88 SER C C 88 172.375 172.375 173.980 -1.605 25567 6957 1 10 . 1 1 88 88 SER CA C 88 55.932 55.932 58.008 -2.076 25567 6958 1 10 . 1 1 88 88 SER CB C 88 59.178 59.178 65.104 -5.926 25567 6959 1 10 . 1 1 88 88 SER H H 88 9.272 9.272 7.768 1.504 25567 6960 1 10 . 1 1 89 89 GLY N N 89 101.498 101.498 110.640 -9.142 25567 6961 1 10 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.758 -4.088 25567 6962 1 10 . 1 1 89 89 GLY H H 89 7.463 7.463 9.338 -1.875 25567 6963 1 10 . 1 1 90 90 TYR N N 90 121.064 121.064 115.316 5.748 25567 6964 1 10 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.022 -0.806 25567 6965 1 10 . 1 1 90 90 TYR CA C 90 54.090 54.090 53.770 0.320 25567 6966 1 10 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.002 0.193 25567 6967 1 10 . 1 1 90 90 TYR H H 90 8.064 8.064 7.693 0.371 25567 6968 1 10 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.370 0.562 25567 6969 1 10 . 1 1 91 91 PRO C C 91 171.019 171.019 176.285 -5.266 25567 6970 1 10 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.994 -5.000 25567 6971 1 10 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.314 -5.821 25567 6972 1 10 . 1 1 92 92 ALA N N 92 119.893 119.893 121.102 -1.209 25567 6973 1 10 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.587 -1.136 25567 6974 1 10 . 1 1 92 92 ALA C C 92 176.477 176.477 175.744 0.733 25567 6975 1 10 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.159 -1.592 25567 6976 1 10 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.374 -5.573 25567 6977 1 10 . 1 1 92 92 ALA H H 92 7.278 7.278 7.720 -0.442 25567 6978 1 10 . 1 1 93 93 THR N N 93 112.992 112.992 109.555 3.437 25567 6979 1 10 . 1 1 93 93 THR HA H 93 4.462 4.462 4.810 -0.348 25567 6980 1 10 . 1 1 93 93 THR CA C 93 66.871 66.871 59.140 7.731 25567 6981 1 10 . 1 1 93 93 THR CB C 93 64.362 64.362 68.170 -3.808 25567 6982 1 10 . 1 1 93 93 THR H H 93 6.861 6.861 7.979 -1.118 25567 6983 1 10 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.335 -0.469 25567 6984 1 10 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.272 -0.251 25567 6985 1 10 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.787 -2.508 25567 6986 1 10 . 1 1 95 95 ILE N N 95 111.298 111.298 119.291 -7.993 25567 6987 1 10 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.543 -0.920 25567 6988 1 10 . 1 1 95 95 ILE C C 95 174.264 174.264 175.133 -0.869 25567 6989 1 10 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.188 -1.740 25567 6990 1 10 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.910 -4.981 25567 6991 1 10 . 1 1 95 95 ILE H H 95 7.974 7.974 7.923 0.051 25567 6992 1 10 . 1 1 96 96 LYS N N 96 123.045 123.045 122.933 0.112 25567 6993 1 10 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.799 -1.687 25567 6994 1 10 . 1 1 96 96 LYS C C 96 174.590 174.590 177.354 -2.764 25567 6995 1 10 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.268 -0.123 25567 6996 1 10 . 1 1 96 96 LYS CB C 96 28.845 28.845 34.041 -5.196 25567 6997 1 10 . 1 1 96 96 LYS H H 96 6.958 6.958 8.133 -1.175 25567 6998 1 10 . 1 1 97 97 THR N N 97 113.412 113.412 117.761 -4.349 25567 6999 1 10 . 1 1 97 97 THR HA H 97 3.461 3.461 4.062 -0.601 25567 7000 1 10 . 1 1 97 97 THR C C 97 173.247 173.247 176.393 -3.146 25567 7001 1 10 . 1 1 97 97 THR CA C 97 62.809 62.809 66.440 -3.631 25567 7002 1 10 . 1 1 97 97 THR CB C 97 65.654 65.654 68.554 -2.900 25567 7003 1 10 . 1 1 97 97 THR H H 97 6.366 6.366 8.334 -1.968 25567 7004 1 10 . 1 1 98 98 LEU N N 98 121.201 121.201 121.973 -0.772 25567 7005 1 10 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.102 -0.468 25567 7006 1 10 . 1 1 98 98 LEU C C 98 174.590 174.590 178.599 -4.009 25567 7007 1 10 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.793 -2.172 25567 7008 1 10 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.922 -1.027 25567 7009 1 10 . 1 1 98 98 LEU H H 98 7.554 7.554 8.080 -0.526 25567 7010 1 10 . 1 1 99 99 LEU N N 99 118.677 118.677 116.311 2.366 25567 7011 1 10 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.993 -0.291 25567 7012 1 10 . 1 1 99 99 LEU C C 99 177.457 177.457 178.997 -1.540 25567 7013 1 10 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.027 -1.848 25567 7014 1 10 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.220 -1.232 25567 7015 1 10 . 1 1 99 99 LEU H H 99 8.160 8.160 8.120 0.040 25567 7016 1 10 . 1 1 100 100 ASP N N 100 118.914 118.914 117.682 1.232 25567 7017 1 10 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.514 -0.285 25567 7018 1 10 . 1 1 100 100 ASP C C 100 176.585 176.585 178.214 -1.629 25567 7019 1 10 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.534 -2.018 25567 7020 1 10 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.186 -3.607 25567 7021 1 10 . 1 1 100 100 ASP H H 100 7.872 7.872 7.718 0.154 25567 7022 1 10 . 1 1 101 101 GLN N N 101 118.135 118.135 118.245 -0.110 25567 7023 1 10 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.227 -0.067 25567 7024 1 10 . 1 1 101 101 GLN C C 101 174.601 174.601 177.725 -3.124 25567 7025 1 10 . 1 1 101 101 GLN CA C 101 54.960 54.960 57.946 -2.986 25567 7026 1 10 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.181 -3.631 25567 7027 1 10 . 1 1 101 101 GLN H H 101 7.673 7.673 7.884 -0.211 25567 7028 1 10 . 1 1 102 102 MET N N 102 118.420 118.420 116.713 1.707 25567 7029 1 10 . 1 1 102 102 MET HA H 102 3.826 3.826 4.575 -0.749 25567 7030 1 10 . 1 1 102 102 MET C C 102 172.780 172.780 177.328 -4.548 25567 7031 1 10 . 1 1 102 102 MET CA C 102 53.428 53.428 56.636 -3.208 25567 7032 1 10 . 1 1 102 102 MET CB C 102 31.221 31.221 31.313 -0.092 25567 7033 1 10 . 1 1 102 102 MET H H 102 7.462 7.462 7.470 -0.008 25567 7034 1 10 . 1 1 103 103 LYS N N 103 116.066 116.066 119.803 -3.737 25567 7035 1 10 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.255 -0.335 25567 7036 1 10 . 1 1 103 103 LYS C C 103 173.922 173.922 177.434 -3.512 25567 7037 1 10 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.173 -1.891 25567 7038 1 10 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.740 -2.249 25567 7039 1 10 . 1 1 103 103 LYS H H 103 6.875 6.875 8.078 -1.203 25567 7040 1 10 . 1 1 104 104 ASN N N 104 114.987 114.987 115.804 -0.817 25567 7041 1 10 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.874 -0.133 25567 7042 1 10 . 1 1 104 104 ASN C C 104 172.587 172.587 174.529 -1.942 25567 7043 1 10 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.986 -2.517 25567 7044 1 10 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.978 -4.156 25567 7045 1 10 . 1 1 104 104 ASN H H 104 8.517 8.517 8.167 0.350 25567 7046 1 10 . 1 1 105 105 TYR N N 105 122.755 122.755 123.243 -0.488 25567 7047 1 10 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.410 0.165 25567 7048 1 10 . 1 1 105 105 TYR C C 105 174.260 174.260 174.741 -0.481 25567 7049 1 10 . 1 1 105 105 TYR CA C 105 55.493 55.493 59.429 -3.936 25567 7050 1 10 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.217 -3.153 25567 7051 1 10 . 1 1 105 105 TYR H H 105 8.287 8.287 7.905 0.382 25567 7052 1 10 . 1 1 106 106 ARG N N 106 128.905 128.905 124.441 4.464 25567 7053 1 10 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.215 0.058 25567 7054 1 10 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.083 -2.062 25567 7055 1 10 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.061 -4.931 25567 7056 1 10 . 1 1 106 106 ARG H H 106 8.841 8.841 7.803 1.038 25567 7057 1 10 . 1 1 107 107 GLY CA C 107 42.497 42.497 45.498 -3.001 25567 7058 1 10 . 1 1 108 108 GLU N N 108 116.989 116.989 120.388 -3.399 25567 7059 1 10 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.708 -0.077 25567 7060 1 10 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.276 -1.600 25567 7061 1 10 . 1 1 108 108 GLU CB C 108 30.402 30.402 34.720 -4.318 25567 7062 1 10 . 1 1 108 108 GLU H H 108 7.536 7.536 8.341 -0.805 25567 7063 1 10 . 1 1 109 109 VAL N N 109 123.416 123.416 118.773 4.643 25567 7064 1 10 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.967 0.354 25567 7065 1 10 . 1 1 109 109 VAL CA C 109 57.443 57.443 61.127 -3.684 25567 7066 1 10 . 1 1 109 109 VAL CB C 109 32.661 32.661 34.791 -2.130 25567 7067 1 10 . 1 1 109 109 VAL H H 109 8.955 8.955 8.882 0.073 25567 7068 1 10 . 1 1 110 110 ALA N N 110 127.975 127.975 128.861 -0.886 25567 7069 1 10 . 1 1 110 110 ALA HA H 110 4.677 4.677 4.945 -0.268 25567 7070 1 10 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.277 -1.836 25567 7071 1 10 . 1 1 110 110 ALA CB C 110 18.416 18.416 21.860 -3.444 25567 7072 1 10 . 1 1 110 110 ALA H H 110 8.860 8.860 8.938 -0.078 25567 7073 1 10 . 1 1 111 111 SER N N 111 110.482 110.482 113.658 -3.176 25567 7074 1 10 . 1 1 111 111 SER HA H 111 5.502 5.502 5.317 0.185 25567 7075 1 10 . 1 1 111 111 SER CA C 111 51.630 51.630 55.711 -4.081 25567 7076 1 10 . 1 1 111 111 SER CB C 111 62.267 62.267 65.395 -3.128 25567 7077 1 10 . 1 1 111 111 SER H H 111 7.484 7.484 8.018 -0.534 25567 7078 1 10 . 1 1 112 112 PHE N N 112 125.082 125.082 120.804 4.278 25567 7079 1 10 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.764 0.684 25567 7080 1 10 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.478 -5.044 25567 7081 1 10 . 1 1 112 112 PHE CB C 112 40.500 40.500 41.745 -1.245 25567 7082 1 10 . 1 1 112 112 PHE H H 112 8.025 8.025 8.154 -0.129 25567 7083 1 10 . 1 1 113 113 PHE N N 113 115.872 115.872 117.680 -1.808 25567 7084 1 10 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.027 0.897 25567 7085 1 10 . 1 1 113 113 PHE C C 113 173.293 173.293 175.059 -1.766 25567 7086 1 10 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.568 -5.100 25567 7087 1 10 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.611 -3.218 25567 7088 1 10 . 1 1 113 113 PHE H H 113 7.391 7.391 7.985 -0.594 25567 7089 1 10 . 1 1 114 114 THR N N 114 108.721 108.721 112.007 -3.286 25567 7090 1 10 . 1 1 114 114 THR HA H 114 4.933 4.933 4.654 0.279 25567 7091 1 10 . 1 1 114 114 THR C C 114 171.891 171.891 174.337 -2.446 25567 7092 1 10 . 1 1 114 114 THR CA C 114 56.815 56.815 61.145 -4.330 25567 7093 1 10 . 1 1 114 114 THR CB C 114 67.899 67.899 69.525 -1.626 25567 7094 1 10 . 1 1 114 114 THR H H 114 7.951 7.951 8.616 -0.665 25567 7095 1 10 . 1 1 115 115 SER N N 115 115.159 115.159 118.253 -3.094 25567 7096 1 10 . 1 1 115 115 SER HA H 115 4.608 4.608 4.752 -0.144 25567 7097 1 10 . 1 1 115 115 SER C C 115 171.403 171.403 173.004 -1.601 25567 7098 1 10 . 1 1 115 115 SER CA C 115 55.570 55.570 58.281 -2.711 25567 7099 1 10 . 1 1 115 115 SER CB C 115 61.418 61.418 64.435 -3.017 25567 7100 1 10 . 1 1 115 115 SER H H 115 8.229 8.229 8.275 -0.046 25567 7101 1 10 . 1 1 116 116 ALA N N 116 127.211 127.211 126.676 0.535 25567 7102 1 10 . 1 1 116 116 ALA HA H 116 4.456 4.456 5.083 -0.627 25567 7103 1 10 . 1 1 116 116 ALA C C 116 175.758 175.758 178.533 -2.775 25567 7104 1 10 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.181 -2.365 25567 7105 1 10 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.873 -3.042 25567 7106 1 10 . 1 1 116 116 ALA H H 116 8.813 8.813 8.470 0.343 25567 7107 1 10 . 1 1 117 117 GLY N N 117 108.099 108.099 109.866 -1.767 25567 7108 1 10 . 1 1 117 117 GLY C C 117 171.805 171.805 175.743 -3.938 25567 7109 1 10 . 1 1 117 117 GLY CA C 117 42.869 42.869 46.942 -4.073 25567 7110 1 10 . 1 1 117 117 GLY H H 117 8.685 8.685 8.987 -0.302 25567 7111 1 10 . 1 1 118 118 THR N N 118 111.284 111.284 112.646 -1.362 25567 7112 1 10 . 1 1 118 118 THR HA H 118 4.343 4.343 4.481 -0.138 25567 7113 1 10 . 1 1 118 118 THR C C 118 171.769 171.769 173.500 -1.731 25567 7114 1 10 . 1 1 118 118 THR CA C 118 58.933 58.933 62.190 -3.257 25567 7115 1 10 . 1 1 118 118 THR CB C 118 67.304 67.304 70.146 -2.842 25567 7116 1 10 . 1 1 118 118 THR H H 118 7.998 7.998 8.557 -0.559 25567 7117 1 10 . 1 1 119 119 ASN N N 119 120.253 120.253 118.235 2.018 25567 7118 1 10 . 1 1 119 119 ASN HA H 119 4.703 4.703 5.026 -0.323 25567 7119 1 10 . 1 1 119 119 ASN C C 119 172.353 172.353 173.719 -1.366 25567 7120 1 10 . 1 1 119 119 ASN CA C 119 50.228 50.228 52.990 -2.762 25567 7121 1 10 . 1 1 119 119 ASN CB C 119 35.376 35.376 41.556 -6.180 25567 7122 1 10 . 1 1 119 119 ASN H H 119 8.381 8.381 7.889 0.492 25567 7123 1 10 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.724 -0.638 25567 7124 1 10 . 1 1 120 120 HIS C C 120 173.395 173.395 176.001 -2.606 25567 7125 1 10 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.712 -2.574 25567 7126 1 10 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.758 -3.336 25567 7127 1 10 . 1 1 121 121 LYS N N 121 119.527 119.527 120.536 -1.009 25567 7128 1 10 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.944 -0.164 25567 7129 1 10 . 1 1 121 121 LYS C C 121 176.053 176.053 178.645 -2.592 25567 7130 1 10 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.907 -1.944 25567 7131 1 10 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.818 -2.158 25567 7132 1 10 . 1 1 121 121 LYS H H 121 8.106 8.106 8.698 -0.592 25567 7133 1 10 . 1 1 122 122 ALA N N 122 121.585 121.585 121.069 0.516 25567 7134 1 10 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.962 -0.241 25567 7135 1 10 . 1 1 122 122 ALA C C 122 175.128 175.128 179.163 -4.035 25567 7136 1 10 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.660 -3.069 25567 7137 1 10 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.829 -2.125 25567 7138 1 10 . 1 1 122 122 ALA H H 122 7.702 7.702 8.298 -0.596 25567 7139 1 10 . 1 1 123 123 TYR N N 123 118.803 118.803 120.393 -1.590 25567 7140 1 10 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.137 -0.771 25567 7141 1 10 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.515 -1.424 25567 7142 1 10 . 1 1 123 123 TYR CB C 123 35.102 35.102 37.967 -2.865 25567 7143 1 10 . 1 1 123 123 TYR H H 123 7.366 7.366 7.447 -0.081 25567 7144 1 10 . 1 1 124 124 VAL N N 124 117.530 117.530 117.898 -0.368 25567 7145 1 10 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.542 -0.343 25567 7146 1 10 . 1 1 124 124 VAL C C 124 175.375 175.375 178.139 -2.764 25567 7147 1 10 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.999 -2.416 25567 7148 1 10 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.326 -2.123 25567 7149 1 10 . 1 1 124 124 VAL H H 124 7.757 7.757 7.486 0.271 25567 7150 1 10 . 1 1 125 125 SER N N 125 114.023 114.023 115.065 -1.042 25567 7151 1 10 . 1 1 125 125 SER HA H 125 4.035 4.035 3.985 0.050 25567 7152 1 10 . 1 1 125 125 SER C C 125 174.636 174.636 176.710 -2.074 25567 7153 1 10 . 1 1 125 125 SER CA C 125 58.885 58.885 61.874 -2.989 25567 7154 1 10 . 1 1 125 125 SER CB C 125 59.666 59.666 62.769 -3.103 25567 7155 1 10 . 1 1 125 125 SER H H 125 7.622 7.622 7.570 0.052 25567 7156 1 10 . 1 1 126 126 HIS N N 126 119.457 119.457 119.194 0.263 25567 7157 1 10 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.084 0.112 25567 7158 1 10 . 1 1 126 126 HIS C C 126 172.942 172.942 177.504 -4.562 25567 7159 1 10 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.359 -3.442 25567 7160 1 10 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.415 -3.336 25567 7161 1 10 . 1 1 126 126 HIS H H 126 8.067 8.067 7.812 0.255 25567 7162 1 10 . 1 1 127 127 PHE N N 127 120.628 120.628 121.101 -0.473 25567 7163 1 10 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.874 -0.675 25567 7164 1 10 . 1 1 127 127 PHE C C 127 173.515 173.515 177.424 -3.909 25567 7165 1 10 . 1 1 127 127 PHE CA C 127 60.681 60.681 60.059 0.622 25567 7166 1 10 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.821 -2.454 25567 7167 1 10 . 1 1 127 127 PHE H H 127 9.083 9.083 8.382 0.701 25567 7168 1 10 . 1 1 128 128 ASN N N 128 114.858 114.858 117.779 -2.921 25567 7169 1 10 . 1 1 128 128 ASN HA H 128 4.078 4.078 3.968 0.110 25567 7170 1 10 . 1 1 128 128 ASN C C 128 175.338 175.338 178.012 -2.674 25567 7171 1 10 . 1 1 128 128 ASN CA C 128 54.250 54.250 55.904 -1.654 25567 7172 1 10 . 1 1 128 128 ASN CB C 128 36.021 36.021 37.788 -1.767 25567 7173 1 10 . 1 1 128 128 ASN H H 128 7.858 7.858 8.209 -0.351 25567 7174 1 10 . 1 1 129 129 GLU N N 129 119.811 119.811 119.269 0.542 25567 7175 1 10 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.130 -0.089 25567 7176 1 10 . 1 1 129 129 GLU C C 129 176.941 176.941 178.599 -1.658 25567 7177 1 10 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.837 -2.205 25567 7178 1 10 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.502 -2.564 25567 7179 1 10 . 1 1 129 129 GLU H H 129 7.569 7.569 7.709 -0.140 25567 7180 1 10 . 1 1 130 130 TRP N N 130 120.585 120.585 117.867 2.718 25567 7181 1 10 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.616 -0.144 25567 7182 1 10 . 1 1 130 130 TRP C C 130 174.262 174.262 175.400 -1.138 25567 7183 1 10 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.255 -1.583 25567 7184 1 10 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.175 -2.219 25567 7185 1 10 . 1 1 130 130 TRP H H 130 7.964 7.964 7.820 0.144 25567 7186 1 10 . 1 1 131 131 ALA N N 131 120.522 120.522 118.545 1.977 25567 7187 1 10 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.517 -0.570 25567 7188 1 10 . 1 1 131 131 ALA C C 131 172.489 172.489 175.250 -2.761 25567 7189 1 10 . 1 1 131 131 ALA CA C 131 48.580 48.580 50.796 -2.216 25567 7190 1 10 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.802 -3.263 25567 7191 1 10 . 1 1 131 131 ALA H H 131 8.114 8.114 7.020 1.094 25567 7192 1 10 . 1 1 132 132 ASP N N 132 117.666 117.666 120.395 -2.729 25567 7193 1 10 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.347 -0.141 25567 7194 1 10 . 1 1 132 132 ASP C C 132 173.779 173.779 177.169 -3.390 25567 7195 1 10 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.905 -1.592 25567 7196 1 10 . 1 1 132 132 ASP CB C 132 39.456 39.456 40.631 -1.175 25567 7197 1 10 . 1 1 132 132 ASP H H 132 6.768 6.768 7.838 -1.070 25567 7198 1 10 . 1 1 133 133 GLY N N 133 114.922 114.922 111.630 3.292 25567 7199 1 10 . 1 1 133 133 GLY C C 133 172.101 172.101 173.877 -1.776 25567 7200 1 10 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.743 -2.234 25567 7201 1 10 . 1 1 133 133 GLY H H 133 8.645 8.645 8.375 0.270 25567 7202 1 10 . 1 1 134 134 LEU N N 134 120.101 120.101 120.535 -0.434 25567 7203 1 10 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.699 -0.237 25567 7204 1 10 . 1 1 134 134 LEU C C 134 174.098 174.098 175.584 -1.486 25567 7205 1 10 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.108 -2.023 25567 7206 1 10 . 1 1 134 134 LEU CB C 134 40.509 40.509 44.809 -4.300 25567 7207 1 10 . 1 1 134 134 LEU H H 134 8.049 8.049 7.527 0.522 25567 7208 1 10 . 1 1 135 135 ASN N N 135 119.258 119.258 121.576 -2.318 25567 7209 1 10 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.825 -0.186 25567 7210 1 10 . 1 1 135 135 ASN C C 135 170.564 170.564 174.238 -3.674 25567 7211 1 10 . 1 1 135 135 ASN CA C 135 49.253 49.253 52.687 -3.434 25567 7212 1 10 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.070 -4.452 25567 7213 1 10 . 1 1 135 135 ASN H H 135 8.567 8.567 8.809 -0.242 25567 7214 1 10 . 1 1 136 136 VAL N N 136 125.460 125.460 125.696 -0.236 25567 7215 1 10 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.528 0.068 25567 7216 1 10 . 1 1 136 136 VAL C C 136 175.318 175.318 176.630 -1.312 25567 7217 1 10 . 1 1 136 136 VAL CA C 136 58.722 58.722 63.362 -4.640 25567 7218 1 10 . 1 1 136 136 VAL CB C 136 29.299 29.299 31.650 -2.351 25567 7219 1 10 . 1 1 136 136 VAL H H 136 7.660 7.660 8.130 -0.470 25567 7220 1 10 . 1 1 137 137 ILE N N 137 122.021 122.021 124.290 -2.269 25567 7221 1 10 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.746 -0.318 25567 7222 1 10 . 1 1 137 137 ILE C C 137 173.943 173.943 174.802 -0.859 25567 7223 1 10 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.760 -0.802 25567 7224 1 10 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.983 -2.814 25567 7225 1 10 . 1 1 137 137 ILE H H 137 9.151 9.151 8.558 0.593 25567 7226 1 10 . 1 1 138 138 GLY N N 138 108.192 108.192 108.229 -0.037 25567 7227 1 10 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.715 -2.221 25567 7228 1 10 . 1 1 138 138 GLY H H 138 6.675 6.675 7.435 -0.760 25567 7229 1 10 . 1 1 139 139 VAL N N 139 119.673 119.673 123.632 -3.959 25567 7230 1 10 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.848 0.472 25567 7231 1 10 . 1 1 139 139 VAL C C 139 172.291 172.291 174.197 -1.906 25567 7232 1 10 . 1 1 139 139 VAL CA C 139 58.209 58.209 60.654 -2.445 25567 7233 1 10 . 1 1 139 139 VAL CB C 139 32.639 32.639 32.644 -0.005 25567 7234 1 10 . 1 1 139 139 VAL H H 139 8.158 8.158 8.869 -0.711 25567 7235 1 10 . 1 1 140 140 ALA N N 140 127.104 127.104 127.659 -0.555 25567 7236 1 10 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.008 -0.412 25567 7237 1 10 . 1 1 140 140 ALA C C 140 171.057 171.057 174.932 -3.875 25567 7238 1 10 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.011 -1.128 25567 7239 1 10 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.499 -1.071 25567 7240 1 10 . 1 1 140 140 ALA H H 140 9.145 9.145 8.380 0.765 25567 7241 1 10 . 1 1 141 141 ARG N N 141 118.828 118.828 118.942 -0.114 25567 7242 1 10 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.523 -1.783 25567 7243 1 10 . 1 1 141 141 ARG C C 141 173.524 173.524 176.142 -2.618 25567 7244 1 10 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.815 -2.929 25567 7245 1 10 . 1 1 141 141 ARG CB C 141 28.454 28.454 32.216 -3.762 25567 7246 1 10 . 1 1 141 141 ARG H H 141 7.759 7.759 8.310 -0.551 25567 7247 1 10 . 1 1 142 142 ASP N N 142 125.557 125.557 121.492 4.065 25567 7248 1 10 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.232 -0.453 25567 7249 1 10 . 1 1 142 142 ASP C C 142 169.292 169.292 175.039 -5.747 25567 7250 1 10 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.956 -2.334 25567 7251 1 10 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.739 -3.659 25567 7252 1 10 . 1 1 142 142 ASP H H 142 9.087 9.087 8.393 0.694 25567 7253 1 10 . 1 1 143 143 ASP N N 143 119.094 119.094 118.922 0.172 25567 7254 1 10 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.614 -0.360 25567 7255 1 10 . 1 1 143 143 ASP C C 143 175.557 175.557 175.188 0.369 25567 7256 1 10 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.622 -4.543 25567 7257 1 10 . 1 1 143 143 ASP CB C 143 36.442 36.442 38.977 -2.535 25567 7258 1 10 . 1 1 143 143 ASP H H 143 8.175 8.175 8.535 -0.360 25567 7259 1 10 . 1 1 144 144 SER N N 144 115.438 115.438 115.320 0.118 25567 7260 1 10 . 1 1 144 144 SER HA H 144 3.745 3.745 4.429 -0.684 25567 7261 1 10 . 1 1 144 144 SER C C 144 172.820 172.820 174.312 -1.492 25567 7262 1 10 . 1 1 144 144 SER CA C 144 59.336 59.336 58.350 0.986 25567 7263 1 10 . 1 1 144 144 SER CB C 144 60.839 60.839 64.138 -3.299 25567 7264 1 10 . 1 1 144 144 SER H H 144 7.742 7.742 7.864 -0.122 25567 7265 1 10 . 1 1 145 145 GLU N N 145 119.631 119.631 119.838 -0.207 25567 7266 1 10 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.137 0.182 25567 7267 1 10 . 1 1 145 145 GLU C C 145 171.927 171.927 175.795 -3.868 25567 7268 1 10 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.598 -3.514 25567 7269 1 10 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.766 -2.992 25567 7270 1 10 . 1 1 145 145 GLU H H 145 7.924 7.924 8.119 -0.195 25567 7271 1 10 . 1 1 146 146 VAL N N 146 118.791 118.791 119.558 -0.767 25567 7272 1 10 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.634 -0.678 25567 7273 1 10 . 1 1 146 146 VAL C C 146 174.582 174.582 176.210 -1.628 25567 7274 1 10 . 1 1 146 146 VAL CA C 146 64.078 64.078 65.475 -1.397 25567 7275 1 10 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.174 -2.034 25567 7276 1 10 . 1 1 146 146 VAL H H 146 6.393 6.393 7.554 -1.161 25567 7277 1 10 . 1 1 147 147 ASP N N 147 119.410 119.410 115.421 3.989 25567 7278 1 10 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.371 -0.301 25567 7279 1 10 . 1 1 147 147 ASP C C 147 174.774 174.774 177.496 -2.722 25567 7280 1 10 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.558 -2.236 25567 7281 1 10 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.668 -3.464 25567 7282 1 10 . 1 1 147 147 ASP H H 147 8.393 8.393 8.329 0.064 25567 7283 1 10 . 1 1 148 148 LYS N N 148 119.422 119.422 118.085 1.337 25567 7284 1 10 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.336 -0.385 25567 7285 1 10 . 1 1 148 148 LYS C C 148 176.410 176.410 178.777 -2.367 25567 7286 1 10 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.077 -2.341 25567 7287 1 10 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.796 -3.220 25567 7288 1 10 . 1 1 148 148 LYS H H 148 7.078 7.078 7.136 -0.058 25567 7289 1 10 . 1 1 149 149 TRP N N 149 118.168 118.168 120.667 -2.499 25567 7290 1 10 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.830 -0.229 25567 7291 1 10 . 1 1 149 149 TRP C C 149 174.199 174.199 175.950 -1.751 25567 7292 1 10 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.951 -2.156 25567 7293 1 10 . 1 1 149 149 TRP CB C 149 27.011 27.011 27.774 -0.763 25567 7294 1 10 . 1 1 149 149 TRP H H 149 7.914 7.914 7.423 0.491 25567 7295 1 10 . 1 1 150 150 SER N N 150 109.636 109.636 112.543 -2.907 25567 7296 1 10 . 1 1 150 150 SER HA H 150 4.242 4.242 4.718 -0.476 25567 7297 1 10 . 1 1 150 150 SER C C 150 170.173 170.173 173.983 -3.810 25567 7298 1 10 . 1 1 150 150 SER CA C 150 56.912 56.912 58.151 -1.239 25567 7299 1 10 . 1 1 150 150 SER CB C 150 62.087 62.087 64.326 -2.239 25567 7300 1 10 . 1 1 150 150 SER H H 150 7.814 7.814 7.345 0.469 25567 7301 1 11 . 1 1 2 2 MET HA H 2 4.416 4.416 5.081 -0.665 25567 7302 1 11 . 1 1 2 2 MET CA C 2 52.847 52.847 54.927 -2.080 25567 7303 1 11 . 1 1 2 2 MET CB C 2 30.672 30.672 34.821 -4.149 25567 7304 1 11 . 1 1 3 3 ALA N N 3 125.563 125.563 126.705 -1.142 25567 7305 1 11 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.569 -0.197 25567 7306 1 11 . 1 1 3 3 ALA C C 3 174.728 174.728 176.424 -1.696 25567 7307 1 11 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.441 -3.093 25567 7308 1 11 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.579 -3.644 25567 7309 1 11 . 1 1 3 3 ALA H H 3 8.342 8.342 8.267 0.075 25567 7310 1 11 . 1 1 4 4 LYS N N 4 121.767 121.767 121.676 0.091 25567 7311 1 11 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.513 -0.283 25567 7312 1 11 . 1 1 4 4 LYS C C 4 174.577 174.577 175.927 -1.350 25567 7313 1 11 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.723 -1.734 25567 7314 1 11 . 1 1 4 4 LYS CB C 4 31.555 31.555 31.841 -0.286 25567 7315 1 11 . 1 1 4 4 LYS H H 4 8.500 8.500 8.301 0.199 25567 7316 1 11 . 1 1 5 5 LYS N N 5 129.654 129.654 123.136 6.518 25567 7317 1 11 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.551 -0.025 25567 7318 1 11 . 1 1 5 5 LYS C C 5 174.731 174.731 176.599 -1.868 25567 7319 1 11 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.970 -1.224 25567 7320 1 11 . 1 1 5 5 LYS CB C 5 29.894 29.894 33.833 -3.938 25567 7321 1 11 . 1 1 5 5 LYS H H 5 10.035 10.035 8.301 1.734 25567 7322 1 11 . 1 1 6 6 THR N N 6 126.212 126.212 114.278 11.934 25567 7323 1 11 . 1 1 6 6 THR HA H 6 5.654 5.654 5.276 0.378 25567 7324 1 11 . 1 1 6 6 THR C C 6 169.897 169.897 173.138 -3.241 25567 7325 1 11 . 1 1 6 6 THR CA C 6 60.647 60.647 61.784 -1.137 25567 7326 1 11 . 1 1 6 6 THR CB C 6 68.152 68.152 72.143 -3.991 25567 7327 1 11 . 1 1 6 6 THR H H 6 8.557 8.557 8.435 0.122 25567 7328 1 11 . 1 1 7 7 LEU N N 7 130.776 130.776 124.315 6.461 25567 7329 1 11 . 1 1 7 7 LEU HA H 7 4.619 4.619 5.349 -0.730 25567 7330 1 11 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.180 -3.084 25567 7331 1 11 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.491 -5.448 25567 7332 1 11 . 1 1 7 7 LEU H H 7 8.610 8.610 8.816 -0.206 25567 7333 1 11 . 1 1 8 8 ILE N N 8 127.175 127.175 120.563 6.612 25567 7334 1 11 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.836 0.020 25567 7335 1 11 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.669 -3.277 25567 7336 1 11 . 1 1 8 8 ILE CB C 8 36.864 36.864 41.452 -4.588 25567 7337 1 11 . 1 1 8 8 ILE H H 8 9.263 9.263 8.315 0.948 25567 7338 1 11 . 1 1 9 9 LEU N N 9 127.117 127.117 126.318 0.799 25567 7339 1 11 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.054 0.642 25567 7340 1 11 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.872 -3.920 25567 7341 1 11 . 1 1 9 9 LEU CB C 9 43.827 43.827 44.775 -0.948 25567 7342 1 11 . 1 1 9 9 LEU H H 9 9.262 9.262 8.299 0.963 25567 7343 1 11 . 1 1 10 10 TYR N N 10 113.544 113.544 120.246 -6.702 25567 7344 1 11 . 1 1 10 10 TYR HA H 10 5.531 5.531 4.877 0.654 25567 7345 1 11 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.285 -2.456 25567 7346 1 11 . 1 1 10 10 TYR CB C 10 38.615 38.615 37.767 0.848 25567 7347 1 11 . 1 1 10 10 TYR H H 10 7.425 7.425 8.153 -0.728 25567 7348 1 11 . 1 1 11 11 TYR N N 11 121.235 121.235 126.169 -4.934 25567 7349 1 11 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.497 0.313 25567 7350 1 11 . 1 1 11 11 TYR CA C 11 53.889 53.889 58.557 -4.668 25567 7351 1 11 . 1 1 11 11 TYR CB C 11 40.467 40.467 37.402 3.065 25567 7352 1 11 . 1 1 11 11 TYR H H 11 7.781 7.781 8.209 -0.428 25567 7353 1 11 . 1 1 14 14 SER CA C 14 54.675 54.675 58.367 -3.692 25567 7354 1 11 . 1 1 14 14 SER CB C 14 61.621 61.621 63.094 -1.473 25567 7355 1 11 . 1 1 15 15 GLY N N 15 110.420 110.420 109.966 0.454 25567 7356 1 11 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.898 -2.171 25567 7357 1 11 . 1 1 15 15 GLY H H 15 7.757 7.757 7.494 0.263 25567 7358 1 11 . 1 1 17 17 THR HA H 17 4.122 4.122 4.106 0.016 25567 7359 1 11 . 1 1 17 17 THR CA C 17 64.748 64.748 63.324 1.424 25567 7360 1 11 . 1 1 17 17 THR CB C 17 64.532 64.532 68.531 -3.999 25567 7361 1 11 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.837 -0.919 25567 7362 1 11 . 1 1 18 18 LYS C C 18 173.812 173.812 177.732 -3.920 25567 7363 1 11 . 1 1 18 18 LYS CA C 18 57.003 57.003 58.881 -1.878 25567 7364 1 11 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.539 -2.771 25567 7365 1 11 . 1 1 19 19 LYS N N 19 116.699 116.699 118.293 -1.594 25567 7366 1 11 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.075 -0.127 25567 7367 1 11 . 1 1 19 19 LYS C C 19 177.221 177.221 177.906 -0.685 25567 7368 1 11 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.769 -2.348 25567 7369 1 11 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.486 -2.853 25567 7370 1 11 . 1 1 19 19 LYS H H 19 7.476 7.476 7.618 -0.142 25567 7371 1 11 . 1 1 20 20 MET N N 20 118.946 118.946 116.590 2.356 25567 7372 1 11 . 1 1 20 20 MET HA H 20 4.474 4.474 4.415 0.059 25567 7373 1 11 . 1 1 20 20 MET C C 20 173.826 173.826 175.351 -1.525 25567 7374 1 11 . 1 1 20 20 MET CA C 20 52.285 52.285 55.854 -3.569 25567 7375 1 11 . 1 1 20 20 MET CB C 20 26.921 26.921 30.913 -3.992 25567 7376 1 11 . 1 1 20 20 MET H H 20 7.457 7.457 8.497 -1.040 25567 7377 1 11 . 1 1 21 21 ALA N N 21 123.375 123.375 120.507 2.868 25567 7378 1 11 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.697 -1.145 25567 7379 1 11 . 1 1 21 21 ALA C C 21 176.542 176.542 178.840 -2.298 25567 7380 1 11 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.316 -0.665 25567 7381 1 11 . 1 1 21 21 ALA CB C 21 16.282 16.282 19.686 -3.404 25567 7382 1 11 . 1 1 21 21 ALA H H 21 8.549 8.549 8.095 0.454 25567 7383 1 11 . 1 1 22 22 GLU N N 22 116.906 116.906 120.021 -3.115 25567 7384 1 11 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.991 -0.318 25567 7385 1 11 . 1 1 22 22 GLU C C 22 176.658 176.658 179.118 -2.460 25567 7386 1 11 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.124 -2.519 25567 7387 1 11 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.612 -2.963 25567 7388 1 11 . 1 1 22 22 GLU H H 22 8.085 8.085 7.739 0.346 25567 7389 1 11 . 1 1 23 23 LYS N N 23 123.301 123.301 119.674 3.627 25567 7390 1 11 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.033 -0.213 25567 7391 1 11 . 1 1 23 23 LYS C C 23 177.363 177.363 179.452 -2.089 25567 7392 1 11 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.212 -2.241 25567 7393 1 11 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.124 -2.593 25567 7394 1 11 . 1 1 23 23 LYS H H 23 7.703 7.703 7.548 0.155 25567 7395 1 11 . 1 1 24 24 ILE N N 24 121.894 121.894 119.972 1.922 25567 7396 1 11 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.867 -0.571 25567 7397 1 11 . 1 1 24 24 ILE C C 24 174.944 174.944 177.591 -2.647 25567 7398 1 11 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.503 -1.270 25567 7399 1 11 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.722 -2.978 25567 7400 1 11 . 1 1 24 24 ILE H H 24 8.458 8.458 8.060 0.398 25567 7401 1 11 . 1 1 25 25 ASN N N 25 118.580 118.580 117.831 0.749 25567 7402 1 11 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.337 -0.103 25567 7403 1 11 . 1 1 25 25 ASN C C 25 173.567 173.567 177.569 -4.002 25567 7404 1 11 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.144 -3.820 25567 7405 1 11 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.629 -0.446 25567 7406 1 11 . 1 1 25 25 ASN H H 25 8.273 8.273 8.339 -0.066 25567 7407 1 11 . 1 1 26 26 SER N N 26 112.132 112.132 113.099 -0.967 25567 7408 1 11 . 1 1 26 26 SER HA H 26 4.148 4.148 4.300 -0.152 25567 7409 1 11 . 1 1 26 26 SER C C 26 172.083 172.083 174.814 -2.731 25567 7410 1 11 . 1 1 26 26 SER CA C 26 57.865 57.865 60.630 -2.765 25567 7411 1 11 . 1 1 26 26 SER CB C 26 60.816 60.816 63.551 -2.735 25567 7412 1 11 . 1 1 26 26 SER H H 26 7.444 7.444 7.637 -0.193 25567 7413 1 11 . 1 1 27 27 GLU N N 27 120.080 120.080 119.067 1.013 25567 7414 1 11 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.357 -0.257 25567 7415 1 11 . 1 1 27 27 GLU C C 27 173.647 173.647 177.131 -3.484 25567 7416 1 11 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.858 -2.656 25567 7417 1 11 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.588 -3.704 25567 7418 1 11 . 1 1 27 27 GLU H H 27 7.453 7.453 7.760 -0.307 25567 7419 1 11 . 1 1 28 28 ILE N N 28 118.759 118.759 120.995 -2.236 25567 7420 1 11 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.181 0.023 25567 7421 1 11 . 1 1 28 28 ILE C C 28 172.474 172.474 175.938 -3.464 25567 7422 1 11 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.774 -3.027 25567 7423 1 11 . 1 1 28 28 ILE CB C 28 35.798 35.798 39.695 -3.897 25567 7424 1 11 . 1 1 28 28 ILE H H 28 7.258 7.258 7.525 -0.267 25567 7425 1 11 . 1 1 29 29 LYS N N 29 130.618 130.618 126.478 4.140 25567 7426 1 11 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.243 -0.238 25567 7427 1 11 . 1 1 29 29 LYS C C 29 174.375 174.375 176.190 -1.815 25567 7428 1 11 . 1 1 29 29 LYS CA C 29 55.659 55.659 56.654 -0.995 25567 7429 1 11 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.751 -3.191 25567 7430 1 11 . 1 1 29 29 LYS H H 29 8.588 8.588 8.542 0.046 25567 7431 1 11 . 1 1 30 30 ASP N N 30 119.366 119.366 122.293 -2.927 25567 7432 1 11 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.335 0.067 25567 7433 1 11 . 1 1 30 30 ASP C C 30 172.580 172.580 175.527 -2.947 25567 7434 1 11 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.327 -1.703 25567 7435 1 11 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.464 -3.636 25567 7436 1 11 . 1 1 30 30 ASP H H 30 8.940 8.940 8.870 0.070 25567 7437 1 11 . 1 1 31 31 SER N N 31 114.035 114.035 112.809 1.226 25567 7438 1 11 . 1 1 31 31 SER HA H 31 4.781 4.781 4.758 0.023 25567 7439 1 11 . 1 1 31 31 SER C C 31 171.136 171.136 174.648 -3.512 25567 7440 1 11 . 1 1 31 31 SER CA C 31 55.638 55.638 58.414 -2.776 25567 7441 1 11 . 1 1 31 31 SER CB C 31 62.388 62.388 64.970 -2.582 25567 7442 1 11 . 1 1 31 31 SER H H 31 8.030 8.030 7.841 0.189 25567 7443 1 11 . 1 1 32 32 GLU N N 32 121.406 121.406 118.618 2.788 25567 7444 1 11 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.645 0.090 25567 7445 1 11 . 1 1 32 32 GLU C C 32 171.205 171.205 174.602 -3.397 25567 7446 1 11 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.569 -3.500 25567 7447 1 11 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.714 -2.824 25567 7448 1 11 . 1 1 32 32 GLU H H 32 8.188 8.188 8.734 -0.546 25567 7449 1 11 . 1 1 33 33 LEU N N 33 126.143 126.143 122.142 4.001 25567 7450 1 11 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.121 0.164 25567 7451 1 11 . 1 1 33 33 LEU C C 33 173.401 173.401 176.003 -2.602 25567 7452 1 11 . 1 1 33 33 LEU CA C 33 51.334 51.334 54.052 -2.718 25567 7453 1 11 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.262 -0.639 25567 7454 1 11 . 1 1 33 33 LEU H H 33 8.627 8.627 8.577 0.050 25567 7455 1 11 . 1 1 34 34 LYS N N 34 127.122 127.122 125.382 1.740 25567 7456 1 11 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.764 -0.165 25567 7457 1 11 . 1 1 34 34 LYS C C 34 169.644 169.644 174.677 -5.033 25567 7458 1 11 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.404 -2.050 25567 7459 1 11 . 1 1 34 34 LYS CB C 34 34.172 34.172 36.552 -2.380 25567 7460 1 11 . 1 1 34 34 LYS H H 34 9.399 9.399 8.893 0.506 25567 7461 1 11 . 1 1 35 35 GLU N N 35 122.766 122.766 120.389 2.377 25567 7462 1 11 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.024 -0.666 25567 7463 1 11 . 1 1 35 35 GLU C C 35 172.875 172.875 174.527 -1.652 25567 7464 1 11 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.472 -2.832 25567 7465 1 11 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.280 -2.012 25567 7466 1 11 . 1 1 35 35 GLU H H 35 8.166 8.166 8.452 -0.286 25567 7467 1 11 . 1 1 36 36 VAL N N 36 126.674 126.674 120.914 5.760 25567 7468 1 11 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.242 -0.381 25567 7469 1 11 . 1 1 36 36 VAL C C 36 171.451 171.451 174.968 -3.517 25567 7470 1 11 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.980 -1.443 25567 7471 1 11 . 1 1 36 36 VAL CB C 36 29.689 29.689 33.648 -3.959 25567 7472 1 11 . 1 1 36 36 VAL H H 36 8.632 8.632 8.106 0.526 25567 7473 1 11 . 1 1 37 37 LYS N N 37 126.181 126.181 127.900 -1.719 25567 7474 1 11 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.831 0.108 25567 7475 1 11 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.091 -1.912 25567 7476 1 11 . 1 1 37 37 LYS CB C 37 32.898 32.898 35.520 -2.622 25567 7477 1 11 . 1 1 37 37 LYS H H 37 7.867 7.867 8.665 -0.798 25567 7478 1 11 . 1 1 38 38 VAL N N 38 113.540 113.540 115.900 -2.360 25567 7479 1 11 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.652 0.034 25567 7480 1 11 . 1 1 38 38 VAL C C 38 173.633 173.633 175.278 -1.645 25567 7481 1 11 . 1 1 38 38 VAL CA C 38 57.284 57.284 60.693 -3.409 25567 7482 1 11 . 1 1 38 38 VAL CB C 38 31.964 31.964 34.147 -2.183 25567 7483 1 11 . 1 1 38 38 VAL H H 38 8.389 8.389 8.239 0.150 25567 7484 1 11 . 1 1 39 39 SER N N 39 118.860 118.860 118.324 0.536 25567 7485 1 11 . 1 1 39 39 SER HA H 39 4.194 4.194 4.550 -0.356 25567 7486 1 11 . 1 1 39 39 SER C C 39 173.059 173.059 175.073 -2.014 25567 7487 1 11 . 1 1 39 39 SER CA C 39 56.227 56.227 58.743 -2.516 25567 7488 1 11 . 1 1 39 39 SER CB C 39 60.771 60.771 64.286 -3.515 25567 7489 1 11 . 1 1 39 39 SER H H 39 8.668 8.668 8.691 -0.023 25567 7490 1 11 . 1 1 40 40 GLU N N 40 125.769 125.769 122.061 3.708 25567 7491 1 11 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.618 -0.461 25567 7492 1 11 . 1 1 40 40 GLU C C 40 174.484 174.484 177.004 -2.520 25567 7493 1 11 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.590 -1.040 25567 7494 1 11 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.189 -3.135 25567 7495 1 11 . 1 1 40 40 GLU H H 40 8.878 8.878 8.538 0.340 25567 7496 1 11 . 1 1 41 41 GLY N N 41 112.165 112.165 106.317 5.848 25567 7497 1 11 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.452 -1.745 25567 7498 1 11 . 1 1 41 41 GLY H H 41 8.743 8.743 8.734 0.009 25567 7499 1 11 . 1 1 44 44 ASP N N 44 122.324 122.324 121.255 1.069 25567 7500 1 11 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.170 1.986 25567 7501 1 11 . 1 1 44 44 ASP H H 44 7.918 7.918 8.541 -0.623 25567 7502 1 11 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.075 -0.013 25567 7503 1 11 . 1 1 45 45 ALA CA C 45 51.410 51.410 54.363 -2.953 25567 7504 1 11 . 1 1 45 45 ALA CB C 45 16.376 16.376 19.193 -2.817 25567 7505 1 11 . 1 1 47 47 MET CA C 47 54.118 54.118 54.971 -0.853 25567 7506 1 11 . 1 1 47 47 MET CB C 47 27.527 27.527 32.937 -5.410 25567 7507 1 11 . 1 1 48 48 TYR N N 48 120.075 120.075 118.017 2.058 25567 7508 1 11 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.252 -0.098 25567 7509 1 11 . 1 1 48 48 TYR C C 48 172.217 172.217 175.079 -2.862 25567 7510 1 11 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.250 -1.873 25567 7511 1 11 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.270 -2.774 25567 7512 1 11 . 1 1 48 48 TYR H H 48 7.810 7.810 7.668 0.142 25567 7513 1 11 . 1 1 49 49 LYS N N 49 118.369 118.369 118.154 0.215 25567 7514 1 11 . 1 1 49 49 LYS H H 49 8.116 8.116 8.544 -0.428 25567 7515 1 11 . 1 1 50 50 THR N N 50 116.979 116.979 115.898 1.081 25567 7516 1 11 . 1 1 50 50 THR CB C 50 66.373 66.373 69.490 -3.117 25567 7517 1 11 . 1 1 50 50 THR H H 50 7.741 7.741 8.414 -0.673 25567 7518 1 11 . 1 1 51 51 SER N N 51 116.155 116.155 115.934 0.221 25567 7519 1 11 . 1 1 51 51 SER HA H 51 3.771 3.771 4.693 -0.922 25567 7520 1 11 . 1 1 51 51 SER C C 51 170.563 170.563 173.280 -2.717 25567 7521 1 11 . 1 1 51 51 SER CA C 51 54.840 54.840 57.911 -3.071 25567 7522 1 11 . 1 1 51 51 SER CB C 51 60.318 60.318 64.545 -4.227 25567 7523 1 11 . 1 1 51 51 SER H H 51 7.853 7.853 7.770 0.083 25567 7524 1 11 . 1 1 54 54 ALA N N 54 123.234 123.234 126.167 -2.933 25567 7525 1 11 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.398 -0.150 25567 7526 1 11 . 1 1 54 54 ALA CA C 54 51.268 51.268 53.028 -1.760 25567 7527 1 11 . 1 1 54 54 ALA CB C 54 16.434 16.434 19.747 -3.313 25567 7528 1 11 . 1 1 54 54 ALA H H 54 8.207 8.207 8.175 0.032 25567 7529 1 11 . 1 1 55 55 LEU N N 55 118.603 118.603 120.828 -2.225 25567 7530 1 11 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.337 -0.397 25567 7531 1 11 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.368 -0.657 25567 7532 1 11 . 1 1 55 55 LEU CB C 55 38.913 38.913 41.351 -2.438 25567 7533 1 11 . 1 1 55 55 LEU H H 55 7.960 7.960 8.143 -0.183 25567 7534 1 11 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.204 -0.527 25567 7535 1 11 . 1 1 58 58 ILE CA C 58 61.494 61.494 60.892 0.603 25567 7536 1 11 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.969 -3.915 25567 7537 1 11 . 1 1 59 59 GLN N N 59 117.579 117.579 121.351 -3.772 25567 7538 1 11 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.316 -0.183 25567 7539 1 11 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.904 -2.895 25567 7540 1 11 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.955 -2.304 25567 7541 1 11 . 1 1 59 59 GLN H H 59 8.268 8.268 8.458 -0.190 25567 7542 1 11 . 1 1 60 60 GLY N N 60 107.308 107.308 113.363 -6.055 25567 7543 1 11 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.329 -2.350 25567 7544 1 11 . 1 1 60 60 GLY H H 60 7.780 7.780 8.829 -1.049 25567 7545 1 11 . 1 1 61 61 ASN N N 61 117.747 117.747 119.243 -1.496 25567 7546 1 11 . 1 1 61 61 ASN HA H 61 4.534 4.534 5.014 -0.480 25567 7547 1 11 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.549 -1.314 25567 7548 1 11 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.762 -3.338 25567 7549 1 11 . 1 1 61 61 ASN H H 61 8.108 8.108 7.714 0.394 25567 7550 1 11 . 1 1 64 64 PHE N N 64 120.102 120.102 121.575 -1.473 25567 7551 1 11 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.633 -0.254 25567 7552 1 11 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.149 -2.401 25567 7553 1 11 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.037 -2.762 25567 7554 1 11 . 1 1 64 64 PHE H H 64 8.300 8.300 7.122 1.178 25567 7555 1 11 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.550 -0.215 25567 7556 1 11 . 1 1 65 65 PRO C C 65 173.870 173.870 176.124 -2.254 25567 7557 1 11 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.850 -2.833 25567 7558 1 11 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.586 -2.951 25567 7559 1 11 . 1 1 66 66 GLU N N 66 121.258 121.258 121.679 -0.421 25567 7560 1 11 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.524 -0.290 25567 7561 1 11 . 1 1 66 66 GLU C C 66 173.981 173.981 176.780 -2.799 25567 7562 1 11 . 1 1 66 66 GLU CA C 66 53.787 53.787 55.298 -1.511 25567 7563 1 11 . 1 1 66 66 GLU CB C 66 27.775 27.775 31.168 -3.393 25567 7564 1 11 . 1 1 66 66 GLU H H 66 8.316 8.316 8.531 -0.215 25567 7565 1 11 . 1 1 67 67 ILE N N 67 114.290 114.290 118.527 -4.237 25567 7566 1 11 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.465 0.664 25567 7567 1 11 . 1 1 67 67 ILE C C 67 172.700 172.700 175.775 -3.075 25567 7568 1 11 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.769 -3.330 25567 7569 1 11 . 1 1 67 67 ILE CB C 67 39.159 39.159 38.968 0.191 25567 7570 1 11 . 1 1 67 67 ILE H H 67 8.366 8.366 8.381 -0.015 25567 7571 1 11 . 1 1 68 68 GLN N N 68 121.422 121.422 120.095 1.327 25567 7572 1 11 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.689 -0.188 25567 7573 1 11 . 1 1 68 68 GLN C C 68 171.675 171.675 173.827 -2.152 25567 7574 1 11 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.730 -2.457 25567 7575 1 11 . 1 1 68 68 GLN CB C 68 27.143 27.143 32.722 -5.579 25567 7576 1 11 . 1 1 68 68 GLN H H 68 8.737 8.737 8.353 0.384 25567 7577 1 11 . 1 1 69 69 LEU N N 69 125.311 125.311 117.083 8.228 25567 7578 1 11 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.657 -0.151 25567 7579 1 11 . 1 1 69 69 LEU C C 69 172.634 172.634 175.054 -2.420 25567 7580 1 11 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.975 -2.216 25567 7581 1 11 . 1 1 69 69 LEU CB C 69 42.404 42.404 44.192 -1.788 25567 7582 1 11 . 1 1 69 69 LEU H H 69 8.051 8.051 8.263 -0.212 25567 7583 1 11 . 1 1 70 70 ASP N N 70 122.763 122.763 119.620 3.143 25567 7584 1 11 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.622 -0.199 25567 7585 1 11 . 1 1 70 70 ASP CA C 70 51.610 51.610 54.992 -3.382 25567 7586 1 11 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.083 -3.366 25567 7587 1 11 . 1 1 70 70 ASP H H 70 8.313 8.313 8.521 -0.208 25567 7588 1 11 . 1 1 71 71 ASN N N 71 117.413 117.413 118.293 -0.880 25567 7589 1 11 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.622 -0.285 25567 7590 1 11 . 1 1 71 71 ASN C C 71 171.770 171.770 174.247 -2.477 25567 7591 1 11 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.551 -2.060 25567 7592 1 11 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.794 -2.468 25567 7593 1 11 . 1 1 71 71 ASN H H 71 8.407 8.407 8.522 -0.115 25567 7594 1 11 . 1 1 72 72 ILE N N 72 123.752 123.752 125.331 -1.579 25567 7595 1 11 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.236 -0.296 25567 7596 1 11 . 1 1 72 72 ILE C C 72 171.621 171.621 174.445 -2.824 25567 7597 1 11 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.206 -2.874 25567 7598 1 11 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.912 -1.423 25567 7599 1 11 . 1 1 72 72 ILE H H 72 7.639 7.639 7.693 -0.054 25567 7600 1 11 . 1 1 73 73 ASP N N 73 125.252 125.252 127.462 -2.210 25567 7601 1 11 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.566 0.059 25567 7602 1 11 . 1 1 73 73 ASP C C 73 174.034 174.034 176.826 -2.792 25567 7603 1 11 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.889 -4.686 25567 7604 1 11 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.685 -4.661 25567 7605 1 11 . 1 1 73 73 ASP H H 73 8.394 8.394 8.636 -0.242 25567 7606 1 11 . 1 1 74 74 TYR N N 74 123.108 123.108 123.591 -0.483 25567 7607 1 11 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.387 -0.509 25567 7608 1 11 . 1 1 74 74 TYR C C 74 173.637 173.637 177.331 -3.694 25567 7609 1 11 . 1 1 74 74 TYR CA C 74 59.474 59.474 60.715 -1.241 25567 7610 1 11 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.125 -3.403 25567 7611 1 11 . 1 1 74 74 TYR H H 74 7.392 7.392 8.309 -0.917 25567 7612 1 11 . 1 1 75 75 ASN N N 75 109.422 109.422 114.881 -5.459 25567 7613 1 11 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.718 0.208 25567 7614 1 11 . 1 1 75 75 ASN C C 75 172.574 172.574 176.188 -3.614 25567 7615 1 11 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.447 -2.686 25567 7616 1 11 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.052 -2.435 25567 7617 1 11 . 1 1 75 75 ASN H H 75 8.058 8.058 8.874 -0.816 25567 7618 1 11 . 1 1 76 76 ASN N N 76 117.422 117.422 116.400 1.022 25567 7619 1 11 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.528 -0.073 25567 7620 1 11 . 1 1 76 76 ASN C C 76 171.132 171.132 174.751 -3.619 25567 7621 1 11 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.992 -2.825 25567 7622 1 11 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.393 -2.665 25567 7623 1 11 . 1 1 76 76 ASN H H 76 7.768 7.768 8.138 -0.370 25567 7624 1 11 . 1 1 77 77 TYR N N 77 116.873 116.873 116.391 0.482 25567 7625 1 11 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.618 -0.255 25567 7626 1 11 . 1 1 77 77 TYR C C 77 172.175 172.175 173.813 -1.638 25567 7627 1 11 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.728 -2.365 25567 7628 1 11 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.147 -3.982 25567 7629 1 11 . 1 1 77 77 TYR H H 77 7.825 7.825 7.436 0.389 25567 7630 1 11 . 1 1 78 78 ASP N N 78 121.271 121.271 119.302 1.969 25567 7631 1 11 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.910 -0.105 25567 7632 1 11 . 1 1 78 78 ASP C C 78 172.641 172.641 175.500 -2.859 25567 7633 1 11 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.703 -0.447 25567 7634 1 11 . 1 1 78 78 ASP CB C 78 41.075 41.075 43.212 -2.137 25567 7635 1 11 . 1 1 78 78 ASP H H 78 9.058 9.058 8.500 0.558 25567 7636 1 11 . 1 1 79 79 LEU N N 79 122.985 122.985 119.171 3.814 25567 7637 1 11 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.087 0.027 25567 7638 1 11 . 1 1 79 79 LEU C C 79 170.721 170.721 174.613 -3.892 25567 7639 1 11 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.295 -2.979 25567 7640 1 11 . 1 1 79 79 LEU CB C 79 42.342 42.342 46.541 -4.199 25567 7641 1 11 . 1 1 79 79 LEU H H 79 7.893 7.893 7.708 0.185 25567 7642 1 11 . 1 1 80 80 ILE N N 80 126.364 126.364 123.017 3.347 25567 7643 1 11 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.669 0.420 25567 7644 1 11 . 1 1 80 80 ILE C C 80 171.580 171.580 174.401 -2.821 25567 7645 1 11 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.722 -3.305 25567 7646 1 11 . 1 1 80 80 ILE CB C 80 38.136 38.136 40.480 -2.344 25567 7647 1 11 . 1 1 80 80 ILE H H 80 8.717 8.717 9.065 -0.348 25567 7648 1 11 . 1 1 81 81 LEU N N 81 126.199 126.199 127.897 -1.698 25567 7649 1 11 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.066 0.069 25567 7650 1 11 . 1 1 81 81 LEU C C 81 172.979 172.979 176.122 -3.143 25567 7651 1 11 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.511 -3.878 25567 7652 1 11 . 1 1 81 81 LEU CB C 81 42.159 42.159 44.772 -2.612 25567 7653 1 11 . 1 1 81 81 LEU H H 81 9.230 9.230 9.084 0.146 25567 7654 1 11 . 1 1 82 82 ILE N N 82 120.505 120.505 118.849 1.656 25567 7655 1 11 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.866 0.050 25567 7656 1 11 . 1 1 82 82 ILE C C 82 173.011 173.011 175.090 -2.079 25567 7657 1 11 . 1 1 82 82 ILE CA C 82 56.828 56.828 60.506 -3.678 25567 7658 1 11 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.587 -3.519 25567 7659 1 11 . 1 1 82 82 ILE H H 82 8.796 8.796 8.096 0.700 25567 7660 1 11 . 1 1 83 83 GLY N N 83 120.857 120.857 113.794 7.063 25567 7661 1 11 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.036 -2.233 25567 7662 1 11 . 1 1 83 83 GLY H H 83 9.525 9.525 8.573 0.952 25567 7663 1 11 . 1 1 84 84 SER N N 84 116.007 116.007 114.606 1.401 25567 7664 1 11 . 1 1 84 84 SER HA H 84 5.476 5.476 5.479 -0.003 25567 7665 1 11 . 1 1 84 84 SER CA C 84 51.937 51.937 55.691 -3.754 25567 7666 1 11 . 1 1 84 84 SER CB C 84 64.533 64.533 65.269 -0.736 25567 7667 1 11 . 1 1 84 84 SER H H 84 7.617 7.617 8.004 -0.387 25567 7668 1 11 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.803 0.398 25567 7669 1 11 . 1 1 85 85 PRO C C 85 173.574 173.574 175.649 -2.075 25567 7670 1 11 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.013 -2.525 25567 7671 1 11 . 1 1 85 85 PRO CB C 85 31.140 31.140 33.247 -2.107 25567 7672 1 11 . 1 1 86 86 VAL N N 86 117.603 117.603 117.227 0.376 25567 7673 1 11 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.341 0.032 25567 7674 1 11 . 1 1 86 86 VAL C C 86 172.777 172.777 174.004 -1.227 25567 7675 1 11 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.644 -2.041 25567 7676 1 11 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.571 -5.997 25567 7677 1 11 . 1 1 86 86 VAL H H 86 8.194 8.194 7.610 0.584 25567 7678 1 11 . 1 1 87 87 TRP N N 87 131.187 131.187 127.121 4.066 25567 7679 1 11 . 1 1 87 87 TRP HA H 87 5.198 5.198 5.040 0.158 25567 7680 1 11 . 1 1 87 87 TRP C C 87 173.295 173.295 174.909 -1.614 25567 7681 1 11 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.096 -7.312 25567 7682 1 11 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.385 -3.639 25567 7683 1 11 . 1 1 87 87 TRP H H 87 9.637 9.637 8.486 1.151 25567 7684 1 11 . 1 1 88 88 SER N N 88 119.829 119.829 113.719 6.110 25567 7685 1 11 . 1 1 88 88 SER HA H 88 3.986 3.986 4.512 -0.526 25567 7686 1 11 . 1 1 88 88 SER C C 88 172.375 172.375 174.454 -2.079 25567 7687 1 11 . 1 1 88 88 SER CA C 88 55.932 55.932 57.702 -1.770 25567 7688 1 11 . 1 1 88 88 SER CB C 88 59.178 59.178 64.995 -5.817 25567 7689 1 11 . 1 1 88 88 SER H H 88 9.272 9.272 7.944 1.328 25567 7690 1 11 . 1 1 89 89 GLY N N 89 101.498 101.498 110.311 -8.813 25567 7691 1 11 . 1 1 89 89 GLY CA C 89 42.671 42.671 45.333 -2.662 25567 7692 1 11 . 1 1 89 89 GLY H H 89 7.463 7.463 8.411 -0.948 25567 7693 1 11 . 1 1 90 90 TYR N N 90 121.064 121.064 116.320 4.744 25567 7694 1 11 . 1 1 90 90 TYR HA H 90 4.216 4.216 4.898 -0.682 25567 7695 1 11 . 1 1 90 90 TYR CA C 90 54.090 54.090 53.654 0.436 25567 7696 1 11 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.386 0.809 25567 7697 1 11 . 1 1 90 90 TYR H H 90 8.064 8.064 8.036 0.028 25567 7698 1 11 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.545 0.387 25567 7699 1 11 . 1 1 91 91 PRO C C 91 171.019 171.019 176.552 -5.533 25567 7700 1 11 . 1 1 91 91 PRO CA C 91 58.994 58.994 64.211 -5.217 25567 7701 1 11 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.586 -6.093 25567 7702 1 11 . 1 1 92 92 ALA N N 92 119.893 119.893 122.211 -2.318 25567 7703 1 11 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.638 -1.187 25567 7704 1 11 . 1 1 92 92 ALA C C 92 176.477 176.477 176.477 0.000 25567 7705 1 11 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.761 -2.194 25567 7706 1 11 . 1 1 92 92 ALA CB C 92 15.801 15.801 20.831 -5.030 25567 7707 1 11 . 1 1 92 92 ALA H H 92 7.278 7.278 8.258 -0.980 25567 7708 1 11 . 1 1 93 93 THR N N 93 112.992 112.992 110.014 2.978 25567 7709 1 11 . 1 1 93 93 THR HA H 93 4.462 4.462 4.723 -0.261 25567 7710 1 11 . 1 1 93 93 THR CA C 93 66.871 66.871 59.481 7.390 25567 7711 1 11 . 1 1 93 93 THR CB C 93 64.362 64.362 68.637 -4.275 25567 7712 1 11 . 1 1 93 93 THR H H 93 6.861 6.861 8.280 -1.419 25567 7713 1 11 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.331 -0.465 25567 7714 1 11 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.425 -0.404 25567 7715 1 11 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.348 -2.069 25567 7716 1 11 . 1 1 95 95 ILE N N 95 111.298 111.298 118.457 -7.159 25567 7717 1 11 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.348 -0.725 25567 7718 1 11 . 1 1 95 95 ILE C C 95 174.264 174.264 175.491 -1.227 25567 7719 1 11 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.018 -1.570 25567 7720 1 11 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.080 -4.151 25567 7721 1 11 . 1 1 95 95 ILE H H 95 7.974 7.974 7.859 0.115 25567 7722 1 11 . 1 1 96 96 LYS N N 96 123.045 123.045 120.737 2.308 25567 7723 1 11 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.445 -1.333 25567 7724 1 11 . 1 1 96 96 LYS C C 96 174.590 174.590 177.581 -2.991 25567 7725 1 11 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.211 -0.066 25567 7726 1 11 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.162 -4.317 25567 7727 1 11 . 1 1 96 96 LYS H H 96 6.958 6.958 7.744 -0.786 25567 7728 1 11 . 1 1 97 97 THR N N 97 113.412 113.412 116.569 -3.157 25567 7729 1 11 . 1 1 97 97 THR HA H 97 3.461 3.461 3.980 -0.519 25567 7730 1 11 . 1 1 97 97 THR C C 97 173.247 173.247 176.021 -2.774 25567 7731 1 11 . 1 1 97 97 THR CA C 97 62.809 62.809 66.874 -4.065 25567 7732 1 11 . 1 1 97 97 THR CB C 97 65.654 65.654 68.520 -2.866 25567 7733 1 11 . 1 1 97 97 THR H H 97 6.366 6.366 8.090 -1.724 25567 7734 1 11 . 1 1 98 98 LEU N N 98 121.201 121.201 121.975 -0.774 25567 7735 1 11 . 1 1 98 98 LEU HA H 98 3.634 3.634 3.991 -0.357 25567 7736 1 11 . 1 1 98 98 LEU C C 98 174.590 174.590 178.427 -3.837 25567 7737 1 11 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.950 -2.329 25567 7738 1 11 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.922 -1.027 25567 7739 1 11 . 1 1 98 98 LEU H H 98 7.554 7.554 7.967 -0.413 25567 7740 1 11 . 1 1 99 99 LEU N N 99 118.677 118.677 117.934 0.743 25567 7741 1 11 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.756 -0.054 25567 7742 1 11 . 1 1 99 99 LEU C C 99 177.457 177.457 178.256 -0.799 25567 7743 1 11 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.439 -2.260 25567 7744 1 11 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.619 -2.631 25567 7745 1 11 . 1 1 99 99 LEU H H 99 8.160 8.160 7.477 0.683 25567 7746 1 11 . 1 1 100 100 ASP N N 100 118.914 118.914 116.014 2.900 25567 7747 1 11 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.418 -0.189 25567 7748 1 11 . 1 1 100 100 ASP C C 100 176.585 176.585 178.378 -1.793 25567 7749 1 11 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.516 -2.000 25567 7750 1 11 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.203 -3.624 25567 7751 1 11 . 1 1 100 100 ASP H H 100 7.872 7.872 7.792 0.080 25567 7752 1 11 . 1 1 101 101 GLN N N 101 118.135 118.135 118.076 0.059 25567 7753 1 11 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.254 -0.094 25567 7754 1 11 . 1 1 101 101 GLN C C 101 174.601 174.601 178.250 -3.649 25567 7755 1 11 . 1 1 101 101 GLN CA C 101 54.960 54.960 57.873 -2.913 25567 7756 1 11 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.398 -3.848 25567 7757 1 11 . 1 1 101 101 GLN H H 101 7.673 7.673 7.708 -0.035 25567 7758 1 11 . 1 1 102 102 MET N N 102 118.420 118.420 119.038 -0.618 25567 7759 1 11 . 1 1 102 102 MET HA H 102 3.826 3.826 4.193 -0.367 25567 7760 1 11 . 1 1 102 102 MET C C 102 172.780 172.780 176.262 -3.482 25567 7761 1 11 . 1 1 102 102 MET CA C 102 53.428 53.428 56.149 -2.721 25567 7762 1 11 . 1 1 102 102 MET CB C 102 31.221 31.221 30.709 0.512 25567 7763 1 11 . 1 1 102 102 MET H H 102 7.462 7.462 7.813 -0.351 25567 7764 1 11 . 1 1 103 103 LYS N N 103 116.066 116.066 119.507 -3.441 25567 7765 1 11 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.276 -0.356 25567 7766 1 11 . 1 1 103 103 LYS C C 103 173.922 173.922 177.467 -3.545 25567 7767 1 11 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.034 -1.752 25567 7768 1 11 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.963 -2.472 25567 7769 1 11 . 1 1 103 103 LYS H H 103 6.875 6.875 7.926 -1.051 25567 7770 1 11 . 1 1 104 104 ASN N N 104 114.987 114.987 116.169 -1.182 25567 7771 1 11 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.888 -0.147 25567 7772 1 11 . 1 1 104 104 ASN C C 104 172.587 172.587 173.267 -0.680 25567 7773 1 11 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.870 -2.401 25567 7774 1 11 . 1 1 104 104 ASN CB C 104 35.822 35.822 40.106 -4.284 25567 7775 1 11 . 1 1 104 104 ASN H H 104 8.517 8.517 8.634 -0.117 25567 7776 1 11 . 1 1 105 105 TYR N N 105 122.755 122.755 120.131 2.624 25567 7777 1 11 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.714 -0.139 25567 7778 1 11 . 1 1 105 105 TYR C C 105 174.260 174.260 174.277 -0.017 25567 7779 1 11 . 1 1 105 105 TYR CA C 105 55.493 55.493 57.870 -2.377 25567 7780 1 11 . 1 1 105 105 TYR CB C 105 36.064 36.064 40.429 -4.365 25567 7781 1 11 . 1 1 105 105 TYR H H 105 8.287 8.287 7.588 0.699 25567 7782 1 11 . 1 1 106 106 ARG N N 106 128.905 128.905 118.807 10.098 25567 7783 1 11 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.711 -0.438 25567 7784 1 11 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.518 -2.497 25567 7785 1 11 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.117 -4.987 25567 7786 1 11 . 1 1 106 106 ARG H H 106 8.841 8.841 8.891 -0.050 25567 7787 1 11 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.548 -2.051 25567 7788 1 11 . 1 1 108 108 GLU N N 108 116.989 116.989 121.043 -4.054 25567 7789 1 11 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.642 -0.011 25567 7790 1 11 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.749 -2.073 25567 7791 1 11 . 1 1 108 108 GLU CB C 108 30.402 30.402 31.567 -1.165 25567 7792 1 11 . 1 1 108 108 GLU H H 108 7.536 7.536 8.336 -0.800 25567 7793 1 11 . 1 1 109 109 VAL N N 109 123.416 123.416 125.854 -2.438 25567 7794 1 11 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.905 0.416 25567 7795 1 11 . 1 1 109 109 VAL CA C 109 57.443 57.443 61.339 -3.896 25567 7796 1 11 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.157 -0.496 25567 7797 1 11 . 1 1 109 109 VAL H H 109 8.955 8.955 9.043 -0.088 25567 7798 1 11 . 1 1 110 110 ALA N N 110 127.975 127.975 128.885 -0.910 25567 7799 1 11 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.304 -0.627 25567 7800 1 11 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.877 -2.436 25567 7801 1 11 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.416 -4.000 25567 7802 1 11 . 1 1 110 110 ALA H H 110 8.860 8.860 8.875 -0.015 25567 7803 1 11 . 1 1 111 111 SER N N 111 110.482 110.482 112.968 -2.486 25567 7804 1 11 . 1 1 111 111 SER HA H 111 5.502 5.502 5.290 0.212 25567 7805 1 11 . 1 1 111 111 SER CA C 111 51.630 51.630 56.451 -4.821 25567 7806 1 11 . 1 1 111 111 SER CB C 111 62.267 62.267 65.491 -3.224 25567 7807 1 11 . 1 1 111 111 SER H H 111 7.484 7.484 7.885 -0.401 25567 7808 1 11 . 1 1 112 112 PHE N N 112 125.082 125.082 122.045 3.037 25567 7809 1 11 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.709 0.739 25567 7810 1 11 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.759 -5.325 25567 7811 1 11 . 1 1 112 112 PHE CB C 112 40.500 40.500 40.535 -0.035 25567 7812 1 11 . 1 1 112 112 PHE H H 112 8.025 8.025 8.515 -0.490 25567 7813 1 11 . 1 1 113 113 PHE N N 113 115.872 115.872 120.939 -5.067 25567 7814 1 11 . 1 1 113 113 PHE HA H 113 5.924 5.924 4.913 1.011 25567 7815 1 11 . 1 1 113 113 PHE C C 113 173.293 173.293 174.804 -1.511 25567 7816 1 11 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.266 -4.798 25567 7817 1 11 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.423 -3.030 25567 7818 1 11 . 1 1 113 113 PHE H H 113 7.391 7.391 8.058 -0.667 25567 7819 1 11 . 1 1 114 114 THR N N 114 108.721 108.721 111.918 -3.197 25567 7820 1 11 . 1 1 114 114 THR HA H 114 4.933 4.933 4.341 0.592 25567 7821 1 11 . 1 1 114 114 THR C C 114 171.891 171.891 174.023 -2.132 25567 7822 1 11 . 1 1 114 114 THR CA C 114 56.815 56.815 60.863 -4.048 25567 7823 1 11 . 1 1 114 114 THR CB C 114 67.899 67.899 67.980 -0.081 25567 7824 1 11 . 1 1 114 114 THR H H 114 7.951 7.951 8.696 -0.745 25567 7825 1 11 . 1 1 115 115 SER N N 115 115.159 115.159 117.245 -2.086 25567 7826 1 11 . 1 1 115 115 SER HA H 115 4.608 4.608 4.569 0.039 25567 7827 1 11 . 1 1 115 115 SER C C 115 171.403 171.403 174.675 -3.272 25567 7828 1 11 . 1 1 115 115 SER CA C 115 55.570 55.570 58.716 -3.146 25567 7829 1 11 . 1 1 115 115 SER CB C 115 61.418 61.418 64.243 -2.825 25567 7830 1 11 . 1 1 115 115 SER H H 115 8.229 8.229 7.843 0.386 25567 7831 1 11 . 1 1 116 116 ALA N N 116 127.211 127.211 125.131 2.080 25567 7832 1 11 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.989 -0.533 25567 7833 1 11 . 1 1 116 116 ALA C C 116 175.758 175.758 178.924 -3.166 25567 7834 1 11 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.959 -3.143 25567 7835 1 11 . 1 1 116 116 ALA CB C 116 16.831 16.831 18.644 -1.813 25567 7836 1 11 . 1 1 116 116 ALA H H 116 8.813 8.813 8.052 0.761 25567 7837 1 11 . 1 1 117 117 GLY N N 117 108.099 108.099 106.537 1.562 25567 7838 1 11 . 1 1 117 117 GLY C C 117 171.805 171.805 175.415 -3.610 25567 7839 1 11 . 1 1 117 117 GLY CA C 117 42.869 42.869 46.856 -3.987 25567 7840 1 11 . 1 1 117 117 GLY H H 117 8.685 8.685 8.527 0.158 25567 7841 1 11 . 1 1 118 118 THR N N 118 111.284 111.284 111.365 -0.081 25567 7842 1 11 . 1 1 118 118 THR HA H 118 4.343 4.343 4.464 -0.121 25567 7843 1 11 . 1 1 118 118 THR C C 118 171.769 171.769 173.376 -1.607 25567 7844 1 11 . 1 1 118 118 THR CA C 118 58.933 58.933 62.106 -3.173 25567 7845 1 11 . 1 1 118 118 THR CB C 118 67.304 67.304 70.717 -3.413 25567 7846 1 11 . 1 1 118 118 THR H H 118 7.998 7.998 7.981 0.017 25567 7847 1 11 . 1 1 119 119 ASN N N 119 120.253 120.253 120.561 -0.308 25567 7848 1 11 . 1 1 119 119 ASN HA H 119 4.703 4.703 5.100 -0.397 25567 7849 1 11 . 1 1 119 119 ASN C C 119 172.353 172.353 173.757 -1.404 25567 7850 1 11 . 1 1 119 119 ASN CA C 119 50.228 50.228 52.771 -2.543 25567 7851 1 11 . 1 1 119 119 ASN CB C 119 35.376 35.376 40.734 -5.358 25567 7852 1 11 . 1 1 119 119 ASN H H 119 8.381 8.381 8.006 0.375 25567 7853 1 11 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.667 -0.581 25567 7854 1 11 . 1 1 120 120 HIS C C 120 173.395 173.395 176.345 -2.950 25567 7855 1 11 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.661 -2.522 25567 7856 1 11 . 1 1 120 120 HIS CB C 120 28.422 28.422 32.008 -3.586 25567 7857 1 11 . 1 1 121 121 LYS N N 121 119.527 119.527 120.647 -1.120 25567 7858 1 11 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.775 0.005 25567 7859 1 11 . 1 1 121 121 LYS C C 121 176.053 176.053 178.264 -2.211 25567 7860 1 11 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.278 -2.315 25567 7861 1 11 . 1 1 121 121 LYS CB C 121 29.660 29.660 32.368 -2.708 25567 7862 1 11 . 1 1 121 121 LYS H H 121 8.106 8.106 8.563 -0.457 25567 7863 1 11 . 1 1 122 122 ALA N N 122 121.585 121.585 121.312 0.273 25567 7864 1 11 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.772 -0.051 25567 7865 1 11 . 1 1 122 122 ALA C C 122 175.128 175.128 179.114 -3.986 25567 7866 1 11 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.599 -3.008 25567 7867 1 11 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.938 -2.234 25567 7868 1 11 . 1 1 122 122 ALA H H 122 7.702 7.702 7.974 -0.272 25567 7869 1 11 . 1 1 123 123 TYR N N 123 118.803 118.803 120.811 -2.008 25567 7870 1 11 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.228 -0.862 25567 7871 1 11 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.324 -1.233 25567 7872 1 11 . 1 1 123 123 TYR CB C 123 35.102 35.102 37.912 -2.810 25567 7873 1 11 . 1 1 123 123 TYR H H 123 7.366 7.366 7.730 -0.364 25567 7874 1 11 . 1 1 124 124 VAL N N 124 117.530 117.530 118.061 -0.531 25567 7875 1 11 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.566 -0.367 25567 7876 1 11 . 1 1 124 124 VAL C C 124 175.375 175.375 178.229 -2.854 25567 7877 1 11 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.989 -2.406 25567 7878 1 11 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.192 -1.989 25567 7879 1 11 . 1 1 124 124 VAL H H 124 7.757 7.757 7.886 -0.129 25567 7880 1 11 . 1 1 125 125 SER N N 125 114.023 114.023 115.535 -1.512 25567 7881 1 11 . 1 1 125 125 SER HA H 125 4.035 4.035 3.993 0.042 25567 7882 1 11 . 1 1 125 125 SER C C 125 174.636 174.636 176.828 -2.192 25567 7883 1 11 . 1 1 125 125 SER CA C 125 58.885 58.885 62.070 -3.185 25567 7884 1 11 . 1 1 125 125 SER CB C 125 59.666 59.666 62.759 -3.093 25567 7885 1 11 . 1 1 125 125 SER H H 125 7.622 7.622 7.445 0.177 25567 7886 1 11 . 1 1 126 126 HIS N N 126 119.457 119.457 119.935 -0.478 25567 7887 1 11 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.975 0.221 25567 7888 1 11 . 1 1 126 126 HIS C C 126 172.942 172.942 177.759 -4.817 25567 7889 1 11 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.478 -3.560 25567 7890 1 11 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.430 -3.351 25567 7891 1 11 . 1 1 126 126 HIS H H 126 8.067 8.067 7.907 0.160 25567 7892 1 11 . 1 1 127 127 PHE N N 127 120.628 120.628 120.367 0.261 25567 7893 1 11 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.906 -0.707 25567 7894 1 11 . 1 1 127 127 PHE C C 127 173.515 173.515 176.374 -2.859 25567 7895 1 11 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.374 1.307 25567 7896 1 11 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.822 -2.455 25567 7897 1 11 . 1 1 127 127 PHE H H 127 9.083 9.083 8.179 0.904 25567 7898 1 11 . 1 1 128 128 ASN N N 128 114.858 114.858 117.294 -2.436 25567 7899 1 11 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.034 0.044 25567 7900 1 11 . 1 1 128 128 ASN C C 128 175.338 175.338 177.525 -2.187 25567 7901 1 11 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.623 -2.373 25567 7902 1 11 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.184 -2.163 25567 7903 1 11 . 1 1 128 128 ASN H H 128 7.858 7.858 7.778 0.080 25567 7904 1 11 . 1 1 129 129 GLU N N 129 119.811 119.811 118.667 1.144 25567 7905 1 11 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.131 -0.090 25567 7906 1 11 . 1 1 129 129 GLU C C 129 176.941 176.941 178.517 -1.576 25567 7907 1 11 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.898 -2.266 25567 7908 1 11 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.105 -2.167 25567 7909 1 11 . 1 1 129 129 GLU H H 129 7.569 7.569 8.060 -0.491 25567 7910 1 11 . 1 1 130 130 TRP N N 130 120.585 120.585 116.428 4.157 25567 7911 1 11 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.721 -0.249 25567 7912 1 11 . 1 1 130 130 TRP C C 130 174.262 174.262 176.245 -1.983 25567 7913 1 11 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.276 -1.603 25567 7914 1 11 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.221 -2.264 25567 7915 1 11 . 1 1 130 130 TRP H H 130 7.964 7.964 7.487 0.477 25567 7916 1 11 . 1 1 131 131 ALA N N 131 120.522 120.522 119.151 1.371 25567 7917 1 11 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.340 -0.393 25567 7918 1 11 . 1 1 131 131 ALA C C 131 172.489 172.489 176.493 -4.004 25567 7919 1 11 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.453 -2.873 25567 7920 1 11 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.933 -3.394 25567 7921 1 11 . 1 1 131 131 ALA H H 131 8.114 8.114 7.373 0.741 25567 7922 1 11 . 1 1 132 132 ASP N N 132 117.666 117.666 121.055 -3.389 25567 7923 1 11 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.417 -0.211 25567 7924 1 11 . 1 1 132 132 ASP C C 132 173.779 173.779 176.455 -2.676 25567 7925 1 11 . 1 1 132 132 ASP CA C 132 54.313 54.313 54.699 -0.386 25567 7926 1 11 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.137 0.319 25567 7927 1 11 . 1 1 132 132 ASP H H 132 6.768 6.768 7.894 -1.126 25567 7928 1 11 . 1 1 133 133 GLY N N 133 114.922 114.922 110.425 4.497 25567 7929 1 11 . 1 1 133 133 GLY C C 133 172.101 172.101 174.260 -2.159 25567 7930 1 11 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.033 -2.524 25567 7931 1 11 . 1 1 133 133 GLY H H 133 8.645 8.645 8.050 0.595 25567 7932 1 11 . 1 1 134 134 LEU N N 134 120.101 120.101 120.815 -0.714 25567 7933 1 11 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.692 -0.230 25567 7934 1 11 . 1 1 134 134 LEU C C 134 174.098 174.098 175.985 -1.887 25567 7935 1 11 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.195 -2.111 25567 7936 1 11 . 1 1 134 134 LEU CB C 134 40.509 40.509 43.330 -2.821 25567 7937 1 11 . 1 1 134 134 LEU H H 134 8.049 8.049 7.577 0.472 25567 7938 1 11 . 1 1 135 135 ASN N N 135 119.258 119.258 120.428 -1.170 25567 7939 1 11 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.684 -0.045 25567 7940 1 11 . 1 1 135 135 ASN C C 135 170.564 170.564 173.989 -3.425 25567 7941 1 11 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.206 -3.954 25567 7942 1 11 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.338 -4.720 25567 7943 1 11 . 1 1 135 135 ASN H H 135 8.567 8.567 8.794 -0.227 25567 7944 1 11 . 1 1 136 136 VAL N N 136 125.460 125.460 127.192 -1.732 25567 7945 1 11 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.747 -0.151 25567 7946 1 11 . 1 1 136 136 VAL C C 136 175.318 175.318 175.997 -0.679 25567 7947 1 11 . 1 1 136 136 VAL CA C 136 58.722 58.722 61.743 -3.022 25567 7948 1 11 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.651 -3.352 25567 7949 1 11 . 1 1 136 136 VAL H H 136 7.660 7.660 8.291 -0.631 25567 7950 1 11 . 1 1 137 137 ILE N N 137 122.021 122.021 123.793 -1.772 25567 7951 1 11 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.627 -0.199 25567 7952 1 11 . 1 1 137 137 ILE C C 137 173.943 173.943 174.972 -1.029 25567 7953 1 11 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.557 -0.599 25567 7954 1 11 . 1 1 137 137 ILE CB C 137 36.169 36.169 37.927 -1.758 25567 7955 1 11 . 1 1 137 137 ILE H H 137 9.151 9.151 8.353 0.798 25567 7956 1 11 . 1 1 138 138 GLY N N 138 108.192 108.192 109.161 -0.969 25567 7957 1 11 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.851 -2.357 25567 7958 1 11 . 1 1 138 138 GLY H H 138 6.675 6.675 7.463 -0.788 25567 7959 1 11 . 1 1 139 139 VAL N N 139 119.673 119.673 123.205 -3.532 25567 7960 1 11 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.790 0.530 25567 7961 1 11 . 1 1 139 139 VAL C C 139 172.291 172.291 174.845 -2.554 25567 7962 1 11 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.222 -3.013 25567 7963 1 11 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.579 -0.940 25567 7964 1 11 . 1 1 139 139 VAL H H 139 8.158 8.158 8.760 -0.602 25567 7965 1 11 . 1 1 140 140 ALA N N 140 127.104 127.104 128.835 -1.731 25567 7966 1 11 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.373 -0.777 25567 7967 1 11 . 1 1 140 140 ALA C C 140 171.057 171.057 175.329 -4.272 25567 7968 1 11 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.579 -1.696 25567 7969 1 11 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.544 -1.116 25567 7970 1 11 . 1 1 140 140 ALA H H 140 9.145 9.145 8.896 0.249 25567 7971 1 11 . 1 1 141 141 ARG N N 141 118.828 118.828 117.597 1.231 25567 7972 1 11 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.822 -2.082 25567 7973 1 11 . 1 1 141 141 ARG C C 141 173.524 173.524 175.582 -2.058 25567 7974 1 11 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.276 -2.389 25567 7975 1 11 . 1 1 141 141 ARG CB C 141 28.454 28.454 33.150 -4.696 25567 7976 1 11 . 1 1 141 141 ARG H H 141 7.759 7.759 8.490 -0.731 25567 7977 1 11 . 1 1 142 142 ASP N N 142 125.557 125.557 120.165 5.392 25567 7978 1 11 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.275 -0.496 25567 7979 1 11 . 1 1 142 142 ASP C C 142 169.292 169.292 174.736 -5.444 25567 7980 1 11 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.717 -3.095 25567 7981 1 11 . 1 1 142 142 ASP CB C 142 37.080 37.080 41.286 -4.206 25567 7982 1 11 . 1 1 142 142 ASP H H 142 9.087 9.087 8.089 0.998 25567 7983 1 11 . 1 1 143 143 ASP N N 143 119.094 119.094 119.627 -0.533 25567 7984 1 11 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.843 -0.589 25567 7985 1 11 . 1 1 143 143 ASP C C 143 175.557 175.557 175.173 0.384 25567 7986 1 11 . 1 1 143 143 ASP CA C 143 49.079 49.079 54.175 -5.096 25567 7987 1 11 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.379 -3.937 25567 7988 1 11 . 1 1 143 143 ASP H H 143 8.175 8.175 8.483 -0.308 25567 7989 1 11 . 1 1 144 144 SER N N 144 115.438 115.438 117.498 -2.060 25567 7990 1 11 . 1 1 144 144 SER HA H 144 3.745 3.745 4.438 -0.693 25567 7991 1 11 . 1 1 144 144 SER C C 144 172.820 172.820 174.873 -2.053 25567 7992 1 11 . 1 1 144 144 SER CA C 144 59.336 59.336 58.718 0.618 25567 7993 1 11 . 1 1 144 144 SER CB C 144 60.839 60.839 63.665 -2.826 25567 7994 1 11 . 1 1 144 144 SER H H 144 7.742 7.742 8.401 -0.659 25567 7995 1 11 . 1 1 145 145 GLU N N 145 119.631 119.631 121.344 -1.713 25567 7996 1 11 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.239 0.080 25567 7997 1 11 . 1 1 145 145 GLU C C 145 171.927 171.927 176.362 -4.435 25567 7998 1 11 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.776 -3.692 25567 7999 1 11 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.850 -3.076 25567 8000 1 11 . 1 1 145 145 GLU H H 145 7.924 7.924 8.314 -0.390 25567 8001 1 11 . 1 1 146 146 VAL N N 146 118.791 118.791 119.583 -0.792 25567 8002 1 11 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.480 -0.524 25567 8003 1 11 . 1 1 146 146 VAL C C 146 174.582 174.582 177.465 -2.883 25567 8004 1 11 . 1 1 146 146 VAL CA C 146 64.078 64.078 65.728 -1.650 25567 8005 1 11 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.113 -1.974 25567 8006 1 11 . 1 1 146 146 VAL H H 146 6.393 6.393 7.677 -1.284 25567 8007 1 11 . 1 1 147 147 ASP N N 147 119.410 119.410 118.731 0.679 25567 8008 1 11 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.285 -0.215 25567 8009 1 11 . 1 1 147 147 ASP C C 147 174.774 174.774 177.237 -2.463 25567 8010 1 11 . 1 1 147 147 ASP CA C 147 54.322 54.322 57.454 -3.132 25567 8011 1 11 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.546 -3.342 25567 8012 1 11 . 1 1 147 147 ASP H H 147 8.393 8.393 8.561 -0.168 25567 8013 1 11 . 1 1 148 148 LYS N N 148 119.422 119.422 118.322 1.100 25567 8014 1 11 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.148 -0.197 25567 8015 1 11 . 1 1 148 148 LYS C C 148 176.410 176.410 177.991 -1.581 25567 8016 1 11 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.542 -2.806 25567 8017 1 11 . 1 1 148 148 LYS CB C 148 29.576 29.576 31.827 -2.251 25567 8018 1 11 . 1 1 148 148 LYS H H 148 7.078 7.078 7.267 -0.189 25567 8019 1 11 . 1 1 149 149 TRP N N 149 118.168 118.168 118.714 -0.546 25567 8020 1 11 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.920 -0.319 25567 8021 1 11 . 1 1 149 149 TRP C C 149 174.199 174.199 175.974 -1.775 25567 8022 1 11 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.091 -1.296 25567 8023 1 11 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.319 -1.308 25567 8024 1 11 . 1 1 149 149 TRP H H 149 7.914 7.914 7.118 0.796 25567 8025 1 11 . 1 1 150 150 SER N N 150 109.636 109.636 113.116 -3.480 25567 8026 1 11 . 1 1 150 150 SER HA H 150 4.242 4.242 4.821 -0.579 25567 8027 1 11 . 1 1 150 150 SER C C 150 170.173 170.173 173.775 -3.602 25567 8028 1 11 . 1 1 150 150 SER CA C 150 56.912 56.912 58.016 -1.104 25567 8029 1 11 . 1 1 150 150 SER CB C 150 62.087 62.087 64.657 -2.570 25567 8030 1 11 . 1 1 150 150 SER H H 150 7.814 7.814 7.818 -0.004 25567 8031 1 12 . 1 1 2 2 MET HA H 2 4.416 4.416 5.011 -0.595 25567 8032 1 12 . 1 1 2 2 MET CA C 2 52.847 52.847 55.244 -2.397 25567 8033 1 12 . 1 1 2 2 MET CB C 2 30.672 30.672 33.095 -2.423 25567 8034 1 12 . 1 1 3 3 ALA N N 3 125.563 125.563 127.414 -1.851 25567 8035 1 12 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.430 -0.058 25567 8036 1 12 . 1 1 3 3 ALA C C 3 174.728 174.728 175.699 -0.971 25567 8037 1 12 . 1 1 3 3 ALA CA C 3 49.348 49.348 51.904 -2.556 25567 8038 1 12 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.510 -3.575 25567 8039 1 12 . 1 1 3 3 ALA H H 3 8.342 8.342 8.567 -0.225 25567 8040 1 12 . 1 1 4 4 LYS N N 4 121.767 121.767 125.364 -3.597 25567 8041 1 12 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.499 -0.269 25567 8042 1 12 . 1 1 4 4 LYS C C 4 174.577 174.577 176.087 -1.510 25567 8043 1 12 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.691 -1.702 25567 8044 1 12 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.635 -1.080 25567 8045 1 12 . 1 1 4 4 LYS H H 4 8.500 8.500 8.509 -0.009 25567 8046 1 12 . 1 1 5 5 LYS N N 5 129.654 129.654 123.320 6.334 25567 8047 1 12 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.551 -0.025 25567 8048 1 12 . 1 1 5 5 LYS C C 5 174.731 174.731 175.673 -0.942 25567 8049 1 12 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.172 -0.426 25567 8050 1 12 . 1 1 5 5 LYS CB C 5 29.894 29.894 34.523 -4.629 25567 8051 1 12 . 1 1 5 5 LYS H H 5 10.035 10.035 8.485 1.550 25567 8052 1 12 . 1 1 6 6 THR N N 6 126.212 126.212 114.220 11.992 25567 8053 1 12 . 1 1 6 6 THR HA H 6 5.654 5.654 5.279 0.375 25567 8054 1 12 . 1 1 6 6 THR C C 6 169.897 169.897 173.342 -3.445 25567 8055 1 12 . 1 1 6 6 THR CA C 6 60.647 60.647 61.596 -0.949 25567 8056 1 12 . 1 1 6 6 THR CB C 6 68.152 68.152 71.911 -3.759 25567 8057 1 12 . 1 1 6 6 THR H H 6 8.557 8.557 8.220 0.337 25567 8058 1 12 . 1 1 7 7 LEU N N 7 130.776 130.776 125.508 5.268 25567 8059 1 12 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.508 0.111 25567 8060 1 12 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.511 -3.415 25567 8061 1 12 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.097 -5.054 25567 8062 1 12 . 1 1 7 7 LEU H H 7 8.610 8.610 8.353 0.257 25567 8063 1 12 . 1 1 8 8 ILE N N 8 127.175 127.175 124.010 3.165 25567 8064 1 12 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.597 0.259 25567 8065 1 12 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.592 -3.200 25567 8066 1 12 . 1 1 8 8 ILE CB C 8 36.864 36.864 38.374 -1.510 25567 8067 1 12 . 1 1 8 8 ILE H H 8 9.263 9.263 8.041 1.222 25567 8068 1 12 . 1 1 9 9 LEU N N 9 127.117 127.117 127.353 -0.236 25567 8069 1 12 . 1 1 9 9 LEU HA H 9 5.696 5.696 4.742 0.954 25567 8070 1 12 . 1 1 9 9 LEU CA C 9 49.952 49.952 54.592 -4.640 25567 8071 1 12 . 1 1 9 9 LEU CB C 9 43.827 43.827 42.950 0.877 25567 8072 1 12 . 1 1 9 9 LEU H H 9 9.262 9.262 8.034 1.228 25567 8073 1 12 . 1 1 10 10 TYR N N 10 113.544 113.544 123.310 -9.766 25567 8074 1 12 . 1 1 10 10 TYR HA H 10 5.531 5.531 4.810 0.721 25567 8075 1 12 . 1 1 10 10 TYR CA C 10 52.829 52.829 56.421 -3.592 25567 8076 1 12 . 1 1 10 10 TYR CB C 10 38.615 38.615 43.377 -4.762 25567 8077 1 12 . 1 1 10 10 TYR H H 10 7.425 7.425 8.170 -0.745 25567 8078 1 12 . 1 1 11 11 TYR N N 11 121.235 121.235 125.771 -4.536 25567 8079 1 12 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.993 -0.183 25567 8080 1 12 . 1 1 11 11 TYR CA C 11 53.889 53.889 56.756 -2.867 25567 8081 1 12 . 1 1 11 11 TYR CB C 11 40.467 40.467 38.788 1.679 25567 8082 1 12 . 1 1 11 11 TYR H H 11 7.781 7.781 8.657 -0.876 25567 8083 1 12 . 1 1 14 14 SER CA C 14 54.675 54.675 58.617 -3.942 25567 8084 1 12 . 1 1 14 14 SER CB C 14 61.621 61.621 62.944 -1.323 25567 8085 1 12 . 1 1 15 15 GLY N N 15 110.420 110.420 108.092 2.328 25567 8086 1 12 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.580 -1.853 25567 8087 1 12 . 1 1 15 15 GLY H H 15 7.757 7.757 8.028 -0.271 25567 8088 1 12 . 1 1 17 17 THR HA H 17 4.122 4.122 3.969 0.153 25567 8089 1 12 . 1 1 17 17 THR CA C 17 64.748 64.748 63.620 1.129 25567 8090 1 12 . 1 1 17 17 THR CB C 17 64.532 64.532 68.996 -4.464 25567 8091 1 12 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.860 -0.942 25567 8092 1 12 . 1 1 18 18 LYS C C 18 173.812 173.812 177.971 -4.159 25567 8093 1 12 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.821 -2.818 25567 8094 1 12 . 1 1 18 18 LYS CB C 18 29.768 29.768 31.994 -2.226 25567 8095 1 12 . 1 1 19 19 LYS N N 19 116.699 116.699 117.905 -1.206 25567 8096 1 12 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.082 -0.134 25567 8097 1 12 . 1 1 19 19 LYS C C 19 177.221 177.221 177.557 -0.336 25567 8098 1 12 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.588 -2.167 25567 8099 1 12 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.622 -2.988 25567 8100 1 12 . 1 1 19 19 LYS H H 19 7.476 7.476 7.457 0.019 25567 8101 1 12 . 1 1 20 20 MET N N 20 118.946 118.946 114.743 4.203 25567 8102 1 12 . 1 1 20 20 MET HA H 20 4.474 4.474 4.825 -0.351 25567 8103 1 12 . 1 1 20 20 MET C C 20 173.826 173.826 175.347 -1.521 25567 8104 1 12 . 1 1 20 20 MET CA C 20 52.285 52.285 53.709 -1.424 25567 8105 1 12 . 1 1 20 20 MET CB C 20 26.921 26.921 31.116 -4.195 25567 8106 1 12 . 1 1 20 20 MET H H 20 7.457 7.457 7.939 -0.482 25567 8107 1 12 . 1 1 21 21 ALA N N 21 123.375 123.375 122.106 1.269 25567 8108 1 12 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.948 -1.396 25567 8109 1 12 . 1 1 21 21 ALA C C 21 176.542 176.542 178.947 -2.405 25567 8110 1 12 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.841 -1.190 25567 8111 1 12 . 1 1 21 21 ALA CB C 21 16.282 16.282 20.377 -4.095 25567 8112 1 12 . 1 1 21 21 ALA H H 21 8.549 8.549 8.121 0.428 25567 8113 1 12 . 1 1 22 22 GLU N N 22 116.906 116.906 119.261 -2.355 25567 8114 1 12 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.023 -0.350 25567 8115 1 12 . 1 1 22 22 GLU C C 22 176.658 176.658 179.007 -2.349 25567 8116 1 12 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.651 -3.046 25567 8117 1 12 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.588 -2.939 25567 8118 1 12 . 1 1 22 22 GLU H H 22 8.085 8.085 8.385 -0.300 25567 8119 1 12 . 1 1 23 23 LYS N N 23 123.301 123.301 119.210 4.091 25567 8120 1 12 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.005 -0.185 25567 8121 1 12 . 1 1 23 23 LYS C C 23 177.363 177.363 178.948 -1.585 25567 8122 1 12 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.584 -2.612 25567 8123 1 12 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.042 -2.511 25567 8124 1 12 . 1 1 23 23 LYS H H 23 7.703 7.703 8.196 -0.493 25567 8125 1 12 . 1 1 24 24 ILE N N 24 121.894 121.894 119.404 2.490 25567 8126 1 12 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.673 -0.377 25567 8127 1 12 . 1 1 24 24 ILE C C 24 174.944 174.944 178.304 -3.360 25567 8128 1 12 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.648 -1.415 25567 8129 1 12 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.579 -2.835 25567 8130 1 12 . 1 1 24 24 ILE H H 24 8.458 8.458 8.081 0.377 25567 8131 1 12 . 1 1 25 25 ASN N N 25 118.580 118.580 118.043 0.537 25567 8132 1 12 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.434 -0.200 25567 8133 1 12 . 1 1 25 25 ASN C C 25 173.567 173.567 177.760 -4.193 25567 8134 1 12 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.315 -3.991 25567 8135 1 12 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.453 -0.271 25567 8136 1 12 . 1 1 25 25 ASN H H 25 8.273 8.273 8.063 0.210 25567 8137 1 12 . 1 1 26 26 SER N N 26 112.132 112.132 114.677 -2.545 25567 8138 1 12 . 1 1 26 26 SER HA H 26 4.148 4.148 4.509 -0.361 25567 8139 1 12 . 1 1 26 26 SER C C 26 172.083 172.083 174.765 -2.682 25567 8140 1 12 . 1 1 26 26 SER CA C 26 57.865 57.865 59.900 -2.035 25567 8141 1 12 . 1 1 26 26 SER CB C 26 60.816 60.816 63.255 -2.439 25567 8142 1 12 . 1 1 26 26 SER H H 26 7.444 7.444 8.121 -0.677 25567 8143 1 12 . 1 1 27 27 GLU N N 27 120.080 120.080 119.285 0.795 25567 8144 1 12 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.496 -0.396 25567 8145 1 12 . 1 1 27 27 GLU C C 27 173.647 173.647 175.842 -2.195 25567 8146 1 12 . 1 1 27 27 GLU CA C 27 54.202 54.202 55.743 -1.541 25567 8147 1 12 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.430 -3.546 25567 8148 1 12 . 1 1 27 27 GLU H H 27 7.453 7.453 7.929 -0.476 25567 8149 1 12 . 1 1 28 28 ILE N N 28 118.759 118.759 121.248 -2.489 25567 8150 1 12 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.279 -0.075 25567 8151 1 12 . 1 1 28 28 ILE C C 28 172.474 172.474 174.902 -2.428 25567 8152 1 12 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.392 -2.645 25567 8153 1 12 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.962 -5.164 25567 8154 1 12 . 1 1 28 28 ILE H H 28 7.258 7.258 7.232 0.026 25567 8155 1 12 . 1 1 29 29 LYS N N 29 130.618 130.618 127.993 2.625 25567 8156 1 12 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.235 -0.230 25567 8157 1 12 . 1 1 29 29 LYS C C 29 174.375 174.375 176.788 -2.413 25567 8158 1 12 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.851 -2.192 25567 8159 1 12 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.189 -3.629 25567 8160 1 12 . 1 1 29 29 LYS H H 29 8.588 8.588 8.886 -0.298 25567 8161 1 12 . 1 1 30 30 ASP N N 30 119.366 119.366 121.332 -1.966 25567 8162 1 12 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.386 0.016 25567 8163 1 12 . 1 1 30 30 ASP C C 30 172.580 172.580 175.632 -3.052 25567 8164 1 12 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.384 -1.760 25567 8165 1 12 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.452 -3.624 25567 8166 1 12 . 1 1 30 30 ASP H H 30 8.940 8.940 8.828 0.112 25567 8167 1 12 . 1 1 31 31 SER N N 31 114.035 114.035 113.715 0.320 25567 8168 1 12 . 1 1 31 31 SER HA H 31 4.781 4.781 4.727 0.054 25567 8169 1 12 . 1 1 31 31 SER C C 31 171.136 171.136 173.898 -2.762 25567 8170 1 12 . 1 1 31 31 SER CA C 31 55.638 55.638 58.785 -3.147 25567 8171 1 12 . 1 1 31 31 SER CB C 31 62.388 62.388 64.433 -2.045 25567 8172 1 12 . 1 1 31 31 SER H H 31 8.030 8.030 7.657 0.373 25567 8173 1 12 . 1 1 32 32 GLU N N 32 121.406 121.406 119.332 2.074 25567 8174 1 12 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.642 0.093 25567 8175 1 12 . 1 1 32 32 GLU C C 32 171.205 171.205 174.093 -2.888 25567 8176 1 12 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.954 -3.885 25567 8177 1 12 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.605 -2.715 25567 8178 1 12 . 1 1 32 32 GLU H H 32 8.188 8.188 8.088 0.100 25567 8179 1 12 . 1 1 33 33 LEU N N 33 126.143 126.143 122.194 3.949 25567 8180 1 12 . 1 1 33 33 LEU HA H 33 5.285 5.285 4.574 0.711 25567 8181 1 12 . 1 1 33 33 LEU C C 33 173.401 173.401 175.601 -2.200 25567 8182 1 12 . 1 1 33 33 LEU CA C 33 51.334 51.334 54.883 -3.549 25567 8183 1 12 . 1 1 33 33 LEU CB C 33 43.623 43.623 43.653 -0.030 25567 8184 1 12 . 1 1 33 33 LEU H H 33 8.627 8.627 8.486 0.141 25567 8185 1 12 . 1 1 34 34 LYS N N 34 127.122 127.122 125.048 2.074 25567 8186 1 12 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.884 -0.285 25567 8187 1 12 . 1 1 34 34 LYS C C 34 169.644 169.644 174.845 -5.201 25567 8188 1 12 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.605 -2.252 25567 8189 1 12 . 1 1 34 34 LYS CB C 34 34.172 34.172 36.948 -2.776 25567 8190 1 12 . 1 1 34 34 LYS H H 34 9.399 9.399 8.396 1.003 25567 8191 1 12 . 1 1 35 35 GLU N N 35 122.766 122.766 121.645 1.121 25567 8192 1 12 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.989 -1.631 25567 8193 1 12 . 1 1 35 35 GLU C C 35 172.875 172.875 175.728 -2.853 25567 8194 1 12 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.204 -2.564 25567 8195 1 12 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.711 -2.443 25567 8196 1 12 . 1 1 35 35 GLU H H 35 8.166 8.166 8.558 -0.392 25567 8197 1 12 . 1 1 36 36 VAL N N 36 126.674 126.674 121.329 5.345 25567 8198 1 12 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.484 -0.623 25567 8199 1 12 . 1 1 36 36 VAL C C 36 171.451 171.451 175.681 -4.230 25567 8200 1 12 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.780 -1.243 25567 8201 1 12 . 1 1 36 36 VAL CB C 36 29.689 29.689 33.333 -3.644 25567 8202 1 12 . 1 1 36 36 VAL H H 36 8.632 8.632 8.282 0.350 25567 8203 1 12 . 1 1 37 37 LYS N N 37 126.181 126.181 126.383 -0.202 25567 8204 1 12 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.861 0.078 25567 8205 1 12 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.562 -2.384 25567 8206 1 12 . 1 1 37 37 LYS CB C 37 32.898 32.898 35.426 -2.528 25567 8207 1 12 . 1 1 37 37 LYS H H 37 7.867 7.867 8.913 -1.046 25567 8208 1 12 . 1 1 38 38 VAL N N 38 113.540 113.540 115.502 -1.962 25567 8209 1 12 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.603 0.083 25567 8210 1 12 . 1 1 38 38 VAL C C 38 173.633 173.633 175.154 -1.521 25567 8211 1 12 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.681 -2.397 25567 8212 1 12 . 1 1 38 38 VAL CB C 38 31.964 31.964 34.757 -2.793 25567 8213 1 12 . 1 1 38 38 VAL H H 38 8.389 8.389 8.361 0.028 25567 8214 1 12 . 1 1 39 39 SER N N 39 118.860 118.860 116.298 2.562 25567 8215 1 12 . 1 1 39 39 SER HA H 39 4.194 4.194 4.802 -0.608 25567 8216 1 12 . 1 1 39 39 SER C C 39 173.059 173.059 172.834 0.225 25567 8217 1 12 . 1 1 39 39 SER CA C 39 56.227 56.227 56.702 -0.474 25567 8218 1 12 . 1 1 39 39 SER CB C 39 60.771 60.771 64.263 -3.492 25567 8219 1 12 . 1 1 39 39 SER H H 39 8.668 8.668 8.269 0.399 25567 8220 1 12 . 1 1 40 40 GLU N N 40 125.769 125.769 121.825 3.944 25567 8221 1 12 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.638 -0.481 25567 8222 1 12 . 1 1 40 40 GLU C C 40 174.484 174.484 174.979 -0.495 25567 8223 1 12 . 1 1 40 40 GLU CA C 40 55.550 55.550 55.448 0.102 25567 8224 1 12 . 1 1 40 40 GLU CB C 40 27.054 27.054 31.663 -4.609 25567 8225 1 12 . 1 1 40 40 GLU H H 40 8.878 8.878 8.228 0.650 25567 8226 1 12 . 1 1 41 41 GLY N N 41 112.165 112.165 109.865 2.300 25567 8227 1 12 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.686 -2.979 25567 8228 1 12 . 1 1 41 41 GLY H H 41 8.743 8.743 8.780 -0.037 25567 8229 1 12 . 1 1 44 44 ASP N N 44 122.324 122.324 121.591 0.733 25567 8230 1 12 . 1 1 44 44 ASP CB C 44 42.156 42.156 41.360 0.796 25567 8231 1 12 . 1 1 44 44 ASP H H 44 7.918 7.918 7.876 0.042 25567 8232 1 12 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.297 -0.235 25567 8233 1 12 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.418 -1.008 25567 8234 1 12 . 1 1 45 45 ALA CB C 45 16.376 16.376 20.506 -4.130 25567 8235 1 12 . 1 1 47 47 MET CA C 47 54.118 54.118 56.509 -2.391 25567 8236 1 12 . 1 1 47 47 MET CB C 47 27.527 27.527 32.534 -5.007 25567 8237 1 12 . 1 1 48 48 TYR N N 48 120.075 120.075 116.976 3.099 25567 8238 1 12 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.517 -0.363 25567 8239 1 12 . 1 1 48 48 TYR C C 48 172.217 172.217 175.565 -3.348 25567 8240 1 12 . 1 1 48 48 TYR CA C 48 57.377 57.377 57.948 -0.571 25567 8241 1 12 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.226 -2.730 25567 8242 1 12 . 1 1 48 48 TYR H H 48 7.810 7.810 8.538 -0.728 25567 8243 1 12 . 1 1 49 49 LYS N N 49 118.369 118.369 125.164 -6.795 25567 8244 1 12 . 1 1 49 49 LYS H H 49 8.116 8.116 8.528 -0.412 25567 8245 1 12 . 1 1 50 50 THR N N 50 116.979 116.979 116.976 0.003 25567 8246 1 12 . 1 1 50 50 THR CB C 50 66.373 66.373 68.497 -2.124 25567 8247 1 12 . 1 1 50 50 THR H H 50 7.741 7.741 8.531 -0.790 25567 8248 1 12 . 1 1 51 51 SER N N 51 116.155 116.155 116.332 -0.177 25567 8249 1 12 . 1 1 51 51 SER HA H 51 3.771 3.771 4.545 -0.774 25567 8250 1 12 . 1 1 51 51 SER C C 51 170.563 170.563 174.889 -4.326 25567 8251 1 12 . 1 1 51 51 SER CA C 51 54.840 54.840 58.890 -4.050 25567 8252 1 12 . 1 1 51 51 SER CB C 51 60.318 60.318 63.869 -3.551 25567 8253 1 12 . 1 1 51 51 SER H H 51 7.853 7.853 7.792 0.061 25567 8254 1 12 . 1 1 54 54 ALA N N 54 123.234 123.234 127.867 -4.633 25567 8255 1 12 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.177 0.071 25567 8256 1 12 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.328 -1.060 25567 8257 1 12 . 1 1 54 54 ALA CB C 54 16.434 16.434 18.812 -2.378 25567 8258 1 12 . 1 1 54 54 ALA H H 54 8.207 8.207 8.362 -0.155 25567 8259 1 12 . 1 1 55 55 LEU N N 55 118.603 118.603 122.984 -4.381 25567 8260 1 12 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.277 -0.337 25567 8261 1 12 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.506 -0.795 25567 8262 1 12 . 1 1 55 55 LEU CB C 55 38.913 38.913 39.639 -0.726 25567 8263 1 12 . 1 1 55 55 LEU H H 55 7.960 7.960 8.337 -0.377 25567 8264 1 12 . 1 1 58 58 ILE HA H 58 3.676 3.676 3.995 -0.319 25567 8265 1 12 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.763 -0.269 25567 8266 1 12 . 1 1 58 58 ILE CB C 58 36.054 36.054 38.876 -2.822 25567 8267 1 12 . 1 1 59 59 GLN N N 59 117.579 117.579 120.901 -3.322 25567 8268 1 12 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.269 -0.136 25567 8269 1 12 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.579 -2.570 25567 8270 1 12 . 1 1 59 59 GLN CB C 59 26.651 26.651 27.937 -1.286 25567 8271 1 12 . 1 1 59 59 GLN H H 59 8.268 8.268 8.361 -0.093 25567 8272 1 12 . 1 1 60 60 GLY N N 60 107.308 107.308 114.033 -6.725 25567 8273 1 12 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.283 -2.304 25567 8274 1 12 . 1 1 60 60 GLY H H 60 7.780 7.780 8.864 -1.084 25567 8275 1 12 . 1 1 61 61 ASN N N 61 117.747 117.747 117.464 0.283 25567 8276 1 12 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.818 -0.284 25567 8277 1 12 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.197 -0.962 25567 8278 1 12 . 1 1 61 61 ASN CB C 61 36.424 36.424 40.760 -4.336 25567 8279 1 12 . 1 1 61 61 ASN H H 61 8.108 8.108 7.503 0.605 25567 8280 1 12 . 1 1 64 64 PHE N N 64 120.102 120.102 112.833 7.269 25567 8281 1 12 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.617 -0.238 25567 8282 1 12 . 1 1 64 64 PHE CA C 64 51.748 51.748 55.499 -3.751 25567 8283 1 12 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.667 -3.392 25567 8284 1 12 . 1 1 64 64 PHE H H 64 8.300 8.300 7.462 0.838 25567 8285 1 12 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.648 -0.313 25567 8286 1 12 . 1 1 65 65 PRO C C 65 173.870 173.870 175.777 -1.907 25567 8287 1 12 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.672 -2.655 25567 8288 1 12 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.790 -3.155 25567 8289 1 12 . 1 1 66 66 GLU N N 66 121.258 121.258 118.637 2.621 25567 8290 1 12 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.315 -0.081 25567 8291 1 12 . 1 1 66 66 GLU C C 66 173.981 173.981 176.885 -2.904 25567 8292 1 12 . 1 1 66 66 GLU CA C 66 53.787 53.787 55.596 -1.809 25567 8293 1 12 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.697 -2.922 25567 8294 1 12 . 1 1 66 66 GLU H H 66 8.316 8.316 8.362 -0.046 25567 8295 1 12 . 1 1 67 67 ILE N N 67 114.290 114.290 113.758 0.532 25567 8296 1 12 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.468 0.661 25567 8297 1 12 . 1 1 67 67 ILE C C 67 172.700 172.700 175.248 -2.548 25567 8298 1 12 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.923 -3.484 25567 8299 1 12 . 1 1 67 67 ILE CB C 67 39.159 39.159 39.960 -0.801 25567 8300 1 12 . 1 1 67 67 ILE H H 67 8.366 8.366 8.161 0.205 25567 8301 1 12 . 1 1 68 68 GLN N N 68 121.422 121.422 117.677 3.745 25567 8302 1 12 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.758 -0.257 25567 8303 1 12 . 1 1 68 68 GLN C C 68 171.675 171.675 173.931 -2.256 25567 8304 1 12 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.656 -2.383 25567 8305 1 12 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.152 -6.009 25567 8306 1 12 . 1 1 68 68 GLN H H 68 8.737 8.737 8.297 0.440 25567 8307 1 12 . 1 1 69 69 LEU N N 69 125.311 125.311 116.552 8.759 25567 8308 1 12 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.802 -0.296 25567 8309 1 12 . 1 1 69 69 LEU C C 69 172.634 172.634 174.931 -2.297 25567 8310 1 12 . 1 1 69 69 LEU CA C 69 51.759 51.759 54.195 -2.436 25567 8311 1 12 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.357 -0.953 25567 8312 1 12 . 1 1 69 69 LEU H H 69 8.051 8.051 8.227 -0.176 25567 8313 1 12 . 1 1 70 70 ASP N N 70 122.763 122.763 119.918 2.845 25567 8314 1 12 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.736 -0.313 25567 8315 1 12 . 1 1 70 70 ASP CA C 70 51.610 51.610 52.959 -1.349 25567 8316 1 12 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.098 -3.381 25567 8317 1 12 . 1 1 70 70 ASP H H 70 8.313 8.313 8.568 -0.255 25567 8318 1 12 . 1 1 71 71 ASN N N 71 117.413 117.413 118.806 -1.393 25567 8319 1 12 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.650 -0.313 25567 8320 1 12 . 1 1 71 71 ASN C C 71 171.770 171.770 175.287 -3.517 25567 8321 1 12 . 1 1 71 71 ASN CA C 71 51.491 51.491 52.900 -1.409 25567 8322 1 12 . 1 1 71 71 ASN CB C 71 35.326 35.326 38.006 -2.680 25567 8323 1 12 . 1 1 71 71 ASN H H 71 8.407 8.407 8.501 -0.094 25567 8324 1 12 . 1 1 72 72 ILE N N 72 123.752 123.752 120.191 3.561 25567 8325 1 12 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.011 -0.071 25567 8326 1 12 . 1 1 72 72 ILE C C 72 171.621 171.621 174.831 -3.210 25567 8327 1 12 . 1 1 72 72 ILE CA C 72 57.332 57.332 62.061 -4.729 25567 8328 1 12 . 1 1 72 72 ILE CB C 72 38.489 38.489 38.402 0.087 25567 8329 1 12 . 1 1 72 72 ILE H H 72 7.639 7.639 7.363 0.276 25567 8330 1 12 . 1 1 73 73 ASP N N 73 125.252 125.252 124.410 0.842 25567 8331 1 12 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.561 0.064 25567 8332 1 12 . 1 1 73 73 ASP C C 73 174.034 174.034 175.650 -1.616 25567 8333 1 12 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.056 -3.853 25567 8334 1 12 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.119 -5.095 25567 8335 1 12 . 1 1 73 73 ASP H H 73 8.394 8.394 8.328 0.066 25567 8336 1 12 . 1 1 74 74 TYR N N 74 123.108 123.108 123.168 -0.060 25567 8337 1 12 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.641 -0.763 25567 8338 1 12 . 1 1 74 74 TYR C C 74 173.637 173.637 177.459 -3.822 25567 8339 1 12 . 1 1 74 74 TYR CA C 74 59.474 59.474 59.324 0.150 25567 8340 1 12 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.520 -3.798 25567 8341 1 12 . 1 1 74 74 TYR H H 74 7.392 7.392 8.529 -1.137 25567 8342 1 12 . 1 1 75 75 ASN N N 75 109.422 109.422 118.307 -8.885 25567 8343 1 12 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.595 0.331 25567 8344 1 12 . 1 1 75 75 ASN C C 75 172.574 172.574 176.297 -3.723 25567 8345 1 12 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.915 -3.154 25567 8346 1 12 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.887 -3.270 25567 8347 1 12 . 1 1 75 75 ASN H H 75 8.058 8.058 8.207 -0.149 25567 8348 1 12 . 1 1 76 76 ASN N N 76 117.422 117.422 116.392 1.030 25567 8349 1 12 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.562 -0.107 25567 8350 1 12 . 1 1 76 76 ASN C C 76 171.132 171.132 174.334 -3.202 25567 8351 1 12 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.625 -2.458 25567 8352 1 12 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.507 -2.779 25567 8353 1 12 . 1 1 76 76 ASN H H 76 7.768 7.768 8.371 -0.603 25567 8354 1 12 . 1 1 77 77 TYR N N 77 116.873 116.873 118.042 -1.169 25567 8355 1 12 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.667 -0.304 25567 8356 1 12 . 1 1 77 77 TYR C C 77 172.175 172.175 174.667 -2.492 25567 8357 1 12 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.243 -1.879 25567 8358 1 12 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.426 -3.261 25567 8359 1 12 . 1 1 77 77 TYR H H 77 7.825 7.825 7.385 0.440 25567 8360 1 12 . 1 1 78 78 ASP N N 78 121.271 121.271 122.420 -1.149 25567 8361 1 12 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.702 0.103 25567 8362 1 12 . 1 1 78 78 ASP C C 78 172.641 172.641 175.390 -2.749 25567 8363 1 12 . 1 1 78 78 ASP CA C 78 53.255 53.255 55.510 -2.255 25567 8364 1 12 . 1 1 78 78 ASP CB C 78 41.075 41.075 42.683 -1.608 25567 8365 1 12 . 1 1 78 78 ASP H H 78 9.058 9.058 8.609 0.449 25567 8366 1 12 . 1 1 79 79 LEU N N 79 122.985 122.985 118.959 4.026 25567 8367 1 12 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.012 0.102 25567 8368 1 12 . 1 1 79 79 LEU C C 79 170.721 170.721 174.572 -3.851 25567 8369 1 12 . 1 1 79 79 LEU CA C 79 51.316 51.316 53.859 -2.543 25567 8370 1 12 . 1 1 79 79 LEU CB C 79 42.342 42.342 46.002 -3.660 25567 8371 1 12 . 1 1 79 79 LEU H H 79 7.893 7.893 7.899 -0.006 25567 8372 1 12 . 1 1 80 80 ILE N N 80 126.364 126.364 123.611 2.753 25567 8373 1 12 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.511 0.578 25567 8374 1 12 . 1 1 80 80 ILE C C 80 171.580 171.580 174.154 -2.574 25567 8375 1 12 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.357 -2.940 25567 8376 1 12 . 1 1 80 80 ILE CB C 80 38.136 38.136 39.982 -1.846 25567 8377 1 12 . 1 1 80 80 ILE H H 80 8.717 8.717 8.702 0.015 25567 8378 1 12 . 1 1 81 81 LEU N N 81 126.199 126.199 128.582 -2.383 25567 8379 1 12 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.100 0.035 25567 8380 1 12 . 1 1 81 81 LEU C C 81 172.979 172.979 176.030 -3.051 25567 8381 1 12 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.677 -4.044 25567 8382 1 12 . 1 1 81 81 LEU CB C 81 42.159 42.159 43.444 -1.285 25567 8383 1 12 . 1 1 81 81 LEU H H 81 9.230 9.230 8.993 0.237 25567 8384 1 12 . 1 1 82 82 ILE N N 82 120.505 120.505 118.348 2.157 25567 8385 1 12 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.003 -0.087 25567 8386 1 12 . 1 1 82 82 ILE C C 82 173.011 173.011 174.289 -1.278 25567 8387 1 12 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.378 -2.550 25567 8388 1 12 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.514 -4.446 25567 8389 1 12 . 1 1 82 82 ILE H H 82 8.796 8.796 7.789 1.007 25567 8390 1 12 . 1 1 83 83 GLY N N 83 120.857 120.857 109.068 11.789 25567 8391 1 12 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.703 -2.900 25567 8392 1 12 . 1 1 83 83 GLY H H 83 9.525 9.525 7.660 1.865 25567 8393 1 12 . 1 1 84 84 SER N N 84 116.007 116.007 113.916 2.091 25567 8394 1 12 . 1 1 84 84 SER HA H 84 5.476 5.476 5.218 0.258 25567 8395 1 12 . 1 1 84 84 SER CA C 84 51.937 51.937 55.408 -3.471 25567 8396 1 12 . 1 1 84 84 SER CB C 84 64.533 64.533 65.684 -1.151 25567 8397 1 12 . 1 1 84 84 SER H H 84 7.617 7.617 8.330 -0.713 25567 8398 1 12 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.593 0.608 25567 8399 1 12 . 1 1 85 85 PRO C C 85 173.574 173.574 175.770 -2.196 25567 8400 1 12 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.637 -3.149 25567 8401 1 12 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.583 -1.442 25567 8402 1 12 . 1 1 86 86 VAL N N 86 117.603 117.603 117.382 0.221 25567 8403 1 12 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.455 -0.082 25567 8404 1 12 . 1 1 86 86 VAL C C 86 172.777 172.777 174.538 -1.761 25567 8405 1 12 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.210 -1.607 25567 8406 1 12 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.123 -5.550 25567 8407 1 12 . 1 1 86 86 VAL H H 86 8.194 8.194 8.085 0.109 25567 8408 1 12 . 1 1 87 87 TRP N N 87 131.187 131.187 126.960 4.227 25567 8409 1 12 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.870 0.328 25567 8410 1 12 . 1 1 87 87 TRP C C 87 173.295 173.295 174.850 -1.555 25567 8411 1 12 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.065 -7.281 25567 8412 1 12 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.426 -3.680 25567 8413 1 12 . 1 1 87 87 TRP H H 87 9.637 9.637 8.319 1.318 25567 8414 1 12 . 1 1 88 88 SER N N 88 119.829 119.829 115.180 4.649 25567 8415 1 12 . 1 1 88 88 SER HA H 88 3.986 3.986 4.678 -0.692 25567 8416 1 12 . 1 1 88 88 SER C C 88 172.375 172.375 174.834 -2.459 25567 8417 1 12 . 1 1 88 88 SER CA C 88 55.932 55.932 56.243 -0.311 25567 8418 1 12 . 1 1 88 88 SER CB C 88 59.178 59.178 62.234 -3.056 25567 8419 1 12 . 1 1 88 88 SER H H 88 9.272 9.272 8.017 1.255 25567 8420 1 12 . 1 1 89 89 GLY N N 89 101.498 101.498 114.848 -13.350 25567 8421 1 12 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.659 -3.988 25567 8422 1 12 . 1 1 89 89 GLY H H 89 7.463 7.463 8.563 -1.100 25567 8423 1 12 . 1 1 90 90 TYR N N 90 121.064 121.064 114.470 6.594 25567 8424 1 12 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.166 -0.950 25567 8425 1 12 . 1 1 90 90 TYR CA C 90 54.090 54.090 53.936 0.154 25567 8426 1 12 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.808 0.387 25567 8427 1 12 . 1 1 90 90 TYR H H 90 8.064 8.064 8.075 -0.011 25567 8428 1 12 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.465 0.467 25567 8429 1 12 . 1 1 91 91 PRO C C 91 171.019 171.019 175.689 -4.670 25567 8430 1 12 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.682 -4.688 25567 8431 1 12 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.110 -5.617 25567 8432 1 12 . 1 1 92 92 ALA N N 92 119.893 119.893 121.273 -1.380 25567 8433 1 12 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.814 -1.363 25567 8434 1 12 . 1 1 92 92 ALA C C 92 176.477 176.477 176.756 -0.279 25567 8435 1 12 . 1 1 92 92 ALA CA C 92 49.567 49.567 50.910 -1.343 25567 8436 1 12 . 1 1 92 92 ALA CB C 92 15.801 15.801 22.462 -6.661 25567 8437 1 12 . 1 1 92 92 ALA H H 92 7.278 7.278 7.801 -0.523 25567 8438 1 12 . 1 1 93 93 THR N N 93 112.992 112.992 111.629 1.363 25567 8439 1 12 . 1 1 93 93 THR HA H 93 4.462 4.462 4.845 -0.383 25567 8440 1 12 . 1 1 93 93 THR CA C 93 66.871 66.871 59.516 7.355 25567 8441 1 12 . 1 1 93 93 THR CB C 93 64.362 64.362 68.269 -3.907 25567 8442 1 12 . 1 1 93 93 THR H H 93 6.861 6.861 8.402 -1.541 25567 8443 1 12 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.084 -0.218 25567 8444 1 12 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.770 -0.749 25567 8445 1 12 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.784 -2.505 25567 8446 1 12 . 1 1 95 95 ILE N N 95 111.298 111.298 117.824 -6.526 25567 8447 1 12 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.312 -0.689 25567 8448 1 12 . 1 1 95 95 ILE C C 95 174.264 174.264 175.299 -1.035 25567 8449 1 12 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.029 -1.581 25567 8450 1 12 . 1 1 95 95 ILE CB C 95 31.929 31.929 35.744 -3.815 25567 8451 1 12 . 1 1 95 95 ILE H H 95 7.974 7.974 8.054 -0.080 25567 8452 1 12 . 1 1 96 96 LYS N N 96 123.045 123.045 120.579 2.466 25567 8453 1 12 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.460 -1.348 25567 8454 1 12 . 1 1 96 96 LYS C C 96 174.590 174.590 177.355 -2.765 25567 8455 1 12 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.961 0.184 25567 8456 1 12 . 1 1 96 96 LYS CB C 96 28.845 28.845 34.093 -5.248 25567 8457 1 12 . 1 1 96 96 LYS H H 96 6.958 6.958 7.538 -0.580 25567 8458 1 12 . 1 1 97 97 THR N N 97 113.412 113.412 117.804 -4.392 25567 8459 1 12 . 1 1 97 97 THR HA H 97 3.461 3.461 4.077 -0.616 25567 8460 1 12 . 1 1 97 97 THR C C 97 173.247 173.247 176.435 -3.188 25567 8461 1 12 . 1 1 97 97 THR CA C 97 62.809 62.809 65.405 -2.596 25567 8462 1 12 . 1 1 97 97 THR CB C 97 65.654 65.654 68.511 -2.857 25567 8463 1 12 . 1 1 97 97 THR H H 97 6.366 6.366 7.594 -1.228 25567 8464 1 12 . 1 1 98 98 LEU N N 98 121.201 121.201 122.862 -1.661 25567 8465 1 12 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.009 -0.375 25567 8466 1 12 . 1 1 98 98 LEU C C 98 174.590 174.590 178.108 -3.518 25567 8467 1 12 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.359 -1.738 25567 8468 1 12 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.034 -1.139 25567 8469 1 12 . 1 1 98 98 LEU H H 98 7.554 7.554 7.401 0.153 25567 8470 1 12 . 1 1 99 99 LEU N N 99 118.677 118.677 116.766 1.911 25567 8471 1 12 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.818 -0.117 25567 8472 1 12 . 1 1 99 99 LEU C C 99 177.457 177.457 179.515 -2.058 25567 8473 1 12 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.647 -2.468 25567 8474 1 12 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.312 -2.324 25567 8475 1 12 . 1 1 99 99 LEU H H 99 8.160 8.160 8.069 0.091 25567 8476 1 12 . 1 1 100 100 ASP N N 100 118.914 118.914 117.249 1.665 25567 8477 1 12 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.520 -0.291 25567 8478 1 12 . 1 1 100 100 ASP C C 100 176.585 176.585 178.420 -1.835 25567 8479 1 12 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.345 -1.829 25567 8480 1 12 . 1 1 100 100 ASP CB C 100 37.579 37.579 40.864 -3.285 25567 8481 1 12 . 1 1 100 100 ASP H H 100 7.872 7.872 7.759 0.113 25567 8482 1 12 . 1 1 101 101 GLN N N 101 118.135 118.135 118.685 -0.550 25567 8483 1 12 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.179 -0.019 25567 8484 1 12 . 1 1 101 101 GLN C C 101 174.601 174.601 177.974 -3.373 25567 8485 1 12 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.082 -3.122 25567 8486 1 12 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.050 -3.500 25567 8487 1 12 . 1 1 101 101 GLN H H 101 7.673 7.673 7.724 -0.051 25567 8488 1 12 . 1 1 102 102 MET N N 102 118.420 118.420 117.425 0.995 25567 8489 1 12 . 1 1 102 102 MET HA H 102 3.826 3.826 4.105 -0.279 25567 8490 1 12 . 1 1 102 102 MET C C 102 172.780 172.780 176.772 -3.992 25567 8491 1 12 . 1 1 102 102 MET CA C 102 53.428 53.428 56.021 -2.593 25567 8492 1 12 . 1 1 102 102 MET CB C 102 31.221 31.221 31.152 0.069 25567 8493 1 12 . 1 1 102 102 MET H H 102 7.462 7.462 7.388 0.074 25567 8494 1 12 . 1 1 103 103 LYS N N 103 116.066 116.066 119.984 -3.918 25567 8495 1 12 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.179 -0.259 25567 8496 1 12 . 1 1 103 103 LYS C C 103 173.922 173.922 177.548 -3.626 25567 8497 1 12 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.606 -2.324 25567 8498 1 12 . 1 1 103 103 LYS CB C 103 29.491 29.491 32.080 -2.589 25567 8499 1 12 . 1 1 103 103 LYS H H 103 6.875 6.875 7.714 -0.839 25567 8500 1 12 . 1 1 104 104 ASN N N 104 114.987 114.987 117.571 -2.584 25567 8501 1 12 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.983 -0.242 25567 8502 1 12 . 1 1 104 104 ASN C C 104 172.587 172.587 174.266 -1.679 25567 8503 1 12 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.580 -2.111 25567 8504 1 12 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.529 -3.707 25567 8505 1 12 . 1 1 104 104 ASN H H 104 8.517 8.517 8.296 0.221 25567 8506 1 12 . 1 1 105 105 TYR N N 105 122.755 122.755 120.152 2.603 25567 8507 1 12 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.527 0.048 25567 8508 1 12 . 1 1 105 105 TYR C C 105 174.260 174.260 175.374 -1.114 25567 8509 1 12 . 1 1 105 105 TYR CA C 105 55.493 55.493 58.462 -2.969 25567 8510 1 12 . 1 1 105 105 TYR CB C 105 36.064 36.064 38.649 -2.585 25567 8511 1 12 . 1 1 105 105 TYR H H 105 8.287 8.287 8.137 0.150 25567 8512 1 12 . 1 1 106 106 ARG N N 106 128.905 128.905 124.576 4.329 25567 8513 1 12 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.429 -0.157 25567 8514 1 12 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.209 -2.188 25567 8515 1 12 . 1 1 106 106 ARG CB C 106 28.130 28.130 30.726 -2.596 25567 8516 1 12 . 1 1 106 106 ARG H H 106 8.841 8.841 8.649 0.192 25567 8517 1 12 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.805 -2.308 25567 8518 1 12 . 1 1 108 108 GLU N N 108 116.989 116.989 119.131 -2.142 25567 8519 1 12 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.838 -0.207 25567 8520 1 12 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.155 -1.479 25567 8521 1 12 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.650 -3.248 25567 8522 1 12 . 1 1 108 108 GLU H H 108 7.536 7.536 8.298 -0.762 25567 8523 1 12 . 1 1 109 109 VAL N N 109 123.416 123.416 119.768 3.648 25567 8524 1 12 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.854 0.467 25567 8525 1 12 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.680 -3.237 25567 8526 1 12 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.545 -0.884 25567 8527 1 12 . 1 1 109 109 VAL H H 109 8.955 8.955 8.134 0.821 25567 8528 1 12 . 1 1 110 110 ALA N N 110 127.975 127.975 128.903 -0.928 25567 8529 1 12 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.173 -0.496 25567 8530 1 12 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.932 -2.491 25567 8531 1 12 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.590 -4.174 25567 8532 1 12 . 1 1 110 110 ALA H H 110 8.860 8.860 8.783 0.077 25567 8533 1 12 . 1 1 111 111 SER N N 111 110.482 110.482 115.888 -5.406 25567 8534 1 12 . 1 1 111 111 SER HA H 111 5.502 5.502 5.083 0.419 25567 8535 1 12 . 1 1 111 111 SER CA C 111 51.630 51.630 57.872 -6.242 25567 8536 1 12 . 1 1 111 111 SER CB C 111 62.267 62.267 64.530 -2.263 25567 8537 1 12 . 1 1 111 111 SER H H 111 7.484 7.484 8.277 -0.793 25567 8538 1 12 . 1 1 112 112 PHE N N 112 125.082 125.082 124.534 0.548 25567 8539 1 12 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.192 1.256 25567 8540 1 12 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.399 -4.965 25567 8541 1 12 . 1 1 112 112 PHE CB C 112 40.500 40.500 40.734 -0.234 25567 8542 1 12 . 1 1 112 112 PHE H H 112 8.025 8.025 9.002 -0.977 25567 8543 1 12 . 1 1 113 113 PHE N N 113 115.872 115.872 121.322 -5.450 25567 8544 1 12 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.333 0.591 25567 8545 1 12 . 1 1 113 113 PHE C C 113 173.293 173.293 174.841 -1.548 25567 8546 1 12 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.240 -4.772 25567 8547 1 12 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.753 -3.360 25567 8548 1 12 . 1 1 113 113 PHE H H 113 7.391 7.391 8.309 -0.918 25567 8549 1 12 . 1 1 114 114 THR N N 114 108.721 108.721 111.056 -2.335 25567 8550 1 12 . 1 1 114 114 THR HA H 114 4.933 4.933 4.408 0.525 25567 8551 1 12 . 1 1 114 114 THR C C 114 171.891 171.891 174.399 -2.508 25567 8552 1 12 . 1 1 114 114 THR CA C 114 56.815 56.815 61.230 -4.415 25567 8553 1 12 . 1 1 114 114 THR CB C 114 67.899 67.899 69.706 -1.807 25567 8554 1 12 . 1 1 114 114 THR H H 114 7.951 7.951 8.466 -0.515 25567 8555 1 12 . 1 1 115 115 SER N N 115 115.159 115.159 117.419 -2.260 25567 8556 1 12 . 1 1 115 115 SER HA H 115 4.608 4.608 4.724 -0.116 25567 8557 1 12 . 1 1 115 115 SER C C 115 171.403 171.403 174.251 -2.848 25567 8558 1 12 . 1 1 115 115 SER CA C 115 55.570 55.570 58.290 -2.720 25567 8559 1 12 . 1 1 115 115 SER CB C 115 61.418 61.418 63.512 -2.094 25567 8560 1 12 . 1 1 115 115 SER H H 115 8.229 8.229 7.888 0.341 25567 8561 1 12 . 1 1 116 116 ALA N N 116 127.211 127.211 124.363 2.848 25567 8562 1 12 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.809 -0.353 25567 8563 1 12 . 1 1 116 116 ALA C C 116 175.758 175.758 178.955 -3.197 25567 8564 1 12 . 1 1 116 116 ALA CA C 116 49.816 49.816 53.538 -3.722 25567 8565 1 12 . 1 1 116 116 ALA CB C 116 16.831 16.831 18.960 -2.129 25567 8566 1 12 . 1 1 116 116 ALA H H 116 8.813 8.813 8.241 0.572 25567 8567 1 12 . 1 1 117 117 GLY N N 117 108.099 108.099 105.734 2.365 25567 8568 1 12 . 1 1 117 117 GLY C C 117 171.805 171.805 175.416 -3.611 25567 8569 1 12 . 1 1 117 117 GLY CA C 117 42.869 42.869 46.280 -3.411 25567 8570 1 12 . 1 1 117 117 GLY H H 117 8.685 8.685 8.676 0.009 25567 8571 1 12 . 1 1 118 118 THR N N 118 111.284 111.284 112.670 -1.386 25567 8572 1 12 . 1 1 118 118 THR HA H 118 4.343 4.343 4.541 -0.198 25567 8573 1 12 . 1 1 118 118 THR C C 118 171.769 171.769 173.050 -1.281 25567 8574 1 12 . 1 1 118 118 THR CA C 118 58.933 58.933 61.778 -2.845 25567 8575 1 12 . 1 1 118 118 THR CB C 118 67.304 67.304 70.361 -3.057 25567 8576 1 12 . 1 1 118 118 THR H H 118 7.998 7.998 8.100 -0.102 25567 8577 1 12 . 1 1 119 119 ASN N N 119 120.253 120.253 119.334 0.919 25567 8578 1 12 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.891 -0.188 25567 8579 1 12 . 1 1 119 119 ASN C C 119 172.353 172.353 173.140 -0.787 25567 8580 1 12 . 1 1 119 119 ASN CA C 119 50.228 50.228 54.174 -3.946 25567 8581 1 12 . 1 1 119 119 ASN CB C 119 35.376 35.376 40.821 -5.444 25567 8582 1 12 . 1 1 119 119 ASN H H 119 8.381 8.381 7.760 0.621 25567 8583 1 12 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.714 -0.628 25567 8584 1 12 . 1 1 120 120 HIS C C 120 173.395 173.395 175.665 -2.270 25567 8585 1 12 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.113 -1.974 25567 8586 1 12 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.708 -3.286 25567 8587 1 12 . 1 1 121 121 LYS N N 121 119.527 119.527 122.244 -2.717 25567 8588 1 12 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.698 0.082 25567 8589 1 12 . 1 1 121 121 LYS C C 121 176.053 176.053 177.782 -1.729 25567 8590 1 12 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.801 -1.838 25567 8591 1 12 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.492 -1.832 25567 8592 1 12 . 1 1 121 121 LYS H H 121 8.106 8.106 8.546 -0.440 25567 8593 1 12 . 1 1 122 122 ALA N N 122 121.585 121.585 121.417 0.168 25567 8594 1 12 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.624 0.097 25567 8595 1 12 . 1 1 122 122 ALA C C 122 175.128 175.128 179.201 -4.073 25567 8596 1 12 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.576 -2.985 25567 8597 1 12 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.704 -2.000 25567 8598 1 12 . 1 1 122 122 ALA H H 122 7.702 7.702 7.907 -0.205 25567 8599 1 12 . 1 1 123 123 TYR N N 123 118.803 118.803 120.379 -1.576 25567 8600 1 12 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.065 -0.699 25567 8601 1 12 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.295 -1.204 25567 8602 1 12 . 1 1 123 123 TYR CB C 123 35.102 35.102 37.984 -2.882 25567 8603 1 12 . 1 1 123 123 TYR H H 123 7.366 7.366 7.817 -0.451 25567 8604 1 12 . 1 1 124 124 VAL N N 124 117.530 117.530 115.769 1.761 25567 8605 1 12 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.772 -0.573 25567 8606 1 12 . 1 1 124 124 VAL C C 124 175.375 175.375 177.319 -1.944 25567 8607 1 12 . 1 1 124 124 VAL CA C 124 64.583 64.583 65.556 -0.974 25567 8608 1 12 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.041 -1.838 25567 8609 1 12 . 1 1 124 124 VAL H H 124 7.757 7.757 7.833 -0.076 25567 8610 1 12 . 1 1 125 125 SER N N 125 114.023 114.023 114.348 -0.325 25567 8611 1 12 . 1 1 125 125 SER HA H 125 4.035 4.035 4.344 -0.309 25567 8612 1 12 . 1 1 125 125 SER C C 125 174.636 174.636 175.867 -1.231 25567 8613 1 12 . 1 1 125 125 SER CA C 125 58.885 58.885 60.411 -1.526 25567 8614 1 12 . 1 1 125 125 SER CB C 125 59.666 59.666 63.784 -4.118 25567 8615 1 12 . 1 1 125 125 SER H H 125 7.622 7.622 7.668 -0.046 25567 8616 1 12 . 1 1 126 126 HIS N N 126 119.457 119.457 120.981 -1.524 25567 8617 1 12 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.031 0.165 25567 8618 1 12 . 1 1 126 126 HIS C C 126 172.942 172.942 177.661 -4.719 25567 8619 1 12 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.764 -3.846 25567 8620 1 12 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.152 -3.073 25567 8621 1 12 . 1 1 126 126 HIS H H 126 8.067 8.067 8.148 -0.081 25567 8622 1 12 . 1 1 127 127 PHE N N 127 120.628 120.628 120.059 0.569 25567 8623 1 12 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.891 -0.692 25567 8624 1 12 . 1 1 127 127 PHE C C 127 173.515 173.515 176.693 -3.178 25567 8625 1 12 . 1 1 127 127 PHE CA C 127 60.681 60.681 60.253 0.428 25567 8626 1 12 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.498 -2.131 25567 8627 1 12 . 1 1 127 127 PHE H H 127 9.083 9.083 8.376 0.707 25567 8628 1 12 . 1 1 128 128 ASN N N 128 114.858 114.858 115.939 -1.081 25567 8629 1 12 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.016 0.062 25567 8630 1 12 . 1 1 128 128 ASN C C 128 175.338 175.338 177.285 -1.947 25567 8631 1 12 . 1 1 128 128 ASN CA C 128 54.250 54.250 55.947 -1.697 25567 8632 1 12 . 1 1 128 128 ASN CB C 128 36.021 36.021 37.677 -1.656 25567 8633 1 12 . 1 1 128 128 ASN H H 128 7.858 7.858 7.750 0.108 25567 8634 1 12 . 1 1 129 129 GLU N N 129 119.811 119.811 117.955 1.856 25567 8635 1 12 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.173 -0.132 25567 8636 1 12 . 1 1 129 129 GLU C C 129 176.941 176.941 178.140 -1.199 25567 8637 1 12 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.252 -1.620 25567 8638 1 12 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.233 -2.295 25567 8639 1 12 . 1 1 129 129 GLU H H 129 7.569 7.569 7.579 -0.010 25567 8640 1 12 . 1 1 130 130 TRP N N 130 120.585 120.585 118.647 1.938 25567 8641 1 12 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.737 -0.265 25567 8642 1 12 . 1 1 130 130 TRP C C 130 174.262 174.262 176.449 -2.187 25567 8643 1 12 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.696 -2.023 25567 8644 1 12 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.777 -2.821 25567 8645 1 12 . 1 1 130 130 TRP H H 130 7.964 7.964 7.547 0.417 25567 8646 1 12 . 1 1 131 131 ALA N N 131 120.522 120.522 119.503 1.019 25567 8647 1 12 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.357 -0.410 25567 8648 1 12 . 1 1 131 131 ALA C C 131 172.489 172.489 176.888 -4.399 25567 8649 1 12 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.361 -2.781 25567 8650 1 12 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.329 -2.790 25567 8651 1 12 . 1 1 131 131 ALA H H 131 8.114 8.114 7.242 0.872 25567 8652 1 12 . 1 1 132 132 ASP N N 132 117.666 117.666 120.435 -2.769 25567 8653 1 12 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.291 -0.085 25567 8654 1 12 . 1 1 132 132 ASP C C 132 173.779 173.779 176.191 -2.412 25567 8655 1 12 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.234 -0.921 25567 8656 1 12 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.001 0.455 25567 8657 1 12 . 1 1 132 132 ASP H H 132 6.768 6.768 7.960 -1.192 25567 8658 1 12 . 1 1 133 133 GLY N N 133 114.922 114.922 107.460 7.462 25567 8659 1 12 . 1 1 133 133 GLY C C 133 172.101 172.101 174.323 -2.222 25567 8660 1 12 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.405 -2.896 25567 8661 1 12 . 1 1 133 133 GLY H H 133 8.645 8.645 8.073 0.572 25567 8662 1 12 . 1 1 134 134 LEU N N 134 120.101 120.101 123.152 -3.051 25567 8663 1 12 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.027 0.435 25567 8664 1 12 . 1 1 134 134 LEU C C 134 174.098 174.098 176.342 -2.244 25567 8665 1 12 . 1 1 134 134 LEU CA C 134 51.084 51.084 54.808 -3.724 25567 8666 1 12 . 1 1 134 134 LEU CB C 134 40.509 40.509 41.399 -0.890 25567 8667 1 12 . 1 1 134 134 LEU H H 134 8.049 8.049 7.690 0.359 25567 8668 1 12 . 1 1 135 135 ASN N N 135 119.258 119.258 122.536 -3.278 25567 8669 1 12 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.560 0.079 25567 8670 1 12 . 1 1 135 135 ASN C C 135 170.564 170.564 174.536 -3.972 25567 8671 1 12 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.389 -4.136 25567 8672 1 12 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.599 -4.981 25567 8673 1 12 . 1 1 135 135 ASN H H 135 8.567 8.567 8.371 0.196 25567 8674 1 12 . 1 1 136 136 VAL N N 136 125.460 125.460 125.577 -0.117 25567 8675 1 12 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.640 -0.044 25567 8676 1 12 . 1 1 136 136 VAL C C 136 175.318 175.318 176.484 -1.166 25567 8677 1 12 . 1 1 136 136 VAL CA C 136 58.722 58.722 61.917 -3.195 25567 8678 1 12 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.702 -3.403 25567 8679 1 12 . 1 1 136 136 VAL H H 136 7.660 7.660 8.231 -0.571 25567 8680 1 12 . 1 1 137 137 ILE N N 137 122.021 122.021 121.649 0.372 25567 8681 1 12 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.632 -0.204 25567 8682 1 12 . 1 1 137 137 ILE C C 137 173.943 173.943 175.064 -1.121 25567 8683 1 12 . 1 1 137 137 ILE CA C 137 58.958 58.958 60.099 -1.141 25567 8684 1 12 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.831 -2.662 25567 8685 1 12 . 1 1 137 137 ILE H H 137 9.151 9.151 8.616 0.535 25567 8686 1 12 . 1 1 138 138 GLY N N 138 108.192 108.192 109.279 -1.087 25567 8687 1 12 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.966 -2.472 25567 8688 1 12 . 1 1 138 138 GLY H H 138 6.675 6.675 7.533 -0.858 25567 8689 1 12 . 1 1 139 139 VAL N N 139 119.673 119.673 122.953 -3.280 25567 8690 1 12 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.755 0.565 25567 8691 1 12 . 1 1 139 139 VAL C C 139 172.291 172.291 175.454 -3.163 25567 8692 1 12 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.713 -3.504 25567 8693 1 12 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.737 -1.098 25567 8694 1 12 . 1 1 139 139 VAL H H 139 8.158 8.158 8.600 -0.442 25567 8695 1 12 . 1 1 140 140 ALA N N 140 127.104 127.104 131.326 -4.222 25567 8696 1 12 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.092 -0.496 25567 8697 1 12 . 1 1 140 140 ALA C C 140 171.057 171.057 175.219 -4.162 25567 8698 1 12 . 1 1 140 140 ALA CA C 140 48.883 48.883 51.666 -2.783 25567 8699 1 12 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.269 -0.841 25567 8700 1 12 . 1 1 140 140 ALA H H 140 9.145 9.145 8.791 0.354 25567 8701 1 12 . 1 1 141 141 ARG N N 141 118.828 118.828 118.671 0.157 25567 8702 1 12 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.760 -2.020 25567 8703 1 12 . 1 1 141 141 ARG C C 141 173.524 173.524 175.755 -2.231 25567 8704 1 12 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.495 -2.609 25567 8705 1 12 . 1 1 141 141 ARG CB C 141 28.454 28.454 32.375 -3.921 25567 8706 1 12 . 1 1 141 141 ARG H H 141 7.759 7.759 8.466 -0.707 25567 8707 1 12 . 1 1 142 142 ASP N N 142 125.557 125.557 120.939 4.618 25567 8708 1 12 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.249 -0.470 25567 8709 1 12 . 1 1 142 142 ASP C C 142 169.292 169.292 175.525 -6.233 25567 8710 1 12 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.923 -2.301 25567 8711 1 12 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.550 -3.470 25567 8712 1 12 . 1 1 142 142 ASP H H 142 9.087 9.087 8.200 0.887 25567 8713 1 12 . 1 1 143 143 ASP N N 143 119.094 119.094 118.924 0.170 25567 8714 1 12 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.763 -0.509 25567 8715 1 12 . 1 1 143 143 ASP C C 143 175.557 175.557 175.647 -0.090 25567 8716 1 12 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.993 -4.914 25567 8717 1 12 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.401 -3.959 25567 8718 1 12 . 1 1 143 143 ASP H H 143 8.175 8.175 8.461 -0.286 25567 8719 1 12 . 1 1 144 144 SER N N 144 115.438 115.438 117.648 -2.210 25567 8720 1 12 . 1 1 144 144 SER HA H 144 3.745 3.745 4.474 -0.729 25567 8721 1 12 . 1 1 144 144 SER C C 144 172.820 172.820 174.236 -1.416 25567 8722 1 12 . 1 1 144 144 SER CA C 144 59.336 59.336 59.030 0.306 25567 8723 1 12 . 1 1 144 144 SER CB C 144 60.839 60.839 64.275 -3.436 25567 8724 1 12 . 1 1 144 144 SER H H 144 7.742 7.742 8.395 -0.653 25567 8725 1 12 . 1 1 145 145 GLU N N 145 119.631 119.631 121.817 -2.186 25567 8726 1 12 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.206 0.113 25567 8727 1 12 . 1 1 145 145 GLU C C 145 171.927 171.927 175.210 -3.283 25567 8728 1 12 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.432 -3.348 25567 8729 1 12 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.960 -3.186 25567 8730 1 12 . 1 1 145 145 GLU H H 145 7.924 7.924 8.197 -0.273 25567 8731 1 12 . 1 1 146 146 VAL N N 146 118.791 118.791 121.220 -2.429 25567 8732 1 12 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.440 -0.484 25567 8733 1 12 . 1 1 146 146 VAL C C 146 174.582 174.582 177.118 -2.536 25567 8734 1 12 . 1 1 146 146 VAL CA C 146 64.078 64.078 65.229 -1.151 25567 8735 1 12 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.499 -2.359 25567 8736 1 12 . 1 1 146 146 VAL H H 146 6.393 6.393 7.678 -1.285 25567 8737 1 12 . 1 1 147 147 ASP N N 147 119.410 119.410 119.717 -0.307 25567 8738 1 12 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.223 -0.153 25567 8739 1 12 . 1 1 147 147 ASP C C 147 174.774 174.774 177.573 -2.799 25567 8740 1 12 . 1 1 147 147 ASP CA C 147 54.322 54.322 58.253 -3.931 25567 8741 1 12 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.081 -2.877 25567 8742 1 12 . 1 1 147 147 ASP H H 147 8.393 8.393 8.620 -0.227 25567 8743 1 12 . 1 1 148 148 LYS N N 148 119.422 119.422 118.444 0.978 25567 8744 1 12 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.064 -0.113 25567 8745 1 12 . 1 1 148 148 LYS C C 148 176.410 176.410 177.282 -0.872 25567 8746 1 12 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.348 -2.612 25567 8747 1 12 . 1 1 148 148 LYS CB C 148 29.576 29.576 31.706 -2.130 25567 8748 1 12 . 1 1 148 148 LYS H H 148 7.078 7.078 7.241 -0.163 25567 8749 1 12 . 1 1 149 149 TRP N N 149 118.168 118.168 119.678 -1.510 25567 8750 1 12 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.881 -0.280 25567 8751 1 12 . 1 1 149 149 TRP C C 149 174.199 174.199 175.975 -1.776 25567 8752 1 12 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.500 -1.705 25567 8753 1 12 . 1 1 149 149 TRP CB C 149 27.011 27.011 27.897 -0.886 25567 8754 1 12 . 1 1 149 149 TRP H H 149 7.914 7.914 7.060 0.854 25567 8755 1 12 . 1 1 150 150 SER N N 150 109.636 109.636 111.704 -2.068 25567 8756 1 12 . 1 1 150 150 SER HA H 150 4.242 4.242 4.707 -0.465 25567 8757 1 12 . 1 1 150 150 SER C C 150 170.173 170.173 174.692 -4.519 25567 8758 1 12 . 1 1 150 150 SER CA C 150 56.912 56.912 58.557 -1.645 25567 8759 1 12 . 1 1 150 150 SER CB C 150 62.087 62.087 64.594 -2.506 25567 8760 1 12 . 1 1 150 150 SER H H 150 7.814 7.814 7.711 0.103 25567 8761 1 13 . 1 1 2 2 MET HA H 2 4.416 4.416 4.713 -0.297 25567 8762 1 13 . 1 1 2 2 MET CA C 2 52.847 52.847 55.946 -3.099 25567 8763 1 13 . 1 1 2 2 MET CB C 2 30.672 30.672 33.939 -3.267 25567 8764 1 13 . 1 1 3 3 ALA N N 3 125.563 125.563 127.737 -2.174 25567 8765 1 13 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.472 -0.100 25567 8766 1 13 . 1 1 3 3 ALA C C 3 174.728 174.728 175.732 -1.004 25567 8767 1 13 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.312 -2.964 25567 8768 1 13 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.064 -3.129 25567 8769 1 13 . 1 1 3 3 ALA H H 3 8.342 8.342 8.332 0.010 25567 8770 1 13 . 1 1 4 4 LYS N N 4 121.767 121.767 123.197 -1.430 25567 8771 1 13 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.381 -0.151 25567 8772 1 13 . 1 1 4 4 LYS C C 4 174.577 174.577 175.586 -1.009 25567 8773 1 13 . 1 1 4 4 LYS CA C 4 53.989 53.989 56.217 -2.228 25567 8774 1 13 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.757 -1.202 25567 8775 1 13 . 1 1 4 4 LYS H H 4 8.500 8.500 8.563 -0.063 25567 8776 1 13 . 1 1 5 5 LYS N N 5 129.654 129.654 124.834 4.820 25567 8777 1 13 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.707 -0.181 25567 8778 1 13 . 1 1 5 5 LYS C C 5 174.731 174.731 176.590 -1.859 25567 8779 1 13 . 1 1 5 5 LYS CA C 5 54.746 54.746 56.104 -1.358 25567 8780 1 13 . 1 1 5 5 LYS CB C 5 29.894 29.894 33.830 -3.936 25567 8781 1 13 . 1 1 5 5 LYS H H 5 10.035 10.035 8.245 1.790 25567 8782 1 13 . 1 1 6 6 THR N N 6 126.212 126.212 114.685 11.527 25567 8783 1 13 . 1 1 6 6 THR HA H 6 5.654 5.654 5.356 0.298 25567 8784 1 13 . 1 1 6 6 THR C C 6 169.897 169.897 172.901 -3.004 25567 8785 1 13 . 1 1 6 6 THR CA C 6 60.647 60.647 61.545 -0.898 25567 8786 1 13 . 1 1 6 6 THR CB C 6 68.152 68.152 72.341 -4.189 25567 8787 1 13 . 1 1 6 6 THR H H 6 8.557 8.557 8.408 0.149 25567 8788 1 13 . 1 1 7 7 LEU N N 7 130.776 130.776 124.437 6.339 25567 8789 1 13 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.842 -0.223 25567 8790 1 13 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.297 -3.201 25567 8791 1 13 . 1 1 7 7 LEU CB C 7 41.043 41.043 45.298 -4.255 25567 8792 1 13 . 1 1 7 7 LEU H H 7 8.610 8.610 8.216 0.394 25567 8793 1 13 . 1 1 8 8 ILE N N 8 127.175 127.175 123.897 3.278 25567 8794 1 13 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.873 -0.017 25567 8795 1 13 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.137 -2.745 25567 8796 1 13 . 1 1 8 8 ILE CB C 8 36.864 36.864 40.853 -3.989 25567 8797 1 13 . 1 1 8 8 ILE H H 8 9.263 9.263 8.143 1.120 25567 8798 1 13 . 1 1 9 9 LEU N N 9 127.117 127.117 124.780 2.337 25567 8799 1 13 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.119 0.577 25567 8800 1 13 . 1 1 9 9 LEU CA C 9 49.952 49.952 52.999 -3.047 25567 8801 1 13 . 1 1 9 9 LEU CB C 9 43.827 43.827 46.356 -2.529 25567 8802 1 13 . 1 1 9 9 LEU H H 9 9.262 9.262 8.235 1.027 25567 8803 1 13 . 1 1 10 10 TYR N N 10 113.544 113.544 115.123 -1.579 25567 8804 1 13 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.422 0.109 25567 8805 1 13 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.555 -2.726 25567 8806 1 13 . 1 1 10 10 TYR CB C 10 38.615 38.615 41.487 -2.872 25567 8807 1 13 . 1 1 10 10 TYR H H 10 7.425 7.425 7.929 -0.504 25567 8808 1 13 . 1 1 11 11 TYR N N 11 121.235 121.235 121.016 0.219 25567 8809 1 13 . 1 1 11 11 TYR HA H 11 4.810 4.810 5.118 -0.308 25567 8810 1 13 . 1 1 11 11 TYR CA C 11 53.889 53.889 57.661 -3.772 25567 8811 1 13 . 1 1 11 11 TYR CB C 11 40.467 40.467 40.081 0.386 25567 8812 1 13 . 1 1 11 11 TYR H H 11 7.781 7.781 8.176 -0.395 25567 8813 1 13 . 1 1 14 14 SER CA C 14 54.675 54.675 58.976 -4.301 25567 8814 1 13 . 1 1 14 14 SER CB C 14 61.621 61.621 62.423 -0.802 25567 8815 1 13 . 1 1 15 15 GLY N N 15 110.420 110.420 110.259 0.161 25567 8816 1 13 . 1 1 15 15 GLY CA C 15 43.727 43.727 46.070 -2.343 25567 8817 1 13 . 1 1 15 15 GLY H H 15 7.757 7.757 7.890 -0.133 25567 8818 1 13 . 1 1 17 17 THR HA H 17 4.122 4.122 4.363 -0.241 25567 8819 1 13 . 1 1 17 17 THR CA C 17 64.748 64.748 62.846 1.902 25567 8820 1 13 . 1 1 17 17 THR CB C 17 64.532 64.532 69.051 -4.519 25567 8821 1 13 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.464 -0.546 25567 8822 1 13 . 1 1 18 18 LYS C C 18 173.812 173.812 177.997 -4.185 25567 8823 1 13 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.463 -2.460 25567 8824 1 13 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.120 -2.352 25567 8825 1 13 . 1 1 19 19 LYS N N 19 116.699 116.699 118.781 -2.082 25567 8826 1 13 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.948 0.000 25567 8827 1 13 . 1 1 19 19 LYS C C 19 177.221 177.221 178.906 -1.685 25567 8828 1 13 . 1 1 19 19 LYS CA C 19 56.421 56.421 59.414 -2.993 25567 8829 1 13 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.883 -2.249 25567 8830 1 13 . 1 1 19 19 LYS H H 19 7.476 7.476 7.365 0.111 25567 8831 1 13 . 1 1 20 20 MET N N 20 118.946 118.946 117.937 1.009 25567 8832 1 13 . 1 1 20 20 MET HA H 20 4.474 4.474 4.247 0.227 25567 8833 1 13 . 1 1 20 20 MET C C 20 173.826 173.826 178.113 -4.287 25567 8834 1 13 . 1 1 20 20 MET CA C 20 52.285 52.285 57.516 -5.231 25567 8835 1 13 . 1 1 20 20 MET CB C 20 26.921 26.921 31.589 -4.668 25567 8836 1 13 . 1 1 20 20 MET H H 20 7.457 7.457 8.267 -0.810 25567 8837 1 13 . 1 1 21 21 ALA N N 21 123.375 123.375 121.939 1.436 25567 8838 1 13 . 1 1 21 21 ALA HA H 21 3.552 3.552 3.894 -0.342 25567 8839 1 13 . 1 1 21 21 ALA C C 21 176.542 176.542 179.395 -2.853 25567 8840 1 13 . 1 1 21 21 ALA CA C 21 52.651 52.651 55.548 -2.897 25567 8841 1 13 . 1 1 21 21 ALA CB C 21 16.282 16.282 18.344 -2.062 25567 8842 1 13 . 1 1 21 21 ALA H H 21 8.549 8.549 7.867 0.682 25567 8843 1 13 . 1 1 22 22 GLU N N 22 116.906 116.906 118.229 -1.323 25567 8844 1 13 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.987 -0.314 25567 8845 1 13 . 1 1 22 22 GLU C C 22 176.658 176.658 179.262 -2.604 25567 8846 1 13 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.410 -2.804 25567 8847 1 13 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.448 -2.799 25567 8848 1 13 . 1 1 22 22 GLU H H 22 8.085 8.085 8.327 -0.242 25567 8849 1 13 . 1 1 23 23 LYS N N 23 123.301 123.301 120.600 2.701 25567 8850 1 13 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.030 -0.210 25567 8851 1 13 . 1 1 23 23 LYS C C 23 177.363 177.363 179.139 -1.776 25567 8852 1 13 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.217 -2.246 25567 8853 1 13 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.308 -2.777 25567 8854 1 13 . 1 1 23 23 LYS H H 23 7.703 7.703 7.844 -0.141 25567 8855 1 13 . 1 1 24 24 ILE N N 24 121.894 121.894 119.208 2.686 25567 8856 1 13 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.526 -0.230 25567 8857 1 13 . 1 1 24 24 ILE C C 24 174.944 174.944 177.459 -2.515 25567 8858 1 13 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.676 -1.443 25567 8859 1 13 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.508 -2.764 25567 8860 1 13 . 1 1 24 24 ILE H H 24 8.458 8.458 7.834 0.624 25567 8861 1 13 . 1 1 25 25 ASN N N 25 118.580 118.580 117.894 0.686 25567 8862 1 13 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.246 -0.012 25567 8863 1 13 . 1 1 25 25 ASN C C 25 173.567 173.567 177.405 -3.838 25567 8864 1 13 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.594 -4.270 25567 8865 1 13 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.608 -0.425 25567 8866 1 13 . 1 1 25 25 ASN H H 25 8.273 8.273 8.128 0.145 25567 8867 1 13 . 1 1 26 26 SER N N 26 112.132 112.132 114.873 -2.741 25567 8868 1 13 . 1 1 26 26 SER HA H 26 4.148 4.148 4.279 -0.131 25567 8869 1 13 . 1 1 26 26 SER C C 26 172.083 172.083 175.343 -3.260 25567 8870 1 13 . 1 1 26 26 SER CA C 26 57.865 57.865 61.028 -3.163 25567 8871 1 13 . 1 1 26 26 SER CB C 26 60.816 60.816 62.930 -2.114 25567 8872 1 13 . 1 1 26 26 SER H H 26 7.444 7.444 7.914 -0.470 25567 8873 1 13 . 1 1 27 27 GLU N N 27 120.080 120.080 118.333 1.747 25567 8874 1 13 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.292 -0.192 25567 8875 1 13 . 1 1 27 27 GLU C C 27 173.647 173.647 176.351 -2.704 25567 8876 1 13 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.470 -2.268 25567 8877 1 13 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.164 -3.280 25567 8878 1 13 . 1 1 27 27 GLU H H 27 7.453 7.453 7.523 -0.070 25567 8879 1 13 . 1 1 28 28 ILE N N 28 118.759 118.759 120.693 -1.934 25567 8880 1 13 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.250 -0.046 25567 8881 1 13 . 1 1 28 28 ILE C C 28 172.474 172.474 174.686 -2.212 25567 8882 1 13 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.185 -2.438 25567 8883 1 13 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.520 -4.722 25567 8884 1 13 . 1 1 28 28 ILE H H 28 7.258 7.258 7.390 -0.132 25567 8885 1 13 . 1 1 29 29 LYS N N 29 130.618 130.618 126.936 3.682 25567 8886 1 13 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.214 -0.209 25567 8887 1 13 . 1 1 29 29 LYS C C 29 174.375 174.375 177.178 -2.803 25567 8888 1 13 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.471 -1.812 25567 8889 1 13 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.814 -3.254 25567 8890 1 13 . 1 1 29 29 LYS H H 29 8.588 8.588 8.613 -0.025 25567 8891 1 13 . 1 1 30 30 ASP N N 30 119.366 119.366 119.220 0.146 25567 8892 1 13 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.411 -0.009 25567 8893 1 13 . 1 1 30 30 ASP C C 30 172.580 172.580 175.783 -3.203 25567 8894 1 13 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.436 -1.812 25567 8895 1 13 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.432 -3.604 25567 8896 1 13 . 1 1 30 30 ASP H H 30 8.940 8.940 8.810 0.130 25567 8897 1 13 . 1 1 31 31 SER N N 31 114.035 114.035 113.371 0.664 25567 8898 1 13 . 1 1 31 31 SER HA H 31 4.781 4.781 4.501 0.280 25567 8899 1 13 . 1 1 31 31 SER C C 31 171.136 171.136 174.546 -3.410 25567 8900 1 13 . 1 1 31 31 SER CA C 31 55.638 55.638 58.707 -3.069 25567 8901 1 13 . 1 1 31 31 SER CB C 31 62.388 62.388 64.420 -2.032 25567 8902 1 13 . 1 1 31 31 SER H H 31 8.030 8.030 7.664 0.366 25567 8903 1 13 . 1 1 32 32 GLU N N 32 121.406 121.406 118.631 2.775 25567 8904 1 13 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.620 0.115 25567 8905 1 13 . 1 1 32 32 GLU C C 32 171.205 171.205 174.583 -3.378 25567 8906 1 13 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.580 -3.511 25567 8907 1 13 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.891 -3.001 25567 8908 1 13 . 1 1 32 32 GLU H H 32 8.188 8.188 8.223 -0.035 25567 8909 1 13 . 1 1 33 33 LEU N N 33 126.143 126.143 117.910 8.233 25567 8910 1 13 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.215 0.070 25567 8911 1 13 . 1 1 33 33 LEU C C 33 173.401 173.401 175.733 -2.332 25567 8912 1 13 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.486 -2.152 25567 8913 1 13 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.554 -0.931 25567 8914 1 13 . 1 1 33 33 LEU H H 33 8.627 8.627 8.408 0.219 25567 8915 1 13 . 1 1 34 34 LYS N N 34 127.122 127.122 123.455 3.667 25567 8916 1 13 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.720 -0.121 25567 8917 1 13 . 1 1 34 34 LYS C C 34 169.644 169.644 174.722 -5.078 25567 8918 1 13 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.412 -2.059 25567 8919 1 13 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.149 -2.977 25567 8920 1 13 . 1 1 34 34 LYS H H 34 9.399 9.399 8.661 0.738 25567 8921 1 13 . 1 1 35 35 GLU N N 35 122.766 122.766 119.040 3.726 25567 8922 1 13 . 1 1 35 35 GLU HA H 35 3.358 3.358 3.983 -0.625 25567 8923 1 13 . 1 1 35 35 GLU C C 35 172.875 172.875 174.899 -2.024 25567 8924 1 13 . 1 1 35 35 GLU CA C 35 52.640 52.640 54.495 -1.855 25567 8925 1 13 . 1 1 35 35 GLU CB C 35 29.268 29.268 32.231 -2.963 25567 8926 1 13 . 1 1 35 35 GLU H H 35 8.166 8.166 8.191 -0.025 25567 8927 1 13 . 1 1 36 36 VAL N N 36 126.674 126.674 118.291 8.383 25567 8928 1 13 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.950 -1.089 25567 8929 1 13 . 1 1 36 36 VAL C C 36 171.451 171.451 175.581 -4.130 25567 8930 1 13 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.626 -1.089 25567 8931 1 13 . 1 1 36 36 VAL CB C 36 29.689 29.689 35.087 -5.398 25567 8932 1 13 . 1 1 36 36 VAL H H 36 8.632 8.632 8.207 0.425 25567 8933 1 13 . 1 1 37 37 LYS N N 37 126.181 126.181 122.576 3.605 25567 8934 1 13 . 1 1 37 37 LYS HA H 37 4.939 4.939 5.060 -0.121 25567 8935 1 13 . 1 1 37 37 LYS CA C 37 52.179 52.179 53.714 -1.535 25567 8936 1 13 . 1 1 37 37 LYS CB C 37 32.898 32.898 36.438 -3.540 25567 8937 1 13 . 1 1 37 37 LYS H H 37 7.867 7.867 9.204 -1.337 25567 8938 1 13 . 1 1 38 38 VAL N N 38 113.540 113.540 116.390 -2.850 25567 8939 1 13 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.672 0.014 25567 8940 1 13 . 1 1 38 38 VAL C C 38 173.633 173.633 175.245 -1.612 25567 8941 1 13 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.681 -2.397 25567 8942 1 13 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.873 -1.909 25567 8943 1 13 . 1 1 38 38 VAL H H 38 8.389 8.389 8.322 0.067 25567 8944 1 13 . 1 1 39 39 SER N N 39 118.860 118.860 119.902 -1.042 25567 8945 1 13 . 1 1 39 39 SER HA H 39 4.194 4.194 4.371 -0.177 25567 8946 1 13 . 1 1 39 39 SER C C 39 173.059 173.059 174.818 -1.759 25567 8947 1 13 . 1 1 39 39 SER CA C 39 56.227 56.227 59.119 -2.892 25567 8948 1 13 . 1 1 39 39 SER CB C 39 60.771 60.771 63.880 -3.109 25567 8949 1 13 . 1 1 39 39 SER H H 39 8.668 8.668 8.352 0.316 25567 8950 1 13 . 1 1 40 40 GLU N N 40 125.769 125.769 120.201 5.568 25567 8951 1 13 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.244 -0.087 25567 8952 1 13 . 1 1 40 40 GLU C C 40 174.484 174.484 176.661 -2.177 25567 8953 1 13 . 1 1 40 40 GLU CA C 40 55.550 55.550 57.470 -1.920 25567 8954 1 13 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.121 -3.067 25567 8955 1 13 . 1 1 40 40 GLU H H 40 8.878 8.878 8.504 0.374 25567 8956 1 13 . 1 1 41 41 GLY N N 41 112.165 112.165 108.026 4.139 25567 8957 1 13 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.658 -1.951 25567 8958 1 13 . 1 1 41 41 GLY H H 41 8.743 8.743 8.553 0.190 25567 8959 1 13 . 1 1 44 44 ASP N N 44 122.324 122.324 120.783 1.541 25567 8960 1 13 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.340 1.817 25567 8961 1 13 . 1 1 44 44 ASP H H 44 7.918 7.918 8.535 -0.617 25567 8962 1 13 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.489 -0.427 25567 8963 1 13 . 1 1 45 45 ALA CA C 45 51.410 51.410 51.551 -0.141 25567 8964 1 13 . 1 1 45 45 ALA CB C 45 16.376 16.376 22.242 -5.866 25567 8965 1 13 . 1 1 47 47 MET CA C 47 54.118 54.118 58.391 -4.273 25567 8966 1 13 . 1 1 47 47 MET CB C 47 27.527 27.527 31.154 -3.627 25567 8967 1 13 . 1 1 48 48 TYR N N 48 120.075 120.075 119.733 0.342 25567 8968 1 13 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.354 -0.201 25567 8969 1 13 . 1 1 48 48 TYR C C 48 172.217 172.217 176.258 -4.041 25567 8970 1 13 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.161 -1.784 25567 8971 1 13 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.104 -2.608 25567 8972 1 13 . 1 1 48 48 TYR H H 48 7.810 7.810 7.954 -0.144 25567 8973 1 13 . 1 1 49 49 LYS N N 49 118.369 118.369 123.085 -4.716 25567 8974 1 13 . 1 1 49 49 LYS H H 49 8.116 8.116 8.494 -0.378 25567 8975 1 13 . 1 1 50 50 THR N N 50 116.979 116.979 112.465 4.514 25567 8976 1 13 . 1 1 50 50 THR CB C 50 66.373 66.373 70.305 -3.932 25567 8977 1 13 . 1 1 50 50 THR H H 50 7.741 7.741 8.429 -0.688 25567 8978 1 13 . 1 1 51 51 SER N N 51 116.155 116.155 118.262 -2.107 25567 8979 1 13 . 1 1 51 51 SER HA H 51 3.771 3.771 4.614 -0.843 25567 8980 1 13 . 1 1 51 51 SER C C 51 170.563 170.563 174.164 -3.601 25567 8981 1 13 . 1 1 51 51 SER CA C 51 54.840 54.840 59.278 -4.438 25567 8982 1 13 . 1 1 51 51 SER CB C 51 60.318 60.318 63.955 -3.636 25567 8983 1 13 . 1 1 51 51 SER H H 51 7.853 7.853 8.315 -0.462 25567 8984 1 13 . 1 1 54 54 ALA N N 54 123.234 123.234 121.617 1.617 25567 8985 1 13 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.726 -0.478 25567 8986 1 13 . 1 1 54 54 ALA CA C 54 51.268 51.268 50.729 0.539 25567 8987 1 13 . 1 1 54 54 ALA CB C 54 16.434 16.434 21.967 -5.533 25567 8988 1 13 . 1 1 54 54 ALA H H 54 8.207 8.207 7.947 0.260 25567 8989 1 13 . 1 1 55 55 LEU N N 55 118.603 118.603 117.282 1.321 25567 8990 1 13 . 1 1 55 55 LEU HA H 55 3.940 3.940 3.987 -0.047 25567 8991 1 13 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.807 -1.096 25567 8992 1 13 . 1 1 55 55 LEU CB C 55 38.913 38.913 40.369 -1.456 25567 8993 1 13 . 1 1 55 55 LEU H H 55 7.960 7.960 8.997 -1.037 25567 8994 1 13 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.109 -0.433 25567 8995 1 13 . 1 1 58 58 ILE CA C 58 61.494 61.494 60.665 0.829 25567 8996 1 13 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.039 -2.985 25567 8997 1 13 . 1 1 59 59 GLN N N 59 117.579 117.579 120.352 -2.773 25567 8998 1 13 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.306 -0.173 25567 8999 1 13 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.262 -2.253 25567 9000 1 13 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.661 -2.010 25567 9001 1 13 . 1 1 59 59 GLN H H 59 8.268 8.268 8.387 -0.119 25567 9002 1 13 . 1 1 60 60 GLY N N 60 107.308 107.308 114.690 -7.382 25567 9003 1 13 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.560 -2.582 25567 9004 1 13 . 1 1 60 60 GLY H H 60 7.780 7.780 8.961 -1.181 25567 9005 1 13 . 1 1 61 61 ASN N N 61 117.747 117.747 120.574 -2.827 25567 9006 1 13 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.481 0.053 25567 9007 1 13 . 1 1 61 61 ASN CA C 61 51.235 51.235 53.580 -2.345 25567 9008 1 13 . 1 1 61 61 ASN CB C 61 36.424 36.424 38.383 -1.960 25567 9009 1 13 . 1 1 61 61 ASN H H 61 8.108 8.108 8.039 0.069 25567 9010 1 13 . 1 1 64 64 PHE N N 64 120.102 120.102 120.603 -0.501 25567 9011 1 13 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.672 -0.293 25567 9012 1 13 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.180 -2.432 25567 9013 1 13 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.914 -3.639 25567 9014 1 13 . 1 1 64 64 PHE H H 64 8.300 8.300 7.889 0.411 25567 9015 1 13 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.438 -0.103 25567 9016 1 13 . 1 1 65 65 PRO C C 65 173.870 173.870 176.332 -2.462 25567 9017 1 13 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.748 -2.731 25567 9018 1 13 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.367 -2.732 25567 9019 1 13 . 1 1 66 66 GLU N N 66 121.258 121.258 121.471 -0.213 25567 9020 1 13 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.216 0.018 25567 9021 1 13 . 1 1 66 66 GLU C C 66 173.981 173.981 177.245 -3.264 25567 9022 1 13 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.721 -2.933 25567 9023 1 13 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.460 -2.685 25567 9024 1 13 . 1 1 66 66 GLU H H 66 8.316 8.316 8.315 0.001 25567 9025 1 13 . 1 1 67 67 ILE N N 67 114.290 114.290 116.320 -2.030 25567 9026 1 13 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.499 0.630 25567 9027 1 13 . 1 1 67 67 ILE C C 67 172.700 172.700 175.765 -3.065 25567 9028 1 13 . 1 1 67 67 ILE CA C 67 56.439 56.439 60.218 -3.779 25567 9029 1 13 . 1 1 67 67 ILE CB C 67 39.159 39.159 39.974 -0.815 25567 9030 1 13 . 1 1 67 67 ILE H H 67 8.366 8.366 8.023 0.343 25567 9031 1 13 . 1 1 68 68 GLN N N 68 121.422 121.422 118.516 2.906 25567 9032 1 13 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.767 -0.266 25567 9033 1 13 . 1 1 68 68 GLN C C 68 171.675 171.675 174.143 -2.468 25567 9034 1 13 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.115 -1.843 25567 9035 1 13 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.005 -5.862 25567 9036 1 13 . 1 1 68 68 GLN H H 68 8.737 8.737 8.489 0.248 25567 9037 1 13 . 1 1 69 69 LEU N N 69 125.311 125.311 117.349 7.962 25567 9038 1 13 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.963 -0.457 25567 9039 1 13 . 1 1 69 69 LEU C C 69 172.634 172.634 175.223 -2.589 25567 9040 1 13 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.737 -1.978 25567 9041 1 13 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.898 -1.494 25567 9042 1 13 . 1 1 69 69 LEU H H 69 8.051 8.051 8.311 -0.260 25567 9043 1 13 . 1 1 70 70 ASP N N 70 122.763 122.763 119.312 3.451 25567 9044 1 13 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.636 -0.213 25567 9045 1 13 . 1 1 70 70 ASP CA C 70 51.610 51.610 54.378 -2.768 25567 9046 1 13 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.687 -3.970 25567 9047 1 13 . 1 1 70 70 ASP H H 70 8.313 8.313 8.614 -0.301 25567 9048 1 13 . 1 1 71 71 ASN N N 71 117.413 117.413 118.431 -1.018 25567 9049 1 13 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.673 -0.336 25567 9050 1 13 . 1 1 71 71 ASN C C 71 171.770 171.770 174.358 -2.588 25567 9051 1 13 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.364 -1.873 25567 9052 1 13 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.768 -2.442 25567 9053 1 13 . 1 1 71 71 ASN H H 71 8.407 8.407 8.515 -0.108 25567 9054 1 13 . 1 1 72 72 ILE N N 72 123.752 123.752 124.422 -0.670 25567 9055 1 13 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.208 -0.268 25567 9056 1 13 . 1 1 72 72 ILE C C 72 171.621 171.621 174.788 -3.167 25567 9057 1 13 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.634 -3.302 25567 9058 1 13 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.186 -0.697 25567 9059 1 13 . 1 1 72 72 ILE H H 72 7.639 7.639 7.591 0.048 25567 9060 1 13 . 1 1 73 73 ASP N N 73 125.252 125.252 125.927 -0.675 25567 9061 1 13 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.551 0.074 25567 9062 1 13 . 1 1 73 73 ASP C C 73 174.034 174.034 175.680 -1.646 25567 9063 1 13 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.198 -3.995 25567 9064 1 13 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.998 -4.974 25567 9065 1 13 . 1 1 73 73 ASP H H 73 8.394 8.394 8.398 -0.004 25567 9066 1 13 . 1 1 74 74 TYR N N 74 123.108 123.108 124.051 -0.943 25567 9067 1 13 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.520 -0.642 25567 9068 1 13 . 1 1 74 74 TYR C C 74 173.637 173.637 177.852 -4.215 25567 9069 1 13 . 1 1 74 74 TYR CA C 74 59.474 59.474 60.623 -1.149 25567 9070 1 13 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.400 -3.678 25567 9071 1 13 . 1 1 74 74 TYR H H 74 7.392 7.392 8.405 -1.013 25567 9072 1 13 . 1 1 75 75 ASN N N 75 109.422 109.422 118.802 -9.380 25567 9073 1 13 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.620 0.306 25567 9074 1 13 . 1 1 75 75 ASN C C 75 172.574 172.574 176.750 -4.176 25567 9075 1 13 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.991 -3.230 25567 9076 1 13 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.479 -2.862 25567 9077 1 13 . 1 1 75 75 ASN H H 75 8.058 8.058 8.794 -0.736 25567 9078 1 13 . 1 1 76 76 ASN N N 76 117.422 117.422 116.966 0.456 25567 9079 1 13 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.497 -0.042 25567 9080 1 13 . 1 1 76 76 ASN C C 76 171.132 171.132 174.688 -3.556 25567 9081 1 13 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.922 -2.755 25567 9082 1 13 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.383 -2.655 25567 9083 1 13 . 1 1 76 76 ASN H H 76 7.768 7.768 8.420 -0.652 25567 9084 1 13 . 1 1 77 77 TYR N N 77 116.873 116.873 117.479 -0.606 25567 9085 1 13 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.561 -0.198 25567 9086 1 13 . 1 1 77 77 TYR C C 77 172.175 172.175 175.509 -3.334 25567 9087 1 13 . 1 1 77 77 TYR CA C 77 55.364 55.364 58.584 -3.220 25567 9088 1 13 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.343 -3.178 25567 9089 1 13 . 1 1 77 77 TYR H H 77 7.825 7.825 7.793 0.032 25567 9090 1 13 . 1 1 78 78 ASP N N 78 121.271 121.271 119.143 2.128 25567 9091 1 13 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.896 -0.091 25567 9092 1 13 . 1 1 78 78 ASP C C 78 172.641 172.641 175.189 -2.548 25567 9093 1 13 . 1 1 78 78 ASP CA C 78 53.255 53.255 55.017 -1.762 25567 9094 1 13 . 1 1 78 78 ASP CB C 78 41.075 41.075 44.225 -3.150 25567 9095 1 13 . 1 1 78 78 ASP H H 78 9.058 9.058 8.521 0.537 25567 9096 1 13 . 1 1 79 79 LEU N N 79 122.985 122.985 119.452 3.533 25567 9097 1 13 . 1 1 79 79 LEU HA H 79 5.114 5.114 4.919 0.195 25567 9098 1 13 . 1 1 79 79 LEU C C 79 170.721 170.721 174.438 -3.717 25567 9099 1 13 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.362 -3.046 25567 9100 1 13 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.462 -3.120 25567 9101 1 13 . 1 1 79 79 LEU H H 79 7.893 7.893 7.905 -0.012 25567 9102 1 13 . 1 1 80 80 ILE N N 80 126.364 126.364 123.901 2.463 25567 9103 1 13 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.920 0.169 25567 9104 1 13 . 1 1 80 80 ILE C C 80 171.580 171.580 173.792 -2.212 25567 9105 1 13 . 1 1 80 80 ILE CA C 80 57.417 57.417 59.965 -2.548 25567 9106 1 13 . 1 1 80 80 ILE CB C 80 38.136 38.136 42.232 -4.096 25567 9107 1 13 . 1 1 80 80 ILE H H 80 8.717 8.717 9.092 -0.375 25567 9108 1 13 . 1 1 81 81 LEU N N 81 126.199 126.199 125.500 0.699 25567 9109 1 13 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.252 -0.117 25567 9110 1 13 . 1 1 81 81 LEU C C 81 172.979 172.979 175.890 -2.911 25567 9111 1 13 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.050 -3.417 25567 9112 1 13 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.281 -3.122 25567 9113 1 13 . 1 1 81 81 LEU H H 81 9.230 9.230 8.746 0.484 25567 9114 1 13 . 1 1 82 82 ILE N N 82 120.505 120.505 118.555 1.950 25567 9115 1 13 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.056 -0.140 25567 9116 1 13 . 1 1 82 82 ILE C C 82 173.011 173.011 174.788 -1.777 25567 9117 1 13 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.964 -3.136 25567 9118 1 13 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.322 -4.254 25567 9119 1 13 . 1 1 82 82 ILE H H 82 8.796 8.796 8.244 0.552 25567 9120 1 13 . 1 1 83 83 GLY N N 83 120.857 120.857 110.525 10.332 25567 9121 1 13 . 1 1 83 83 GLY CA C 83 40.803 40.803 44.183 -3.380 25567 9122 1 13 . 1 1 83 83 GLY H H 83 9.525 9.525 8.220 1.305 25567 9123 1 13 . 1 1 84 84 SER N N 84 116.007 116.007 113.143 2.864 25567 9124 1 13 . 1 1 84 84 SER HA H 84 5.476 5.476 5.095 0.381 25567 9125 1 13 . 1 1 84 84 SER CA C 84 51.937 51.937 56.512 -4.575 25567 9126 1 13 . 1 1 84 84 SER CB C 84 64.533 64.533 64.498 0.035 25567 9127 1 13 . 1 1 84 84 SER H H 84 7.617 7.617 7.773 -0.156 25567 9128 1 13 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.581 0.620 25567 9129 1 13 . 1 1 85 85 PRO C C 85 173.574 173.574 175.702 -2.128 25567 9130 1 13 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.409 -2.921 25567 9131 1 13 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.943 -1.803 25567 9132 1 13 . 1 1 86 86 VAL N N 86 117.603 117.603 118.870 -1.267 25567 9133 1 13 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.335 0.038 25567 9134 1 13 . 1 1 86 86 VAL C C 86 172.777 172.777 174.184 -1.407 25567 9135 1 13 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.641 -2.038 25567 9136 1 13 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.508 -4.935 25567 9137 1 13 . 1 1 86 86 VAL H H 86 8.194 8.194 7.425 0.769 25567 9138 1 13 . 1 1 87 87 TRP N N 87 131.187 131.187 126.797 4.390 25567 9139 1 13 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.983 0.215 25567 9140 1 13 . 1 1 87 87 TRP C C 87 173.295 173.295 174.298 -1.003 25567 9141 1 13 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.766 -6.982 25567 9142 1 13 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.963 -4.217 25567 9143 1 13 . 1 1 87 87 TRP H H 87 9.637 9.637 8.630 1.007 25567 9144 1 13 . 1 1 88 88 SER N N 88 119.829 119.829 115.022 4.807 25567 9145 1 13 . 1 1 88 88 SER HA H 88 3.986 3.986 4.787 -0.801 25567 9146 1 13 . 1 1 88 88 SER C C 88 172.375 172.375 174.910 -2.535 25567 9147 1 13 . 1 1 88 88 SER CA C 88 55.932 55.932 57.368 -1.436 25567 9148 1 13 . 1 1 88 88 SER CB C 88 59.178 59.178 62.802 -3.624 25567 9149 1 13 . 1 1 88 88 SER H H 88 9.272 9.272 7.743 1.529 25567 9150 1 13 . 1 1 89 89 GLY N N 89 101.498 101.498 111.248 -9.750 25567 9151 1 13 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.144 -3.473 25567 9152 1 13 . 1 1 89 89 GLY H H 89 7.463 7.463 8.756 -1.293 25567 9153 1 13 . 1 1 90 90 TYR N N 90 121.064 121.064 116.529 4.535 25567 9154 1 13 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.100 -0.884 25567 9155 1 13 . 1 1 90 90 TYR CA C 90 54.090 54.090 53.514 0.577 25567 9156 1 13 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.429 -0.234 25567 9157 1 13 . 1 1 90 90 TYR H H 90 8.064 8.064 7.647 0.417 25567 9158 1 13 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.432 0.500 25567 9159 1 13 . 1 1 91 91 PRO C C 91 171.019 171.019 175.730 -4.711 25567 9160 1 13 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.720 -4.726 25567 9161 1 13 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.326 -5.833 25567 9162 1 13 . 1 1 92 92 ALA N N 92 119.893 119.893 121.281 -1.388 25567 9163 1 13 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.915 -1.464 25567 9164 1 13 . 1 1 92 92 ALA C C 92 176.477 176.477 175.461 1.016 25567 9165 1 13 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.480 -1.913 25567 9166 1 13 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.682 -5.881 25567 9167 1 13 . 1 1 92 92 ALA H H 92 7.278 7.278 7.888 -0.610 25567 9168 1 13 . 1 1 93 93 THR N N 93 112.992 112.992 108.419 4.573 25567 9169 1 13 . 1 1 93 93 THR HA H 93 4.462 4.462 4.508 -0.046 25567 9170 1 13 . 1 1 93 93 THR CA C 93 66.871 66.871 59.708 7.163 25567 9171 1 13 . 1 1 93 93 THR CB C 93 64.362 64.362 67.753 -3.391 25567 9172 1 13 . 1 1 93 93 THR H H 93 6.861 6.861 8.198 -1.337 25567 9173 1 13 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.351 -0.485 25567 9174 1 13 . 1 1 94 94 PRO CA C 94 63.021 63.021 62.986 0.035 25567 9175 1 13 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.846 -2.567 25567 9176 1 13 . 1 1 95 95 ILE N N 95 111.298 111.298 119.098 -7.800 25567 9177 1 13 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.391 -0.768 25567 9178 1 13 . 1 1 95 95 ILE C C 95 174.264 174.264 175.294 -1.030 25567 9179 1 13 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.596 -2.148 25567 9180 1 13 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.964 -5.035 25567 9181 1 13 . 1 1 95 95 ILE H H 95 7.974 7.974 7.617 0.357 25567 9182 1 13 . 1 1 96 96 LYS N N 96 123.045 123.045 122.782 0.263 25567 9183 1 13 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.606 -1.494 25567 9184 1 13 . 1 1 96 96 LYS C C 96 174.590 174.590 177.645 -3.055 25567 9185 1 13 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.228 -0.083 25567 9186 1 13 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.976 -5.131 25567 9187 1 13 . 1 1 96 96 LYS H H 96 6.958 6.958 8.134 -1.176 25567 9188 1 13 . 1 1 97 97 THR N N 97 113.412 113.412 116.966 -3.554 25567 9189 1 13 . 1 1 97 97 THR HA H 97 3.461 3.461 4.062 -0.601 25567 9190 1 13 . 1 1 97 97 THR C C 97 173.247 173.247 176.152 -2.905 25567 9191 1 13 . 1 1 97 97 THR CA C 97 62.809 62.809 65.901 -3.092 25567 9192 1 13 . 1 1 97 97 THR CB C 97 65.654 65.654 68.810 -3.156 25567 9193 1 13 . 1 1 97 97 THR H H 97 6.366 6.366 8.276 -1.910 25567 9194 1 13 . 1 1 98 98 LEU N N 98 121.201 121.201 121.954 -0.753 25567 9195 1 13 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.120 -0.486 25567 9196 1 13 . 1 1 98 98 LEU C C 98 174.590 174.590 178.103 -3.513 25567 9197 1 13 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.556 -1.935 25567 9198 1 13 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.004 -1.109 25567 9199 1 13 . 1 1 98 98 LEU H H 98 7.554 7.554 8.017 -0.463 25567 9200 1 13 . 1 1 99 99 LEU N N 99 118.677 118.677 118.149 0.528 25567 9201 1 13 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.932 -0.230 25567 9202 1 13 . 1 1 99 99 LEU C C 99 177.457 177.457 178.687 -1.230 25567 9203 1 13 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.120 -1.941 25567 9204 1 13 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.603 -1.615 25567 9205 1 13 . 1 1 99 99 LEU H H 99 8.160 8.160 7.561 0.599 25567 9206 1 13 . 1 1 100 100 ASP N N 100 118.914 118.914 116.503 2.411 25567 9207 1 13 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.384 -0.155 25567 9208 1 13 . 1 1 100 100 ASP C C 100 176.585 176.585 179.014 -2.429 25567 9209 1 13 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.732 -2.216 25567 9210 1 13 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.291 -3.712 25567 9211 1 13 . 1 1 100 100 ASP H H 100 7.872 7.872 7.625 0.247 25567 9212 1 13 . 1 1 101 101 GLN N N 101 118.135 118.135 118.420 -0.285 25567 9213 1 13 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.189 -0.029 25567 9214 1 13 . 1 1 101 101 GLN C C 101 174.601 174.601 178.000 -3.399 25567 9215 1 13 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.029 -3.069 25567 9216 1 13 . 1 1 101 101 GLN CB C 101 25.550 25.550 28.973 -3.423 25567 9217 1 13 . 1 1 101 101 GLN H H 101 7.673 7.673 7.649 0.024 25567 9218 1 13 . 1 1 102 102 MET N N 102 118.420 118.420 116.185 2.235 25567 9219 1 13 . 1 1 102 102 MET HA H 102 3.826 3.826 4.440 -0.614 25567 9220 1 13 . 1 1 102 102 MET C C 102 172.780 172.780 177.085 -4.305 25567 9221 1 13 . 1 1 102 102 MET CA C 102 53.428 53.428 56.183 -2.755 25567 9222 1 13 . 1 1 102 102 MET CB C 102 31.221 31.221 31.540 -0.319 25567 9223 1 13 . 1 1 102 102 MET H H 102 7.462 7.462 7.540 -0.078 25567 9224 1 13 . 1 1 103 103 LYS N N 103 116.066 116.066 119.861 -3.795 25567 9225 1 13 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.172 -0.252 25567 9226 1 13 . 1 1 103 103 LYS C C 103 173.922 173.922 176.553 -2.631 25567 9227 1 13 . 1 1 103 103 LYS CA C 103 56.282 56.282 57.947 -1.665 25567 9228 1 13 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.128 -1.637 25567 9229 1 13 . 1 1 103 103 LYS H H 103 6.875 6.875 7.702 -0.827 25567 9230 1 13 . 1 1 104 104 ASN N N 104 114.987 114.987 112.676 2.311 25567 9231 1 13 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.760 -0.019 25567 9232 1 13 . 1 1 104 104 ASN C C 104 172.587 172.587 174.851 -2.264 25567 9233 1 13 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.565 -2.096 25567 9234 1 13 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.177 -3.355 25567 9235 1 13 . 1 1 104 104 ASN H H 104 8.517 8.517 7.396 1.121 25567 9236 1 13 . 1 1 105 105 TYR N N 105 122.755 122.755 123.342 -0.587 25567 9237 1 13 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.416 0.159 25567 9238 1 13 . 1 1 105 105 TYR C C 105 174.260 174.260 175.295 -1.035 25567 9239 1 13 . 1 1 105 105 TYR CA C 105 55.493 55.493 60.375 -4.882 25567 9240 1 13 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.073 -3.009 25567 9241 1 13 . 1 1 105 105 TYR H H 105 8.287 8.287 7.970 0.317 25567 9242 1 13 . 1 1 106 106 ARG N N 106 128.905 128.905 125.669 3.236 25567 9243 1 13 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.305 -0.032 25567 9244 1 13 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.552 -2.531 25567 9245 1 13 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.596 -3.466 25567 9246 1 13 . 1 1 106 106 ARG H H 106 8.841 8.841 8.460 0.381 25567 9247 1 13 . 1 1 107 107 GLY CA C 107 42.497 42.497 43.679 -1.183 25567 9248 1 13 . 1 1 108 108 GLU N N 108 116.989 116.989 120.248 -3.259 25567 9249 1 13 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.800 -0.169 25567 9250 1 13 . 1 1 108 108 GLU CA C 108 53.676 53.676 54.744 -1.068 25567 9251 1 13 . 1 1 108 108 GLU CB C 108 30.402 30.402 32.913 -2.511 25567 9252 1 13 . 1 1 108 108 GLU H H 108 7.536 7.536 8.314 -0.778 25567 9253 1 13 . 1 1 109 109 VAL N N 109 123.416 123.416 121.998 1.418 25567 9254 1 13 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.859 0.462 25567 9255 1 13 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.978 -3.535 25567 9256 1 13 . 1 1 109 109 VAL CB C 109 32.661 32.661 34.312 -1.651 25567 9257 1 13 . 1 1 109 109 VAL H H 109 8.955 8.955 8.695 0.260 25567 9258 1 13 . 1 1 110 110 ALA N N 110 127.975 127.975 128.300 -0.325 25567 9259 1 13 . 1 1 110 110 ALA HA H 110 4.677 4.677 4.997 -0.320 25567 9260 1 13 . 1 1 110 110 ALA CA C 110 47.441 47.441 50.027 -2.586 25567 9261 1 13 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.292 -3.876 25567 9262 1 13 . 1 1 110 110 ALA H H 110 8.860 8.860 8.603 0.257 25567 9263 1 13 . 1 1 111 111 SER N N 111 110.482 110.482 113.976 -3.494 25567 9264 1 13 . 1 1 111 111 SER HA H 111 5.502 5.502 5.527 -0.025 25567 9265 1 13 . 1 1 111 111 SER CA C 111 51.630 51.630 56.888 -5.258 25567 9266 1 13 . 1 1 111 111 SER CB C 111 62.267 62.267 65.528 -3.262 25567 9267 1 13 . 1 1 111 111 SER H H 111 7.484 7.484 7.876 -0.392 25567 9268 1 13 . 1 1 112 112 PHE N N 112 125.082 125.082 121.716 3.366 25567 9269 1 13 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.884 0.564 25567 9270 1 13 . 1 1 112 112 PHE CA C 112 50.434 50.434 54.843 -4.409 25567 9271 1 13 . 1 1 112 112 PHE CB C 112 40.500 40.500 41.731 -1.232 25567 9272 1 13 . 1 1 112 112 PHE H H 112 8.025 8.025 8.542 -0.517 25567 9273 1 13 . 1 1 113 113 PHE N N 113 115.872 115.872 115.166 0.706 25567 9274 1 13 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.125 0.799 25567 9275 1 13 . 1 1 113 113 PHE C C 113 173.293 173.293 175.058 -1.765 25567 9276 1 13 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.569 -5.101 25567 9277 1 13 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.804 -3.411 25567 9278 1 13 . 1 1 113 113 PHE H H 113 7.391 7.391 7.419 -0.028 25567 9279 1 13 . 1 1 114 114 THR N N 114 108.721 108.721 110.215 -1.494 25567 9280 1 13 . 1 1 114 114 THR HA H 114 4.933 4.933 4.591 0.342 25567 9281 1 13 . 1 1 114 114 THR C C 114 171.891 171.891 174.343 -2.452 25567 9282 1 13 . 1 1 114 114 THR CA C 114 56.815 56.815 61.498 -4.684 25567 9283 1 13 . 1 1 114 114 THR CB C 114 67.899 67.899 70.010 -2.111 25567 9284 1 13 . 1 1 114 114 THR H H 114 7.951 7.951 8.528 -0.577 25567 9285 1 13 . 1 1 115 115 SER N N 115 115.159 115.159 118.228 -3.069 25567 9286 1 13 . 1 1 115 115 SER HA H 115 4.608 4.608 4.695 -0.087 25567 9287 1 13 . 1 1 115 115 SER C C 115 171.403 171.403 173.050 -1.647 25567 9288 1 13 . 1 1 115 115 SER CA C 115 55.570 55.570 58.184 -2.614 25567 9289 1 13 . 1 1 115 115 SER CB C 115 61.418 61.418 65.026 -3.608 25567 9290 1 13 . 1 1 115 115 SER H H 115 8.229 8.229 8.119 0.110 25567 9291 1 13 . 1 1 116 116 ALA N N 116 127.211 127.211 126.742 0.469 25567 9292 1 13 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.709 -0.253 25567 9293 1 13 . 1 1 116 116 ALA C C 116 175.758 175.758 178.027 -2.269 25567 9294 1 13 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.367 -2.551 25567 9295 1 13 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.730 -2.899 25567 9296 1 13 . 1 1 116 116 ALA H H 116 8.813 8.813 8.493 0.320 25567 9297 1 13 . 1 1 117 117 GLY N N 117 108.099 108.099 107.722 0.377 25567 9298 1 13 . 1 1 117 117 GLY C C 117 171.805 171.805 175.836 -4.031 25567 9299 1 13 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.021 -4.152 25567 9300 1 13 . 1 1 117 117 GLY H H 117 8.685 8.685 8.880 -0.195 25567 9301 1 13 . 1 1 118 118 THR N N 118 111.284 111.284 109.635 1.649 25567 9302 1 13 . 1 1 118 118 THR HA H 118 4.343 4.343 4.362 -0.019 25567 9303 1 13 . 1 1 118 118 THR C C 118 171.769 171.769 174.081 -2.312 25567 9304 1 13 . 1 1 118 118 THR CA C 118 58.933 58.933 62.429 -3.496 25567 9305 1 13 . 1 1 118 118 THR CB C 118 67.304 67.304 70.254 -2.950 25567 9306 1 13 . 1 1 118 118 THR H H 118 7.998 7.998 8.140 -0.142 25567 9307 1 13 . 1 1 119 119 ASN N N 119 120.253 120.253 119.520 0.733 25567 9308 1 13 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.961 -0.258 25567 9309 1 13 . 1 1 119 119 ASN C C 119 172.353 172.353 174.200 -1.847 25567 9310 1 13 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.506 -3.278 25567 9311 1 13 . 1 1 119 119 ASN CB C 119 35.376 35.376 39.760 -4.384 25567 9312 1 13 . 1 1 119 119 ASN H H 119 8.381 8.381 8.325 0.056 25567 9313 1 13 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.474 -0.388 25567 9314 1 13 . 1 1 120 120 HIS C C 120 173.395 173.395 175.912 -2.517 25567 9315 1 13 . 1 1 120 120 HIS CA C 120 55.139 55.139 56.724 -1.585 25567 9316 1 13 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.311 -2.889 25567 9317 1 13 . 1 1 121 121 LYS N N 121 119.527 119.527 122.078 -2.551 25567 9318 1 13 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.677 0.103 25567 9319 1 13 . 1 1 121 121 LYS C C 121 176.053 176.053 177.373 -1.320 25567 9320 1 13 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.252 -1.289 25567 9321 1 13 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.684 -2.024 25567 9322 1 13 . 1 1 121 121 LYS H H 121 8.106 8.106 8.492 -0.386 25567 9323 1 13 . 1 1 122 122 ALA N N 122 121.585 121.585 122.162 -0.577 25567 9324 1 13 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.838 -0.117 25567 9325 1 13 . 1 1 122 122 ALA C C 122 175.128 175.128 178.831 -3.703 25567 9326 1 13 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.069 -2.478 25567 9327 1 13 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.848 -2.144 25567 9328 1 13 . 1 1 122 122 ALA H H 122 7.702 7.702 7.706 -0.004 25567 9329 1 13 . 1 1 123 123 TYR N N 123 118.803 118.803 120.233 -1.430 25567 9330 1 13 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.921 -0.555 25567 9331 1 13 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.288 -1.197 25567 9332 1 13 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.287 -3.185 25567 9333 1 13 . 1 1 123 123 TYR H H 123 7.366 7.366 7.782 -0.416 25567 9334 1 13 . 1 1 124 124 VAL N N 124 117.530 117.530 117.067 0.463 25567 9335 1 13 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.632 -0.433 25567 9336 1 13 . 1 1 124 124 VAL C C 124 175.375 175.375 178.156 -2.781 25567 9337 1 13 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.460 -1.877 25567 9338 1 13 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.573 -1.371 25567 9339 1 13 . 1 1 124 124 VAL H H 124 7.757 7.757 7.567 0.190 25567 9340 1 13 . 1 1 125 125 SER N N 125 114.023 114.023 115.305 -1.282 25567 9341 1 13 . 1 1 125 125 SER HA H 125 4.035 4.035 3.989 0.046 25567 9342 1 13 . 1 1 125 125 SER C C 125 174.636 174.636 176.333 -1.697 25567 9343 1 13 . 1 1 125 125 SER CA C 125 58.885 58.885 61.077 -2.192 25567 9344 1 13 . 1 1 125 125 SER CB C 125 59.666 59.666 62.964 -3.298 25567 9345 1 13 . 1 1 125 125 SER H H 125 7.622 7.622 7.568 0.054 25567 9346 1 13 . 1 1 126 126 HIS N N 126 119.457 119.457 120.243 -0.786 25567 9347 1 13 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.836 0.360 25567 9348 1 13 . 1 1 126 126 HIS C C 126 172.942 172.942 177.544 -4.602 25567 9349 1 13 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.062 -3.144 25567 9350 1 13 . 1 1 126 126 HIS CB C 126 26.079 26.079 28.843 -2.764 25567 9351 1 13 . 1 1 126 126 HIS H H 126 8.067 8.067 7.388 0.679 25567 9352 1 13 . 1 1 127 127 PHE N N 127 120.628 120.628 119.312 1.316 25567 9353 1 13 . 1 1 127 127 PHE HA H 127 3.199 3.199 4.095 -0.896 25567 9354 1 13 . 1 1 127 127 PHE C C 127 173.515 173.515 176.981 -3.466 25567 9355 1 13 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.648 1.033 25567 9356 1 13 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.591 -2.224 25567 9357 1 13 . 1 1 127 127 PHE H H 127 9.083 9.083 8.631 0.452 25567 9358 1 13 . 1 1 128 128 ASN N N 128 114.858 114.858 117.004 -2.146 25567 9359 1 13 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.115 -0.037 25567 9360 1 13 . 1 1 128 128 ASN C C 128 175.338 175.338 177.971 -2.633 25567 9361 1 13 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.037 -1.787 25567 9362 1 13 . 1 1 128 128 ASN CB C 128 36.021 36.021 37.934 -1.913 25567 9363 1 13 . 1 1 128 128 ASN H H 128 7.858 7.858 7.608 0.250 25567 9364 1 13 . 1 1 129 129 GLU N N 129 119.811 119.811 120.350 -0.539 25567 9365 1 13 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.185 -0.144 25567 9366 1 13 . 1 1 129 129 GLU C C 129 176.941 176.941 179.414 -2.473 25567 9367 1 13 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.857 -2.225 25567 9368 1 13 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.378 -2.440 25567 9369 1 13 . 1 1 129 129 GLU H H 129 7.569 7.569 8.091 -0.522 25567 9370 1 13 . 1 1 130 130 TRP N N 130 120.585 120.585 120.428 0.157 25567 9371 1 13 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.608 -0.136 25567 9372 1 13 . 1 1 130 130 TRP C C 130 174.262 174.262 177.367 -3.105 25567 9373 1 13 . 1 1 130 130 TRP CA C 130 54.673 54.673 58.192 -3.519 25567 9374 1 13 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.636 -1.679 25567 9375 1 13 . 1 1 130 130 TRP H H 130 7.964 7.964 8.120 -0.156 25567 9376 1 13 . 1 1 131 131 ALA N N 131 120.522 120.522 117.613 2.909 25567 9377 1 13 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.418 -0.471 25567 9378 1 13 . 1 1 131 131 ALA C C 131 172.489 172.489 175.954 -3.465 25567 9379 1 13 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.117 -2.537 25567 9380 1 13 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.473 -2.934 25567 9381 1 13 . 1 1 131 131 ALA H H 131 8.114 8.114 7.374 0.740 25567 9382 1 13 . 1 1 132 132 ASP N N 132 117.666 117.666 120.488 -2.822 25567 9383 1 13 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.412 -0.206 25567 9384 1 13 . 1 1 132 132 ASP C C 132 173.779 173.779 176.911 -3.132 25567 9385 1 13 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.650 -1.337 25567 9386 1 13 . 1 1 132 132 ASP CB C 132 39.456 39.456 40.911 -1.455 25567 9387 1 13 . 1 1 132 132 ASP H H 132 6.768 6.768 7.368 -0.600 25567 9388 1 13 . 1 1 133 133 GLY N N 133 114.922 114.922 112.891 2.031 25567 9389 1 13 . 1 1 133 133 GLY C C 133 172.101 172.101 174.212 -2.111 25567 9390 1 13 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.723 -2.214 25567 9391 1 13 . 1 1 133 133 GLY H H 133 8.645 8.645 8.501 0.144 25567 9392 1 13 . 1 1 134 134 LEU N N 134 120.101 120.101 121.532 -1.431 25567 9393 1 13 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.250 0.212 25567 9394 1 13 . 1 1 134 134 LEU C C 134 174.098 174.098 176.316 -2.218 25567 9395 1 13 . 1 1 134 134 LEU CA C 134 51.084 51.084 54.572 -3.488 25567 9396 1 13 . 1 1 134 134 LEU CB C 134 40.509 40.509 42.463 -1.954 25567 9397 1 13 . 1 1 134 134 LEU H H 134 8.049 8.049 7.573 0.476 25567 9398 1 13 . 1 1 135 135 ASN N N 135 119.258 119.258 119.153 0.105 25567 9399 1 13 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.651 -0.012 25567 9400 1 13 . 1 1 135 135 ASN C C 135 170.564 170.564 174.095 -3.531 25567 9401 1 13 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.599 -4.346 25567 9402 1 13 . 1 1 135 135 ASN CB C 135 33.618 33.618 39.424 -5.806 25567 9403 1 13 . 1 1 135 135 ASN H H 135 8.567 8.567 8.545 0.022 25567 9404 1 13 . 1 1 136 136 VAL N N 136 125.460 125.460 118.890 6.570 25567 9405 1 13 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.630 -0.034 25567 9406 1 13 . 1 1 136 136 VAL C C 136 175.318 175.318 175.608 -0.290 25567 9407 1 13 . 1 1 136 136 VAL CA C 136 58.722 58.722 61.482 -2.760 25567 9408 1 13 . 1 1 136 136 VAL CB C 136 29.299 29.299 34.954 -5.655 25567 9409 1 13 . 1 1 136 136 VAL H H 136 7.660 7.660 8.114 -0.454 25567 9410 1 13 . 1 1 137 137 ILE N N 137 122.021 122.021 118.628 3.393 25567 9411 1 13 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.696 -0.268 25567 9412 1 13 . 1 1 137 137 ILE C C 137 173.943 173.943 174.653 -0.710 25567 9413 1 13 . 1 1 137 137 ILE CA C 137 58.958 58.958 60.032 -1.074 25567 9414 1 13 . 1 1 137 137 ILE CB C 137 36.169 36.169 39.158 -2.989 25567 9415 1 13 . 1 1 137 137 ILE H H 137 9.151 9.151 9.135 0.016 25567 9416 1 13 . 1 1 138 138 GLY N N 138 108.192 108.192 107.428 0.764 25567 9417 1 13 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.620 -2.126 25567 9418 1 13 . 1 1 138 138 GLY H H 138 6.675 6.675 7.379 -0.704 25567 9419 1 13 . 1 1 139 139 VAL N N 139 119.673 119.673 119.840 -0.167 25567 9420 1 13 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.891 0.429 25567 9421 1 13 . 1 1 139 139 VAL C C 139 172.291 172.291 175.170 -2.879 25567 9422 1 13 . 1 1 139 139 VAL CA C 139 58.209 58.209 62.686 -4.477 25567 9423 1 13 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.657 -1.018 25567 9424 1 13 . 1 1 139 139 VAL H H 139 8.158 8.158 8.743 -0.585 25567 9425 1 13 . 1 1 140 140 ALA N N 140 127.104 127.104 129.697 -2.593 25567 9426 1 13 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.179 -0.583 25567 9427 1 13 . 1 1 140 140 ALA C C 140 171.057 171.057 174.893 -3.836 25567 9428 1 13 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.685 -1.802 25567 9429 1 13 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.980 -1.552 25567 9430 1 13 . 1 1 140 140 ALA H H 140 9.145 9.145 8.377 0.768 25567 9431 1 13 . 1 1 141 141 ARG N N 141 118.828 118.828 119.245 -0.417 25567 9432 1 13 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.695 -0.955 25567 9433 1 13 . 1 1 141 141 ARG C C 141 173.524 173.524 176.367 -2.843 25567 9434 1 13 . 1 1 141 141 ARG CA C 141 51.886 51.886 55.410 -3.524 25567 9435 1 13 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.748 -2.294 25567 9436 1 13 . 1 1 141 141 ARG H H 141 7.759 7.759 8.262 -0.503 25567 9437 1 13 . 1 1 142 142 ASP N N 142 125.557 125.557 121.878 3.679 25567 9438 1 13 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.251 -0.472 25567 9439 1 13 . 1 1 142 142 ASP C C 142 169.292 169.292 174.995 -5.703 25567 9440 1 13 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.084 -2.462 25567 9441 1 13 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.754 -3.674 25567 9442 1 13 . 1 1 142 142 ASP H H 142 9.087 9.087 8.454 0.633 25567 9443 1 13 . 1 1 143 143 ASP N N 143 119.094 119.094 119.439 -0.345 25567 9444 1 13 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.566 -0.312 25567 9445 1 13 . 1 1 143 143 ASP C C 143 175.557 175.557 176.169 -0.612 25567 9446 1 13 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.492 -4.412 25567 9447 1 13 . 1 1 143 143 ASP CB C 143 36.442 36.442 39.519 -3.077 25567 9448 1 13 . 1 1 143 143 ASP H H 143 8.175 8.175 8.545 -0.370 25567 9449 1 13 . 1 1 144 144 SER N N 144 115.438 115.438 116.203 -0.765 25567 9450 1 13 . 1 1 144 144 SER HA H 144 3.745 3.745 4.242 -0.497 25567 9451 1 13 . 1 1 144 144 SER C C 144 172.820 172.820 175.097 -2.277 25567 9452 1 13 . 1 1 144 144 SER CA C 144 59.336 59.336 60.278 -0.942 25567 9453 1 13 . 1 1 144 144 SER CB C 144 60.839 60.839 63.175 -2.336 25567 9454 1 13 . 1 1 144 144 SER H H 144 7.742 7.742 7.811 -0.069 25567 9455 1 13 . 1 1 145 145 GLU N N 145 119.631 119.631 119.240 0.391 25567 9456 1 13 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.178 0.141 25567 9457 1 13 . 1 1 145 145 GLU C C 145 171.927 171.927 176.283 -4.356 25567 9458 1 13 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.377 -3.293 25567 9459 1 13 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.408 -2.634 25567 9460 1 13 . 1 1 145 145 GLU H H 145 7.924 7.924 8.103 -0.179 25567 9461 1 13 . 1 1 146 146 VAL N N 146 118.791 118.791 120.059 -1.268 25567 9462 1 13 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.506 -0.550 25567 9463 1 13 . 1 1 146 146 VAL C C 146 174.582 174.582 177.138 -2.556 25567 9464 1 13 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.415 -2.337 25567 9465 1 13 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.613 -2.473 25567 9466 1 13 . 1 1 146 146 VAL H H 146 6.393 6.393 7.420 -1.027 25567 9467 1 13 . 1 1 147 147 ASP N N 147 119.410 119.410 116.782 2.628 25567 9468 1 13 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.418 -0.348 25567 9469 1 13 . 1 1 147 147 ASP C C 147 174.774 174.774 176.686 -1.912 25567 9470 1 13 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.362 -2.040 25567 9471 1 13 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.053 -2.849 25567 9472 1 13 . 1 1 147 147 ASP H H 147 8.393 8.393 8.775 -0.382 25567 9473 1 13 . 1 1 148 148 LYS N N 148 119.422 119.422 115.801 3.621 25567 9474 1 13 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.615 -0.664 25567 9475 1 13 . 1 1 148 148 LYS C C 148 176.410 176.410 176.897 -0.487 25567 9476 1 13 . 1 1 148 148 LYS CA C 148 55.736 55.736 55.830 -0.094 25567 9477 1 13 . 1 1 148 148 LYS CB C 148 29.576 29.576 33.279 -3.703 25567 9478 1 13 . 1 1 148 148 LYS H H 148 7.078 7.078 7.612 -0.534 25567 9479 1 13 . 1 1 149 149 TRP N N 149 118.168 118.168 120.956 -2.788 25567 9480 1 13 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.920 -0.319 25567 9481 1 13 . 1 1 149 149 TRP C C 149 174.199 174.199 175.964 -1.765 25567 9482 1 13 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.192 -1.397 25567 9483 1 13 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.376 -1.365 25567 9484 1 13 . 1 1 149 149 TRP H H 149 7.914 7.914 7.603 0.311 25567 9485 1 13 . 1 1 150 150 SER N N 150 109.636 109.636 113.406 -3.770 25567 9486 1 13 . 1 1 150 150 SER HA H 150 4.242 4.242 4.581 -0.339 25567 9487 1 13 . 1 1 150 150 SER C C 150 170.173 170.173 174.373 -4.200 25567 9488 1 13 . 1 1 150 150 SER CA C 150 56.912 56.912 58.644 -1.732 25567 9489 1 13 . 1 1 150 150 SER CB C 150 62.087 62.087 63.459 -1.372 25567 9490 1 13 . 1 1 150 150 SER H H 150 7.814 7.814 8.116 -0.302 25567 9491 1 14 . 1 1 2 2 MET HA H 2 4.416 4.416 5.321 -0.905 25567 9492 1 14 . 1 1 2 2 MET CA C 2 52.847 52.847 54.289 -1.442 25567 9493 1 14 . 1 1 2 2 MET CB C 2 30.672 30.672 35.297 -4.625 25567 9494 1 14 . 1 1 3 3 ALA N N 3 125.563 125.563 125.382 0.181 25567 9495 1 14 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.549 -0.177 25567 9496 1 14 . 1 1 3 3 ALA C C 3 174.728 174.728 175.761 -1.033 25567 9497 1 14 . 1 1 3 3 ALA CA C 3 49.348 49.348 51.536 -2.188 25567 9498 1 14 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.836 -3.901 25567 9499 1 14 . 1 1 3 3 ALA H H 3 8.342 8.342 8.620 -0.278 25567 9500 1 14 . 1 1 4 4 LYS N N 4 121.767 121.767 122.937 -1.170 25567 9501 1 14 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.410 -0.180 25567 9502 1 14 . 1 1 4 4 LYS C C 4 174.577 174.577 175.833 -1.256 25567 9503 1 14 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.752 -1.763 25567 9504 1 14 . 1 1 4 4 LYS CB C 4 31.555 31.555 33.285 -1.730 25567 9505 1 14 . 1 1 4 4 LYS H H 4 8.500 8.500 8.457 0.043 25567 9506 1 14 . 1 1 5 5 LYS N N 5 129.654 129.654 121.653 8.001 25567 9507 1 14 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.670 -0.144 25567 9508 1 14 . 1 1 5 5 LYS C C 5 174.731 174.731 175.330 -0.599 25567 9509 1 14 . 1 1 5 5 LYS CA C 5 54.746 54.746 54.684 0.062 25567 9510 1 14 . 1 1 5 5 LYS CB C 5 29.894 29.894 36.155 -6.261 25567 9511 1 14 . 1 1 5 5 LYS H H 5 10.035 10.035 8.471 1.564 25567 9512 1 14 . 1 1 6 6 THR N N 6 126.212 126.212 115.286 10.926 25567 9513 1 14 . 1 1 6 6 THR HA H 6 5.654 5.654 5.412 0.242 25567 9514 1 14 . 1 1 6 6 THR C C 6 169.897 169.897 173.435 -3.538 25567 9515 1 14 . 1 1 6 6 THR CA C 6 60.647 60.647 61.607 -0.960 25567 9516 1 14 . 1 1 6 6 THR CB C 6 68.152 68.152 72.276 -4.124 25567 9517 1 14 . 1 1 6 6 THR H H 6 8.557 8.557 8.384 0.173 25567 9518 1 14 . 1 1 7 7 LEU N N 7 130.776 130.776 125.583 5.193 25567 9519 1 14 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.853 -0.234 25567 9520 1 14 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.998 -3.902 25567 9521 1 14 . 1 1 7 7 LEU CB C 7 41.043 41.043 45.890 -4.847 25567 9522 1 14 . 1 1 7 7 LEU H H 7 8.610 8.610 8.431 0.179 25567 9523 1 14 . 1 1 8 8 ILE N N 8 127.175 127.175 125.885 1.290 25567 9524 1 14 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.503 0.353 25567 9525 1 14 . 1 1 8 8 ILE CA C 8 57.392 57.392 61.248 -3.856 25567 9526 1 14 . 1 1 8 8 ILE CB C 8 36.864 36.864 38.499 -1.635 25567 9527 1 14 . 1 1 8 8 ILE H H 8 9.263 9.263 8.935 0.328 25567 9528 1 14 . 1 1 9 9 LEU N N 9 127.117 127.117 130.072 -2.955 25567 9529 1 14 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.180 0.516 25567 9530 1 14 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.373 -3.421 25567 9531 1 14 . 1 1 9 9 LEU CB C 9 43.827 43.827 41.047 2.780 25567 9532 1 14 . 1 1 9 9 LEU H H 9 9.262 9.262 8.879 0.383 25567 9533 1 14 . 1 1 10 10 TYR N N 10 113.544 113.544 123.151 -9.607 25567 9534 1 14 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.035 0.496 25567 9535 1 14 . 1 1 10 10 TYR CA C 10 52.829 52.829 54.726 -1.897 25567 9536 1 14 . 1 1 10 10 TYR CB C 10 38.615 38.615 41.416 -2.801 25567 9537 1 14 . 1 1 10 10 TYR H H 10 7.425 7.425 8.256 -0.831 25567 9538 1 14 . 1 1 11 11 TYR N N 11 121.235 121.235 123.065 -1.830 25567 9539 1 14 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.890 -0.080 25567 9540 1 14 . 1 1 11 11 TYR CA C 11 53.889 53.889 56.916 -3.027 25567 9541 1 14 . 1 1 11 11 TYR CB C 11 40.467 40.467 41.970 -1.503 25567 9542 1 14 . 1 1 11 11 TYR H H 11 7.781 7.781 8.018 -0.237 25567 9543 1 14 . 1 1 14 14 SER CA C 14 54.675 54.675 58.351 -3.676 25567 9544 1 14 . 1 1 14 14 SER CB C 14 61.621 61.621 63.763 -2.142 25567 9545 1 14 . 1 1 15 15 GLY N N 15 110.420 110.420 110.721 -0.301 25567 9546 1 14 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.057 -1.330 25567 9547 1 14 . 1 1 15 15 GLY H H 15 7.757 7.757 8.673 -0.916 25567 9548 1 14 . 1 1 17 17 THR HA H 17 4.122 4.122 4.498 -0.376 25567 9549 1 14 . 1 1 17 17 THR CA C 17 64.748 64.748 62.114 2.634 25567 9550 1 14 . 1 1 17 17 THR CB C 17 64.532 64.532 69.863 -5.331 25567 9551 1 14 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.444 -0.526 25567 9552 1 14 . 1 1 18 18 LYS C C 18 173.812 173.812 177.883 -4.071 25567 9553 1 14 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.619 -2.616 25567 9554 1 14 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.419 -2.651 25567 9555 1 14 . 1 1 19 19 LYS N N 19 116.699 116.699 118.162 -1.463 25567 9556 1 14 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.856 0.092 25567 9557 1 14 . 1 1 19 19 LYS C C 19 177.221 177.221 178.949 -1.728 25567 9558 1 14 . 1 1 19 19 LYS CA C 19 56.421 56.421 59.016 -2.595 25567 9559 1 14 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.329 -1.695 25567 9560 1 14 . 1 1 19 19 LYS H H 19 7.476 7.476 7.935 -0.459 25567 9561 1 14 . 1 1 20 20 MET N N 20 118.946 118.946 119.069 -0.123 25567 9562 1 14 . 1 1 20 20 MET HA H 20 4.474 4.474 4.051 0.423 25567 9563 1 14 . 1 1 20 20 MET C C 20 173.826 173.826 177.906 -4.080 25567 9564 1 14 . 1 1 20 20 MET CA C 20 52.285 52.285 58.492 -6.207 25567 9565 1 14 . 1 1 20 20 MET CB C 20 26.921 26.921 32.236 -5.315 25567 9566 1 14 . 1 1 20 20 MET H H 20 7.457 7.457 7.732 -0.275 25567 9567 1 14 . 1 1 21 21 ALA N N 21 123.375 123.375 122.132 1.243 25567 9568 1 14 . 1 1 21 21 ALA HA H 21 3.552 3.552 3.844 -0.292 25567 9569 1 14 . 1 1 21 21 ALA C C 21 176.542 176.542 179.362 -2.820 25567 9570 1 14 . 1 1 21 21 ALA CA C 21 52.651 52.651 55.249 -2.598 25567 9571 1 14 . 1 1 21 21 ALA CB C 21 16.282 16.282 17.839 -1.557 25567 9572 1 14 . 1 1 21 21 ALA H H 21 8.549 8.549 7.177 1.372 25567 9573 1 14 . 1 1 22 22 GLU N N 22 116.906 116.906 117.345 -0.439 25567 9574 1 14 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.046 -0.373 25567 9575 1 14 . 1 1 22 22 GLU C C 22 176.658 176.658 179.517 -2.859 25567 9576 1 14 . 1 1 22 22 GLU CA C 22 56.605 56.605 58.896 -2.291 25567 9577 1 14 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.428 -2.779 25567 9578 1 14 . 1 1 22 22 GLU H H 22 8.085 8.085 8.203 -0.118 25567 9579 1 14 . 1 1 23 23 LYS N N 23 123.301 123.301 120.335 2.966 25567 9580 1 14 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.053 -0.233 25567 9581 1 14 . 1 1 23 23 LYS C C 23 177.363 177.363 179.241 -1.878 25567 9582 1 14 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.313 -2.342 25567 9583 1 14 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.426 -2.896 25567 9584 1 14 . 1 1 23 23 LYS H H 23 7.703 7.703 8.050 -0.347 25567 9585 1 14 . 1 1 24 24 ILE N N 24 121.894 121.894 119.840 2.054 25567 9586 1 14 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.679 -0.383 25567 9587 1 14 . 1 1 24 24 ILE C C 24 174.944 174.944 178.431 -3.487 25567 9588 1 14 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.742 -1.509 25567 9589 1 14 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.564 -2.820 25567 9590 1 14 . 1 1 24 24 ILE H H 24 8.458 8.458 7.770 0.688 25567 9591 1 14 . 1 1 25 25 ASN N N 25 118.580 118.580 118.409 0.171 25567 9592 1 14 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.472 -0.238 25567 9593 1 14 . 1 1 25 25 ASN C C 25 173.567 173.567 177.264 -3.697 25567 9594 1 14 . 1 1 25 25 ASN CA C 25 52.324 52.324 55.847 -3.523 25567 9595 1 14 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.524 -0.341 25567 9596 1 14 . 1 1 25 25 ASN H H 25 8.273 8.273 8.402 -0.129 25567 9597 1 14 . 1 1 26 26 SER N N 26 112.132 112.132 114.695 -2.563 25567 9598 1 14 . 1 1 26 26 SER HA H 26 4.148 4.148 4.504 -0.356 25567 9599 1 14 . 1 1 26 26 SER C C 26 172.083 172.083 174.790 -2.707 25567 9600 1 14 . 1 1 26 26 SER CA C 26 57.865 57.865 60.081 -2.216 25567 9601 1 14 . 1 1 26 26 SER CB C 26 60.816 60.816 63.608 -2.792 25567 9602 1 14 . 1 1 26 26 SER H H 26 7.444 7.444 7.948 -0.504 25567 9603 1 14 . 1 1 27 27 GLU N N 27 120.080 120.080 119.285 0.795 25567 9604 1 14 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.411 -0.311 25567 9605 1 14 . 1 1 27 27 GLU C C 27 173.647 173.647 175.396 -1.749 25567 9606 1 14 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.066 -1.864 25567 9607 1 14 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.875 -3.991 25567 9608 1 14 . 1 1 27 27 GLU H H 27 7.453 7.453 7.713 -0.260 25567 9609 1 14 . 1 1 28 28 ILE N N 28 118.759 118.759 120.163 -1.404 25567 9610 1 14 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.239 -0.035 25567 9611 1 14 . 1 1 28 28 ILE C C 28 172.474 172.474 174.757 -2.283 25567 9612 1 14 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.422 -2.675 25567 9613 1 14 . 1 1 28 28 ILE CB C 28 35.798 35.798 41.266 -5.468 25567 9614 1 14 . 1 1 28 28 ILE H H 28 7.258 7.258 7.311 -0.053 25567 9615 1 14 . 1 1 29 29 LYS N N 29 130.618 130.618 128.673 1.945 25567 9616 1 14 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.230 -0.225 25567 9617 1 14 . 1 1 29 29 LYS C C 29 174.375 174.375 176.672 -2.297 25567 9618 1 14 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.270 -1.611 25567 9619 1 14 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.908 -3.348 25567 9620 1 14 . 1 1 29 29 LYS H H 29 8.588 8.588 8.776 -0.188 25567 9621 1 14 . 1 1 30 30 ASP N N 30 119.366 119.366 122.649 -3.283 25567 9622 1 14 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.335 0.067 25567 9623 1 14 . 1 1 30 30 ASP C C 30 172.580 172.580 175.815 -3.235 25567 9624 1 14 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.447 -1.823 25567 9625 1 14 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.351 -3.523 25567 9626 1 14 . 1 1 30 30 ASP H H 30 8.940 8.940 8.836 0.104 25567 9627 1 14 . 1 1 31 31 SER N N 31 114.035 114.035 114.249 -0.214 25567 9628 1 14 . 1 1 31 31 SER HA H 31 4.781 4.781 4.563 0.218 25567 9629 1 14 . 1 1 31 31 SER C C 31 171.136 171.136 174.113 -2.977 25567 9630 1 14 . 1 1 31 31 SER CA C 31 55.638 55.638 59.534 -3.896 25567 9631 1 14 . 1 1 31 31 SER CB C 31 62.388 62.388 64.229 -1.841 25567 9632 1 14 . 1 1 31 31 SER H H 31 8.030 8.030 7.652 0.378 25567 9633 1 14 . 1 1 32 32 GLU N N 32 121.406 121.406 119.783 1.623 25567 9634 1 14 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.687 0.048 25567 9635 1 14 . 1 1 32 32 GLU C C 32 171.205 171.205 174.806 -3.601 25567 9636 1 14 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.219 -3.151 25567 9637 1 14 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.821 -2.930 25567 9638 1 14 . 1 1 32 32 GLU H H 32 8.188 8.188 8.192 -0.004 25567 9639 1 14 . 1 1 33 33 LEU N N 33 126.143 126.143 117.044 9.099 25567 9640 1 14 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.474 -0.189 25567 9641 1 14 . 1 1 33 33 LEU C C 33 173.401 173.401 175.596 -2.195 25567 9642 1 14 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.327 -1.993 25567 9643 1 14 . 1 1 33 33 LEU CB C 33 43.623 43.623 45.382 -1.759 25567 9644 1 14 . 1 1 33 33 LEU H H 33 8.627 8.627 8.411 0.216 25567 9645 1 14 . 1 1 34 34 LYS N N 34 127.122 127.122 122.036 5.086 25567 9646 1 14 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.627 -0.028 25567 9647 1 14 . 1 1 34 34 LYS C C 34 169.644 169.644 174.306 -4.662 25567 9648 1 14 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.835 -2.482 25567 9649 1 14 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.144 -2.972 25567 9650 1 14 . 1 1 34 34 LYS H H 34 9.399 9.399 9.258 0.141 25567 9651 1 14 . 1 1 35 35 GLU N N 35 122.766 122.766 123.678 -0.912 25567 9652 1 14 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.405 -1.047 25567 9653 1 14 . 1 1 35 35 GLU C C 35 172.875 172.875 175.876 -3.001 25567 9654 1 14 . 1 1 35 35 GLU CA C 35 52.640 52.640 54.366 -1.726 25567 9655 1 14 . 1 1 35 35 GLU CB C 35 29.268 29.268 30.010 -0.742 25567 9656 1 14 . 1 1 35 35 GLU H H 35 8.166 8.166 8.426 -0.260 25567 9657 1 14 . 1 1 36 36 VAL N N 36 126.674 126.674 125.796 0.878 25567 9658 1 14 . 1 1 36 36 VAL HA H 36 3.861 3.861 3.899 -0.038 25567 9659 1 14 . 1 1 36 36 VAL C C 36 171.451 171.451 176.192 -4.741 25567 9660 1 14 . 1 1 36 36 VAL CA C 36 59.537 59.537 63.291 -3.754 25567 9661 1 14 . 1 1 36 36 VAL CB C 36 29.689 29.689 31.930 -2.241 25567 9662 1 14 . 1 1 36 36 VAL H H 36 8.632 8.632 8.628 0.004 25567 9663 1 14 . 1 1 37 37 LYS N N 37 126.181 126.181 123.515 2.666 25567 9664 1 14 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.868 0.071 25567 9665 1 14 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.592 -2.413 25567 9666 1 14 . 1 1 37 37 LYS CB C 37 32.898 32.898 35.464 -2.566 25567 9667 1 14 . 1 1 37 37 LYS H H 37 7.867 7.867 8.925 -1.058 25567 9668 1 14 . 1 1 38 38 VAL N N 38 113.540 113.540 115.540 -2.000 25567 9669 1 14 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.749 -0.063 25567 9670 1 14 . 1 1 38 38 VAL C C 38 173.633 173.633 175.594 -1.961 25567 9671 1 14 . 1 1 38 38 VAL CA C 38 57.284 57.284 60.395 -3.111 25567 9672 1 14 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.609 -1.645 25567 9673 1 14 . 1 1 38 38 VAL H H 38 8.389 8.389 8.389 -0.000 25567 9674 1 14 . 1 1 39 39 SER N N 39 118.860 118.860 118.938 -0.078 25567 9675 1 14 . 1 1 39 39 SER HA H 39 4.194 4.194 4.453 -0.259 25567 9676 1 14 . 1 1 39 39 SER C C 39 173.059 173.059 174.461 -1.402 25567 9677 1 14 . 1 1 39 39 SER CA C 39 56.227 56.227 58.426 -2.199 25567 9678 1 14 . 1 1 39 39 SER CB C 39 60.771 60.771 64.087 -3.316 25567 9679 1 14 . 1 1 39 39 SER H H 39 8.668 8.668 8.479 0.189 25567 9680 1 14 . 1 1 40 40 GLU N N 40 125.769 125.769 120.156 5.613 25567 9681 1 14 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.215 -0.058 25567 9682 1 14 . 1 1 40 40 GLU C C 40 174.484 174.484 175.781 -1.297 25567 9683 1 14 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.625 -1.075 25567 9684 1 14 . 1 1 40 40 GLU CB C 40 27.054 27.054 29.713 -2.659 25567 9685 1 14 . 1 1 40 40 GLU H H 40 8.878 8.878 8.252 0.626 25567 9686 1 14 . 1 1 41 41 GLY N N 41 112.165 112.165 106.774 5.391 25567 9687 1 14 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.060 -2.353 25567 9688 1 14 . 1 1 41 41 GLY H H 41 8.743 8.743 8.195 0.548 25567 9689 1 14 . 1 1 44 44 ASP N N 44 122.324 122.324 120.211 2.113 25567 9690 1 14 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.898 1.258 25567 9691 1 14 . 1 1 44 44 ASP H H 44 7.918 7.918 8.470 -0.552 25567 9692 1 14 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.370 -0.308 25567 9693 1 14 . 1 1 45 45 ALA CA C 45 51.410 51.410 51.315 0.095 25567 9694 1 14 . 1 1 45 45 ALA CB C 45 16.376 16.376 21.070 -4.694 25567 9695 1 14 . 1 1 47 47 MET CA C 47 54.118 54.118 54.961 -0.843 25567 9696 1 14 . 1 1 47 47 MET CB C 47 27.527 27.527 35.035 -7.508 25567 9697 1 14 . 1 1 48 48 TYR N N 48 120.075 120.075 121.863 -1.788 25567 9698 1 14 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.224 -0.070 25567 9699 1 14 . 1 1 48 48 TYR C C 48 172.217 172.217 175.525 -3.308 25567 9700 1 14 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.227 -1.850 25567 9701 1 14 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.165 -2.669 25567 9702 1 14 . 1 1 48 48 TYR H H 48 7.810 7.810 8.648 -0.838 25567 9703 1 14 . 1 1 49 49 LYS N N 49 118.369 118.369 124.599 -6.230 25567 9704 1 14 . 1 1 49 49 LYS H H 49 8.116 8.116 8.280 -0.164 25567 9705 1 14 . 1 1 50 50 THR N N 50 116.979 116.979 116.444 0.535 25567 9706 1 14 . 1 1 50 50 THR CB C 50 66.373 66.373 68.460 -2.087 25567 9707 1 14 . 1 1 50 50 THR H H 50 7.741 7.741 8.403 -0.662 25567 9708 1 14 . 1 1 51 51 SER N N 51 116.155 116.155 116.350 -0.195 25567 9709 1 14 . 1 1 51 51 SER HA H 51 3.771 3.771 4.864 -1.093 25567 9710 1 14 . 1 1 51 51 SER C C 51 170.563 170.563 173.372 -2.809 25567 9711 1 14 . 1 1 51 51 SER CA C 51 54.840 54.840 57.483 -2.643 25567 9712 1 14 . 1 1 51 51 SER CB C 51 60.318 60.318 64.238 -3.920 25567 9713 1 14 . 1 1 51 51 SER H H 51 7.853 7.853 7.676 0.177 25567 9714 1 14 . 1 1 54 54 ALA N N 54 123.234 123.234 126.288 -3.054 25567 9715 1 14 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.857 -0.609 25567 9716 1 14 . 1 1 54 54 ALA CA C 54 51.268 51.268 51.755 -0.487 25567 9717 1 14 . 1 1 54 54 ALA CB C 54 16.434 16.434 20.077 -3.643 25567 9718 1 14 . 1 1 54 54 ALA H H 54 8.207 8.207 8.474 -0.267 25567 9719 1 14 . 1 1 55 55 LEU N N 55 118.603 118.603 118.745 -0.142 25567 9720 1 14 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.387 -0.447 25567 9721 1 14 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.441 -0.730 25567 9722 1 14 . 1 1 55 55 LEU CB C 55 38.913 38.913 42.464 -3.551 25567 9723 1 14 . 1 1 55 55 LEU H H 55 7.960 7.960 7.771 0.189 25567 9724 1 14 . 1 1 58 58 ILE HA H 58 3.676 3.676 3.973 -0.297 25567 9725 1 14 . 1 1 58 58 ILE CA C 58 61.494 61.494 62.177 -0.683 25567 9726 1 14 . 1 1 58 58 ILE CB C 58 36.054 36.054 38.797 -2.743 25567 9727 1 14 . 1 1 59 59 GLN N N 59 117.579 117.579 119.736 -2.157 25567 9728 1 14 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.303 -0.170 25567 9729 1 14 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.049 -2.040 25567 9730 1 14 . 1 1 59 59 GLN CB C 59 26.651 26.651 27.259 -0.608 25567 9731 1 14 . 1 1 59 59 GLN H H 59 8.268 8.268 8.487 -0.219 25567 9732 1 14 . 1 1 60 60 GLY N N 60 107.308 107.308 109.413 -2.105 25567 9733 1 14 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.414 -2.435 25567 9734 1 14 . 1 1 60 60 GLY H H 60 7.780 7.780 8.440 -0.660 25567 9735 1 14 . 1 1 61 61 ASN N N 61 117.747 117.747 117.773 -0.026 25567 9736 1 14 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.707 -0.173 25567 9737 1 14 . 1 1 61 61 ASN CA C 61 51.235 51.235 53.409 -2.174 25567 9738 1 14 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.268 -2.844 25567 9739 1 14 . 1 1 61 61 ASN H H 61 8.108 8.108 8.097 0.011 25567 9740 1 14 . 1 1 64 64 PHE N N 64 120.102 120.102 113.907 6.195 25567 9741 1 14 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.823 -0.444 25567 9742 1 14 . 1 1 64 64 PHE CA C 64 51.748 51.748 55.269 -3.521 25567 9743 1 14 . 1 1 64 64 PHE CB C 64 35.275 35.275 39.347 -4.072 25567 9744 1 14 . 1 1 64 64 PHE H H 64 8.300 8.300 7.825 0.475 25567 9745 1 14 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.511 -0.176 25567 9746 1 14 . 1 1 65 65 PRO C C 65 173.870 173.870 176.396 -2.526 25567 9747 1 14 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.936 -2.919 25567 9748 1 14 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.601 -2.966 25567 9749 1 14 . 1 1 66 66 GLU N N 66 121.258 121.258 122.647 -1.389 25567 9750 1 14 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.232 0.002 25567 9751 1 14 . 1 1 66 66 GLU C C 66 173.981 173.981 177.425 -3.444 25567 9752 1 14 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.546 -2.759 25567 9753 1 14 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.384 -2.609 25567 9754 1 14 . 1 1 66 66 GLU H H 66 8.316 8.316 8.460 -0.144 25567 9755 1 14 . 1 1 67 67 ILE N N 67 114.290 114.290 115.250 -0.960 25567 9756 1 14 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.593 0.536 25567 9757 1 14 . 1 1 67 67 ILE C C 67 172.700 172.700 175.806 -3.106 25567 9758 1 14 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.920 -3.482 25567 9759 1 14 . 1 1 67 67 ILE CB C 67 39.159 39.159 40.237 -1.078 25567 9760 1 14 . 1 1 67 67 ILE H H 67 8.366 8.366 7.995 0.371 25567 9761 1 14 . 1 1 68 68 GLN N N 68 121.422 121.422 118.856 2.566 25567 9762 1 14 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.683 -0.182 25567 9763 1 14 . 1 1 68 68 GLN C C 68 171.675 171.675 173.777 -2.102 25567 9764 1 14 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.923 -2.651 25567 9765 1 14 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.151 -6.008 25567 9766 1 14 . 1 1 68 68 GLN H H 68 8.737 8.737 8.547 0.190 25567 9767 1 14 . 1 1 69 69 LEU N N 69 125.311 125.311 120.984 4.327 25567 9768 1 14 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.677 -0.171 25567 9769 1 14 . 1 1 69 69 LEU C C 69 172.634 172.634 175.251 -2.617 25567 9770 1 14 . 1 1 69 69 LEU CA C 69 51.759 51.759 54.240 -2.481 25567 9771 1 14 . 1 1 69 69 LEU CB C 69 42.404 42.404 44.485 -2.081 25567 9772 1 14 . 1 1 69 69 LEU H H 69 8.051 8.051 8.360 -0.309 25567 9773 1 14 . 1 1 70 70 ASP N N 70 122.763 122.763 121.342 1.421 25567 9774 1 14 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.557 -0.134 25567 9775 1 14 . 1 1 70 70 ASP CA C 70 51.610 51.610 54.014 -2.404 25567 9776 1 14 . 1 1 70 70 ASP CB C 70 38.717 38.717 41.411 -2.694 25567 9777 1 14 . 1 1 70 70 ASP H H 70 8.313 8.313 8.430 -0.117 25567 9778 1 14 . 1 1 71 71 ASN N N 71 117.413 117.413 119.460 -2.047 25567 9779 1 14 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.695 -0.358 25567 9780 1 14 . 1 1 71 71 ASN C C 71 171.770 171.770 174.618 -2.848 25567 9781 1 14 . 1 1 71 71 ASN CA C 71 51.491 51.491 52.761 -1.270 25567 9782 1 14 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.964 -2.638 25567 9783 1 14 . 1 1 71 71 ASN H H 71 8.407 8.407 8.493 -0.086 25567 9784 1 14 . 1 1 72 72 ILE N N 72 123.752 123.752 124.265 -0.513 25567 9785 1 14 . 1 1 72 72 ILE HA H 72 3.940 3.940 3.902 0.038 25567 9786 1 14 . 1 1 72 72 ILE C C 72 171.621 171.621 174.906 -3.285 25567 9787 1 14 . 1 1 72 72 ILE CA C 72 57.332 57.332 61.580 -4.247 25567 9788 1 14 . 1 1 72 72 ILE CB C 72 38.489 38.489 38.225 0.264 25567 9789 1 14 . 1 1 72 72 ILE H H 72 7.639 7.639 7.586 0.053 25567 9790 1 14 . 1 1 73 73 ASP N N 73 125.252 125.252 127.141 -1.889 25567 9791 1 14 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.577 0.048 25567 9792 1 14 . 1 1 73 73 ASP C C 73 174.034 174.034 176.586 -2.552 25567 9793 1 14 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.479 -4.276 25567 9794 1 14 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.199 -4.175 25567 9795 1 14 . 1 1 73 73 ASP H H 73 8.394 8.394 8.612 -0.218 25567 9796 1 14 . 1 1 74 74 TYR N N 74 123.108 123.108 123.910 -0.802 25567 9797 1 14 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.352 -0.474 25567 9798 1 14 . 1 1 74 74 TYR C C 74 173.637 173.637 176.888 -3.251 25567 9799 1 14 . 1 1 74 74 TYR CA C 74 59.474 59.474 60.779 -1.305 25567 9800 1 14 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.246 -3.524 25567 9801 1 14 . 1 1 74 74 TYR H H 74 7.392 7.392 7.981 -0.589 25567 9802 1 14 . 1 1 75 75 ASN N N 75 109.422 109.422 113.712 -4.290 25567 9803 1 14 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.618 0.308 25567 9804 1 14 . 1 1 75 75 ASN C C 75 172.574 172.574 176.043 -3.469 25567 9805 1 14 . 1 1 75 75 ASN CA C 75 52.761 52.761 54.940 -2.179 25567 9806 1 14 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.087 -2.470 25567 9807 1 14 . 1 1 75 75 ASN H H 75 8.058 8.058 8.695 -0.637 25567 9808 1 14 . 1 1 76 76 ASN N N 76 117.422 117.422 115.761 1.661 25567 9809 1 14 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.677 -0.222 25567 9810 1 14 . 1 1 76 76 ASN C C 76 171.132 171.132 174.570 -3.438 25567 9811 1 14 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.287 -2.120 25567 9812 1 14 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.721 -2.993 25567 9813 1 14 . 1 1 76 76 ASN H H 76 7.768 7.768 7.870 -0.102 25567 9814 1 14 . 1 1 77 77 TYR N N 77 116.873 116.873 118.252 -1.379 25567 9815 1 14 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.683 -0.320 25567 9816 1 14 . 1 1 77 77 TYR C C 77 172.175 172.175 173.950 -1.775 25567 9817 1 14 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.440 -2.076 25567 9818 1 14 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.148 -3.983 25567 9819 1 14 . 1 1 77 77 TYR H H 77 7.825 7.825 7.596 0.229 25567 9820 1 14 . 1 1 78 78 ASP N N 78 121.271 121.271 120.880 0.391 25567 9821 1 14 . 1 1 78 78 ASP HA H 78 4.805 4.805 5.242 -0.437 25567 9822 1 14 . 1 1 78 78 ASP C C 78 172.641 172.641 175.624 -2.983 25567 9823 1 14 . 1 1 78 78 ASP CA C 78 53.255 53.255 52.933 0.322 25567 9824 1 14 . 1 1 78 78 ASP CB C 78 41.075 41.075 42.851 -1.776 25567 9825 1 14 . 1 1 78 78 ASP H H 78 9.058 9.058 8.353 0.705 25567 9826 1 14 . 1 1 79 79 LEU N N 79 122.985 122.985 119.266 3.719 25567 9827 1 14 . 1 1 79 79 LEU HA H 79 5.114 5.114 4.974 0.140 25567 9828 1 14 . 1 1 79 79 LEU C C 79 170.721 170.721 174.415 -3.694 25567 9829 1 14 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.554 -3.238 25567 9830 1 14 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.266 -2.924 25567 9831 1 14 . 1 1 79 79 LEU H H 79 7.893 7.893 7.671 0.222 25567 9832 1 14 . 1 1 80 80 ILE N N 80 126.364 126.364 124.378 1.986 25567 9833 1 14 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.995 0.094 25567 9834 1 14 . 1 1 80 80 ILE C C 80 171.580 171.580 174.285 -2.705 25567 9835 1 14 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.125 -2.708 25567 9836 1 14 . 1 1 80 80 ILE CB C 80 38.136 38.136 41.937 -3.801 25567 9837 1 14 . 1 1 80 80 ILE H H 80 8.717 8.717 9.006 -0.289 25567 9838 1 14 . 1 1 81 81 LEU N N 81 126.199 126.199 124.767 1.432 25567 9839 1 14 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.303 -0.168 25567 9840 1 14 . 1 1 81 81 LEU C C 81 172.979 172.979 175.688 -2.709 25567 9841 1 14 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.553 -3.920 25567 9842 1 14 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.522 -3.363 25567 9843 1 14 . 1 1 81 81 LEU H H 81 9.230 9.230 8.948 0.282 25567 9844 1 14 . 1 1 82 82 ILE N N 82 120.505 120.505 121.346 -0.841 25567 9845 1 14 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.261 -0.345 25567 9846 1 14 . 1 1 82 82 ILE C C 82 173.011 173.011 174.627 -1.616 25567 9847 1 14 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.770 -2.942 25567 9848 1 14 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.665 -3.597 25567 9849 1 14 . 1 1 82 82 ILE H H 82 8.796 8.796 8.488 0.308 25567 9850 1 14 . 1 1 83 83 GLY N N 83 120.857 120.857 112.844 8.013 25567 9851 1 14 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.160 -2.357 25567 9852 1 14 . 1 1 83 83 GLY H H 83 9.525 9.525 7.935 1.590 25567 9853 1 14 . 1 1 84 84 SER N N 84 116.007 116.007 114.316 1.691 25567 9854 1 14 . 1 1 84 84 SER HA H 84 5.476 5.476 5.059 0.417 25567 9855 1 14 . 1 1 84 84 SER CA C 84 51.937 51.937 56.928 -4.991 25567 9856 1 14 . 1 1 84 84 SER CB C 84 64.533 64.533 66.113 -1.580 25567 9857 1 14 . 1 1 84 84 SER H H 84 7.617 7.617 7.579 0.038 25567 9858 1 14 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.686 0.515 25567 9859 1 14 . 1 1 85 85 PRO C C 85 173.574 173.574 175.741 -2.167 25567 9860 1 14 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.295 -2.808 25567 9861 1 14 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.916 -1.776 25567 9862 1 14 . 1 1 86 86 VAL N N 86 117.603 117.603 118.244 -0.641 25567 9863 1 14 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.492 -0.119 25567 9864 1 14 . 1 1 86 86 VAL C C 86 172.777 172.777 174.429 -1.652 25567 9865 1 14 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.624 -2.021 25567 9866 1 14 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.312 -4.739 25567 9867 1 14 . 1 1 86 86 VAL H H 86 8.194 8.194 7.964 0.230 25567 9868 1 14 . 1 1 87 87 TRP N N 87 131.187 131.187 129.714 1.473 25567 9869 1 14 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.950 0.248 25567 9870 1 14 . 1 1 87 87 TRP C C 87 173.295 173.295 174.546 -1.251 25567 9871 1 14 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.158 -7.374 25567 9872 1 14 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.672 -3.926 25567 9873 1 14 . 1 1 87 87 TRP H H 87 9.637 9.637 8.471 1.166 25567 9874 1 14 . 1 1 88 88 SER N N 88 119.829 119.829 114.929 4.900 25567 9875 1 14 . 1 1 88 88 SER HA H 88 3.986 3.986 4.746 -0.760 25567 9876 1 14 . 1 1 88 88 SER C C 88 172.375 172.375 173.859 -1.484 25567 9877 1 14 . 1 1 88 88 SER CA C 88 55.932 55.932 57.878 -1.946 25567 9878 1 14 . 1 1 88 88 SER CB C 88 59.178 59.178 64.790 -5.612 25567 9879 1 14 . 1 1 88 88 SER H H 88 9.272 9.272 8.039 1.233 25567 9880 1 14 . 1 1 89 89 GLY N N 89 101.498 101.498 110.750 -9.252 25567 9881 1 14 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.483 -3.812 25567 9882 1 14 . 1 1 89 89 GLY H H 89 7.463 7.463 8.467 -1.004 25567 9883 1 14 . 1 1 90 90 TYR N N 90 121.064 121.064 115.953 5.111 25567 9884 1 14 . 1 1 90 90 TYR HA H 90 4.216 4.216 4.992 -0.776 25567 9885 1 14 . 1 1 90 90 TYR CA C 90 54.090 54.090 53.710 0.380 25567 9886 1 14 . 1 1 90 90 TYR CB C 90 37.195 37.195 37.455 -0.260 25567 9887 1 14 . 1 1 90 90 TYR H H 90 8.064 8.064 7.651 0.413 25567 9888 1 14 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.742 0.190 25567 9889 1 14 . 1 1 91 91 PRO C C 91 171.019 171.019 176.178 -5.159 25567 9890 1 14 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.736 -4.742 25567 9891 1 14 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.560 -6.067 25567 9892 1 14 . 1 1 92 92 ALA N N 92 119.893 119.893 121.879 -1.986 25567 9893 1 14 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.801 -1.350 25567 9894 1 14 . 1 1 92 92 ALA C C 92 176.477 176.477 175.770 0.707 25567 9895 1 14 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.780 -2.213 25567 9896 1 14 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.590 -5.789 25567 9897 1 14 . 1 1 92 92 ALA H H 92 7.278 7.278 7.922 -0.644 25567 9898 1 14 . 1 1 93 93 THR N N 93 112.992 112.992 110.961 2.031 25567 9899 1 14 . 1 1 93 93 THR HA H 93 4.462 4.462 4.710 -0.248 25567 9900 1 14 . 1 1 93 93 THR CA C 93 66.871 66.871 59.130 7.741 25567 9901 1 14 . 1 1 93 93 THR CB C 93 64.362 64.362 68.394 -4.032 25567 9902 1 14 . 1 1 93 93 THR H H 93 6.861 6.861 8.362 -1.501 25567 9903 1 14 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.250 -0.384 25567 9904 1 14 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.133 -0.112 25567 9905 1 14 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.626 -2.347 25567 9906 1 14 . 1 1 95 95 ILE N N 95 111.298 111.298 119.229 -7.931 25567 9907 1 14 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.310 -0.687 25567 9908 1 14 . 1 1 95 95 ILE C C 95 174.264 174.264 175.447 -1.183 25567 9909 1 14 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.436 -1.988 25567 9910 1 14 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.443 -4.513 25567 9911 1 14 . 1 1 95 95 ILE H H 95 7.974 7.974 7.666 0.308 25567 9912 1 14 . 1 1 96 96 LYS N N 96 123.045 123.045 120.446 2.599 25567 9913 1 14 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.500 -1.388 25567 9914 1 14 . 1 1 96 96 LYS C C 96 174.590 174.590 177.585 -2.995 25567 9915 1 14 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.870 0.275 25567 9916 1 14 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.583 -4.738 25567 9917 1 14 . 1 1 96 96 LYS H H 96 6.958 6.958 7.851 -0.893 25567 9918 1 14 . 1 1 97 97 THR N N 97 113.412 113.412 116.279 -2.867 25567 9919 1 14 . 1 1 97 97 THR HA H 97 3.461 3.461 4.051 -0.590 25567 9920 1 14 . 1 1 97 97 THR C C 97 173.247 173.247 175.965 -2.718 25567 9921 1 14 . 1 1 97 97 THR CA C 97 62.809 62.809 65.729 -2.920 25567 9922 1 14 . 1 1 97 97 THR CB C 97 65.654 65.654 68.476 -2.822 25567 9923 1 14 . 1 1 97 97 THR H H 97 6.366 6.366 8.152 -1.786 25567 9924 1 14 . 1 1 98 98 LEU N N 98 121.201 121.201 122.581 -1.380 25567 9925 1 14 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.104 -0.470 25567 9926 1 14 . 1 1 98 98 LEU C C 98 174.590 174.590 178.239 -3.649 25567 9927 1 14 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.655 -2.034 25567 9928 1 14 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.769 -0.874 25567 9929 1 14 . 1 1 98 98 LEU H H 98 7.554 7.554 8.138 -0.584 25567 9930 1 14 . 1 1 99 99 LEU N N 99 118.677 118.677 118.877 -0.200 25567 9931 1 14 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.840 -0.138 25567 9932 1 14 . 1 1 99 99 LEU C C 99 177.457 177.457 178.904 -1.447 25567 9933 1 14 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.704 -2.525 25567 9934 1 14 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.293 -1.305 25567 9935 1 14 . 1 1 99 99 LEU H H 99 8.160 8.160 8.008 0.152 25567 9936 1 14 . 1 1 100 100 ASP N N 100 118.914 118.914 116.715 2.199 25567 9937 1 14 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.375 -0.146 25567 9938 1 14 . 1 1 100 100 ASP C C 100 176.585 176.585 178.749 -2.164 25567 9939 1 14 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.967 -2.451 25567 9940 1 14 . 1 1 100 100 ASP CB C 100 37.579 37.579 40.516 -2.937 25567 9941 1 14 . 1 1 100 100 ASP H H 100 7.872 7.872 8.375 -0.503 25567 9942 1 14 . 1 1 101 101 GLN N N 101 118.135 118.135 117.861 0.274 25567 9943 1 14 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.223 -0.063 25567 9944 1 14 . 1 1 101 101 GLN C C 101 174.601 174.601 178.108 -3.507 25567 9945 1 14 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.033 -3.073 25567 9946 1 14 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.119 -3.569 25567 9947 1 14 . 1 1 101 101 GLN H H 101 7.673 7.673 7.695 -0.022 25567 9948 1 14 . 1 1 102 102 MET N N 102 118.420 118.420 115.933 2.487 25567 9949 1 14 . 1 1 102 102 MET HA H 102 3.826 3.826 4.603 -0.777 25567 9950 1 14 . 1 1 102 102 MET C C 102 172.780 172.780 176.633 -3.853 25567 9951 1 14 . 1 1 102 102 MET CA C 102 53.428 53.428 55.619 -2.191 25567 9952 1 14 . 1 1 102 102 MET CB C 102 31.221 31.221 31.227 -0.006 25567 9953 1 14 . 1 1 102 102 MET H H 102 7.462 7.462 7.517 -0.055 25567 9954 1 14 . 1 1 103 103 LYS N N 103 116.066 116.066 120.593 -4.527 25567 9955 1 14 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.102 -0.182 25567 9956 1 14 . 1 1 103 103 LYS C C 103 173.922 173.922 177.257 -3.335 25567 9957 1 14 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.737 -2.455 25567 9958 1 14 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.977 -2.486 25567 9959 1 14 . 1 1 103 103 LYS H H 103 6.875 6.875 7.511 -0.636 25567 9960 1 14 . 1 1 104 104 ASN N N 104 114.987 114.987 116.667 -1.680 25567 9961 1 14 . 1 1 104 104 ASN HA H 104 4.741 4.741 5.057 -0.316 25567 9962 1 14 . 1 1 104 104 ASN C C 104 172.587 172.587 174.656 -2.069 25567 9963 1 14 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.521 -2.052 25567 9964 1 14 . 1 1 104 104 ASN CB C 104 35.822 35.822 40.156 -4.334 25567 9965 1 14 . 1 1 104 104 ASN H H 104 8.517 8.517 8.213 0.304 25567 9966 1 14 . 1 1 105 105 TYR N N 105 122.755 122.755 121.802 0.953 25567 9967 1 14 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.490 0.085 25567 9968 1 14 . 1 1 105 105 TYR C C 105 174.260 174.260 175.497 -1.237 25567 9969 1 14 . 1 1 105 105 TYR CA C 105 55.493 55.493 58.132 -2.639 25567 9970 1 14 . 1 1 105 105 TYR CB C 105 36.064 36.064 38.873 -2.809 25567 9971 1 14 . 1 1 105 105 TYR H H 105 8.287 8.287 8.349 -0.062 25567 9972 1 14 . 1 1 106 106 ARG N N 106 128.905 128.905 123.003 5.902 25567 9973 1 14 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.335 -0.062 25567 9974 1 14 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.114 -2.093 25567 9975 1 14 . 1 1 106 106 ARG CB C 106 28.130 28.130 30.570 -2.440 25567 9976 1 14 . 1 1 106 106 ARG H H 106 8.841 8.841 8.797 0.044 25567 9977 1 14 . 1 1 107 107 GLY CA C 107 42.497 42.497 45.514 -3.017 25567 9978 1 14 . 1 1 108 108 GLU N N 108 116.989 116.989 121.007 -4.018 25567 9979 1 14 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.885 -0.254 25567 9980 1 14 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.194 -1.518 25567 9981 1 14 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.657 -3.255 25567 9982 1 14 . 1 1 108 108 GLU H H 108 7.536 7.536 8.171 -0.635 25567 9983 1 14 . 1 1 109 109 VAL N N 109 123.416 123.416 118.644 4.772 25567 9984 1 14 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.259 0.062 25567 9985 1 14 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.938 -3.495 25567 9986 1 14 . 1 1 109 109 VAL CB C 109 32.661 32.661 36.224 -3.563 25567 9987 1 14 . 1 1 109 109 VAL H H 109 8.955 8.955 8.414 0.541 25567 9988 1 14 . 1 1 110 110 ALA N N 110 127.975 127.975 126.296 1.679 25567 9989 1 14 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.191 -0.514 25567 9990 1 14 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.529 -2.087 25567 9991 1 14 . 1 1 110 110 ALA CB C 110 18.416 18.416 21.883 -3.467 25567 9992 1 14 . 1 1 110 110 ALA H H 110 8.860 8.860 8.664 0.196 25567 9993 1 14 . 1 1 111 111 SER N N 111 110.482 110.482 114.495 -4.013 25567 9994 1 14 . 1 1 111 111 SER HA H 111 5.502 5.502 5.338 0.164 25567 9995 1 14 . 1 1 111 111 SER CA C 111 51.630 51.630 56.837 -5.207 25567 9996 1 14 . 1 1 111 111 SER CB C 111 62.267 62.267 64.558 -2.291 25567 9997 1 14 . 1 1 111 111 SER H H 111 7.484 7.484 8.069 -0.585 25567 9998 1 14 . 1 1 112 112 PHE N N 112 125.082 125.082 121.491 3.591 25567 9999 1 14 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.529 0.919 25567 10000 1 14 . 1 1 112 112 PHE CA C 112 50.434 50.434 54.791 -4.357 25567 10001 1 14 . 1 1 112 112 PHE CB C 112 40.500 40.500 39.224 1.276 25567 10002 1 14 . 1 1 112 112 PHE H H 112 8.025 8.025 8.627 -0.602 25567 10003 1 14 . 1 1 113 113 PHE N N 113 115.872 115.872 122.053 -6.181 25567 10004 1 14 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.165 0.759 25567 10005 1 14 . 1 1 113 113 PHE C C 113 173.293 173.293 176.068 -2.775 25567 10006 1 14 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.659 -5.191 25567 10007 1 14 . 1 1 113 113 PHE CB C 113 38.393 38.393 38.990 -0.597 25567 10008 1 14 . 1 1 113 113 PHE H H 113 7.391 7.391 7.472 -0.081 25567 10009 1 14 . 1 1 114 114 THR N N 114 108.721 108.721 114.532 -5.811 25567 10010 1 14 . 1 1 114 114 THR HA H 114 4.933 4.933 4.915 0.018 25567 10011 1 14 . 1 1 114 114 THR C C 114 171.891 171.891 174.144 -2.253 25567 10012 1 14 . 1 1 114 114 THR CA C 114 56.815 56.815 60.591 -3.776 25567 10013 1 14 . 1 1 114 114 THR CB C 114 67.899 67.899 68.469 -0.570 25567 10014 1 14 . 1 1 114 114 THR H H 114 7.951 7.951 8.406 -0.455 25567 10015 1 14 . 1 1 115 115 SER N N 115 115.159 115.159 116.778 -1.619 25567 10016 1 14 . 1 1 115 115 SER HA H 115 4.608 4.608 4.659 -0.051 25567 10017 1 14 . 1 1 115 115 SER C C 115 171.403 171.403 173.058 -1.655 25567 10018 1 14 . 1 1 115 115 SER CA C 115 55.570 55.570 58.138 -2.568 25567 10019 1 14 . 1 1 115 115 SER CB C 115 61.418 61.418 65.623 -4.205 25567 10020 1 14 . 1 1 115 115 SER H H 115 8.229 8.229 7.910 0.319 25567 10021 1 14 . 1 1 116 116 ALA N N 116 127.211 127.211 126.925 0.286 25567 10022 1 14 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.744 -0.288 25567 10023 1 14 . 1 1 116 116 ALA C C 116 175.758 175.758 176.418 -0.660 25567 10024 1 14 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.098 -2.282 25567 10025 1 14 . 1 1 116 116 ALA CB C 116 16.831 16.831 20.323 -3.492 25567 10026 1 14 . 1 1 116 116 ALA H H 116 8.813 8.813 8.305 0.508 25567 10027 1 14 . 1 1 117 117 GLY N N 117 108.099 108.099 111.332 -3.233 25567 10028 1 14 . 1 1 117 117 GLY C C 117 171.805 171.805 174.727 -2.922 25567 10029 1 14 . 1 1 117 117 GLY CA C 117 42.869 42.869 46.461 -3.592 25567 10030 1 14 . 1 1 117 117 GLY H H 117 8.685 8.685 9.029 -0.344 25567 10031 1 14 . 1 1 118 118 THR N N 118 111.284 111.284 113.887 -2.603 25567 10032 1 14 . 1 1 118 118 THR HA H 118 4.343 4.343 4.344 -0.001 25567 10033 1 14 . 1 1 118 118 THR C C 118 171.769 171.769 173.360 -1.591 25567 10034 1 14 . 1 1 118 118 THR CA C 118 58.933 58.933 62.642 -3.709 25567 10035 1 14 . 1 1 118 118 THR CB C 118 67.304 67.304 69.565 -2.261 25567 10036 1 14 . 1 1 118 118 THR H H 118 7.998 7.998 8.040 -0.042 25567 10037 1 14 . 1 1 119 119 ASN N N 119 120.253 120.253 119.319 0.934 25567 10038 1 14 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.840 -0.137 25567 10039 1 14 . 1 1 119 119 ASN C C 119 172.353 172.353 173.818 -1.465 25567 10040 1 14 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.602 -3.374 25567 10041 1 14 . 1 1 119 119 ASN CB C 119 35.376 35.376 39.873 -4.497 25567 10042 1 14 . 1 1 119 119 ASN H H 119 8.381 8.381 7.897 0.484 25567 10043 1 14 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.351 -0.265 25567 10044 1 14 . 1 1 120 120 HIS C C 120 173.395 173.395 175.930 -2.535 25567 10045 1 14 . 1 1 120 120 HIS CA C 120 55.139 55.139 56.970 -1.831 25567 10046 1 14 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.381 -2.959 25567 10047 1 14 . 1 1 121 121 LYS N N 121 119.527 119.527 121.072 -1.545 25567 10048 1 14 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.627 0.153 25567 10049 1 14 . 1 1 121 121 LYS C C 121 176.053 176.053 177.835 -1.782 25567 10050 1 14 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.505 -1.542 25567 10051 1 14 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.618 -1.958 25567 10052 1 14 . 1 1 121 121 LYS H H 121 8.106 8.106 8.353 -0.247 25567 10053 1 14 . 1 1 122 122 ALA N N 122 121.585 121.585 121.798 -0.213 25567 10054 1 14 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.774 -0.053 25567 10055 1 14 . 1 1 122 122 ALA C C 122 175.128 175.128 179.289 -4.161 25567 10056 1 14 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.481 -2.890 25567 10057 1 14 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.773 -2.069 25567 10058 1 14 . 1 1 122 122 ALA H H 122 7.702 7.702 7.903 -0.201 25567 10059 1 14 . 1 1 123 123 TYR N N 123 118.803 118.803 119.932 -1.129 25567 10060 1 14 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.054 -0.688 25567 10061 1 14 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.871 -1.780 25567 10062 1 14 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.064 -2.962 25567 10063 1 14 . 1 1 123 123 TYR H H 123 7.366 7.366 7.855 -0.489 25567 10064 1 14 . 1 1 124 124 VAL N N 124 117.530 117.530 118.218 -0.688 25567 10065 1 14 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.610 -0.411 25567 10066 1 14 . 1 1 124 124 VAL C C 124 175.375 175.375 178.067 -2.692 25567 10067 1 14 . 1 1 124 124 VAL CA C 124 64.583 64.583 67.047 -2.464 25567 10068 1 14 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.347 -2.144 25567 10069 1 14 . 1 1 124 124 VAL H H 124 7.757 7.757 7.586 0.171 25567 10070 1 14 . 1 1 125 125 SER N N 125 114.023 114.023 115.351 -1.328 25567 10071 1 14 . 1 1 125 125 SER HA H 125 4.035 4.035 3.963 0.072 25567 10072 1 14 . 1 1 125 125 SER C C 125 174.636 174.636 176.411 -1.775 25567 10073 1 14 . 1 1 125 125 SER CA C 125 58.885 58.885 61.943 -3.058 25567 10074 1 14 . 1 1 125 125 SER CB C 125 59.666 59.666 62.968 -3.301 25567 10075 1 14 . 1 1 125 125 SER H H 125 7.622 7.622 7.350 0.272 25567 10076 1 14 . 1 1 126 126 HIS N N 126 119.457 119.457 120.385 -0.928 25567 10077 1 14 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.018 0.178 25567 10078 1 14 . 1 1 126 126 HIS C C 126 172.942 172.942 177.455 -4.513 25567 10079 1 14 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.537 -3.619 25567 10080 1 14 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.222 -3.143 25567 10081 1 14 . 1 1 126 126 HIS H H 126 8.067 8.067 8.119 -0.052 25567 10082 1 14 . 1 1 127 127 PHE N N 127 120.628 120.628 121.127 -0.499 25567 10083 1 14 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.949 -0.750 25567 10084 1 14 . 1 1 127 127 PHE C C 127 173.515 173.515 176.960 -3.445 25567 10085 1 14 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.884 0.797 25567 10086 1 14 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.529 -2.162 25567 10087 1 14 . 1 1 127 127 PHE H H 127 9.083 9.083 8.571 0.512 25567 10088 1 14 . 1 1 128 128 ASN N N 128 114.858 114.858 116.939 -2.081 25567 10089 1 14 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.048 0.030 25567 10090 1 14 . 1 1 128 128 ASN C C 128 175.338 175.338 177.328 -1.990 25567 10091 1 14 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.201 -1.951 25567 10092 1 14 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.202 -2.181 25567 10093 1 14 . 1 1 128 128 ASN H H 128 7.858 7.858 8.132 -0.274 25567 10094 1 14 . 1 1 129 129 GLU N N 129 119.811 119.811 117.758 2.053 25567 10095 1 14 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.222 -0.181 25567 10096 1 14 . 1 1 129 129 GLU C C 129 176.941 176.941 178.447 -1.506 25567 10097 1 14 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.108 -1.476 25567 10098 1 14 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.535 -2.596 25567 10099 1 14 . 1 1 129 129 GLU H H 129 7.569 7.569 7.842 -0.273 25567 10100 1 14 . 1 1 130 130 TRP N N 130 120.585 120.585 118.379 2.206 25567 10101 1 14 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.708 -0.236 25567 10102 1 14 . 1 1 130 130 TRP C C 130 174.262 174.262 176.795 -2.533 25567 10103 1 14 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.734 -2.061 25567 10104 1 14 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.757 -2.801 25567 10105 1 14 . 1 1 130 130 TRP H H 130 7.964 7.964 7.716 0.248 25567 10106 1 14 . 1 1 131 131 ALA N N 131 120.522 120.522 119.089 1.433 25567 10107 1 14 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.409 -0.462 25567 10108 1 14 . 1 1 131 131 ALA C C 131 172.489 172.489 175.669 -3.180 25567 10109 1 14 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.325 -2.745 25567 10110 1 14 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.541 -3.002 25567 10111 1 14 . 1 1 131 131 ALA H H 131 8.114 8.114 7.646 0.468 25567 10112 1 14 . 1 1 132 132 ASP N N 132 117.666 117.666 120.433 -2.767 25567 10113 1 14 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.302 -0.096 25567 10114 1 14 . 1 1 132 132 ASP C C 132 173.779 173.779 176.310 -2.531 25567 10115 1 14 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.041 -0.728 25567 10116 1 14 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.890 -0.434 25567 10117 1 14 . 1 1 132 132 ASP H H 132 6.768 6.768 7.849 -1.081 25567 10118 1 14 . 1 1 133 133 GLY N N 133 114.922 114.922 112.355 2.567 25567 10119 1 14 . 1 1 133 133 GLY C C 133 172.101 172.101 173.881 -1.780 25567 10120 1 14 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.137 -2.628 25567 10121 1 14 . 1 1 133 133 GLY H H 133 8.645 8.645 7.862 0.783 25567 10122 1 14 . 1 1 134 134 LEU N N 134 120.101 120.101 120.911 -0.810 25567 10123 1 14 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.591 -0.129 25567 10124 1 14 . 1 1 134 134 LEU C C 134 174.098 174.098 175.801 -1.703 25567 10125 1 14 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.145 -2.061 25567 10126 1 14 . 1 1 134 134 LEU CB C 134 40.509 40.509 42.693 -2.184 25567 10127 1 14 . 1 1 134 134 LEU H H 134 8.049 8.049 7.420 0.629 25567 10128 1 14 . 1 1 135 135 ASN N N 135 119.258 119.258 119.304 -0.046 25567 10129 1 14 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.720 -0.081 25567 10130 1 14 . 1 1 135 135 ASN C C 135 170.564 170.564 174.986 -4.422 25567 10131 1 14 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.533 -4.280 25567 10132 1 14 . 1 1 135 135 ASN CB C 135 33.618 33.618 39.549 -5.931 25567 10133 1 14 . 1 1 135 135 ASN H H 135 8.567 8.567 8.370 0.197 25567 10134 1 14 . 1 1 136 136 VAL N N 136 125.460 125.460 120.094 5.366 25567 10135 1 14 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.528 0.068 25567 10136 1 14 . 1 1 136 136 VAL C C 136 175.318 175.318 175.650 -0.332 25567 10137 1 14 . 1 1 136 136 VAL CA C 136 58.722 58.722 61.809 -3.087 25567 10138 1 14 . 1 1 136 136 VAL CB C 136 29.299 29.299 34.478 -5.179 25567 10139 1 14 . 1 1 136 136 VAL H H 136 7.660 7.660 8.373 -0.713 25567 10140 1 14 . 1 1 137 137 ILE N N 137 122.021 122.021 121.739 0.282 25567 10141 1 14 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.840 -0.412 25567 10142 1 14 . 1 1 137 137 ILE C C 137 173.943 173.943 175.026 -1.083 25567 10143 1 14 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.807 -0.849 25567 10144 1 14 . 1 1 137 137 ILE CB C 137 36.169 36.169 39.039 -2.870 25567 10145 1 14 . 1 1 137 137 ILE H H 137 9.151 9.151 9.089 0.062 25567 10146 1 14 . 1 1 138 138 GLY N N 138 108.192 108.192 108.293 -0.101 25567 10147 1 14 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.985 -2.491 25567 10148 1 14 . 1 1 138 138 GLY H H 138 6.675 6.675 7.588 -0.913 25567 10149 1 14 . 1 1 139 139 VAL N N 139 119.673 119.673 121.618 -1.945 25567 10150 1 14 . 1 1 139 139 VAL HA H 139 5.320 5.320 5.135 0.185 25567 10151 1 14 . 1 1 139 139 VAL C C 139 172.291 172.291 175.558 -3.267 25567 10152 1 14 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.616 -3.407 25567 10153 1 14 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.350 -0.711 25567 10154 1 14 . 1 1 139 139 VAL H H 139 8.158 8.158 8.652 -0.494 25567 10155 1 14 . 1 1 140 140 ALA N N 140 127.104 127.104 130.618 -3.514 25567 10156 1 14 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.890 -0.294 25567 10157 1 14 . 1 1 140 140 ALA C C 140 171.057 171.057 174.599 -3.542 25567 10158 1 14 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.752 -1.869 25567 10159 1 14 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.476 -1.048 25567 10160 1 14 . 1 1 140 140 ALA H H 140 9.145 9.145 8.320 0.825 25567 10161 1 14 . 1 1 141 141 ARG N N 141 118.828 118.828 119.713 -0.885 25567 10162 1 14 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.829 -1.089 25567 10163 1 14 . 1 1 141 141 ARG C C 141 173.524 173.524 176.832 -3.308 25567 10164 1 14 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.495 -2.608 25567 10165 1 14 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.753 -2.299 25567 10166 1 14 . 1 1 141 141 ARG H H 141 7.759 7.759 8.132 -0.373 25567 10167 1 14 . 1 1 142 142 ASP N N 142 125.557 125.557 122.402 3.155 25567 10168 1 14 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.298 -0.519 25567 10169 1 14 . 1 1 142 142 ASP C C 142 169.292 169.292 175.543 -6.251 25567 10170 1 14 . 1 1 142 142 ASP CA C 142 53.622 53.622 57.136 -3.514 25567 10171 1 14 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.065 -2.985 25567 10172 1 14 . 1 1 142 142 ASP H H 142 9.087 9.087 8.620 0.467 25567 10173 1 14 . 1 1 143 143 ASP N N 143 119.094 119.094 115.391 3.703 25567 10174 1 14 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.586 -0.332 25567 10175 1 14 . 1 1 143 143 ASP C C 143 175.557 175.557 176.166 -0.609 25567 10176 1 14 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.479 -4.400 25567 10177 1 14 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.579 -4.137 25567 10178 1 14 . 1 1 143 143 ASP H H 143 8.175 8.175 7.971 0.204 25567 10179 1 14 . 1 1 144 144 SER N N 144 115.438 115.438 116.885 -1.447 25567 10180 1 14 . 1 1 144 144 SER HA H 144 3.745 3.745 4.103 -0.358 25567 10181 1 14 . 1 1 144 144 SER C C 144 172.820 172.820 174.698 -1.878 25567 10182 1 14 . 1 1 144 144 SER CA C 144 59.336 59.336 61.096 -1.760 25567 10183 1 14 . 1 1 144 144 SER CB C 144 60.839 60.839 63.289 -2.450 25567 10184 1 14 . 1 1 144 144 SER H H 144 7.742 7.742 8.179 -0.437 25567 10185 1 14 . 1 1 145 145 GLU N N 145 119.631 119.631 120.240 -0.609 25567 10186 1 14 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.245 0.074 25567 10187 1 14 . 1 1 145 145 GLU C C 145 171.927 171.927 174.698 -2.771 25567 10188 1 14 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.254 -3.170 25567 10189 1 14 . 1 1 145 145 GLU CB C 145 26.774 26.774 30.586 -3.812 25567 10190 1 14 . 1 1 145 145 GLU H H 145 7.924 7.924 7.879 0.045 25567 10191 1 14 . 1 1 146 146 VAL N N 146 118.791 118.791 120.901 -2.110 25567 10192 1 14 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.619 -0.663 25567 10193 1 14 . 1 1 146 146 VAL C C 146 174.582 174.582 176.648 -2.066 25567 10194 1 14 . 1 1 146 146 VAL CA C 146 64.078 64.078 64.074 0.004 25567 10195 1 14 . 1 1 146 146 VAL CB C 146 29.140 29.140 32.471 -3.331 25567 10196 1 14 . 1 1 146 146 VAL H H 146 6.393 6.393 8.157 -1.764 25567 10197 1 14 . 1 1 147 147 ASP N N 147 119.410 119.410 119.328 0.082 25567 10198 1 14 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.392 -0.322 25567 10199 1 14 . 1 1 147 147 ASP C C 147 174.774 174.774 176.590 -1.816 25567 10200 1 14 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.330 -2.008 25567 10201 1 14 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.697 -3.493 25567 10202 1 14 . 1 1 147 147 ASP H H 147 8.393 8.393 8.687 -0.294 25567 10203 1 14 . 1 1 148 148 LYS N N 148 119.422 119.422 115.032 4.390 25567 10204 1 14 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.340 -0.389 25567 10205 1 14 . 1 1 148 148 LYS C C 148 176.410 176.410 176.711 -0.301 25567 10206 1 14 . 1 1 148 148 LYS CA C 148 55.736 55.736 56.870 -1.134 25567 10207 1 14 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.273 -2.697 25567 10208 1 14 . 1 1 148 148 LYS H H 148 7.078 7.078 7.575 -0.497 25567 10209 1 14 . 1 1 149 149 TRP N N 149 118.168 118.168 120.573 -2.405 25567 10210 1 14 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.971 -0.370 25567 10211 1 14 . 1 1 149 149 TRP C C 149 174.199 174.199 175.685 -1.486 25567 10212 1 14 . 1 1 149 149 TRP CA C 149 53.795 53.795 54.910 -1.115 25567 10213 1 14 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.345 -1.334 25567 10214 1 14 . 1 1 149 149 TRP H H 149 7.914 7.914 7.415 0.499 25567 10215 1 14 . 1 1 150 150 SER N N 150 109.636 109.636 111.109 -1.473 25567 10216 1 14 . 1 1 150 150 SER HA H 150 4.242 4.242 4.666 -0.424 25567 10217 1 14 . 1 1 150 150 SER C C 150 170.173 170.173 174.817 -4.644 25567 10218 1 14 . 1 1 150 150 SER CA C 150 56.912 56.912 58.229 -1.317 25567 10219 1 14 . 1 1 150 150 SER CB C 150 62.087 62.087 64.491 -2.404 25567 10220 1 14 . 1 1 150 150 SER H H 150 7.814 7.814 7.999 -0.185 25567 10221 1 15 . 1 1 2 2 MET HA H 2 4.416 4.416 4.596 -0.180 25567 10222 1 15 . 1 1 2 2 MET CA C 2 52.847 52.847 55.094 -2.247 25567 10223 1 15 . 1 1 2 2 MET CB C 2 30.672 30.672 32.067 -1.395 25567 10224 1 15 . 1 1 3 3 ALA N N 3 125.563 125.563 127.072 -1.509 25567 10225 1 15 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.484 -0.112 25567 10226 1 15 . 1 1 3 3 ALA C C 3 174.728 174.728 175.493 -0.765 25567 10227 1 15 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.134 -2.786 25567 10228 1 15 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.550 -3.615 25567 10229 1 15 . 1 1 3 3 ALA H H 3 8.342 8.342 8.404 -0.062 25567 10230 1 15 . 1 1 4 4 LYS N N 4 121.767 121.767 125.174 -3.407 25567 10231 1 15 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.457 -0.227 25567 10232 1 15 . 1 1 4 4 LYS C C 4 174.577 174.577 175.639 -1.062 25567 10233 1 15 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.903 -1.914 25567 10234 1 15 . 1 1 4 4 LYS CB C 4 31.555 31.555 33.273 -1.718 25567 10235 1 15 . 1 1 4 4 LYS H H 4 8.500 8.500 8.308 0.192 25567 10236 1 15 . 1 1 5 5 LYS N N 5 129.654 129.654 123.135 6.519 25567 10237 1 15 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.754 -0.228 25567 10238 1 15 . 1 1 5 5 LYS C C 5 174.731 174.731 175.467 -0.736 25567 10239 1 15 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.026 -0.281 25567 10240 1 15 . 1 1 5 5 LYS CB C 5 29.894 29.894 36.142 -6.248 25567 10241 1 15 . 1 1 5 5 LYS H H 5 10.035 10.035 8.521 1.514 25567 10242 1 15 . 1 1 6 6 THR N N 6 126.212 126.212 116.775 9.437 25567 10243 1 15 . 1 1 6 6 THR HA H 6 5.654 5.654 4.905 0.749 25567 10244 1 15 . 1 1 6 6 THR C C 6 169.897 169.897 172.722 -2.825 25567 10245 1 15 . 1 1 6 6 THR CA C 6 60.647 60.647 62.384 -1.737 25567 10246 1 15 . 1 1 6 6 THR CB C 6 68.152 68.152 70.328 -2.176 25567 10247 1 15 . 1 1 6 6 THR H H 6 8.557 8.557 8.451 0.106 25567 10248 1 15 . 1 1 7 7 LEU N N 7 130.776 130.776 128.592 2.184 25567 10249 1 15 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.827 -0.208 25567 10250 1 15 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.291 -3.195 25567 10251 1 15 . 1 1 7 7 LEU CB C 7 41.043 41.043 44.589 -3.546 25567 10252 1 15 . 1 1 7 7 LEU H H 7 8.610 8.610 8.527 0.083 25567 10253 1 15 . 1 1 8 8 ILE N N 8 127.175 127.175 123.194 3.981 25567 10254 1 15 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.604 0.252 25567 10255 1 15 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.631 -3.239 25567 10256 1 15 . 1 1 8 8 ILE CB C 8 36.864 36.864 40.291 -3.427 25567 10257 1 15 . 1 1 8 8 ILE H H 8 9.263 9.263 8.057 1.206 25567 10258 1 15 . 1 1 9 9 LEU N N 9 127.117 127.117 128.473 -1.356 25567 10259 1 15 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.303 0.393 25567 10260 1 15 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.559 -3.607 25567 10261 1 15 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.645 0.181 25567 10262 1 15 . 1 1 9 9 LEU H H 9 9.262 9.262 8.728 0.534 25567 10263 1 15 . 1 1 10 10 TYR N N 10 113.544 113.544 120.767 -7.223 25567 10264 1 15 . 1 1 10 10 TYR HA H 10 5.531 5.531 4.974 0.557 25567 10265 1 15 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.095 -2.266 25567 10266 1 15 . 1 1 10 10 TYR CB C 10 38.615 38.615 38.256 0.359 25567 10267 1 15 . 1 1 10 10 TYR H H 10 7.425 7.425 8.144 -0.719 25567 10268 1 15 . 1 1 11 11 TYR N N 11 121.235 121.235 125.774 -4.539 25567 10269 1 15 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.809 0.001 25567 10270 1 15 . 1 1 11 11 TYR CA C 11 53.889 53.889 57.967 -4.078 25567 10271 1 15 . 1 1 11 11 TYR CB C 11 40.467 40.467 37.360 3.107 25567 10272 1 15 . 1 1 11 11 TYR H H 11 7.781 7.781 7.985 -0.204 25567 10273 1 15 . 1 1 14 14 SER CA C 14 54.675 54.675 60.312 -5.637 25567 10274 1 15 . 1 1 14 14 SER CB C 14 61.621 61.621 62.937 -1.316 25567 10275 1 15 . 1 1 15 15 GLY N N 15 110.420 110.420 108.213 2.207 25567 10276 1 15 . 1 1 15 15 GLY CA C 15 43.727 43.727 46.019 -2.292 25567 10277 1 15 . 1 1 15 15 GLY H H 15 7.757 7.757 7.702 0.055 25567 10278 1 15 . 1 1 17 17 THR HA H 17 4.122 4.122 4.366 -0.244 25567 10279 1 15 . 1 1 17 17 THR CA C 17 64.748 64.748 62.838 1.910 25567 10280 1 15 . 1 1 17 17 THR CB C 17 64.532 64.532 69.573 -5.041 25567 10281 1 15 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.787 -0.869 25567 10282 1 15 . 1 1 18 18 LYS C C 18 173.812 173.812 177.443 -3.631 25567 10283 1 15 . 1 1 18 18 LYS CA C 18 57.003 57.003 60.052 -3.049 25567 10284 1 15 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.280 -2.512 25567 10285 1 15 . 1 1 19 19 LYS N N 19 116.699 116.699 114.907 1.792 25567 10286 1 15 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.096 -0.148 25567 10287 1 15 . 1 1 19 19 LYS C C 19 177.221 177.221 177.899 -0.678 25567 10288 1 15 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.330 -1.909 25567 10289 1 15 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.569 -1.935 25567 10290 1 15 . 1 1 19 19 LYS H H 19 7.476 7.476 8.471 -0.995 25567 10291 1 15 . 1 1 20 20 MET N N 20 118.946 118.946 116.582 2.364 25567 10292 1 15 . 1 1 20 20 MET HA H 20 4.474 4.474 4.586 -0.112 25567 10293 1 15 . 1 1 20 20 MET C C 20 173.826 173.826 175.234 -1.408 25567 10294 1 15 . 1 1 20 20 MET CA C 20 52.285 52.285 53.565 -1.280 25567 10295 1 15 . 1 1 20 20 MET CB C 20 26.921 26.921 32.581 -5.660 25567 10296 1 15 . 1 1 20 20 MET H H 20 7.457 7.457 7.865 -0.408 25567 10297 1 15 . 1 1 21 21 ALA N N 21 123.375 123.375 122.282 1.093 25567 10298 1 15 . 1 1 21 21 ALA HA H 21 3.552 3.552 3.953 -0.401 25567 10299 1 15 . 1 1 21 21 ALA C C 21 176.542 176.542 178.432 -1.890 25567 10300 1 15 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.269 -0.618 25567 10301 1 15 . 1 1 21 21 ALA CB C 21 16.282 16.282 19.583 -3.301 25567 10302 1 15 . 1 1 21 21 ALA H H 21 8.549 8.549 7.819 0.730 25567 10303 1 15 . 1 1 22 22 GLU N N 22 116.906 116.906 118.488 -1.582 25567 10304 1 15 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.860 -0.187 25567 10305 1 15 . 1 1 22 22 GLU C C 22 176.658 176.658 178.895 -2.237 25567 10306 1 15 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.450 -2.845 25567 10307 1 15 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.576 -2.927 25567 10308 1 15 . 1 1 22 22 GLU H H 22 8.085 8.085 8.094 -0.009 25567 10309 1 15 . 1 1 23 23 LYS N N 23 123.301 123.301 118.984 4.317 25567 10310 1 15 . 1 1 23 23 LYS HA H 23 3.820 3.820 3.928 -0.108 25567 10311 1 15 . 1 1 23 23 LYS C C 23 177.363 177.363 179.119 -1.756 25567 10312 1 15 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.314 -2.343 25567 10313 1 15 . 1 1 23 23 LYS CB C 23 29.531 29.531 31.732 -2.201 25567 10314 1 15 . 1 1 23 23 LYS H H 23 7.703 7.703 8.034 -0.331 25567 10315 1 15 . 1 1 24 24 ILE N N 24 121.894 121.894 118.841 3.053 25567 10316 1 15 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.589 -0.293 25567 10317 1 15 . 1 1 24 24 ILE C C 24 174.944 174.944 177.753 -2.809 25567 10318 1 15 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.785 -1.552 25567 10319 1 15 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.337 -2.592 25567 10320 1 15 . 1 1 24 24 ILE H H 24 8.458 8.458 7.896 0.562 25567 10321 1 15 . 1 1 25 25 ASN N N 25 118.580 118.580 116.793 1.787 25567 10322 1 15 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.376 -0.142 25567 10323 1 15 . 1 1 25 25 ASN C C 25 173.567 173.567 176.070 -2.503 25567 10324 1 15 . 1 1 25 25 ASN CA C 25 52.324 52.324 55.537 -3.213 25567 10325 1 15 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.599 -0.416 25567 10326 1 15 . 1 1 25 25 ASN H H 25 8.273 8.273 8.052 0.221 25567 10327 1 15 . 1 1 26 26 SER N N 26 112.132 112.132 113.523 -1.391 25567 10328 1 15 . 1 1 26 26 SER HA H 26 4.148 4.148 4.395 -0.247 25567 10329 1 15 . 1 1 26 26 SER C C 26 172.083 172.083 174.895 -2.812 25567 10330 1 15 . 1 1 26 26 SER CA C 26 57.865 57.865 59.932 -2.067 25567 10331 1 15 . 1 1 26 26 SER CB C 26 60.816 60.816 63.946 -3.130 25567 10332 1 15 . 1 1 26 26 SER H H 26 7.444 7.444 7.609 -0.165 25567 10333 1 15 . 1 1 27 27 GLU N N 27 120.080 120.080 118.738 1.342 25567 10334 1 15 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.248 -0.148 25567 10335 1 15 . 1 1 27 27 GLU C C 27 173.647 173.647 176.485 -2.838 25567 10336 1 15 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.811 -2.609 25567 10337 1 15 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.377 -3.493 25567 10338 1 15 . 1 1 27 27 GLU H H 27 7.453 7.453 7.657 -0.204 25567 10339 1 15 . 1 1 28 28 ILE N N 28 118.759 118.759 118.598 0.161 25567 10340 1 15 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.259 -0.055 25567 10341 1 15 . 1 1 28 28 ILE C C 28 172.474 172.474 174.966 -2.492 25567 10342 1 15 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.067 -2.320 25567 10343 1 15 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.951 -5.153 25567 10344 1 15 . 1 1 28 28 ILE H H 28 7.258 7.258 7.409 -0.151 25567 10345 1 15 . 1 1 29 29 LYS N N 29 130.618 130.618 126.985 3.633 25567 10346 1 15 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.322 -0.318 25567 10347 1 15 . 1 1 29 29 LYS C C 29 174.375 174.375 176.869 -2.494 25567 10348 1 15 . 1 1 29 29 LYS CA C 29 55.659 55.659 56.611 -0.952 25567 10349 1 15 . 1 1 29 29 LYS CB C 29 29.560 29.560 32.929 -3.369 25567 10350 1 15 . 1 1 29 29 LYS H H 29 8.588 8.588 8.880 -0.292 25567 10351 1 15 . 1 1 30 30 ASP N N 30 119.366 119.366 120.983 -1.617 25567 10352 1 15 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.313 0.089 25567 10353 1 15 . 1 1 30 30 ASP C C 30 172.580 172.580 175.889 -3.309 25567 10354 1 15 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.361 -1.737 25567 10355 1 15 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.822 -3.994 25567 10356 1 15 . 1 1 30 30 ASP H H 30 8.940 8.940 8.897 0.043 25567 10357 1 15 . 1 1 31 31 SER N N 31 114.035 114.035 114.550 -0.515 25567 10358 1 15 . 1 1 31 31 SER HA H 31 4.781 4.781 4.632 0.149 25567 10359 1 15 . 1 1 31 31 SER C C 31 171.136 171.136 174.574 -3.438 25567 10360 1 15 . 1 1 31 31 SER CA C 31 55.638 55.638 59.440 -3.802 25567 10361 1 15 . 1 1 31 31 SER CB C 31 62.388 62.388 64.307 -1.919 25567 10362 1 15 . 1 1 31 31 SER H H 31 8.030 8.030 7.728 0.302 25567 10363 1 15 . 1 1 32 32 GLU N N 32 121.406 121.406 122.236 -0.830 25567 10364 1 15 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.665 0.070 25567 10365 1 15 . 1 1 32 32 GLU C C 32 171.205 171.205 174.542 -3.337 25567 10366 1 15 . 1 1 32 32 GLU CA C 32 52.069 52.069 54.713 -2.644 25567 10367 1 15 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.580 -2.690 25567 10368 1 15 . 1 1 32 32 GLU H H 32 8.188 8.188 8.532 -0.344 25567 10369 1 15 . 1 1 33 33 LEU N N 33 126.143 126.143 116.915 9.228 25567 10370 1 15 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.424 -0.139 25567 10371 1 15 . 1 1 33 33 LEU C C 33 173.401 173.401 175.180 -1.779 25567 10372 1 15 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.192 -1.858 25567 10373 1 15 . 1 1 33 33 LEU CB C 33 43.623 43.623 45.874 -2.252 25567 10374 1 15 . 1 1 33 33 LEU H H 33 8.627 8.627 8.308 0.319 25567 10375 1 15 . 1 1 34 34 LYS N N 34 127.122 127.122 119.327 7.795 25567 10376 1 15 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.815 -0.216 25567 10377 1 15 . 1 1 34 34 LYS C C 34 169.644 169.644 174.464 -4.820 25567 10378 1 15 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.420 -2.067 25567 10379 1 15 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.618 -3.446 25567 10380 1 15 . 1 1 34 34 LYS H H 34 9.399 9.399 9.262 0.137 25567 10381 1 15 . 1 1 35 35 GLU N N 35 122.766 122.766 119.387 3.379 25567 10382 1 15 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.148 -0.790 25567 10383 1 15 . 1 1 35 35 GLU C C 35 172.875 172.875 174.394 -1.519 25567 10384 1 15 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.101 -2.461 25567 10385 1 15 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.103 -1.835 25567 10386 1 15 . 1 1 35 35 GLU H H 35 8.166 8.166 8.486 -0.320 25567 10387 1 15 . 1 1 36 36 VAL N N 36 126.674 126.674 121.553 5.121 25567 10388 1 15 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.604 -0.743 25567 10389 1 15 . 1 1 36 36 VAL C C 36 171.451 171.451 174.292 -2.841 25567 10390 1 15 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.801 -1.264 25567 10391 1 15 . 1 1 36 36 VAL CB C 36 29.689 29.689 33.979 -4.290 25567 10392 1 15 . 1 1 36 36 VAL H H 36 8.632 8.632 8.386 0.246 25567 10393 1 15 . 1 1 37 37 LYS N N 37 126.181 126.181 126.588 -0.407 25567 10394 1 15 . 1 1 37 37 LYS HA H 37 4.939 4.939 5.079 -0.140 25567 10395 1 15 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.607 -2.428 25567 10396 1 15 . 1 1 37 37 LYS CB C 37 32.898 32.898 37.236 -4.338 25567 10397 1 15 . 1 1 37 37 LYS H H 37 7.867 7.867 8.764 -0.897 25567 10398 1 15 . 1 1 38 38 VAL N N 38 113.540 113.540 115.608 -2.068 25567 10399 1 15 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.750 -0.064 25567 10400 1 15 . 1 1 38 38 VAL C C 38 173.633 173.633 174.861 -1.228 25567 10401 1 15 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.764 -2.480 25567 10402 1 15 . 1 1 38 38 VAL CB C 38 31.964 31.964 34.777 -2.813 25567 10403 1 15 . 1 1 38 38 VAL H H 38 8.389 8.389 8.513 -0.124 25567 10404 1 15 . 1 1 39 39 SER N N 39 118.860 118.860 120.547 -1.687 25567 10405 1 15 . 1 1 39 39 SER HA H 39 4.194 4.194 4.438 -0.244 25567 10406 1 15 . 1 1 39 39 SER C C 39 173.059 173.059 174.210 -1.151 25567 10407 1 15 . 1 1 39 39 SER CA C 39 56.227 56.227 59.244 -3.017 25567 10408 1 15 . 1 1 39 39 SER CB C 39 60.771 60.771 63.908 -3.137 25567 10409 1 15 . 1 1 39 39 SER H H 39 8.668 8.668 8.696 -0.028 25567 10410 1 15 . 1 1 40 40 GLU N N 40 125.769 125.769 123.789 1.980 25567 10411 1 15 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.561 -0.404 25567 10412 1 15 . 1 1 40 40 GLU C C 40 174.484 174.484 175.961 -1.477 25567 10413 1 15 . 1 1 40 40 GLU CA C 40 55.550 55.550 55.659 -0.109 25567 10414 1 15 . 1 1 40 40 GLU CB C 40 27.054 27.054 31.504 -4.450 25567 10415 1 15 . 1 1 40 40 GLU H H 40 8.878 8.878 8.176 0.702 25567 10416 1 15 . 1 1 41 41 GLY N N 41 112.165 112.165 107.993 4.172 25567 10417 1 15 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.478 -1.771 25567 10418 1 15 . 1 1 41 41 GLY H H 41 8.743 8.743 8.469 0.274 25567 10419 1 15 . 1 1 44 44 ASP N N 44 122.324 122.324 120.430 1.894 25567 10420 1 15 . 1 1 44 44 ASP CB C 44 42.156 42.156 43.289 -1.133 25567 10421 1 15 . 1 1 44 44 ASP H H 44 7.918 7.918 7.768 0.150 25567 10422 1 15 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.283 -0.221 25567 10423 1 15 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.733 -1.323 25567 10424 1 15 . 1 1 45 45 ALA CB C 45 16.376 16.376 19.330 -2.954 25567 10425 1 15 . 1 1 47 47 MET CA C 47 54.118 54.118 56.230 -2.111 25567 10426 1 15 . 1 1 47 47 MET CB C 47 27.527 27.527 33.086 -5.559 25567 10427 1 15 . 1 1 48 48 TYR N N 48 120.075 120.075 116.577 3.498 25567 10428 1 15 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.719 -0.565 25567 10429 1 15 . 1 1 48 48 TYR C C 48 172.217 172.217 174.730 -2.513 25567 10430 1 15 . 1 1 48 48 TYR CA C 48 57.377 57.377 55.818 1.559 25567 10431 1 15 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.939 -3.443 25567 10432 1 15 . 1 1 48 48 TYR H H 48 7.810 7.810 7.228 0.582 25567 10433 1 15 . 1 1 49 49 LYS N N 49 118.369 118.369 123.707 -5.338 25567 10434 1 15 . 1 1 49 49 LYS H H 49 8.116 8.116 8.388 -0.272 25567 10435 1 15 . 1 1 50 50 THR N N 50 116.979 116.979 114.365 2.614 25567 10436 1 15 . 1 1 50 50 THR CB C 50 66.373 66.373 69.805 -3.432 25567 10437 1 15 . 1 1 50 50 THR H H 50 7.741 7.741 8.325 -0.584 25567 10438 1 15 . 1 1 51 51 SER N N 51 116.155 116.155 117.370 -1.215 25567 10439 1 15 . 1 1 51 51 SER HA H 51 3.771 3.771 4.868 -1.097 25567 10440 1 15 . 1 1 51 51 SER C C 51 170.563 170.563 173.797 -3.234 25567 10441 1 15 . 1 1 51 51 SER CA C 51 54.840 54.840 57.753 -2.913 25567 10442 1 15 . 1 1 51 51 SER CB C 51 60.318 60.318 63.546 -3.228 25567 10443 1 15 . 1 1 51 51 SER H H 51 7.853 7.853 7.911 -0.058 25567 10444 1 15 . 1 1 54 54 ALA N N 54 123.234 123.234 125.190 -1.956 25567 10445 1 15 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.558 -0.310 25567 10446 1 15 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.440 -1.172 25567 10447 1 15 . 1 1 54 54 ALA CB C 54 16.434 16.434 19.728 -3.294 25567 10448 1 15 . 1 1 54 54 ALA H H 54 8.207 8.207 8.153 0.054 25567 10449 1 15 . 1 1 55 55 LEU N N 55 118.603 118.603 119.564 -0.961 25567 10450 1 15 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.030 -0.090 25567 10451 1 15 . 1 1 55 55 LEU CA C 55 54.711 54.711 56.112 -1.401 25567 10452 1 15 . 1 1 55 55 LEU CB C 55 38.913 38.913 42.021 -3.108 25567 10453 1 15 . 1 1 55 55 LEU H H 55 7.960 7.960 8.356 -0.396 25567 10454 1 15 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.232 -0.556 25567 10455 1 15 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.127 0.367 25567 10456 1 15 . 1 1 58 58 ILE CB C 58 36.054 36.054 40.077 -4.023 25567 10457 1 15 . 1 1 59 59 GLN N N 59 117.579 117.579 120.924 -3.345 25567 10458 1 15 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.332 -0.199 25567 10459 1 15 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.087 -2.078 25567 10460 1 15 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.163 -1.512 25567 10461 1 15 . 1 1 59 59 GLN H H 59 8.268 8.268 8.396 -0.128 25567 10462 1 15 . 1 1 60 60 GLY N N 60 107.308 107.308 112.842 -5.534 25567 10463 1 15 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.062 -2.083 25567 10464 1 15 . 1 1 60 60 GLY H H 60 7.780 7.780 8.172 -0.392 25567 10465 1 15 . 1 1 61 61 ASN N N 61 117.747 117.747 122.604 -4.857 25567 10466 1 15 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.831 -0.297 25567 10467 1 15 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.334 -1.099 25567 10468 1 15 . 1 1 61 61 ASN CB C 61 36.424 36.424 37.154 -0.730 25567 10469 1 15 . 1 1 61 61 ASN H H 61 8.108 8.108 8.460 -0.352 25567 10470 1 15 . 1 1 64 64 PHE N N 64 120.102 120.102 115.368 4.734 25567 10471 1 15 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.775 -0.396 25567 10472 1 15 . 1 1 64 64 PHE CA C 64 51.748 51.748 55.234 -3.486 25567 10473 1 15 . 1 1 64 64 PHE CB C 64 35.275 35.275 39.724 -4.449 25567 10474 1 15 . 1 1 64 64 PHE H H 64 8.300 8.300 7.276 1.024 25567 10475 1 15 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.531 -0.196 25567 10476 1 15 . 1 1 65 65 PRO C C 65 173.870 173.870 176.049 -2.179 25567 10477 1 15 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.615 -2.598 25567 10478 1 15 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.953 -3.318 25567 10479 1 15 . 1 1 66 66 GLU N N 66 121.258 121.258 121.109 0.149 25567 10480 1 15 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.225 0.009 25567 10481 1 15 . 1 1 66 66 GLU C C 66 173.981 173.981 176.793 -2.812 25567 10482 1 15 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.156 -2.369 25567 10483 1 15 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.823 -3.048 25567 10484 1 15 . 1 1 66 66 GLU H H 66 8.316 8.316 8.430 -0.114 25567 10485 1 15 . 1 1 67 67 ILE N N 67 114.290 114.290 118.984 -4.694 25567 10486 1 15 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.501 0.628 25567 10487 1 15 . 1 1 67 67 ILE C C 67 172.700 172.700 175.493 -2.793 25567 10488 1 15 . 1 1 67 67 ILE CA C 67 56.439 56.439 60.131 -3.692 25567 10489 1 15 . 1 1 67 67 ILE CB C 67 39.159 39.159 38.137 1.022 25567 10490 1 15 . 1 1 67 67 ILE H H 67 8.366 8.366 8.369 -0.003 25567 10491 1 15 . 1 1 68 68 GLN N N 68 121.422 121.422 126.036 -4.614 25567 10492 1 15 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.476 0.025 25567 10493 1 15 . 1 1 68 68 GLN C C 68 171.675 171.675 175.062 -3.387 25567 10494 1 15 . 1 1 68 68 GLN CA C 68 52.273 52.273 55.623 -3.350 25567 10495 1 15 . 1 1 68 68 GLN CB C 68 27.143 27.143 30.020 -2.877 25567 10496 1 15 . 1 1 68 68 GLN H H 68 8.737 8.737 8.334 0.403 25567 10497 1 15 . 1 1 69 69 LEU N N 69 125.311 125.311 118.459 6.852 25567 10498 1 15 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.683 -0.177 25567 10499 1 15 . 1 1 69 69 LEU C C 69 172.634 172.634 175.295 -2.661 25567 10500 1 15 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.524 -1.765 25567 10501 1 15 . 1 1 69 69 LEU CB C 69 42.404 42.404 44.097 -1.693 25567 10502 1 15 . 1 1 69 69 LEU H H 69 8.051 8.051 8.323 -0.272 25567 10503 1 15 . 1 1 70 70 ASP N N 70 122.763 122.763 119.583 3.180 25567 10504 1 15 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.571 -0.148 25567 10505 1 15 . 1 1 70 70 ASP CA C 70 51.610 51.610 54.825 -3.215 25567 10506 1 15 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.403 -3.686 25567 10507 1 15 . 1 1 70 70 ASP H H 70 8.313 8.313 8.645 -0.332 25567 10508 1 15 . 1 1 71 71 ASN N N 71 117.413 117.413 118.552 -1.139 25567 10509 1 15 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.705 -0.368 25567 10510 1 15 . 1 1 71 71 ASN C C 71 171.770 171.770 174.855 -3.085 25567 10511 1 15 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.140 -1.649 25567 10512 1 15 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.682 -2.356 25567 10513 1 15 . 1 1 71 71 ASN H H 71 8.407 8.407 8.499 -0.092 25567 10514 1 15 . 1 1 72 72 ILE N N 72 123.752 123.752 122.612 1.140 25567 10515 1 15 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.077 -0.137 25567 10516 1 15 . 1 1 72 72 ILE C C 72 171.621 171.621 175.100 -3.479 25567 10517 1 15 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.722 -3.390 25567 10518 1 15 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.092 -0.603 25567 10519 1 15 . 1 1 72 72 ILE H H 72 7.639 7.639 7.577 0.062 25567 10520 1 15 . 1 1 73 73 ASP N N 73 125.252 125.252 122.033 3.219 25567 10521 1 15 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.634 -0.009 25567 10522 1 15 . 1 1 73 73 ASP C C 73 174.034 174.034 174.978 -0.944 25567 10523 1 15 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.924 -3.721 25567 10524 1 15 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.156 -5.132 25567 10525 1 15 . 1 1 73 73 ASP H H 73 8.394 8.394 8.378 0.016 25567 10526 1 15 . 1 1 74 74 TYR N N 74 123.108 123.108 122.992 0.116 25567 10527 1 15 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.507 -0.629 25567 10528 1 15 . 1 1 74 74 TYR C C 74 173.637 173.637 177.692 -4.055 25567 10529 1 15 . 1 1 74 74 TYR CA C 74 59.474 59.474 60.100 -0.626 25567 10530 1 15 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.438 -3.716 25567 10531 1 15 . 1 1 74 74 TYR H H 74 7.392 7.392 8.485 -1.093 25567 10532 1 15 . 1 1 75 75 ASN N N 75 109.422 109.422 117.533 -8.111 25567 10533 1 15 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.674 0.252 25567 10534 1 15 . 1 1 75 75 ASN C C 75 172.574 172.574 176.012 -3.438 25567 10535 1 15 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.754 -2.993 25567 10536 1 15 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.892 -3.275 25567 10537 1 15 . 1 1 75 75 ASN H H 75 8.058 8.058 8.374 -0.316 25567 10538 1 15 . 1 1 76 76 ASN N N 76 117.422 117.422 115.358 2.064 25567 10539 1 15 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.607 -0.152 25567 10540 1 15 . 1 1 76 76 ASN C C 76 171.132 171.132 174.380 -3.248 25567 10541 1 15 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.755 -2.588 25567 10542 1 15 . 1 1 76 76 ASN CB C 76 35.728 35.728 39.020 -3.292 25567 10543 1 15 . 1 1 76 76 ASN H H 76 7.768 7.768 8.641 -0.873 25567 10544 1 15 . 1 1 77 77 TYR N N 77 116.873 116.873 117.576 -0.703 25567 10545 1 15 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.683 -0.320 25567 10546 1 15 . 1 1 77 77 TYR C C 77 172.175 172.175 175.037 -2.862 25567 10547 1 15 . 1 1 77 77 TYR CA C 77 55.364 55.364 58.166 -2.802 25567 10548 1 15 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.867 -3.702 25567 10549 1 15 . 1 1 77 77 TYR H H 77 7.825 7.825 7.757 0.068 25567 10550 1 15 . 1 1 78 78 ASP N N 78 121.271 121.271 120.202 1.069 25567 10551 1 15 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.820 -0.015 25567 10552 1 15 . 1 1 78 78 ASP C C 78 172.641 172.641 175.606 -2.965 25567 10553 1 15 . 1 1 78 78 ASP CA C 78 53.255 53.255 54.982 -1.727 25567 10554 1 15 . 1 1 78 78 ASP CB C 78 41.075 41.075 43.890 -2.815 25567 10555 1 15 . 1 1 78 78 ASP H H 78 9.058 9.058 8.459 0.599 25567 10556 1 15 . 1 1 79 79 LEU N N 79 122.985 122.985 119.267 3.718 25567 10557 1 15 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.192 -0.078 25567 10558 1 15 . 1 1 79 79 LEU C C 79 170.721 170.721 174.698 -3.977 25567 10559 1 15 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.354 -3.038 25567 10560 1 15 . 1 1 79 79 LEU CB C 79 42.342 42.342 46.797 -4.455 25567 10561 1 15 . 1 1 79 79 LEU H H 79 7.893 7.893 8.351 -0.458 25567 10562 1 15 . 1 1 80 80 ILE N N 80 126.364 126.364 121.546 4.818 25567 10563 1 15 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.784 0.305 25567 10564 1 15 . 1 1 80 80 ILE C C 80 171.580 171.580 174.295 -2.715 25567 10565 1 15 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.603 -3.186 25567 10566 1 15 . 1 1 80 80 ILE CB C 80 38.136 38.136 41.273 -3.137 25567 10567 1 15 . 1 1 80 80 ILE H H 80 8.717 8.717 9.120 -0.403 25567 10568 1 15 . 1 1 81 81 LEU N N 81 126.199 126.199 126.296 -0.097 25567 10569 1 15 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.342 -0.207 25567 10570 1 15 . 1 1 81 81 LEU C C 81 172.979 172.979 176.096 -3.117 25567 10571 1 15 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.083 -3.450 25567 10572 1 15 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.587 -3.429 25567 10573 1 15 . 1 1 81 81 LEU H H 81 9.230 9.230 9.023 0.207 25567 10574 1 15 . 1 1 82 82 ILE N N 82 120.505 120.505 117.817 2.688 25567 10575 1 15 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.886 0.030 25567 10576 1 15 . 1 1 82 82 ILE C C 82 173.011 173.011 173.845 -0.834 25567 10577 1 15 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.668 -2.840 25567 10578 1 15 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.373 -4.305 25567 10579 1 15 . 1 1 82 82 ILE H H 82 8.796 8.796 7.805 0.991 25567 10580 1 15 . 1 1 83 83 GLY N N 83 120.857 120.857 109.897 10.960 25567 10581 1 15 . 1 1 83 83 GLY CA C 83 40.803 40.803 42.947 -2.144 25567 10582 1 15 . 1 1 83 83 GLY H H 83 9.525 9.525 8.199 1.326 25567 10583 1 15 . 1 1 84 84 SER N N 84 116.007 116.007 113.384 2.623 25567 10584 1 15 . 1 1 84 84 SER HA H 84 5.476 5.476 5.137 0.339 25567 10585 1 15 . 1 1 84 84 SER CA C 84 51.937 51.937 56.848 -4.911 25567 10586 1 15 . 1 1 84 84 SER CB C 84 64.533 64.533 66.133 -1.600 25567 10587 1 15 . 1 1 84 84 SER H H 84 7.617 7.617 7.779 -0.162 25567 10588 1 15 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.604 0.597 25567 10589 1 15 . 1 1 85 85 PRO C C 85 173.574 173.574 176.084 -2.510 25567 10590 1 15 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.637 -3.149 25567 10591 1 15 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.678 -1.538 25567 10592 1 15 . 1 1 86 86 VAL N N 86 117.603 117.603 118.954 -1.351 25567 10593 1 15 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.454 -0.081 25567 10594 1 15 . 1 1 86 86 VAL C C 86 172.777 172.777 173.898 -1.121 25567 10595 1 15 . 1 1 86 86 VAL CA C 86 59.603 59.603 62.402 -2.799 25567 10596 1 15 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.249 -5.676 25567 10597 1 15 . 1 1 86 86 VAL H H 86 8.194 8.194 8.083 0.111 25567 10598 1 15 . 1 1 87 87 TRP N N 87 131.187 131.187 128.199 2.988 25567 10599 1 15 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.941 0.257 25567 10600 1 15 . 1 1 87 87 TRP C C 87 173.295 173.295 174.262 -0.967 25567 10601 1 15 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.632 -6.848 25567 10602 1 15 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.701 -3.954 25567 10603 1 15 . 1 1 87 87 TRP H H 87 9.637 9.637 8.616 1.021 25567 10604 1 15 . 1 1 88 88 SER N N 88 119.829 119.829 114.436 5.393 25567 10605 1 15 . 1 1 88 88 SER HA H 88 3.986 3.986 4.845 -0.859 25567 10606 1 15 . 1 1 88 88 SER C C 88 172.375 172.375 174.462 -2.087 25567 10607 1 15 . 1 1 88 88 SER CA C 88 55.932 55.932 57.810 -1.878 25567 10608 1 15 . 1 1 88 88 SER CB C 88 59.178 59.178 63.214 -4.036 25567 10609 1 15 . 1 1 88 88 SER H H 88 9.272 9.272 7.830 1.442 25567 10610 1 15 . 1 1 89 89 GLY N N 89 101.498 101.498 112.054 -10.556 25567 10611 1 15 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.903 -4.232 25567 10612 1 15 . 1 1 89 89 GLY H H 89 7.463 7.463 9.228 -1.765 25567 10613 1 15 . 1 1 90 90 TYR N N 90 121.064 121.064 116.187 4.877 25567 10614 1 15 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.062 -0.846 25567 10615 1 15 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.135 -0.045 25567 10616 1 15 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.987 0.208 25567 10617 1 15 . 1 1 90 90 TYR H H 90 8.064 8.064 8.051 0.013 25567 10618 1 15 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.495 0.437 25567 10619 1 15 . 1 1 91 91 PRO C C 91 171.019 171.019 175.710 -4.691 25567 10620 1 15 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.710 -4.716 25567 10621 1 15 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.343 -5.850 25567 10622 1 15 . 1 1 92 92 ALA N N 92 119.893 119.893 120.491 -0.598 25567 10623 1 15 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.804 -1.353 25567 10624 1 15 . 1 1 92 92 ALA C C 92 176.477 176.477 176.205 0.272 25567 10625 1 15 . 1 1 92 92 ALA CA C 92 49.567 49.567 50.888 -1.321 25567 10626 1 15 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.783 -5.982 25567 10627 1 15 . 1 1 92 92 ALA H H 92 7.278 7.278 7.802 -0.524 25567 10628 1 15 . 1 1 93 93 THR N N 93 112.992 112.992 111.048 1.944 25567 10629 1 15 . 1 1 93 93 THR HA H 93 4.462 4.462 4.597 -0.135 25567 10630 1 15 . 1 1 93 93 THR CA C 93 66.871 66.871 58.530 8.341 25567 10631 1 15 . 1 1 93 93 THR CB C 93 64.362 64.362 68.231 -3.869 25567 10632 1 15 . 1 1 93 93 THR H H 93 6.861 6.861 8.277 -1.416 25567 10633 1 15 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.154 -0.288 25567 10634 1 15 . 1 1 94 94 PRO CA C 94 63.021 63.021 64.020 -0.999 25567 10635 1 15 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.521 -2.242 25567 10636 1 15 . 1 1 95 95 ILE N N 95 111.298 111.298 119.552 -8.254 25567 10637 1 15 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.205 -0.582 25567 10638 1 15 . 1 1 95 95 ILE C C 95 174.264 174.264 175.066 -0.802 25567 10639 1 15 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.157 -1.709 25567 10640 1 15 . 1 1 95 95 ILE CB C 95 31.929 31.929 34.871 -2.942 25567 10641 1 15 . 1 1 95 95 ILE H H 95 7.974 7.974 8.117 -0.143 25567 10642 1 15 . 1 1 96 96 LYS N N 96 123.045 123.045 121.558 1.487 25567 10643 1 15 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.542 -1.430 25567 10644 1 15 . 1 1 96 96 LYS C C 96 174.590 174.590 177.461 -2.871 25567 10645 1 15 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.181 -0.036 25567 10646 1 15 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.509 -4.664 25567 10647 1 15 . 1 1 96 96 LYS H H 96 6.958 6.958 7.853 -0.895 25567 10648 1 15 . 1 1 97 97 THR N N 97 113.412 113.412 118.407 -4.995 25567 10649 1 15 . 1 1 97 97 THR HA H 97 3.461 3.461 4.003 -0.542 25567 10650 1 15 . 1 1 97 97 THR C C 97 173.247 173.247 176.480 -3.233 25567 10651 1 15 . 1 1 97 97 THR CA C 97 62.809 62.809 66.627 -3.818 25567 10652 1 15 . 1 1 97 97 THR CB C 97 65.654 65.654 68.380 -2.726 25567 10653 1 15 . 1 1 97 97 THR H H 97 6.366 6.366 7.759 -1.393 25567 10654 1 15 . 1 1 98 98 LEU N N 98 121.201 121.201 122.539 -1.338 25567 10655 1 15 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.007 -0.373 25567 10656 1 15 . 1 1 98 98 LEU C C 98 174.590 174.590 178.104 -3.514 25567 10657 1 15 . 1 1 98 98 LEU CA C 98 55.621 55.621 58.440 -2.819 25567 10658 1 15 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.891 -1.996 25567 10659 1 15 . 1 1 98 98 LEU H H 98 7.554 7.554 7.566 -0.012 25567 10660 1 15 . 1 1 99 99 LEU N N 99 118.677 118.677 116.327 2.350 25567 10661 1 15 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.884 -0.182 25567 10662 1 15 . 1 1 99 99 LEU C C 99 177.457 177.457 178.240 -0.783 25567 10663 1 15 . 1 1 99 99 LEU CA C 99 55.179 55.179 56.939 -1.760 25567 10664 1 15 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.541 -1.553 25567 10665 1 15 . 1 1 99 99 LEU H H 99 8.160 8.160 7.673 0.487 25567 10666 1 15 . 1 1 100 100 ASP N N 100 118.914 118.914 116.055 2.859 25567 10667 1 15 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.399 -0.170 25567 10668 1 15 . 1 1 100 100 ASP C C 100 176.585 176.585 178.790 -2.205 25567 10669 1 15 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.181 -1.665 25567 10670 1 15 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.208 -3.629 25567 10671 1 15 . 1 1 100 100 ASP H H 100 7.872 7.872 7.597 0.275 25567 10672 1 15 . 1 1 101 101 GLN N N 101 118.135 118.135 119.575 -1.440 25567 10673 1 15 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.149 0.011 25567 10674 1 15 . 1 1 101 101 GLN C C 101 174.601 174.601 178.189 -3.588 25567 10675 1 15 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.358 -3.398 25567 10676 1 15 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.068 -3.518 25567 10677 1 15 . 1 1 101 101 GLN H H 101 7.673 7.673 7.633 0.040 25567 10678 1 15 . 1 1 102 102 MET N N 102 118.420 118.420 116.817 1.603 25567 10679 1 15 . 1 1 102 102 MET HA H 102 3.826 3.826 3.949 -0.123 25567 10680 1 15 . 1 1 102 102 MET C C 102 172.780 172.780 176.951 -4.171 25567 10681 1 15 . 1 1 102 102 MET CA C 102 53.428 53.428 56.686 -3.258 25567 10682 1 15 . 1 1 102 102 MET CB C 102 31.221 31.221 31.298 -0.077 25567 10683 1 15 . 1 1 102 102 MET H H 102 7.462 7.462 8.003 -0.541 25567 10684 1 15 . 1 1 103 103 LYS N N 103 116.066 116.066 118.701 -2.635 25567 10685 1 15 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.062 -0.142 25567 10686 1 15 . 1 1 103 103 LYS C C 103 173.922 173.922 177.878 -3.956 25567 10687 1 15 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.380 -2.098 25567 10688 1 15 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.891 -2.400 25567 10689 1 15 . 1 1 103 103 LYS H H 103 6.875 6.875 7.695 -0.820 25567 10690 1 15 . 1 1 104 104 ASN N N 104 114.987 114.987 112.934 2.053 25567 10691 1 15 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.838 -0.097 25567 10692 1 15 . 1 1 104 104 ASN C C 104 172.587 172.587 175.210 -2.623 25567 10693 1 15 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.393 -1.924 25567 10694 1 15 . 1 1 104 104 ASN CB C 104 35.822 35.822 38.914 -3.092 25567 10695 1 15 . 1 1 104 104 ASN H H 104 8.517 8.517 7.793 0.724 25567 10696 1 15 . 1 1 105 105 TYR N N 105 122.755 122.755 123.029 -0.274 25567 10697 1 15 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.407 0.168 25567 10698 1 15 . 1 1 105 105 TYR C C 105 174.260 174.260 175.257 -0.997 25567 10699 1 15 . 1 1 105 105 TYR CA C 105 55.493 55.493 59.468 -3.975 25567 10700 1 15 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.222 -3.158 25567 10701 1 15 . 1 1 105 105 TYR H H 105 8.287 8.287 7.932 0.355 25567 10702 1 15 . 1 1 106 106 ARG N N 106 128.905 128.905 126.402 2.503 25567 10703 1 15 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.361 -0.088 25567 10704 1 15 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.039 -2.018 25567 10705 1 15 . 1 1 106 106 ARG CB C 106 28.130 28.130 30.227 -2.097 25567 10706 1 15 . 1 1 106 106 ARG H H 106 8.841 8.841 8.095 0.747 25567 10707 1 15 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.947 -2.450 25567 10708 1 15 . 1 1 108 108 GLU N N 108 116.989 116.989 118.841 -1.852 25567 10709 1 15 . 1 1 108 108 GLU HA H 108 4.631 4.631 5.339 -0.708 25567 10710 1 15 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.011 -1.335 25567 10711 1 15 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.441 -3.039 25567 10712 1 15 . 1 1 108 108 GLU H H 108 7.536 7.536 8.116 -0.580 25567 10713 1 15 . 1 1 109 109 VAL N N 109 123.416 123.416 122.215 1.201 25567 10714 1 15 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.168 0.153 25567 10715 1 15 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.945 -3.502 25567 10716 1 15 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.921 -1.260 25567 10717 1 15 . 1 1 109 109 VAL H H 109 8.955 8.955 9.076 -0.121 25567 10718 1 15 . 1 1 110 110 ALA N N 110 127.975 127.975 128.032 -0.057 25567 10719 1 15 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.052 -0.375 25567 10720 1 15 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.851 -2.410 25567 10721 1 15 . 1 1 110 110 ALA CB C 110 18.416 18.416 21.562 -3.146 25567 10722 1 15 . 1 1 110 110 ALA H H 110 8.860 8.860 8.225 0.635 25567 10723 1 15 . 1 1 111 111 SER N N 111 110.482 110.482 113.034 -2.552 25567 10724 1 15 . 1 1 111 111 SER HA H 111 5.502 5.502 5.398 0.104 25567 10725 1 15 . 1 1 111 111 SER CA C 111 51.630 51.630 55.966 -4.336 25567 10726 1 15 . 1 1 111 111 SER CB C 111 62.267 62.267 65.393 -3.126 25567 10727 1 15 . 1 1 111 111 SER H H 111 7.484 7.484 7.437 0.047 25567 10728 1 15 . 1 1 112 112 PHE N N 112 125.082 125.082 118.655 6.427 25567 10729 1 15 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.520 0.928 25567 10730 1 15 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.768 -5.334 25567 10731 1 15 . 1 1 112 112 PHE CB C 112 40.500 40.500 40.610 -0.110 25567 10732 1 15 . 1 1 112 112 PHE H H 112 8.025 8.025 8.551 -0.526 25567 10733 1 15 . 1 1 113 113 PHE N N 113 115.872 115.872 121.707 -5.835 25567 10734 1 15 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.347 0.577 25567 10735 1 15 . 1 1 113 113 PHE C C 113 173.293 173.293 176.126 -2.833 25567 10736 1 15 . 1 1 113 113 PHE CA C 113 50.468 50.468 54.769 -4.301 25567 10737 1 15 . 1 1 113 113 PHE CB C 113 38.393 38.393 40.239 -1.846 25567 10738 1 15 . 1 1 113 113 PHE H H 113 7.391 7.391 8.679 -1.288 25567 10739 1 15 . 1 1 114 114 THR N N 114 108.721 108.721 113.244 -4.523 25567 10740 1 15 . 1 1 114 114 THR HA H 114 4.933 4.933 4.377 0.556 25567 10741 1 15 . 1 1 114 114 THR C C 114 171.891 171.891 174.956 -3.065 25567 10742 1 15 . 1 1 114 114 THR CA C 114 56.815 56.815 62.248 -5.433 25567 10743 1 15 . 1 1 114 114 THR CB C 114 67.899 67.899 69.088 -1.189 25567 10744 1 15 . 1 1 114 114 THR H H 114 7.951 7.951 8.353 -0.402 25567 10745 1 15 . 1 1 115 115 SER N N 115 115.159 115.159 117.393 -2.234 25567 10746 1 15 . 1 1 115 115 SER HA H 115 4.608 4.608 4.559 0.049 25567 10747 1 15 . 1 1 115 115 SER C C 115 171.403 171.403 173.071 -1.668 25567 10748 1 15 . 1 1 115 115 SER CA C 115 55.570 55.570 57.091 -1.521 25567 10749 1 15 . 1 1 115 115 SER CB C 115 61.418 61.418 64.243 -2.825 25567 10750 1 15 . 1 1 115 115 SER H H 115 8.229 8.229 7.986 0.243 25567 10751 1 15 . 1 1 116 116 ALA N N 116 127.211 127.211 129.580 -2.369 25567 10752 1 15 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.682 -0.226 25567 10753 1 15 . 1 1 116 116 ALA C C 116 175.758 175.758 178.286 -2.528 25567 10754 1 15 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.528 -1.712 25567 10755 1 15 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.721 -2.890 25567 10756 1 15 . 1 1 116 116 ALA H H 116 8.813 8.813 8.447 0.366 25567 10757 1 15 . 1 1 117 117 GLY N N 117 108.099 108.099 108.431 -0.332 25567 10758 1 15 . 1 1 117 117 GLY C C 117 171.805 171.805 175.482 -3.677 25567 10759 1 15 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.601 -4.732 25567 10760 1 15 . 1 1 117 117 GLY H H 117 8.685 8.685 8.703 -0.018 25567 10761 1 15 . 1 1 118 118 THR N N 118 111.284 111.284 110.586 0.698 25567 10762 1 15 . 1 1 118 118 THR HA H 118 4.343 4.343 4.473 -0.130 25567 10763 1 15 . 1 1 118 118 THR C C 118 171.769 171.769 173.470 -1.701 25567 10764 1 15 . 1 1 118 118 THR CA C 118 58.933 58.933 62.070 -3.137 25567 10765 1 15 . 1 1 118 118 THR CB C 118 67.304 67.304 70.299 -2.995 25567 10766 1 15 . 1 1 118 118 THR H H 118 7.998 7.998 8.323 -0.325 25567 10767 1 15 . 1 1 119 119 ASN N N 119 120.253 120.253 119.778 0.475 25567 10768 1 15 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.983 -0.280 25567 10769 1 15 . 1 1 119 119 ASN C C 119 172.353 172.353 173.808 -1.455 25567 10770 1 15 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.172 -2.944 25567 10771 1 15 . 1 1 119 119 ASN CB C 119 35.376 35.376 40.881 -5.505 25567 10772 1 15 . 1 1 119 119 ASN H H 119 8.381 8.381 7.986 0.395 25567 10773 1 15 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.353 -0.267 25567 10774 1 15 . 1 1 120 120 HIS C C 120 173.395 173.395 176.463 -3.068 25567 10775 1 15 . 1 1 120 120 HIS CA C 120 55.139 55.139 56.944 -1.805 25567 10776 1 15 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.278 -2.856 25567 10777 1 15 . 1 1 121 121 LYS N N 121 119.527 119.527 120.236 -0.709 25567 10778 1 15 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.964 -0.184 25567 10779 1 15 . 1 1 121 121 LYS C C 121 176.053 176.053 178.686 -2.633 25567 10780 1 15 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.729 -1.766 25567 10781 1 15 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.720 -2.060 25567 10782 1 15 . 1 1 121 121 LYS H H 121 8.106 8.106 8.516 -0.410 25567 10783 1 15 . 1 1 122 122 ALA N N 122 121.585 121.585 120.853 0.732 25567 10784 1 15 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.649 0.072 25567 10785 1 15 . 1 1 122 122 ALA C C 122 175.128 175.128 179.010 -3.882 25567 10786 1 15 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.704 -3.113 25567 10787 1 15 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.740 -2.036 25567 10788 1 15 . 1 1 122 122 ALA H H 122 7.702 7.702 8.109 -0.407 25567 10789 1 15 . 1 1 123 123 TYR N N 123 118.803 118.803 119.058 -0.255 25567 10790 1 15 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.226 -0.860 25567 10791 1 15 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.293 -1.202 25567 10792 1 15 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.230 -3.127 25567 10793 1 15 . 1 1 123 123 TYR H H 123 7.366 7.366 8.099 -0.733 25567 10794 1 15 . 1 1 124 124 VAL N N 124 117.530 117.530 118.219 -0.689 25567 10795 1 15 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.734 -0.535 25567 10796 1 15 . 1 1 124 124 VAL C C 124 175.375 175.375 178.208 -2.833 25567 10797 1 15 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.720 -2.137 25567 10798 1 15 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.295 -2.092 25567 10799 1 15 . 1 1 124 124 VAL H H 124 7.757 7.757 7.687 0.070 25567 10800 1 15 . 1 1 125 125 SER N N 125 114.023 114.023 115.382 -1.359 25567 10801 1 15 . 1 1 125 125 SER HA H 125 4.035 4.035 4.190 -0.155 25567 10802 1 15 . 1 1 125 125 SER C C 125 174.636 174.636 176.861 -2.225 25567 10803 1 15 . 1 1 125 125 SER CA C 125 58.885 58.885 61.519 -2.634 25567 10804 1 15 . 1 1 125 125 SER CB C 125 59.666 59.666 62.637 -2.971 25567 10805 1 15 . 1 1 125 125 SER H H 125 7.622 7.622 7.705 -0.083 25567 10806 1 15 . 1 1 126 126 HIS N N 126 119.457 119.457 121.229 -1.772 25567 10807 1 15 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.078 0.118 25567 10808 1 15 . 1 1 126 126 HIS C C 126 172.942 172.942 177.688 -4.746 25567 10809 1 15 . 1 1 126 126 HIS CA C 126 54.918 54.918 57.952 -3.034 25567 10810 1 15 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.691 -3.612 25567 10811 1 15 . 1 1 126 126 HIS H H 126 8.067 8.067 8.299 -0.232 25567 10812 1 15 . 1 1 127 127 PHE N N 127 120.628 120.628 120.968 -0.340 25567 10813 1 15 . 1 1 127 127 PHE HA H 127 3.199 3.199 4.079 -0.880 25567 10814 1 15 . 1 1 127 127 PHE C C 127 173.515 173.515 176.689 -3.174 25567 10815 1 15 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.544 1.137 25567 10816 1 15 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.881 -2.514 25567 10817 1 15 . 1 1 127 127 PHE H H 127 9.083 9.083 8.467 0.616 25567 10818 1 15 . 1 1 128 128 ASN N N 128 114.858 114.858 117.555 -2.697 25567 10819 1 15 . 1 1 128 128 ASN HA H 128 4.078 4.078 3.972 0.106 25567 10820 1 15 . 1 1 128 128 ASN C C 128 175.338 175.338 176.985 -1.647 25567 10821 1 15 . 1 1 128 128 ASN CA C 128 54.250 54.250 57.102 -2.852 25567 10822 1 15 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.408 -2.387 25567 10823 1 15 . 1 1 128 128 ASN H H 128 7.858 7.858 7.867 -0.009 25567 10824 1 15 . 1 1 129 129 GLU N N 129 119.811 119.811 120.219 -0.408 25567 10825 1 15 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.180 -0.139 25567 10826 1 15 . 1 1 129 129 GLU C C 129 176.941 176.941 179.690 -2.749 25567 10827 1 15 . 1 1 129 129 GLU CA C 129 56.632 56.632 59.165 -2.533 25567 10828 1 15 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.720 -2.782 25567 10829 1 15 . 1 1 129 129 GLU H H 129 7.569 7.569 7.553 0.016 25567 10830 1 15 . 1 1 130 130 TRP N N 130 120.585 120.585 119.572 1.013 25567 10831 1 15 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.589 -0.117 25567 10832 1 15 . 1 1 130 130 TRP C C 130 174.262 174.262 177.145 -2.883 25567 10833 1 15 . 1 1 130 130 TRP CA C 130 54.673 54.673 57.433 -2.760 25567 10834 1 15 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.921 -1.965 25567 10835 1 15 . 1 1 130 130 TRP H H 130 7.964 7.964 8.096 -0.132 25567 10836 1 15 . 1 1 131 131 ALA N N 131 120.522 120.522 118.165 2.357 25567 10837 1 15 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.511 -0.564 25567 10838 1 15 . 1 1 131 131 ALA C C 131 172.489 172.489 175.651 -3.162 25567 10839 1 15 . 1 1 131 131 ALA CA C 131 48.580 48.580 50.400 -1.820 25567 10840 1 15 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.468 -2.929 25567 10841 1 15 . 1 1 131 131 ALA H H 131 8.114 8.114 7.601 0.513 25567 10842 1 15 . 1 1 132 132 ASP N N 132 117.666 117.666 121.085 -3.419 25567 10843 1 15 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.356 -0.150 25567 10844 1 15 . 1 1 132 132 ASP C C 132 173.779 173.779 177.361 -3.582 25567 10845 1 15 . 1 1 132 132 ASP CA C 132 54.313 54.313 56.235 -1.922 25567 10846 1 15 . 1 1 132 132 ASP CB C 132 39.456 39.456 41.284 -1.828 25567 10847 1 15 . 1 1 132 132 ASP H H 132 6.768 6.768 7.485 -0.717 25567 10848 1 15 . 1 1 133 133 GLY N N 133 114.922 114.922 113.008 1.914 25567 10849 1 15 . 1 1 133 133 GLY C C 133 172.101 172.101 173.902 -1.801 25567 10850 1 15 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.812 -2.304 25567 10851 1 15 . 1 1 133 133 GLY H H 133 8.645 8.645 8.711 -0.066 25567 10852 1 15 . 1 1 134 134 LEU N N 134 120.101 120.101 121.492 -1.391 25567 10853 1 15 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.487 -0.025 25567 10854 1 15 . 1 1 134 134 LEU C C 134 174.098 174.098 175.666 -1.568 25567 10855 1 15 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.613 -2.529 25567 10856 1 15 . 1 1 134 134 LEU CB C 134 40.509 40.509 42.504 -1.995 25567 10857 1 15 . 1 1 134 134 LEU H H 134 8.049 8.049 7.409 0.640 25567 10858 1 15 . 1 1 135 135 ASN N N 135 119.258 119.258 121.452 -2.194 25567 10859 1 15 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.688 -0.049 25567 10860 1 15 . 1 1 135 135 ASN C C 135 170.564 170.564 173.617 -3.053 25567 10861 1 15 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.370 -4.117 25567 10862 1 15 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.760 -5.142 25567 10863 1 15 . 1 1 135 135 ASN H H 135 8.567 8.567 8.893 -0.326 25567 10864 1 15 . 1 1 136 136 VAL N N 136 125.460 125.460 126.484 -1.024 25567 10865 1 15 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.830 -0.234 25567 10866 1 15 . 1 1 136 136 VAL C C 136 175.318 175.318 175.521 -0.203 25567 10867 1 15 . 1 1 136 136 VAL CA C 136 58.722 58.722 60.722 -2.000 25567 10868 1 15 . 1 1 136 136 VAL CB C 136 29.299 29.299 34.112 -4.813 25567 10869 1 15 . 1 1 136 136 VAL H H 136 7.660 7.660 8.203 -0.543 25567 10870 1 15 . 1 1 137 137 ILE N N 137 122.021 122.021 124.884 -2.863 25567 10871 1 15 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.815 -0.387 25567 10872 1 15 . 1 1 137 137 ILE C C 137 173.943 173.943 174.746 -0.803 25567 10873 1 15 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.618 -0.660 25567 10874 1 15 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.967 -2.798 25567 10875 1 15 . 1 1 137 137 ILE H H 137 9.151 9.151 9.158 -0.007 25567 10876 1 15 . 1 1 138 138 GLY N N 138 108.192 108.192 107.248 0.944 25567 10877 1 15 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.449 -1.955 25567 10878 1 15 . 1 1 138 138 GLY H H 138 6.675 6.675 7.414 -0.739 25567 10879 1 15 . 1 1 139 139 VAL N N 139 119.673 119.673 119.369 0.304 25567 10880 1 15 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.469 0.851 25567 10881 1 15 . 1 1 139 139 VAL C C 139 172.291 172.291 174.075 -1.784 25567 10882 1 15 . 1 1 139 139 VAL CA C 139 58.209 58.209 62.446 -4.237 25567 10883 1 15 . 1 1 139 139 VAL CB C 139 32.639 32.639 32.535 0.104 25567 10884 1 15 . 1 1 139 139 VAL H H 139 8.158 8.158 8.901 -0.743 25567 10885 1 15 . 1 1 140 140 ALA N N 140 127.104 127.104 129.732 -2.628 25567 10886 1 15 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.856 -0.260 25567 10887 1 15 . 1 1 140 140 ALA C C 140 171.057 171.057 174.232 -3.175 25567 10888 1 15 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.673 -1.790 25567 10889 1 15 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.782 -1.354 25567 10890 1 15 . 1 1 140 140 ALA H H 140 9.145 9.145 8.815 0.330 25567 10891 1 15 . 1 1 141 141 ARG N N 141 118.828 118.828 119.310 -0.482 25567 10892 1 15 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.234 -1.494 25567 10893 1 15 . 1 1 141 141 ARG C C 141 173.524 173.524 176.852 -3.328 25567 10894 1 15 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.534 -2.648 25567 10895 1 15 . 1 1 141 141 ARG CB C 141 28.454 28.454 31.828 -3.374 25567 10896 1 15 . 1 1 141 141 ARG H H 141 7.759 7.759 8.169 -0.410 25567 10897 1 15 . 1 1 142 142 ASP N N 142 125.557 125.557 126.910 -1.353 25567 10898 1 15 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.112 -0.333 25567 10899 1 15 . 1 1 142 142 ASP C C 142 169.292 169.292 175.781 -6.489 25567 10900 1 15 . 1 1 142 142 ASP CA C 142 53.622 53.622 57.219 -3.597 25567 10901 1 15 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.368 -3.288 25567 10902 1 15 . 1 1 142 142 ASP H H 142 9.087 9.087 8.530 0.557 25567 10903 1 15 . 1 1 143 143 ASP N N 143 119.094 119.094 116.548 2.546 25567 10904 1 15 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.567 -0.313 25567 10905 1 15 . 1 1 143 143 ASP C C 143 175.557 175.557 177.208 -1.651 25567 10906 1 15 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.864 -4.785 25567 10907 1 15 . 1 1 143 143 ASP CB C 143 36.442 36.442 41.931 -5.489 25567 10908 1 15 . 1 1 143 143 ASP H H 143 8.175 8.175 8.126 0.049 25567 10909 1 15 . 1 1 144 144 SER N N 144 115.438 115.438 116.803 -1.365 25567 10910 1 15 . 1 1 144 144 SER HA H 144 3.745 3.745 4.112 -0.367 25567 10911 1 15 . 1 1 144 144 SER C C 144 172.820 172.820 174.926 -2.106 25567 10912 1 15 . 1 1 144 144 SER CA C 144 59.336 59.336 61.090 -1.754 25567 10913 1 15 . 1 1 144 144 SER CB C 144 60.839 60.839 63.071 -2.232 25567 10914 1 15 . 1 1 144 144 SER H H 144 7.742 7.742 7.782 -0.040 25567 10915 1 15 . 1 1 145 145 GLU N N 145 119.631 119.631 118.381 1.250 25567 10916 1 15 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.098 0.221 25567 10917 1 15 . 1 1 145 145 GLU C C 145 171.927 171.927 175.529 -3.602 25567 10918 1 15 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.539 -3.455 25567 10919 1 15 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.448 -2.674 25567 10920 1 15 . 1 1 145 145 GLU H H 145 7.924 7.924 7.531 0.393 25567 10921 1 15 . 1 1 146 146 VAL N N 146 118.791 118.791 120.966 -2.175 25567 10922 1 15 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.402 -0.446 25567 10923 1 15 . 1 1 146 146 VAL C C 146 174.582 174.582 177.169 -2.587 25567 10924 1 15 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.796 -2.719 25567 10925 1 15 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.558 -2.417 25567 10926 1 15 . 1 1 146 146 VAL H H 146 6.393 6.393 7.357 -0.964 25567 10927 1 15 . 1 1 147 147 ASP N N 147 119.410 119.410 119.501 -0.091 25567 10928 1 15 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.201 -0.131 25567 10929 1 15 . 1 1 147 147 ASP C C 147 174.774 174.774 177.402 -2.628 25567 10930 1 15 . 1 1 147 147 ASP CA C 147 54.322 54.322 57.554 -3.232 25567 10931 1 15 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.726 -3.522 25567 10932 1 15 . 1 1 147 147 ASP H H 147 8.393 8.393 8.611 -0.218 25567 10933 1 15 . 1 1 148 148 LYS N N 148 119.422 119.422 117.739 1.683 25567 10934 1 15 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.161 -0.210 25567 10935 1 15 . 1 1 148 148 LYS C C 148 176.410 176.410 179.129 -2.719 25567 10936 1 15 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.597 -2.861 25567 10937 1 15 . 1 1 148 148 LYS CB C 148 29.576 29.576 31.746 -2.170 25567 10938 1 15 . 1 1 148 148 LYS H H 148 7.078 7.078 7.517 -0.439 25567 10939 1 15 . 1 1 149 149 TRP N N 149 118.168 118.168 119.370 -1.202 25567 10940 1 15 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.895 -0.294 25567 10941 1 15 . 1 1 149 149 TRP C C 149 174.199 174.199 177.030 -2.831 25567 10942 1 15 . 1 1 149 149 TRP CA C 149 53.795 53.795 56.211 -2.416 25567 10943 1 15 . 1 1 149 149 TRP CB C 149 27.011 27.011 27.928 -0.917 25567 10944 1 15 . 1 1 149 149 TRP H H 149 7.914 7.914 7.597 0.317 25567 10945 1 15 . 1 1 150 150 SER N N 150 109.636 109.636 114.256 -4.620 25567 10946 1 15 . 1 1 150 150 SER HA H 150 4.242 4.242 4.579 -0.337 25567 10947 1 15 . 1 1 150 150 SER C C 150 170.173 170.173 174.415 -4.242 25567 10948 1 15 . 1 1 150 150 SER CA C 150 56.912 56.912 58.658 -1.746 25567 10949 1 15 . 1 1 150 150 SER CB C 150 62.087 62.087 64.764 -2.677 25567 10950 1 15 . 1 1 150 150 SER H H 150 7.814 7.814 7.833 -0.019 25567 10951 1 16 . 1 1 2 2 MET HA H 2 4.416 4.416 4.610 -0.194 25567 10952 1 16 . 1 1 2 2 MET CA C 2 52.847 52.847 55.777 -2.930 25567 10953 1 16 . 1 1 2 2 MET CB C 2 30.672 30.672 34.665 -3.993 25567 10954 1 16 . 1 1 3 3 ALA N N 3 125.563 125.563 126.686 -1.123 25567 10955 1 16 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.622 -0.250 25567 10956 1 16 . 1 1 3 3 ALA C C 3 174.728 174.728 175.902 -1.174 25567 10957 1 16 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.034 -2.686 25567 10958 1 16 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.456 -3.521 25567 10959 1 16 . 1 1 3 3 ALA H H 3 8.342 8.342 8.339 0.003 25567 10960 1 16 . 1 1 4 4 LYS N N 4 121.767 121.767 122.996 -1.229 25567 10961 1 16 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.549 -0.319 25567 10962 1 16 . 1 1 4 4 LYS C C 4 174.577 174.577 175.959 -1.382 25567 10963 1 16 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.505 -1.516 25567 10964 1 16 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.262 -0.707 25567 10965 1 16 . 1 1 4 4 LYS H H 4 8.500 8.500 8.500 0.000 25567 10966 1 16 . 1 1 5 5 LYS N N 5 129.654 129.654 123.826 5.828 25567 10967 1 16 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.527 -0.001 25567 10968 1 16 . 1 1 5 5 LYS C C 5 174.731 174.731 176.248 -1.517 25567 10969 1 16 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.820 -1.074 25567 10970 1 16 . 1 1 5 5 LYS CB C 5 29.894 29.894 34.013 -4.119 25567 10971 1 16 . 1 1 5 5 LYS H H 5 10.035 10.035 8.405 1.630 25567 10972 1 16 . 1 1 6 6 THR N N 6 126.212 126.212 113.692 12.520 25567 10973 1 16 . 1 1 6 6 THR HA H 6 5.654 5.654 5.449 0.205 25567 10974 1 16 . 1 1 6 6 THR C C 6 169.897 169.897 172.936 -3.039 25567 10975 1 16 . 1 1 6 6 THR CA C 6 60.647 60.647 61.792 -1.145 25567 10976 1 16 . 1 1 6 6 THR CB C 6 68.152 68.152 72.203 -4.051 25567 10977 1 16 . 1 1 6 6 THR H H 6 8.557 8.557 8.718 -0.161 25567 10978 1 16 . 1 1 7 7 LEU N N 7 130.776 130.776 125.200 5.576 25567 10979 1 16 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.905 -0.286 25567 10980 1 16 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.529 -3.433 25567 10981 1 16 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.377 -5.334 25567 10982 1 16 . 1 1 7 7 LEU H H 7 8.610 8.610 8.790 -0.180 25567 10983 1 16 . 1 1 8 8 ILE N N 8 127.175 127.175 124.841 2.334 25567 10984 1 16 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.868 -0.012 25567 10985 1 16 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.421 -3.029 25567 10986 1 16 . 1 1 8 8 ILE CB C 8 36.864 36.864 39.915 -3.051 25567 10987 1 16 . 1 1 8 8 ILE H H 8 9.263 9.263 7.966 1.297 25567 10988 1 16 . 1 1 9 9 LEU N N 9 127.117 127.117 127.853 -0.736 25567 10989 1 16 . 1 1 9 9 LEU HA H 9 5.696 5.696 4.957 0.739 25567 10990 1 16 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.075 -3.123 25567 10991 1 16 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.293 0.534 25567 10992 1 16 . 1 1 9 9 LEU H H 9 9.262 9.262 8.058 1.204 25567 10993 1 16 . 1 1 10 10 TYR N N 10 113.544 113.544 118.662 -5.118 25567 10994 1 16 . 1 1 10 10 TYR HA H 10 5.531 5.531 4.941 0.590 25567 10995 1 16 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.431 -2.602 25567 10996 1 16 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.190 -1.575 25567 10997 1 16 . 1 1 10 10 TYR H H 10 7.425 7.425 7.601 -0.176 25567 10998 1 16 . 1 1 11 11 TYR N N 11 121.235 121.235 126.012 -4.777 25567 10999 1 16 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.830 -0.021 25567 11000 1 16 . 1 1 11 11 TYR CA C 11 53.889 53.889 57.007 -3.118 25567 11001 1 16 . 1 1 11 11 TYR CB C 11 40.467 40.467 39.983 0.484 25567 11002 1 16 . 1 1 11 11 TYR H H 11 7.781 7.781 8.937 -1.156 25567 11003 1 16 . 1 1 14 14 SER CA C 14 54.675 54.675 59.907 -5.232 25567 11004 1 16 . 1 1 14 14 SER CB C 14 61.621 61.621 62.655 -1.034 25567 11005 1 16 . 1 1 15 15 GLY N N 15 110.420 110.420 111.963 -1.543 25567 11006 1 16 . 1 1 15 15 GLY CA C 15 43.727 43.727 46.418 -2.691 25567 11007 1 16 . 1 1 15 15 GLY H H 15 7.757 7.757 8.565 -0.808 25567 11008 1 16 . 1 1 17 17 THR HA H 17 4.122 4.122 4.224 -0.102 25567 11009 1 16 . 1 1 17 17 THR CA C 17 64.748 64.748 65.109 -0.361 25567 11010 1 16 . 1 1 17 17 THR CB C 17 64.532 64.532 68.257 -3.725 25567 11011 1 16 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.288 -0.370 25567 11012 1 16 . 1 1 18 18 LYS C C 18 173.812 173.812 177.424 -3.612 25567 11013 1 16 . 1 1 18 18 LYS CA C 18 57.003 57.003 60.029 -3.026 25567 11014 1 16 . 1 1 18 18 LYS CB C 18 29.768 29.768 31.867 -2.099 25567 11015 1 16 . 1 1 19 19 LYS N N 19 116.699 116.699 116.332 0.367 25567 11016 1 16 . 1 1 19 19 LYS HA H 19 3.948 3.948 4.079 -0.131 25567 11017 1 16 . 1 1 19 19 LYS C C 19 177.221 177.221 177.825 -0.604 25567 11018 1 16 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.368 -1.947 25567 11019 1 16 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.460 -2.826 25567 11020 1 16 . 1 1 19 19 LYS H H 19 7.476 7.476 7.634 -0.158 25567 11021 1 16 . 1 1 20 20 MET N N 20 118.946 118.946 114.319 4.627 25567 11022 1 16 . 1 1 20 20 MET HA H 20 4.474 4.474 4.751 -0.277 25567 11023 1 16 . 1 1 20 20 MET C C 20 173.826 173.826 175.496 -1.670 25567 11024 1 16 . 1 1 20 20 MET CA C 20 52.285 52.285 54.351 -2.066 25567 11025 1 16 . 1 1 20 20 MET CB C 20 26.921 26.921 32.858 -5.937 25567 11026 1 16 . 1 1 20 20 MET H H 20 7.457 7.457 7.853 -0.396 25567 11027 1 16 . 1 1 21 21 ALA N N 21 123.375 123.375 121.397 1.978 25567 11028 1 16 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.442 -0.890 25567 11029 1 16 . 1 1 21 21 ALA C C 21 176.542 176.542 178.665 -2.123 25567 11030 1 16 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.554 -0.903 25567 11031 1 16 . 1 1 21 21 ALA CB C 21 16.282 16.282 20.401 -4.119 25567 11032 1 16 . 1 1 21 21 ALA H H 21 8.549 8.549 7.922 0.627 25567 11033 1 16 . 1 1 22 22 GLU N N 22 116.906 116.906 119.970 -3.064 25567 11034 1 16 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.942 -0.269 25567 11035 1 16 . 1 1 22 22 GLU C C 22 176.658 176.658 179.016 -2.358 25567 11036 1 16 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.516 -2.911 25567 11037 1 16 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.309 -2.660 25567 11038 1 16 . 1 1 22 22 GLU H H 22 8.085 8.085 8.316 -0.231 25567 11039 1 16 . 1 1 23 23 LYS N N 23 123.301 123.301 118.870 4.431 25567 11040 1 16 . 1 1 23 23 LYS HA H 23 3.820 3.820 3.985 -0.165 25567 11041 1 16 . 1 1 23 23 LYS C C 23 177.363 177.363 179.020 -1.657 25567 11042 1 16 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.125 -2.154 25567 11043 1 16 . 1 1 23 23 LYS CB C 23 29.531 29.531 31.234 -1.703 25567 11044 1 16 . 1 1 23 23 LYS H H 23 7.703 7.703 8.218 -0.515 25567 11045 1 16 . 1 1 24 24 ILE N N 24 121.894 121.894 119.629 2.265 25567 11046 1 16 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.750 -0.454 25567 11047 1 16 . 1 1 24 24 ILE C C 24 174.944 174.944 178.622 -3.678 25567 11048 1 16 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.323 -1.090 25567 11049 1 16 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.210 -2.466 25567 11050 1 16 . 1 1 24 24 ILE H H 24 8.458 8.458 7.803 0.655 25567 11051 1 16 . 1 1 25 25 ASN N N 25 118.580 118.580 117.828 0.752 25567 11052 1 16 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.437 -0.203 25567 11053 1 16 . 1 1 25 25 ASN C C 25 173.567 173.567 176.280 -2.713 25567 11054 1 16 . 1 1 25 25 ASN CA C 25 52.324 52.324 55.747 -3.423 25567 11055 1 16 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.749 -0.566 25567 11056 1 16 . 1 1 25 25 ASN H H 25 8.273 8.273 8.222 0.051 25567 11057 1 16 . 1 1 26 26 SER N N 26 112.132 112.132 112.841 -0.709 25567 11058 1 16 . 1 1 26 26 SER HA H 26 4.148 4.148 4.394 -0.246 25567 11059 1 16 . 1 1 26 26 SER C C 26 172.083 172.083 174.958 -2.875 25567 11060 1 16 . 1 1 26 26 SER CA C 26 57.865 57.865 59.904 -2.039 25567 11061 1 16 . 1 1 26 26 SER CB C 26 60.816 60.816 63.648 -2.832 25567 11062 1 16 . 1 1 26 26 SER H H 26 7.444 7.444 7.798 -0.354 25567 11063 1 16 . 1 1 27 27 GLU N N 27 120.080 120.080 118.416 1.664 25567 11064 1 16 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.428 -0.328 25567 11065 1 16 . 1 1 27 27 GLU C C 27 173.647 173.647 175.988 -2.341 25567 11066 1 16 . 1 1 27 27 GLU CA C 27 54.202 54.202 55.700 -1.498 25567 11067 1 16 . 1 1 27 27 GLU CB C 27 26.884 26.884 31.060 -4.176 25567 11068 1 16 . 1 1 27 27 GLU H H 27 7.453 7.453 7.625 -0.172 25567 11069 1 16 . 1 1 28 28 ILE N N 28 118.759 118.759 119.938 -1.179 25567 11070 1 16 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.247 -0.043 25567 11071 1 16 . 1 1 28 28 ILE C C 28 172.474 172.474 174.799 -2.325 25567 11072 1 16 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.171 -2.424 25567 11073 1 16 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.960 -5.162 25567 11074 1 16 . 1 1 28 28 ILE H H 28 7.258 7.258 7.299 -0.041 25567 11075 1 16 . 1 1 29 29 LYS N N 29 130.618 130.618 128.446 2.172 25567 11076 1 16 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.176 -0.171 25567 11077 1 16 . 1 1 29 29 LYS C C 29 174.375 174.375 176.157 -1.782 25567 11078 1 16 . 1 1 29 29 LYS CA C 29 55.659 55.659 58.129 -2.470 25567 11079 1 16 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.008 -3.448 25567 11080 1 16 . 1 1 29 29 LYS H H 29 8.588 8.588 8.782 -0.194 25567 11081 1 16 . 1 1 30 30 ASP N N 30 119.366 119.366 120.294 -0.928 25567 11082 1 16 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.395 0.007 25567 11083 1 16 . 1 1 30 30 ASP C C 30 172.580 172.580 175.633 -3.053 25567 11084 1 16 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.459 -1.835 25567 11085 1 16 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.587 -3.759 25567 11086 1 16 . 1 1 30 30 ASP H H 30 8.940 8.940 8.729 0.211 25567 11087 1 16 . 1 1 31 31 SER N N 31 114.035 114.035 113.886 0.149 25567 11088 1 16 . 1 1 31 31 SER HA H 31 4.781 4.781 4.368 0.413 25567 11089 1 16 . 1 1 31 31 SER C C 31 171.136 171.136 174.599 -3.463 25567 11090 1 16 . 1 1 31 31 SER CA C 31 55.638 55.638 59.624 -3.986 25567 11091 1 16 . 1 1 31 31 SER CB C 31 62.388 62.388 63.982 -1.594 25567 11092 1 16 . 1 1 31 31 SER H H 31 8.030 8.030 7.623 0.407 25567 11093 1 16 . 1 1 32 32 GLU N N 32 121.406 121.406 121.493 -0.087 25567 11094 1 16 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.726 0.009 25567 11095 1 16 . 1 1 32 32 GLU C C 32 171.205 171.205 174.561 -3.356 25567 11096 1 16 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.032 -2.963 25567 11097 1 16 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.464 -2.574 25567 11098 1 16 . 1 1 32 32 GLU H H 32 8.188 8.188 8.185 0.003 25567 11099 1 16 . 1 1 33 33 LEU N N 33 126.143 126.143 117.492 8.651 25567 11100 1 16 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.442 -0.157 25567 11101 1 16 . 1 1 33 33 LEU C C 33 173.401 173.401 176.142 -2.741 25567 11102 1 16 . 1 1 33 33 LEU CA C 33 51.334 51.334 52.508 -1.173 25567 11103 1 16 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.791 -1.168 25567 11104 1 16 . 1 1 33 33 LEU H H 33 8.627 8.627 8.208 0.419 25567 11105 1 16 . 1 1 34 34 LYS N N 34 127.122 127.122 116.784 10.338 25567 11106 1 16 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.518 0.081 25567 11107 1 16 . 1 1 34 34 LYS C C 34 169.644 169.644 174.006 -4.362 25567 11108 1 16 . 1 1 34 34 LYS CA C 34 52.353 52.353 55.515 -3.162 25567 11109 1 16 . 1 1 34 34 LYS CB C 34 34.172 34.172 36.080 -1.908 25567 11110 1 16 . 1 1 34 34 LYS H H 34 9.399 9.399 8.509 0.890 25567 11111 1 16 . 1 1 35 35 GLU N N 35 122.766 122.766 119.253 3.513 25567 11112 1 16 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.354 -0.996 25567 11113 1 16 . 1 1 35 35 GLU C C 35 172.875 172.875 174.354 -1.479 25567 11114 1 16 . 1 1 35 35 GLU CA C 35 52.640 52.640 54.342 -1.702 25567 11115 1 16 . 1 1 35 35 GLU CB C 35 29.268 29.268 32.734 -3.466 25567 11116 1 16 . 1 1 35 35 GLU H H 35 8.166 8.166 8.281 -0.115 25567 11117 1 16 . 1 1 36 36 VAL N N 36 126.674 126.674 118.813 7.861 25567 11118 1 16 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.149 -0.288 25567 11119 1 16 . 1 1 36 36 VAL C C 36 171.451 171.451 175.693 -4.242 25567 11120 1 16 . 1 1 36 36 VAL CA C 36 59.537 59.537 59.983 -0.446 25567 11121 1 16 . 1 1 36 36 VAL CB C 36 29.689 29.689 32.672 -2.983 25567 11122 1 16 . 1 1 36 36 VAL H H 36 8.632 8.632 8.019 0.613 25567 11123 1 16 . 1 1 37 37 LYS N N 37 126.181 126.181 125.341 0.840 25567 11124 1 16 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.842 0.097 25567 11125 1 16 . 1 1 37 37 LYS CA C 37 52.179 52.179 53.335 -1.156 25567 11126 1 16 . 1 1 37 37 LYS CB C 37 32.898 32.898 34.289 -1.391 25567 11127 1 16 . 1 1 37 37 LYS H H 37 7.867 7.867 8.006 -0.139 25567 11128 1 16 . 1 1 38 38 VAL N N 38 113.540 113.540 115.713 -2.173 25567 11129 1 16 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.403 0.283 25567 11130 1 16 . 1 1 38 38 VAL C C 38 173.633 173.633 175.891 -2.258 25567 11131 1 16 . 1 1 38 38 VAL CA C 38 57.284 57.284 61.954 -4.670 25567 11132 1 16 . 1 1 38 38 VAL CB C 38 31.964 31.964 32.577 -0.613 25567 11133 1 16 . 1 1 38 38 VAL H H 38 8.389 8.389 8.427 -0.038 25567 11134 1 16 . 1 1 39 39 SER N N 39 118.860 118.860 115.746 3.114 25567 11135 1 16 . 1 1 39 39 SER HA H 39 4.194 4.194 4.645 -0.451 25567 11136 1 16 . 1 1 39 39 SER C C 39 173.059 173.059 174.194 -1.135 25567 11137 1 16 . 1 1 39 39 SER CA C 39 56.227 56.227 56.642 -0.415 25567 11138 1 16 . 1 1 39 39 SER CB C 39 60.771 60.771 65.328 -4.557 25567 11139 1 16 . 1 1 39 39 SER H H 39 8.668 8.668 8.390 0.278 25567 11140 1 16 . 1 1 40 40 GLU N N 40 125.769 125.769 121.501 4.268 25567 11141 1 16 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.311 -0.154 25567 11142 1 16 . 1 1 40 40 GLU C C 40 174.484 174.484 175.923 -1.439 25567 11143 1 16 . 1 1 40 40 GLU CA C 40 55.550 55.550 57.559 -2.009 25567 11144 1 16 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.066 -3.012 25567 11145 1 16 . 1 1 40 40 GLU H H 40 8.878 8.878 8.454 0.424 25567 11146 1 16 . 1 1 41 41 GLY N N 41 112.165 112.165 112.337 -0.172 25567 11147 1 16 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.494 -1.787 25567 11148 1 16 . 1 1 41 41 GLY H H 41 8.743 8.743 8.288 0.455 25567 11149 1 16 . 1 1 44 44 ASP N N 44 122.324 122.324 119.207 3.117 25567 11150 1 16 . 1 1 44 44 ASP CB C 44 42.156 42.156 42.407 -0.251 25567 11151 1 16 . 1 1 44 44 ASP H H 44 7.918 7.918 8.639 -0.721 25567 11152 1 16 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.504 -0.442 25567 11153 1 16 . 1 1 45 45 ALA CA C 45 51.410 51.410 51.939 -0.529 25567 11154 1 16 . 1 1 45 45 ALA CB C 45 16.376 16.376 20.767 -4.391 25567 11155 1 16 . 1 1 47 47 MET CA C 47 54.118 54.118 54.873 -0.755 25567 11156 1 16 . 1 1 47 47 MET CB C 47 27.527 27.527 35.999 -8.472 25567 11157 1 16 . 1 1 48 48 TYR N N 48 120.075 120.075 121.859 -1.784 25567 11158 1 16 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.397 -0.243 25567 11159 1 16 . 1 1 48 48 TYR C C 48 172.217 172.217 175.450 -3.233 25567 11160 1 16 . 1 1 48 48 TYR CA C 48 57.377 57.377 58.441 -1.064 25567 11161 1 16 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.199 -2.703 25567 11162 1 16 . 1 1 48 48 TYR H H 48 7.810 7.810 8.776 -0.966 25567 11163 1 16 . 1 1 49 49 LYS N N 49 118.369 118.369 123.011 -4.642 25567 11164 1 16 . 1 1 49 49 LYS H H 49 8.116 8.116 8.106 0.010 25567 11165 1 16 . 1 1 50 50 THR N N 50 116.979 116.979 116.501 0.478 25567 11166 1 16 . 1 1 50 50 THR CB C 50 66.373 66.373 67.928 -1.555 25567 11167 1 16 . 1 1 50 50 THR H H 50 7.741 7.741 7.954 -0.213 25567 11168 1 16 . 1 1 51 51 SER N N 51 116.155 116.155 112.034 4.121 25567 11169 1 16 . 1 1 51 51 SER HA H 51 3.771 3.771 4.313 -0.542 25567 11170 1 16 . 1 1 51 51 SER C C 51 170.563 170.563 171.982 -1.419 25567 11171 1 16 . 1 1 51 51 SER CA C 51 54.840 54.840 56.577 -1.737 25567 11172 1 16 . 1 1 51 51 SER CB C 51 60.318 60.318 66.150 -5.832 25567 11173 1 16 . 1 1 51 51 SER H H 51 7.853 7.853 7.018 0.835 25567 11174 1 16 . 1 1 54 54 ALA N N 54 123.234 123.234 120.086 3.148 25567 11175 1 16 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.483 -0.235 25567 11176 1 16 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.273 -1.005 25567 11177 1 16 . 1 1 54 54 ALA CB C 54 16.434 16.434 19.534 -3.100 25567 11178 1 16 . 1 1 54 54 ALA H H 54 8.207 8.207 7.688 0.519 25567 11179 1 16 . 1 1 55 55 LEU N N 55 118.603 118.603 121.276 -2.673 25567 11180 1 16 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.223 -0.283 25567 11181 1 16 . 1 1 55 55 LEU CA C 55 54.711 54.711 56.178 -1.467 25567 11182 1 16 . 1 1 55 55 LEU CB C 55 38.913 38.913 42.403 -3.490 25567 11183 1 16 . 1 1 55 55 LEU H H 55 7.960 7.960 8.359 -0.399 25567 11184 1 16 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.058 -0.382 25567 11185 1 16 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.584 -0.090 25567 11186 1 16 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.583 -3.529 25567 11187 1 16 . 1 1 59 59 GLN N N 59 117.579 117.579 121.394 -3.815 25567 11188 1 16 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.325 -0.192 25567 11189 1 16 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.169 -2.160 25567 11190 1 16 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.215 -1.565 25567 11191 1 16 . 1 1 59 59 GLN H H 59 8.268 8.268 8.417 -0.149 25567 11192 1 16 . 1 1 60 60 GLY N N 60 107.308 107.308 113.703 -6.395 25567 11193 1 16 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.049 -2.070 25567 11194 1 16 . 1 1 60 60 GLY H H 60 7.780 7.780 8.208 -0.428 25567 11195 1 16 . 1 1 61 61 ASN N N 61 117.747 117.747 118.996 -1.249 25567 11196 1 16 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.824 -0.290 25567 11197 1 16 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.677 -1.442 25567 11198 1 16 . 1 1 61 61 ASN CB C 61 36.424 36.424 38.853 -2.429 25567 11199 1 16 . 1 1 61 61 ASN H H 61 8.108 8.108 8.357 -0.249 25567 11200 1 16 . 1 1 64 64 PHE N N 64 120.102 120.102 124.275 -4.173 25567 11201 1 16 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.936 -0.557 25567 11202 1 16 . 1 1 64 64 PHE CA C 64 51.748 51.748 53.504 -1.756 25567 11203 1 16 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.284 -3.009 25567 11204 1 16 . 1 1 64 64 PHE H H 64 8.300 8.300 6.980 1.320 25567 11205 1 16 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.614 -0.279 25567 11206 1 16 . 1 1 65 65 PRO C C 65 173.870 173.870 176.387 -2.517 25567 11207 1 16 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.630 -2.613 25567 11208 1 16 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.689 -3.054 25567 11209 1 16 . 1 1 66 66 GLU N N 66 121.258 121.258 118.949 2.309 25567 11210 1 16 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.325 -0.091 25567 11211 1 16 . 1 1 66 66 GLU C C 66 173.981 173.981 176.142 -2.161 25567 11212 1 16 . 1 1 66 66 GLU CA C 66 53.787 53.787 55.992 -2.205 25567 11213 1 16 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.655 -2.880 25567 11214 1 16 . 1 1 66 66 GLU H H 66 8.316 8.316 8.502 -0.186 25567 11215 1 16 . 1 1 67 67 ILE N N 67 114.290 114.290 111.641 2.649 25567 11216 1 16 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.853 0.276 25567 11217 1 16 . 1 1 67 67 ILE C C 67 172.700 172.700 174.701 -2.001 25567 11218 1 16 . 1 1 67 67 ILE CA C 67 56.439 56.439 58.906 -2.467 25567 11219 1 16 . 1 1 67 67 ILE CB C 67 39.159 39.159 41.752 -2.593 25567 11220 1 16 . 1 1 67 67 ILE H H 67 8.366 8.366 8.158 0.208 25567 11221 1 16 . 1 1 68 68 GLN N N 68 121.422 121.422 118.611 2.811 25567 11222 1 16 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.838 -0.337 25567 11223 1 16 . 1 1 68 68 GLN C C 68 171.675 171.675 173.842 -2.167 25567 11224 1 16 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.610 -2.337 25567 11225 1 16 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.131 -5.988 25567 11226 1 16 . 1 1 68 68 GLN H H 68 8.737 8.737 8.679 0.058 25567 11227 1 16 . 1 1 69 69 LEU N N 69 125.311 125.311 116.141 9.170 25567 11228 1 16 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.732 -0.226 25567 11229 1 16 . 1 1 69 69 LEU C C 69 172.634 172.634 174.920 -2.286 25567 11230 1 16 . 1 1 69 69 LEU CA C 69 51.759 51.759 54.143 -2.384 25567 11231 1 16 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.259 -0.855 25567 11232 1 16 . 1 1 69 69 LEU H H 69 8.051 8.051 8.142 -0.091 25567 11233 1 16 . 1 1 70 70 ASP N N 70 122.763 122.763 119.853 2.910 25567 11234 1 16 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.695 -0.272 25567 11235 1 16 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.054 -1.444 25567 11236 1 16 . 1 1 70 70 ASP CB C 70 38.717 38.717 41.934 -3.217 25567 11237 1 16 . 1 1 70 70 ASP H H 70 8.313 8.313 8.397 -0.084 25567 11238 1 16 . 1 1 71 71 ASN N N 71 117.413 117.413 118.548 -1.135 25567 11239 1 16 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.708 -0.371 25567 11240 1 16 . 1 1 71 71 ASN C C 71 171.770 171.770 174.596 -2.826 25567 11241 1 16 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.846 -2.355 25567 11242 1 16 . 1 1 71 71 ASN CB C 71 35.326 35.326 38.051 -2.725 25567 11243 1 16 . 1 1 71 71 ASN H H 71 8.407 8.407 8.456 -0.049 25567 11244 1 16 . 1 1 72 72 ILE N N 72 123.752 123.752 123.110 0.642 25567 11245 1 16 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.217 -0.277 25567 11246 1 16 . 1 1 72 72 ILE C C 72 171.621 171.621 174.808 -3.187 25567 11247 1 16 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.349 -3.017 25567 11248 1 16 . 1 1 72 72 ILE CB C 72 38.489 38.489 40.133 -1.643 25567 11249 1 16 . 1 1 72 72 ILE H H 72 7.639 7.639 7.606 0.033 25567 11250 1 16 . 1 1 73 73 ASP N N 73 125.252 125.252 123.063 2.189 25567 11251 1 16 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.528 0.097 25567 11252 1 16 . 1 1 73 73 ASP C C 73 174.034 174.034 175.812 -1.778 25567 11253 1 16 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.147 -3.944 25567 11254 1 16 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.565 -5.541 25567 11255 1 16 . 1 1 73 73 ASP H H 73 8.394 8.394 8.284 0.110 25567 11256 1 16 . 1 1 74 74 TYR N N 74 123.108 123.108 124.419 -1.311 25567 11257 1 16 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.482 -0.604 25567 11258 1 16 . 1 1 74 74 TYR C C 74 173.637 173.637 177.198 -3.561 25567 11259 1 16 . 1 1 74 74 TYR CA C 74 59.474 59.474 58.721 0.752 25567 11260 1 16 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.516 -3.793 25567 11261 1 16 . 1 1 74 74 TYR H H 74 7.392 7.392 8.260 -0.868 25567 11262 1 16 . 1 1 75 75 ASN N N 75 109.422 109.422 117.338 -7.916 25567 11263 1 16 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.713 0.213 25567 11264 1 16 . 1 1 75 75 ASN C C 75 172.574 172.574 176.059 -3.485 25567 11265 1 16 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.933 -3.172 25567 11266 1 16 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.993 -3.376 25567 11267 1 16 . 1 1 75 75 ASN H H 75 8.058 8.058 8.814 -0.756 25567 11268 1 16 . 1 1 76 76 ASN N N 76 117.422 117.422 116.973 0.449 25567 11269 1 16 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.678 -0.223 25567 11270 1 16 . 1 1 76 76 ASN C C 76 171.132 171.132 174.497 -3.365 25567 11271 1 16 . 1 1 76 76 ASN CA C 76 51.167 51.167 52.883 -1.716 25567 11272 1 16 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.487 -2.759 25567 11273 1 16 . 1 1 76 76 ASN H H 76 7.768 7.768 7.766 0.002 25567 11274 1 16 . 1 1 77 77 TYR N N 77 116.873 116.873 117.069 -0.196 25567 11275 1 16 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.624 -0.261 25567 11276 1 16 . 1 1 77 77 TYR C C 77 172.175 172.175 174.791 -2.616 25567 11277 1 16 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.720 -2.356 25567 11278 1 16 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.963 -3.798 25567 11279 1 16 . 1 1 77 77 TYR H H 77 7.825 7.825 7.489 0.336 25567 11280 1 16 . 1 1 78 78 ASP N N 78 121.271 121.271 119.225 2.046 25567 11281 1 16 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.969 -0.164 25567 11282 1 16 . 1 1 78 78 ASP C C 78 172.641 172.641 175.228 -2.587 25567 11283 1 16 . 1 1 78 78 ASP CA C 78 53.255 53.255 54.191 -0.936 25567 11284 1 16 . 1 1 78 78 ASP CB C 78 41.075 41.075 44.125 -3.050 25567 11285 1 16 . 1 1 78 78 ASP H H 78 9.058 9.058 8.620 0.438 25567 11286 1 16 . 1 1 79 79 LEU N N 79 122.985 122.985 120.548 2.437 25567 11287 1 16 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.339 -0.225 25567 11288 1 16 . 1 1 79 79 LEU C C 79 170.721 170.721 174.222 -3.501 25567 11289 1 16 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.611 -3.295 25567 11290 1 16 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.274 -2.932 25567 11291 1 16 . 1 1 79 79 LEU H H 79 7.893 7.893 7.784 0.109 25567 11292 1 16 . 1 1 80 80 ILE N N 80 126.364 126.364 126.302 0.062 25567 11293 1 16 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.831 0.258 25567 11294 1 16 . 1 1 80 80 ILE C C 80 171.580 171.580 174.235 -2.655 25567 11295 1 16 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.210 -2.793 25567 11296 1 16 . 1 1 80 80 ILE CB C 80 38.136 38.136 40.222 -2.086 25567 11297 1 16 . 1 1 80 80 ILE H H 80 8.717 8.717 9.130 -0.413 25567 11298 1 16 . 1 1 81 81 LEU N N 81 126.199 126.199 127.824 -1.625 25567 11299 1 16 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.284 -0.149 25567 11300 1 16 . 1 1 81 81 LEU C C 81 172.979 172.979 175.572 -2.593 25567 11301 1 16 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.453 -3.820 25567 11302 1 16 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.271 -3.112 25567 11303 1 16 . 1 1 81 81 LEU H H 81 9.230 9.230 8.806 0.424 25567 11304 1 16 . 1 1 82 82 ILE N N 82 120.505 120.505 119.915 0.590 25567 11305 1 16 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.922 -0.006 25567 11306 1 16 . 1 1 82 82 ILE C C 82 173.011 173.011 174.874 -1.863 25567 11307 1 16 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.594 -2.766 25567 11308 1 16 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.717 -3.649 25567 11309 1 16 . 1 1 82 82 ILE H H 82 8.796 8.796 8.083 0.713 25567 11310 1 16 . 1 1 83 83 GLY N N 83 120.857 120.857 111.516 9.341 25567 11311 1 16 . 1 1 83 83 GLY CA C 83 40.803 40.803 42.740 -1.937 25567 11312 1 16 . 1 1 83 83 GLY H H 83 9.525 9.525 7.768 1.757 25567 11313 1 16 . 1 1 84 84 SER N N 84 116.007 116.007 113.228 2.779 25567 11314 1 16 . 1 1 84 84 SER HA H 84 5.476 5.476 4.838 0.638 25567 11315 1 16 . 1 1 84 84 SER CA C 84 51.937 51.937 56.107 -4.170 25567 11316 1 16 . 1 1 84 84 SER CB C 84 64.533 64.533 64.955 -0.422 25567 11317 1 16 . 1 1 84 84 SER H H 84 7.617 7.617 7.685 -0.068 25567 11318 1 16 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.518 0.683 25567 11319 1 16 . 1 1 85 85 PRO C C 85 173.574 173.574 175.208 -1.634 25567 11320 1 16 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.160 -2.672 25567 11321 1 16 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.807 -1.667 25567 11322 1 16 . 1 1 86 86 VAL N N 86 117.603 117.603 117.864 -0.261 25567 11323 1 16 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.401 -0.028 25567 11324 1 16 . 1 1 86 86 VAL C C 86 172.777 172.777 173.982 -1.205 25567 11325 1 16 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.914 -2.312 25567 11326 1 16 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.139 -5.566 25567 11327 1 16 . 1 1 86 86 VAL H H 86 8.194 8.194 7.689 0.505 25567 11328 1 16 . 1 1 87 87 TRP N N 87 131.187 131.187 130.502 0.685 25567 11329 1 16 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.939 0.259 25567 11330 1 16 . 1 1 87 87 TRP C C 87 173.295 173.295 175.083 -1.788 25567 11331 1 16 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.535 -6.750 25567 11332 1 16 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.942 -4.197 25567 11333 1 16 . 1 1 87 87 TRP H H 87 9.637 9.637 8.632 1.005 25567 11334 1 16 . 1 1 88 88 SER N N 88 119.829 119.829 113.091 6.738 25567 11335 1 16 . 1 1 88 88 SER HA H 88 3.986 3.986 4.752 -0.766 25567 11336 1 16 . 1 1 88 88 SER C C 88 172.375 172.375 174.591 -2.216 25567 11337 1 16 . 1 1 88 88 SER CA C 88 55.932 55.932 56.472 -0.540 25567 11338 1 16 . 1 1 88 88 SER CB C 88 59.178 59.178 62.341 -3.163 25567 11339 1 16 . 1 1 88 88 SER H H 88 9.272 9.272 7.838 1.434 25567 11340 1 16 . 1 1 89 89 GLY N N 89 101.498 101.498 116.266 -14.768 25567 11341 1 16 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.894 -4.223 25567 11342 1 16 . 1 1 89 89 GLY H H 89 7.463 7.463 8.891 -1.428 25567 11343 1 16 . 1 1 90 90 TYR N N 90 121.064 121.064 116.233 4.831 25567 11344 1 16 . 1 1 90 90 TYR HA H 90 4.216 4.216 4.878 -0.662 25567 11345 1 16 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.034 0.056 25567 11346 1 16 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.714 0.481 25567 11347 1 16 . 1 1 90 90 TYR H H 90 8.064 8.064 8.225 -0.161 25567 11348 1 16 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.731 0.201 25567 11349 1 16 . 1 1 91 91 PRO C C 91 171.019 171.019 175.638 -4.619 25567 11350 1 16 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.547 -4.553 25567 11351 1 16 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.674 -6.181 25567 11352 1 16 . 1 1 92 92 ALA N N 92 119.893 119.893 118.872 1.021 25567 11353 1 16 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.977 -1.526 25567 11354 1 16 . 1 1 92 92 ALA C C 92 176.477 176.477 177.026 -0.549 25567 11355 1 16 . 1 1 92 92 ALA CA C 92 49.567 49.567 50.596 -1.028 25567 11356 1 16 . 1 1 92 92 ALA CB C 92 15.801 15.801 22.168 -6.367 25567 11357 1 16 . 1 1 92 92 ALA H H 92 7.278 7.278 7.646 -0.368 25567 11358 1 16 . 1 1 93 93 THR N N 93 112.992 112.992 110.439 2.553 25567 11359 1 16 . 1 1 93 93 THR HA H 93 4.462 4.462 4.944 -0.482 25567 11360 1 16 . 1 1 93 93 THR CA C 93 66.871 66.871 60.630 6.241 25567 11361 1 16 . 1 1 93 93 THR CB C 93 64.362 64.362 68.412 -4.050 25567 11362 1 16 . 1 1 93 93 THR H H 93 6.861 6.861 8.327 -1.466 25567 11363 1 16 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.594 -0.728 25567 11364 1 16 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.559 -0.538 25567 11365 1 16 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.783 -2.504 25567 11366 1 16 . 1 1 95 95 ILE N N 95 111.298 111.298 118.405 -7.107 25567 11367 1 16 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.468 -0.845 25567 11368 1 16 . 1 1 95 95 ILE C C 95 174.264 174.264 175.235 -0.971 25567 11369 1 16 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.177 -1.729 25567 11370 1 16 . 1 1 95 95 ILE CB C 95 31.929 31.929 37.430 -5.501 25567 11371 1 16 . 1 1 95 95 ILE H H 95 7.974 7.974 7.988 -0.014 25567 11372 1 16 . 1 1 96 96 LYS N N 96 123.045 123.045 121.724 1.321 25567 11373 1 16 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.491 -1.379 25567 11374 1 16 . 1 1 96 96 LYS C C 96 174.590 174.590 177.729 -3.139 25567 11375 1 16 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.945 0.200 25567 11376 1 16 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.757 -4.912 25567 11377 1 16 . 1 1 96 96 LYS H H 96 6.958 6.958 7.919 -0.961 25567 11378 1 16 . 1 1 97 97 THR N N 97 113.412 113.412 116.621 -3.209 25567 11379 1 16 . 1 1 97 97 THR HA H 97 3.461 3.461 4.081 -0.620 25567 11380 1 16 . 1 1 97 97 THR C C 97 173.247 173.247 176.418 -3.171 25567 11381 1 16 . 1 1 97 97 THR CA C 97 62.809 62.809 66.353 -3.544 25567 11382 1 16 . 1 1 97 97 THR CB C 97 65.654 65.654 68.645 -2.991 25567 11383 1 16 . 1 1 97 97 THR H H 97 6.366 6.366 8.014 -1.648 25567 11384 1 16 . 1 1 98 98 LEU N N 98 121.201 121.201 121.943 -0.742 25567 11385 1 16 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.046 -0.412 25567 11386 1 16 . 1 1 98 98 LEU C C 98 174.590 174.590 178.510 -3.920 25567 11387 1 16 . 1 1 98 98 LEU CA C 98 55.621 55.621 58.201 -2.580 25567 11388 1 16 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.721 -0.826 25567 11389 1 16 . 1 1 98 98 LEU H H 98 7.554 7.554 8.300 -0.746 25567 11390 1 16 . 1 1 99 99 LEU N N 99 118.677 118.677 116.894 1.783 25567 11391 1 16 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.951 -0.249 25567 11392 1 16 . 1 1 99 99 LEU C C 99 177.457 177.457 178.409 -0.952 25567 11393 1 16 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.375 -2.196 25567 11394 1 16 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.189 -1.201 25567 11395 1 16 . 1 1 99 99 LEU H H 99 8.160 8.160 8.073 0.087 25567 11396 1 16 . 1 1 100 100 ASP N N 100 118.914 118.914 115.898 3.016 25567 11397 1 16 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.482 -0.253 25567 11398 1 16 . 1 1 100 100 ASP C C 100 176.585 176.585 179.261 -2.676 25567 11399 1 16 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.424 -1.908 25567 11400 1 16 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.186 -3.607 25567 11401 1 16 . 1 1 100 100 ASP H H 100 7.872 7.872 7.760 0.112 25567 11402 1 16 . 1 1 101 101 GLN N N 101 118.135 118.135 119.169 -1.034 25567 11403 1 16 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.262 -0.102 25567 11404 1 16 . 1 1 101 101 GLN C C 101 174.601 174.601 178.304 -3.703 25567 11405 1 16 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.172 -3.212 25567 11406 1 16 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.332 -3.782 25567 11407 1 16 . 1 1 101 101 GLN H H 101 7.673 7.673 7.924 -0.251 25567 11408 1 16 . 1 1 102 102 MET N N 102 118.420 118.420 117.028 1.392 25567 11409 1 16 . 1 1 102 102 MET HA H 102 3.826 3.826 4.287 -0.461 25567 11410 1 16 . 1 1 102 102 MET C C 102 172.780 172.780 176.746 -3.966 25567 11411 1 16 . 1 1 102 102 MET CA C 102 53.428 53.428 56.937 -3.509 25567 11412 1 16 . 1 1 102 102 MET CB C 102 31.221 31.221 31.328 -0.107 25567 11413 1 16 . 1 1 102 102 MET H H 102 7.462 7.462 8.199 -0.737 25567 11414 1 16 . 1 1 103 103 LYS N N 103 116.066 116.066 119.281 -3.215 25567 11415 1 16 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.152 -0.232 25567 11416 1 16 . 1 1 103 103 LYS C C 103 173.922 173.922 177.517 -3.595 25567 11417 1 16 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.355 -2.073 25567 11418 1 16 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.995 -2.504 25567 11419 1 16 . 1 1 103 103 LYS H H 103 6.875 6.875 7.705 -0.830 25567 11420 1 16 . 1 1 104 104 ASN N N 104 114.987 114.987 117.010 -2.023 25567 11421 1 16 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.854 -0.113 25567 11422 1 16 . 1 1 104 104 ASN C C 104 172.587 172.587 173.730 -1.143 25567 11423 1 16 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.774 -2.305 25567 11424 1 16 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.244 -3.422 25567 11425 1 16 . 1 1 104 104 ASN H H 104 8.517 8.517 8.003 0.514 25567 11426 1 16 . 1 1 105 105 TYR N N 105 122.755 122.755 122.225 0.530 25567 11427 1 16 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.781 -0.206 25567 11428 1 16 . 1 1 105 105 TYR C C 105 174.260 174.260 174.110 0.150 25567 11429 1 16 . 1 1 105 105 TYR CA C 105 55.493 55.493 57.898 -2.405 25567 11430 1 16 . 1 1 105 105 TYR CB C 105 36.064 36.064 40.713 -4.649 25567 11431 1 16 . 1 1 105 105 TYR H H 105 8.287 8.287 7.895 0.392 25567 11432 1 16 . 1 1 106 106 ARG N N 106 128.905 128.905 126.472 2.433 25567 11433 1 16 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.277 -0.004 25567 11434 1 16 . 1 1 106 106 ARG CA C 106 53.021 53.021 54.894 -1.873 25567 11435 1 16 . 1 1 106 106 ARG CB C 106 28.130 28.130 33.642 -5.512 25567 11436 1 16 . 1 1 106 106 ARG H H 106 8.841 8.841 8.414 0.427 25567 11437 1 16 . 1 1 107 107 GLY CA C 107 42.497 42.497 45.312 -2.814 25567 11438 1 16 . 1 1 108 108 GLU N N 108 116.989 116.989 121.040 -4.051 25567 11439 1 16 . 1 1 108 108 GLU HA H 108 4.631 4.631 5.011 -0.380 25567 11440 1 16 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.484 -1.808 25567 11441 1 16 . 1 1 108 108 GLU CB C 108 30.402 30.402 34.274 -3.872 25567 11442 1 16 . 1 1 108 108 GLU H H 108 7.536 7.536 8.440 -0.904 25567 11443 1 16 . 1 1 109 109 VAL N N 109 123.416 123.416 123.394 0.022 25567 11444 1 16 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.252 0.069 25567 11445 1 16 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.240 -2.797 25567 11446 1 16 . 1 1 109 109 VAL CB C 109 32.661 32.661 34.959 -2.298 25567 11447 1 16 . 1 1 109 109 VAL H H 109 8.955 8.955 9.010 -0.055 25567 11448 1 16 . 1 1 110 110 ALA N N 110 127.975 127.975 127.565 0.410 25567 11449 1 16 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.259 -0.582 25567 11450 1 16 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.618 -2.177 25567 11451 1 16 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.131 -3.715 25567 11452 1 16 . 1 1 110 110 ALA H H 110 8.860 8.860 8.046 0.814 25567 11453 1 16 . 1 1 111 111 SER N N 111 110.482 110.482 114.637 -4.155 25567 11454 1 16 . 1 1 111 111 SER HA H 111 5.502 5.502 5.105 0.397 25567 11455 1 16 . 1 1 111 111 SER CA C 111 51.630 51.630 56.916 -5.286 25567 11456 1 16 . 1 1 111 111 SER CB C 111 62.267 62.267 63.531 -1.264 25567 11457 1 16 . 1 1 111 111 SER H H 111 7.484 7.484 8.382 -0.898 25567 11458 1 16 . 1 1 112 112 PHE N N 112 125.082 125.082 121.634 3.448 25567 11459 1 16 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.377 1.071 25567 11460 1 16 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.357 -4.923 25567 11461 1 16 . 1 1 112 112 PHE CB C 112 40.500 40.500 37.603 2.897 25567 11462 1 16 . 1 1 112 112 PHE H H 112 8.025 8.025 7.804 0.221 25567 11463 1 16 . 1 1 113 113 PHE N N 113 115.872 115.872 119.634 -3.762 25567 11464 1 16 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.070 0.854 25567 11465 1 16 . 1 1 113 113 PHE C C 113 173.293 173.293 175.972 -2.679 25567 11466 1 16 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.758 -5.290 25567 11467 1 16 . 1 1 113 113 PHE CB C 113 38.393 38.393 39.169 -0.776 25567 11468 1 16 . 1 1 113 113 PHE H H 113 7.391 7.391 7.907 -0.516 25567 11469 1 16 . 1 1 114 114 THR N N 114 108.721 108.721 108.039 0.682 25567 11470 1 16 . 1 1 114 114 THR HA H 114 4.933 4.933 4.546 0.387 25567 11471 1 16 . 1 1 114 114 THR C C 114 171.891 171.891 173.972 -2.081 25567 11472 1 16 . 1 1 114 114 THR CA C 114 56.815 56.815 61.108 -4.293 25567 11473 1 16 . 1 1 114 114 THR CB C 114 67.899 67.899 70.148 -2.249 25567 11474 1 16 . 1 1 114 114 THR H H 114 7.951 7.951 8.071 -0.120 25567 11475 1 16 . 1 1 115 115 SER N N 115 115.159 115.159 117.325 -2.166 25567 11476 1 16 . 1 1 115 115 SER HA H 115 4.608 4.608 4.637 -0.029 25567 11477 1 16 . 1 1 115 115 SER C C 115 171.403 171.403 172.990 -1.587 25567 11478 1 16 . 1 1 115 115 SER CA C 115 55.570 55.570 58.349 -2.779 25567 11479 1 16 . 1 1 115 115 SER CB C 115 61.418 61.418 65.750 -4.332 25567 11480 1 16 . 1 1 115 115 SER H H 115 8.229 8.229 7.775 0.454 25567 11481 1 16 . 1 1 116 116 ALA N N 116 127.211 127.211 126.769 0.442 25567 11482 1 16 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.642 -0.186 25567 11483 1 16 . 1 1 116 116 ALA C C 116 175.758 175.758 177.341 -1.583 25567 11484 1 16 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.902 -2.086 25567 11485 1 16 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.549 -2.718 25567 11486 1 16 . 1 1 116 116 ALA H H 116 8.813 8.813 8.550 0.263 25567 11487 1 16 . 1 1 117 117 GLY N N 117 108.099 108.099 109.923 -1.824 25567 11488 1 16 . 1 1 117 117 GLY C C 117 171.805 171.805 175.531 -3.726 25567 11489 1 16 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.382 -4.513 25567 11490 1 16 . 1 1 117 117 GLY H H 117 8.685 8.685 8.945 -0.260 25567 11491 1 16 . 1 1 118 118 THR N N 118 111.284 111.284 109.798 1.486 25567 11492 1 16 . 1 1 118 118 THR HA H 118 4.343 4.343 4.332 0.011 25567 11493 1 16 . 1 1 118 118 THR C C 118 171.769 171.769 174.053 -2.284 25567 11494 1 16 . 1 1 118 118 THR CA C 118 58.933 58.933 62.306 -3.373 25567 11495 1 16 . 1 1 118 118 THR CB C 118 67.304 67.304 69.999 -2.695 25567 11496 1 16 . 1 1 118 118 THR H H 118 7.998 7.998 8.057 -0.059 25567 11497 1 16 . 1 1 119 119 ASN N N 119 120.253 120.253 119.368 0.885 25567 11498 1 16 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.878 -0.175 25567 11499 1 16 . 1 1 119 119 ASN C C 119 172.353 172.353 174.310 -1.957 25567 11500 1 16 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.209 -2.981 25567 11501 1 16 . 1 1 119 119 ASN CB C 119 35.376 35.376 39.231 -3.855 25567 11502 1 16 . 1 1 119 119 ASN H H 119 8.381 8.381 8.186 0.195 25567 11503 1 16 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.598 -0.512 25567 11504 1 16 . 1 1 120 120 HIS C C 120 173.395 173.395 176.302 -2.907 25567 11505 1 16 . 1 1 120 120 HIS CA C 120 55.139 55.139 56.932 -1.793 25567 11506 1 16 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.125 -2.703 25567 11507 1 16 . 1 1 121 121 LYS N N 121 119.527 119.527 121.039 -1.512 25567 11508 1 16 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.928 -0.148 25567 11509 1 16 . 1 1 121 121 LYS C C 121 176.053 176.053 177.805 -1.752 25567 11510 1 16 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.820 -1.857 25567 11511 1 16 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.552 -1.892 25567 11512 1 16 . 1 1 121 121 LYS H H 121 8.106 8.106 8.482 -0.376 25567 11513 1 16 . 1 1 122 122 ALA N N 122 121.585 121.585 120.949 0.636 25567 11514 1 16 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.704 0.017 25567 11515 1 16 . 1 1 122 122 ALA C C 122 175.128 175.128 179.090 -3.962 25567 11516 1 16 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.343 -2.752 25567 11517 1 16 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.647 -1.943 25567 11518 1 16 . 1 1 122 122 ALA H H 122 7.702 7.702 7.912 -0.210 25567 11519 1 16 . 1 1 123 123 TYR N N 123 118.803 118.803 119.375 -0.572 25567 11520 1 16 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.937 -0.571 25567 11521 1 16 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.373 -1.282 25567 11522 1 16 . 1 1 123 123 TYR CB C 123 35.102 35.102 37.999 -2.897 25567 11523 1 16 . 1 1 123 123 TYR H H 123 7.366 7.366 7.727 -0.361 25567 11524 1 16 . 1 1 124 124 VAL N N 124 117.530 117.530 117.883 -0.353 25567 11525 1 16 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.567 -0.368 25567 11526 1 16 . 1 1 124 124 VAL C C 124 175.375 175.375 178.324 -2.949 25567 11527 1 16 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.747 -2.164 25567 11528 1 16 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.627 -1.424 25567 11529 1 16 . 1 1 124 124 VAL H H 124 7.757 7.757 7.504 0.253 25567 11530 1 16 . 1 1 125 125 SER N N 125 114.023 114.023 114.142 -0.119 25567 11531 1 16 . 1 1 125 125 SER HA H 125 4.035 4.035 4.124 -0.089 25567 11532 1 16 . 1 1 125 125 SER C C 125 174.636 174.636 176.735 -2.099 25567 11533 1 16 . 1 1 125 125 SER CA C 125 58.885 58.885 61.857 -2.972 25567 11534 1 16 . 1 1 125 125 SER CB C 125 59.666 59.666 62.941 -3.275 25567 11535 1 16 . 1 1 125 125 SER H H 125 7.622 7.622 7.594 0.028 25567 11536 1 16 . 1 1 126 126 HIS N N 126 119.457 119.457 121.098 -1.641 25567 11537 1 16 . 1 1 126 126 HIS HA H 126 4.196 4.196 4.112 0.084 25567 11538 1 16 . 1 1 126 126 HIS C C 126 172.942 172.942 177.576 -4.634 25567 11539 1 16 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.392 -3.474 25567 11540 1 16 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.641 -3.562 25567 11541 1 16 . 1 1 126 126 HIS H H 126 8.067 8.067 8.183 -0.116 25567 11542 1 16 . 1 1 127 127 PHE N N 127 120.628 120.628 119.977 0.651 25567 11543 1 16 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.873 -0.674 25567 11544 1 16 . 1 1 127 127 PHE C C 127 173.515 173.515 176.667 -3.152 25567 11545 1 16 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.619 1.062 25567 11546 1 16 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.674 -2.307 25567 11547 1 16 . 1 1 127 127 PHE H H 127 9.083 9.083 8.455 0.628 25567 11548 1 16 . 1 1 128 128 ASN N N 128 114.858 114.858 115.484 -0.626 25567 11549 1 16 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.176 -0.098 25567 11550 1 16 . 1 1 128 128 ASN C C 128 175.338 175.338 176.160 -0.822 25567 11551 1 16 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.069 -1.819 25567 11552 1 16 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.274 -2.253 25567 11553 1 16 . 1 1 128 128 ASN H H 128 7.858 7.858 7.697 0.161 25567 11554 1 16 . 1 1 129 129 GLU N N 129 119.811 119.811 117.230 2.581 25567 11555 1 16 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.303 -0.262 25567 11556 1 16 . 1 1 129 129 GLU C C 129 176.941 176.941 178.712 -1.771 25567 11557 1 16 . 1 1 129 129 GLU CA C 129 56.632 56.632 57.569 -0.937 25567 11558 1 16 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.750 -2.812 25567 11559 1 16 . 1 1 129 129 GLU H H 129 7.569 7.569 7.526 0.043 25567 11560 1 16 . 1 1 130 130 TRP N N 130 120.585 120.585 119.782 0.803 25567 11561 1 16 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.637 -0.165 25567 11562 1 16 . 1 1 130 130 TRP C C 130 174.262 174.262 176.545 -2.283 25567 11563 1 16 . 1 1 130 130 TRP CA C 130 54.673 54.673 57.576 -2.903 25567 11564 1 16 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.843 -2.887 25567 11565 1 16 . 1 1 130 130 TRP H H 130 7.964 7.964 7.656 0.308 25567 11566 1 16 . 1 1 131 131 ALA N N 131 120.522 120.522 117.994 2.528 25567 11567 1 16 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.473 -0.526 25567 11568 1 16 . 1 1 131 131 ALA C C 131 172.489 172.489 175.610 -3.121 25567 11569 1 16 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.096 -2.516 25567 11570 1 16 . 1 1 131 131 ALA CB C 131 16.539 16.539 18.738 -2.199 25567 11571 1 16 . 1 1 131 131 ALA H H 131 8.114 8.114 7.673 0.441 25567 11572 1 16 . 1 1 132 132 ASP N N 132 117.666 117.666 121.062 -3.396 25567 11573 1 16 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.420 -0.214 25567 11574 1 16 . 1 1 132 132 ASP C C 132 173.779 173.779 176.150 -2.371 25567 11575 1 16 . 1 1 132 132 ASP CA C 132 54.313 54.313 54.526 -0.213 25567 11576 1 16 . 1 1 132 132 ASP CB C 132 39.456 39.456 38.532 0.924 25567 11577 1 16 . 1 1 132 132 ASP H H 132 6.768 6.768 8.198 -1.430 25567 11578 1 16 . 1 1 133 133 GLY N N 133 114.922 114.922 109.427 5.495 25567 11579 1 16 . 1 1 133 133 GLY C C 133 172.101 172.101 174.346 -2.245 25567 11580 1 16 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.461 -2.952 25567 11581 1 16 . 1 1 133 133 GLY H H 133 8.645 8.645 8.055 0.590 25567 11582 1 16 . 1 1 134 134 LEU N N 134 120.101 120.101 120.970 -0.869 25567 11583 1 16 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.714 -0.252 25567 11584 1 16 . 1 1 134 134 LEU C C 134 174.098 174.098 176.342 -2.244 25567 11585 1 16 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.298 -2.214 25567 11586 1 16 . 1 1 134 134 LEU CB C 134 40.509 40.509 43.008 -2.499 25567 11587 1 16 . 1 1 134 134 LEU H H 134 8.049 8.049 7.444 0.605 25567 11588 1 16 . 1 1 135 135 ASN N N 135 119.258 119.258 120.774 -1.516 25567 11589 1 16 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.724 -0.085 25567 11590 1 16 . 1 1 135 135 ASN C C 135 170.564 170.564 174.992 -4.428 25567 11591 1 16 . 1 1 135 135 ASN CA C 135 49.253 49.253 52.579 -3.326 25567 11592 1 16 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.124 -4.506 25567 11593 1 16 . 1 1 135 135 ASN H H 135 8.567 8.567 8.691 -0.124 25567 11594 1 16 . 1 1 136 136 VAL N N 136 125.460 125.460 123.765 1.695 25567 11595 1 16 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.295 0.301 25567 11596 1 16 . 1 1 136 136 VAL C C 136 175.318 175.318 176.199 -0.881 25567 11597 1 16 . 1 1 136 136 VAL CA C 136 58.722 58.722 63.339 -4.617 25567 11598 1 16 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.335 -3.036 25567 11599 1 16 . 1 1 136 136 VAL H H 136 7.660 7.660 7.794 -0.134 25567 11600 1 16 . 1 1 137 137 ILE N N 137 122.021 122.021 123.780 -1.759 25567 11601 1 16 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.717 -0.289 25567 11602 1 16 . 1 1 137 137 ILE C C 137 173.943 173.943 175.487 -1.544 25567 11603 1 16 . 1 1 137 137 ILE CA C 137 58.958 58.958 60.530 -1.572 25567 11604 1 16 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.790 -2.621 25567 11605 1 16 . 1 1 137 137 ILE H H 137 9.151 9.151 8.680 0.471 25567 11606 1 16 . 1 1 138 138 GLY N N 138 108.192 108.192 108.613 -0.421 25567 11607 1 16 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.851 -2.357 25567 11608 1 16 . 1 1 138 138 GLY H H 138 6.675 6.675 7.446 -0.771 25567 11609 1 16 . 1 1 139 139 VAL N N 139 119.673 119.673 119.460 0.213 25567 11610 1 16 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.534 0.786 25567 11611 1 16 . 1 1 139 139 VAL C C 139 172.291 172.291 175.184 -2.893 25567 11612 1 16 . 1 1 139 139 VAL CA C 139 58.209 58.209 62.538 -4.329 25567 11613 1 16 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.256 -0.617 25567 11614 1 16 . 1 1 139 139 VAL H H 139 8.158 8.158 8.671 -0.513 25567 11615 1 16 . 1 1 140 140 ALA N N 140 127.104 127.104 130.190 -3.086 25567 11616 1 16 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.059 -0.463 25567 11617 1 16 . 1 1 140 140 ALA C C 140 171.057 171.057 175.860 -4.803 25567 11618 1 16 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.584 -1.701 25567 11619 1 16 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.371 -0.943 25567 11620 1 16 . 1 1 140 140 ALA H H 140 9.145 9.145 8.695 0.450 25567 11621 1 16 . 1 1 141 141 ARG N N 141 118.828 118.828 120.029 -1.201 25567 11622 1 16 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.846 -1.106 25567 11623 1 16 . 1 1 141 141 ARG C C 141 173.524 173.524 176.377 -2.853 25567 11624 1 16 . 1 1 141 141 ARG CA C 141 51.886 51.886 55.401 -3.514 25567 11625 1 16 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.277 -1.823 25567 11626 1 16 . 1 1 141 141 ARG H H 141 7.759 7.759 8.363 -0.604 25567 11627 1 16 . 1 1 142 142 ASP N N 142 125.557 125.557 119.871 5.686 25567 11628 1 16 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.249 -0.470 25567 11629 1 16 . 1 1 142 142 ASP C C 142 169.292 169.292 175.435 -6.143 25567 11630 1 16 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.934 -2.312 25567 11631 1 16 . 1 1 142 142 ASP CB C 142 37.080 37.080 39.906 -2.826 25567 11632 1 16 . 1 1 142 142 ASP H H 142 9.087 9.087 8.818 0.269 25567 11633 1 16 . 1 1 143 143 ASP N N 143 119.094 119.094 119.740 -0.646 25567 11634 1 16 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.710 -0.456 25567 11635 1 16 . 1 1 143 143 ASP C C 143 175.557 175.557 177.098 -1.541 25567 11636 1 16 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.013 -3.934 25567 11637 1 16 . 1 1 143 143 ASP CB C 143 36.442 36.442 39.898 -3.456 25567 11638 1 16 . 1 1 143 143 ASP H H 143 8.175 8.175 8.547 -0.372 25567 11639 1 16 . 1 1 144 144 SER N N 144 115.438 115.438 115.927 -0.489 25567 11640 1 16 . 1 1 144 144 SER HA H 144 3.745 3.745 4.100 -0.355 25567 11641 1 16 . 1 1 144 144 SER C C 144 172.820 172.820 174.538 -1.718 25567 11642 1 16 . 1 1 144 144 SER CA C 144 59.336 59.336 60.519 -1.183 25567 11643 1 16 . 1 1 144 144 SER CB C 144 60.839 60.839 63.251 -2.412 25567 11644 1 16 . 1 1 144 144 SER H H 144 7.742 7.742 7.700 0.042 25567 11645 1 16 . 1 1 145 145 GLU N N 145 119.631 119.631 117.333 2.298 25567 11646 1 16 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.022 0.297 25567 11647 1 16 . 1 1 145 145 GLU C C 145 171.927 171.927 175.470 -3.543 25567 11648 1 16 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.528 -3.444 25567 11649 1 16 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.649 -2.875 25567 11650 1 16 . 1 1 145 145 GLU H H 145 7.924 7.924 7.711 0.213 25567 11651 1 16 . 1 1 146 146 VAL N N 146 118.791 118.791 120.752 -1.961 25567 11652 1 16 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.624 -0.668 25567 11653 1 16 . 1 1 146 146 VAL C C 146 174.582 174.582 176.866 -2.284 25567 11654 1 16 . 1 1 146 146 VAL CA C 146 64.078 64.078 67.282 -3.204 25567 11655 1 16 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.613 -2.473 25567 11656 1 16 . 1 1 146 146 VAL H H 146 6.393 6.393 6.976 -0.583 25567 11657 1 16 . 1 1 147 147 ASP N N 147 119.410 119.410 115.757 3.653 25567 11658 1 16 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.278 -0.208 25567 11659 1 16 . 1 1 147 147 ASP C C 147 174.774 174.774 177.057 -2.283 25567 11660 1 16 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.946 -2.624 25567 11661 1 16 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.853 -3.649 25567 11662 1 16 . 1 1 147 147 ASP H H 147 8.393 8.393 8.701 -0.308 25567 11663 1 16 . 1 1 148 148 LYS N N 148 119.422 119.422 115.774 3.648 25567 11664 1 16 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.376 -0.425 25567 11665 1 16 . 1 1 148 148 LYS C C 148 176.410 176.410 179.508 -3.098 25567 11666 1 16 . 1 1 148 148 LYS CA C 148 55.736 55.736 57.512 -1.776 25567 11667 1 16 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.499 -2.923 25567 11668 1 16 . 1 1 148 148 LYS H H 148 7.078 7.078 7.359 -0.281 25567 11669 1 16 . 1 1 149 149 TRP N N 149 118.168 118.168 120.621 -2.453 25567 11670 1 16 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.689 -0.088 25567 11671 1 16 . 1 1 149 149 TRP C C 149 174.199 174.199 176.696 -2.497 25567 11672 1 16 . 1 1 149 149 TRP CA C 149 53.795 53.795 58.240 -4.445 25567 11673 1 16 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.463 -1.452 25567 11674 1 16 . 1 1 149 149 TRP H H 149 7.914 7.914 8.307 -0.393 25567 11675 1 16 . 1 1 150 150 SER N N 150 109.636 109.636 111.979 -2.343 25567 11676 1 16 . 1 1 150 150 SER HA H 150 4.242 4.242 4.723 -0.481 25567 11677 1 16 . 1 1 150 150 SER C C 150 170.173 170.173 173.562 -3.389 25567 11678 1 16 . 1 1 150 150 SER CA C 150 56.912 56.912 57.951 -1.039 25567 11679 1 16 . 1 1 150 150 SER CB C 150 62.087 62.087 63.896 -1.809 25567 11680 1 16 . 1 1 150 150 SER H H 150 7.814 7.814 7.924 -0.110 25567 11681 1 17 . 1 1 2 2 MET HA H 2 4.416 4.416 4.837 -0.421 25567 11682 1 17 . 1 1 2 2 MET CA C 2 52.847 52.847 56.255 -3.408 25567 11683 1 17 . 1 1 2 2 MET CB C 2 30.672 30.672 33.365 -2.693 25567 11684 1 17 . 1 1 3 3 ALA N N 3 125.563 125.563 127.701 -2.138 25567 11685 1 17 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.446 -0.074 25567 11686 1 17 . 1 1 3 3 ALA C C 3 174.728 174.728 175.132 -0.404 25567 11687 1 17 . 1 1 3 3 ALA CA C 3 49.348 49.348 51.935 -2.587 25567 11688 1 17 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.494 -3.559 25567 11689 1 17 . 1 1 3 3 ALA H H 3 8.342 8.342 8.093 0.249 25567 11690 1 17 . 1 1 4 4 LYS N N 4 121.767 121.767 123.044 -1.277 25567 11691 1 17 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.391 -0.161 25567 11692 1 17 . 1 1 4 4 LYS C C 4 174.577 174.577 175.904 -1.327 25567 11693 1 17 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.712 -1.723 25567 11694 1 17 . 1 1 4 4 LYS CB C 4 31.555 31.555 33.378 -1.823 25567 11695 1 17 . 1 1 4 4 LYS H H 4 8.500 8.500 8.508 -0.008 25567 11696 1 17 . 1 1 5 5 LYS N N 5 129.654 129.654 122.817 6.837 25567 11697 1 17 . 1 1 5 5 LYS HA H 5 4.526 4.526 5.280 -0.754 25567 11698 1 17 . 1 1 5 5 LYS C C 5 174.731 174.731 176.010 -1.279 25567 11699 1 17 . 1 1 5 5 LYS CA C 5 54.746 54.746 54.521 0.225 25567 11700 1 17 . 1 1 5 5 LYS CB C 5 29.894 29.894 35.977 -6.083 25567 11701 1 17 . 1 1 5 5 LYS H H 5 10.035 10.035 8.353 1.682 25567 11702 1 17 . 1 1 6 6 THR N N 6 126.212 126.212 115.206 11.006 25567 11703 1 17 . 1 1 6 6 THR HA H 6 5.654 5.654 5.272 0.382 25567 11704 1 17 . 1 1 6 6 THR C C 6 169.897 169.897 173.148 -3.251 25567 11705 1 17 . 1 1 6 6 THR CA C 6 60.647 60.647 61.874 -1.227 25567 11706 1 17 . 1 1 6 6 THR CB C 6 68.152 68.152 71.854 -3.702 25567 11707 1 17 . 1 1 6 6 THR H H 6 8.557 8.557 8.322 0.235 25567 11708 1 17 . 1 1 7 7 LEU N N 7 130.776 130.776 125.651 5.125 25567 11709 1 17 . 1 1 7 7 LEU HA H 7 4.619 4.619 5.031 -0.412 25567 11710 1 17 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.039 -2.943 25567 11711 1 17 . 1 1 7 7 LEU CB C 7 41.043 41.043 45.932 -4.889 25567 11712 1 17 . 1 1 7 7 LEU H H 7 8.610 8.610 8.833 -0.223 25567 11713 1 17 . 1 1 8 8 ILE N N 8 127.175 127.175 122.812 4.363 25567 11714 1 17 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.712 0.144 25567 11715 1 17 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.697 -3.305 25567 11716 1 17 . 1 1 8 8 ILE CB C 8 36.864 36.864 39.959 -3.095 25567 11717 1 17 . 1 1 8 8 ILE H H 8 9.263 9.263 8.222 1.041 25567 11718 1 17 . 1 1 9 9 LEU N N 9 127.117 127.117 127.665 -0.548 25567 11719 1 17 . 1 1 9 9 LEU HA H 9 5.696 5.696 4.792 0.904 25567 11720 1 17 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.899 -3.947 25567 11721 1 17 . 1 1 9 9 LEU CB C 9 43.827 43.827 44.335 -0.508 25567 11722 1 17 . 1 1 9 9 LEU H H 9 9.262 9.262 8.538 0.724 25567 11723 1 17 . 1 1 10 10 TYR N N 10 113.544 113.544 125.702 -12.158 25567 11724 1 17 . 1 1 10 10 TYR HA H 10 5.531 5.531 4.849 0.682 25567 11725 1 17 . 1 1 10 10 TYR CA C 10 52.829 52.829 56.323 -3.494 25567 11726 1 17 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.206 -1.591 25567 11727 1 17 . 1 1 10 10 TYR H H 10 7.425 7.425 8.951 -1.526 25567 11728 1 17 . 1 1 11 11 TYR N N 11 121.235 121.235 127.968 -6.733 25567 11729 1 17 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.851 -0.041 25567 11730 1 17 . 1 1 11 11 TYR CA C 11 53.889 53.889 58.150 -4.261 25567 11731 1 17 . 1 1 11 11 TYR CB C 11 40.467 40.467 40.637 -0.170 25567 11732 1 17 . 1 1 11 11 TYR H H 11 7.781 7.781 8.056 -0.275 25567 11733 1 17 . 1 1 14 14 SER CA C 14 54.675 54.675 59.194 -4.519 25567 11734 1 17 . 1 1 14 14 SER CB C 14 61.621 61.621 61.186 0.435 25567 11735 1 17 . 1 1 15 15 GLY N N 15 110.420 110.420 111.318 -0.898 25567 11736 1 17 . 1 1 15 15 GLY CA C 15 43.727 43.727 46.213 -2.486 25567 11737 1 17 . 1 1 15 15 GLY H H 15 7.757 7.757 8.532 -0.775 25567 11738 1 17 . 1 1 17 17 THR HA H 17 4.122 4.122 3.551 0.571 25567 11739 1 17 . 1 1 17 17 THR CA C 17 64.748 64.748 64.898 -0.150 25567 11740 1 17 . 1 1 17 17 THR CB C 17 64.532 64.532 67.932 -3.400 25567 11741 1 17 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.767 -0.849 25567 11742 1 17 . 1 1 18 18 LYS C C 18 173.812 173.812 178.072 -4.260 25567 11743 1 17 . 1 1 18 18 LYS CA C 18 57.003 57.003 60.071 -3.068 25567 11744 1 17 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.281 -2.513 25567 11745 1 17 . 1 1 19 19 LYS N N 19 116.699 116.699 117.532 -0.833 25567 11746 1 17 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.948 -0.000 25567 11747 1 17 . 1 1 19 19 LYS C C 19 177.221 177.221 179.250 -2.029 25567 11748 1 17 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.994 -2.573 25567 11749 1 17 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.586 -1.952 25567 11750 1 17 . 1 1 19 19 LYS H H 19 7.476 7.476 8.000 -0.524 25567 11751 1 17 . 1 1 20 20 MET N N 20 118.946 118.946 120.111 -1.165 25567 11752 1 17 . 1 1 20 20 MET HA H 20 4.474 4.474 4.215 0.259 25567 11753 1 17 . 1 1 20 20 MET C C 20 173.826 173.826 178.245 -4.419 25567 11754 1 17 . 1 1 20 20 MET CA C 20 52.285 52.285 58.495 -6.210 25567 11755 1 17 . 1 1 20 20 MET CB C 20 26.921 26.921 32.400 -5.479 25567 11756 1 17 . 1 1 20 20 MET H H 20 7.457 7.457 7.700 -0.243 25567 11757 1 17 . 1 1 21 21 ALA N N 21 123.375 123.375 122.290 1.085 25567 11758 1 17 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.303 -0.751 25567 11759 1 17 . 1 1 21 21 ALA C C 21 176.542 176.542 179.785 -3.243 25567 11760 1 17 . 1 1 21 21 ALA CA C 21 52.651 52.651 55.748 -3.098 25567 11761 1 17 . 1 1 21 21 ALA CB C 21 16.282 16.282 18.094 -1.812 25567 11762 1 17 . 1 1 21 21 ALA H H 21 8.549 8.549 7.814 0.735 25567 11763 1 17 . 1 1 22 22 GLU N N 22 116.906 116.906 118.112 -1.206 25567 11764 1 17 . 1 1 22 22 GLU HA H 22 3.673 3.673 4.065 -0.392 25567 11765 1 17 . 1 1 22 22 GLU C C 22 176.658 176.658 179.415 -2.757 25567 11766 1 17 . 1 1 22 22 GLU CA C 22 56.605 56.605 58.832 -2.227 25567 11767 1 17 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.426 -2.777 25567 11768 1 17 . 1 1 22 22 GLU H H 22 8.085 8.085 7.924 0.161 25567 11769 1 17 . 1 1 23 23 LYS N N 23 123.301 123.301 120.616 2.685 25567 11770 1 17 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.067 -0.247 25567 11771 1 17 . 1 1 23 23 LYS C C 23 177.363 177.363 179.367 -2.004 25567 11772 1 17 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.295 -2.324 25567 11773 1 17 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.406 -2.875 25567 11774 1 17 . 1 1 23 23 LYS H H 23 7.703 7.703 8.199 -0.496 25567 11775 1 17 . 1 1 24 24 ILE N N 24 121.894 121.894 119.517 2.377 25567 11776 1 17 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.807 -0.511 25567 11777 1 17 . 1 1 24 24 ILE C C 24 174.944 174.944 178.356 -3.412 25567 11778 1 17 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.977 -1.744 25567 11779 1 17 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.582 -2.838 25567 11780 1 17 . 1 1 24 24 ILE H H 24 8.458 8.458 7.865 0.593 25567 11781 1 17 . 1 1 25 25 ASN N N 25 118.580 118.580 118.726 -0.146 25567 11782 1 17 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.350 -0.116 25567 11783 1 17 . 1 1 25 25 ASN C C 25 173.567 173.567 177.528 -3.961 25567 11784 1 17 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.564 -4.240 25567 11785 1 17 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.505 -0.322 25567 11786 1 17 . 1 1 25 25 ASN H H 25 8.273 8.273 8.485 -0.212 25567 11787 1 17 . 1 1 26 26 SER N N 26 112.132 112.132 113.853 -1.721 25567 11788 1 17 . 1 1 26 26 SER HA H 26 4.148 4.148 4.361 -0.213 25567 11789 1 17 . 1 1 26 26 SER C C 26 172.083 172.083 175.111 -3.028 25567 11790 1 17 . 1 1 26 26 SER CA C 26 57.865 57.865 60.195 -2.330 25567 11791 1 17 . 1 1 26 26 SER CB C 26 60.816 60.816 63.377 -2.561 25567 11792 1 17 . 1 1 26 26 SER H H 26 7.444 7.444 8.066 -0.622 25567 11793 1 17 . 1 1 27 27 GLU N N 27 120.080 120.080 119.737 0.343 25567 11794 1 17 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.432 -0.332 25567 11795 1 17 . 1 1 27 27 GLU C C 27 173.647 173.647 177.002 -3.355 25567 11796 1 17 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.325 -2.123 25567 11797 1 17 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.064 -3.180 25567 11798 1 17 . 1 1 27 27 GLU H H 27 7.453 7.453 7.663 -0.210 25567 11799 1 17 . 1 1 28 28 ILE N N 28 118.759 118.759 119.116 -0.357 25567 11800 1 17 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.255 -0.051 25567 11801 1 17 . 1 1 28 28 ILE C C 28 172.474 172.474 174.703 -2.229 25567 11802 1 17 . 1 1 28 28 ILE CA C 28 57.747 57.747 59.928 -2.181 25567 11803 1 17 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.507 -4.708 25567 11804 1 17 . 1 1 28 28 ILE H H 28 7.258 7.258 7.232 0.026 25567 11805 1 17 . 1 1 29 29 LYS N N 29 130.618 130.618 123.592 7.026 25567 11806 1 17 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.428 -0.423 25567 11807 1 17 . 1 1 29 29 LYS C C 29 174.375 174.375 176.692 -2.317 25567 11808 1 17 . 1 1 29 29 LYS CA C 29 55.659 55.659 55.830 -0.171 25567 11809 1 17 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.524 -3.964 25567 11810 1 17 . 1 1 29 29 LYS H H 29 8.588 8.588 8.663 -0.075 25567 11811 1 17 . 1 1 30 30 ASP N N 30 119.366 119.366 122.576 -3.210 25567 11812 1 17 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.407 -0.005 25567 11813 1 17 . 1 1 30 30 ASP C C 30 172.580 172.580 174.678 -2.098 25567 11814 1 17 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.013 -1.389 25567 11815 1 17 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.614 -3.786 25567 11816 1 17 . 1 1 30 30 ASP H H 30 8.940 8.940 8.817 0.123 25567 11817 1 17 . 1 1 31 31 SER N N 31 114.035 114.035 112.665 1.370 25567 11818 1 17 . 1 1 31 31 SER HA H 31 4.781 4.781 4.808 -0.027 25567 11819 1 17 . 1 1 31 31 SER C C 31 171.136 171.136 174.092 -2.956 25567 11820 1 17 . 1 1 31 31 SER CA C 31 55.638 55.638 57.779 -2.141 25567 11821 1 17 . 1 1 31 31 SER CB C 31 62.388 62.388 64.912 -2.524 25567 11822 1 17 . 1 1 31 31 SER H H 31 8.030 8.030 8.093 -0.063 25567 11823 1 17 . 1 1 32 32 GLU N N 32 121.406 121.406 123.098 -1.692 25567 11824 1 17 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.670 0.065 25567 11825 1 17 . 1 1 32 32 GLU C C 32 171.205 171.205 174.273 -3.068 25567 11826 1 17 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.715 -3.647 25567 11827 1 17 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.694 -2.804 25567 11828 1 17 . 1 1 32 32 GLU H H 32 8.188 8.188 8.775 -0.587 25567 11829 1 17 . 1 1 33 33 LEU N N 33 126.143 126.143 122.517 3.626 25567 11830 1 17 . 1 1 33 33 LEU HA H 33 5.285 5.285 4.969 0.316 25567 11831 1 17 . 1 1 33 33 LEU C C 33 173.401 173.401 176.643 -3.242 25567 11832 1 17 . 1 1 33 33 LEU CA C 33 51.334 51.334 54.036 -2.702 25567 11833 1 17 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.688 -1.065 25567 11834 1 17 . 1 1 33 33 LEU H H 33 8.627 8.627 8.511 0.116 25567 11835 1 17 . 1 1 34 34 LYS N N 34 127.122 127.122 121.997 5.125 25567 11836 1 17 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.629 -0.030 25567 11837 1 17 . 1 1 34 34 LYS C C 34 169.644 169.644 174.876 -5.232 25567 11838 1 17 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.864 -2.511 25567 11839 1 17 . 1 1 34 34 LYS CB C 34 34.172 34.172 35.669 -1.497 25567 11840 1 17 . 1 1 34 34 LYS H H 34 9.399 9.399 8.513 0.886 25567 11841 1 17 . 1 1 35 35 GLU N N 35 122.766 122.766 118.718 4.048 25567 11842 1 17 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.638 -1.280 25567 11843 1 17 . 1 1 35 35 GLU C C 35 172.875 172.875 174.758 -1.883 25567 11844 1 17 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.436 -2.796 25567 11845 1 17 . 1 1 35 35 GLU CB C 35 29.268 29.268 32.557 -3.289 25567 11846 1 17 . 1 1 35 35 GLU H H 35 8.166 8.166 8.469 -0.303 25567 11847 1 17 . 1 1 36 36 VAL N N 36 126.674 126.674 120.833 5.841 25567 11848 1 17 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.742 -0.881 25567 11849 1 17 . 1 1 36 36 VAL C C 36 171.451 171.451 174.685 -3.234 25567 11850 1 17 . 1 1 36 36 VAL CA C 36 59.537 59.537 60.184 -0.648 25567 11851 1 17 . 1 1 36 36 VAL CB C 36 29.689 29.689 34.971 -5.282 25567 11852 1 17 . 1 1 36 36 VAL H H 36 8.632 8.632 8.732 -0.100 25567 11853 1 17 . 1 1 37 37 LYS N N 37 126.181 126.181 127.209 -1.028 25567 11854 1 17 . 1 1 37 37 LYS HA H 37 4.939 4.939 5.151 -0.212 25567 11855 1 17 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.456 -2.277 25567 11856 1 17 . 1 1 37 37 LYS CB C 37 32.898 32.898 35.241 -2.343 25567 11857 1 17 . 1 1 37 37 LYS H H 37 7.867 7.867 8.462 -0.595 25567 11858 1 17 . 1 1 38 38 VAL N N 38 113.540 113.540 113.042 0.498 25567 11859 1 17 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.747 -0.061 25567 11860 1 17 . 1 1 38 38 VAL C C 38 173.633 173.633 175.870 -2.237 25567 11861 1 17 . 1 1 38 38 VAL CA C 38 57.284 57.284 59.620 -2.336 25567 11862 1 17 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.504 -1.540 25567 11863 1 17 . 1 1 38 38 VAL H H 38 8.389 8.389 8.439 -0.050 25567 11864 1 17 . 1 1 39 39 SER N N 39 118.860 118.860 114.258 4.602 25567 11865 1 17 . 1 1 39 39 SER HA H 39 4.194 4.194 4.601 -0.406 25567 11866 1 17 . 1 1 39 39 SER C C 39 173.059 173.059 173.713 -0.654 25567 11867 1 17 . 1 1 39 39 SER CA C 39 56.227 56.227 58.252 -2.025 25567 11868 1 17 . 1 1 39 39 SER CB C 39 60.771 60.771 64.038 -3.267 25567 11869 1 17 . 1 1 39 39 SER H H 39 8.668 8.668 8.592 0.076 25567 11870 1 17 . 1 1 40 40 GLU N N 40 125.769 125.769 122.399 3.370 25567 11871 1 17 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.578 -0.421 25567 11872 1 17 . 1 1 40 40 GLU C C 40 174.484 174.484 175.711 -1.227 25567 11873 1 17 . 1 1 40 40 GLU CA C 40 55.550 55.550 55.169 0.382 25567 11874 1 17 . 1 1 40 40 GLU CB C 40 27.054 27.054 31.015 -3.961 25567 11875 1 17 . 1 1 40 40 GLU H H 40 8.878 8.878 8.439 0.439 25567 11876 1 17 . 1 1 41 41 GLY N N 41 112.165 112.165 109.004 3.161 25567 11877 1 17 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.547 -2.840 25567 11878 1 17 . 1 1 41 41 GLY H H 41 8.743 8.743 8.633 0.110 25567 11879 1 17 . 1 1 44 44 ASP N N 44 122.324 122.324 120.036 2.288 25567 11880 1 17 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.474 1.682 25567 11881 1 17 . 1 1 44 44 ASP H H 44 7.918 7.918 7.725 0.193 25567 11882 1 17 . 1 1 45 45 ALA HA H 45 4.062 4.062 3.873 0.189 25567 11883 1 17 . 1 1 45 45 ALA CA C 45 51.410 51.410 53.244 -1.834 25567 11884 1 17 . 1 1 45 45 ALA CB C 45 16.376 16.376 18.356 -1.980 25567 11885 1 17 . 1 1 47 47 MET CA C 47 54.118 54.118 54.593 -0.475 25567 11886 1 17 . 1 1 47 47 MET CB C 47 27.527 27.527 34.530 -7.003 25567 11887 1 17 . 1 1 48 48 TYR N N 48 120.075 120.075 118.977 1.098 25567 11888 1 17 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.540 -0.386 25567 11889 1 17 . 1 1 48 48 TYR C C 48 172.217 172.217 176.730 -4.513 25567 11890 1 17 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.650 -2.273 25567 11891 1 17 . 1 1 48 48 TYR CB C 48 34.496 34.496 39.024 -4.528 25567 11892 1 17 . 1 1 48 48 TYR H H 48 7.810 7.810 8.670 -0.860 25567 11893 1 17 . 1 1 49 49 LYS N N 49 118.369 118.369 120.357 -1.988 25567 11894 1 17 . 1 1 49 49 LYS H H 49 8.116 8.116 8.679 -0.563 25567 11895 1 17 . 1 1 50 50 THR N N 50 116.979 116.979 113.205 3.774 25567 11896 1 17 . 1 1 50 50 THR CB C 50 66.373 66.373 70.369 -3.996 25567 11897 1 17 . 1 1 50 50 THR H H 50 7.741 7.741 7.899 -0.158 25567 11898 1 17 . 1 1 51 51 SER N N 51 116.155 116.155 116.294 -0.139 25567 11899 1 17 . 1 1 51 51 SER HA H 51 3.771 3.771 4.877 -1.106 25567 11900 1 17 . 1 1 51 51 SER C C 51 170.563 170.563 173.600 -3.037 25567 11901 1 17 . 1 1 51 51 SER CA C 51 54.840 54.840 57.491 -2.651 25567 11902 1 17 . 1 1 51 51 SER CB C 51 60.318 60.318 63.795 -3.477 25567 11903 1 17 . 1 1 51 51 SER H H 51 7.853 7.853 8.379 -0.526 25567 11904 1 17 . 1 1 54 54 ALA N N 54 123.234 123.234 121.778 1.456 25567 11905 1 17 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.080 0.168 25567 11906 1 17 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.647 -1.379 25567 11907 1 17 . 1 1 54 54 ALA CB C 54 16.434 16.434 18.398 -1.964 25567 11908 1 17 . 1 1 54 54 ALA H H 54 8.207 8.207 7.661 0.546 25567 11909 1 17 . 1 1 55 55 LEU N N 55 118.603 118.603 118.011 0.592 25567 11910 1 17 . 1 1 55 55 LEU HA H 55 3.940 3.940 3.969 -0.029 25567 11911 1 17 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.542 -0.831 25567 11912 1 17 . 1 1 55 55 LEU CB C 55 38.913 38.913 41.869 -2.956 25567 11913 1 17 . 1 1 55 55 LEU H H 55 7.960 7.960 8.864 -0.904 25567 11914 1 17 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.144 -0.468 25567 11915 1 17 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.270 0.224 25567 11916 1 17 . 1 1 58 58 ILE CB C 58 36.054 36.054 38.507 -2.453 25567 11917 1 17 . 1 1 59 59 GLN N N 59 117.579 117.579 119.865 -2.286 25567 11918 1 17 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.485 -0.352 25567 11919 1 17 . 1 1 59 59 GLN CA C 59 54.009 54.009 54.848 -0.839 25567 11920 1 17 . 1 1 59 59 GLN CB C 59 26.651 26.651 30.951 -4.300 25567 11921 1 17 . 1 1 59 59 GLN H H 59 8.268 8.268 8.207 0.061 25567 11922 1 17 . 1 1 60 60 GLY N N 60 107.308 107.308 110.488 -3.180 25567 11923 1 17 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.724 -2.745 25567 11924 1 17 . 1 1 60 60 GLY H H 60 7.780 7.780 8.717 -0.937 25567 11925 1 17 . 1 1 61 61 ASN N N 61 117.747 117.747 118.555 -0.808 25567 11926 1 17 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.886 -0.352 25567 11927 1 17 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.845 -1.610 25567 11928 1 17 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.891 -3.467 25567 11929 1 17 . 1 1 61 61 ASN H H 61 8.108 8.108 8.179 -0.071 25567 11930 1 17 . 1 1 64 64 PHE N N 64 120.102 120.102 121.235 -1.133 25567 11931 1 17 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.534 -0.155 25567 11932 1 17 . 1 1 64 64 PHE CA C 64 51.748 51.748 56.895 -5.147 25567 11933 1 17 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.960 -3.685 25567 11934 1 17 . 1 1 64 64 PHE H H 64 8.300 8.300 8.114 0.186 25567 11935 1 17 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.477 -0.142 25567 11936 1 17 . 1 1 65 65 PRO C C 65 173.870 173.870 175.774 -1.904 25567 11937 1 17 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.867 -2.850 25567 11938 1 17 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.748 -3.113 25567 11939 1 17 . 1 1 66 66 GLU N N 66 121.258 121.258 117.482 3.776 25567 11940 1 17 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.497 -0.263 25567 11941 1 17 . 1 1 66 66 GLU C C 66 173.981 173.981 176.422 -2.441 25567 11942 1 17 . 1 1 66 66 GLU CA C 66 53.787 53.787 55.424 -1.637 25567 11943 1 17 . 1 1 66 66 GLU CB C 66 27.775 27.775 32.108 -4.333 25567 11944 1 17 . 1 1 66 66 GLU H H 66 8.316 8.316 8.410 -0.094 25567 11945 1 17 . 1 1 67 67 ILE N N 67 114.290 114.290 114.363 -0.073 25567 11946 1 17 . 1 1 67 67 ILE HA H 67 5.129 5.129 5.024 0.105 25567 11947 1 17 . 1 1 67 67 ILE C C 67 172.700 172.700 175.512 -2.812 25567 11948 1 17 . 1 1 67 67 ILE CA C 67 56.439 56.439 58.966 -2.527 25567 11949 1 17 . 1 1 67 67 ILE CB C 67 39.159 39.159 41.150 -1.991 25567 11950 1 17 . 1 1 67 67 ILE H H 67 8.366 8.366 8.262 0.104 25567 11951 1 17 . 1 1 68 68 GLN N N 68 121.422 121.422 119.282 2.140 25567 11952 1 17 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.705 -0.204 25567 11953 1 17 . 1 1 68 68 GLN C C 68 171.675 171.675 173.935 -2.260 25567 11954 1 17 . 1 1 68 68 GLN CA C 68 52.273 52.273 55.176 -2.903 25567 11955 1 17 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.009 -5.866 25567 11956 1 17 . 1 1 68 68 GLN H H 68 8.737 8.737 8.417 0.320 25567 11957 1 17 . 1 1 69 69 LEU N N 69 125.311 125.311 117.913 7.398 25567 11958 1 17 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.989 -0.483 25567 11959 1 17 . 1 1 69 69 LEU C C 69 172.634 172.634 175.335 -2.701 25567 11960 1 17 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.978 -2.219 25567 11961 1 17 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.518 -1.114 25567 11962 1 17 . 1 1 69 69 LEU H H 69 8.051 8.051 8.292 -0.241 25567 11963 1 17 . 1 1 70 70 ASP N N 70 122.763 122.763 119.457 3.306 25567 11964 1 17 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.691 -0.268 25567 11965 1 17 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.785 -2.175 25567 11966 1 17 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.497 -3.780 25567 11967 1 17 . 1 1 70 70 ASP H H 70 8.313 8.313 8.642 -0.329 25567 11968 1 17 . 1 1 71 71 ASN N N 71 117.413 117.413 118.489 -1.076 25567 11969 1 17 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.642 -0.305 25567 11970 1 17 . 1 1 71 71 ASN C C 71 171.770 171.770 174.482 -2.712 25567 11971 1 17 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.853 -2.362 25567 11972 1 17 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.599 -2.273 25567 11973 1 17 . 1 1 71 71 ASN H H 71 8.407 8.407 8.546 -0.139 25567 11974 1 17 . 1 1 72 72 ILE N N 72 123.752 123.752 123.102 0.650 25567 11975 1 17 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.249 -0.309 25567 11976 1 17 . 1 1 72 72 ILE C C 72 171.621 171.621 174.528 -2.907 25567 11977 1 17 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.437 -3.105 25567 11978 1 17 . 1 1 72 72 ILE CB C 72 38.489 38.489 40.719 -2.230 25567 11979 1 17 . 1 1 72 72 ILE H H 72 7.639 7.639 7.533 0.106 25567 11980 1 17 . 1 1 73 73 ASP N N 73 125.252 125.252 125.611 -0.359 25567 11981 1 17 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.708 -0.083 25567 11982 1 17 . 1 1 73 73 ASP C C 73 174.034 174.034 176.055 -2.021 25567 11983 1 17 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.984 -3.781 25567 11984 1 17 . 1 1 73 73 ASP CB C 73 37.024 37.024 41.337 -4.314 25567 11985 1 17 . 1 1 73 73 ASP H H 73 8.394 8.394 8.502 -0.108 25567 11986 1 17 . 1 1 74 74 TYR N N 74 123.108 123.108 124.213 -1.105 25567 11987 1 17 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.395 -0.517 25567 11988 1 17 . 1 1 74 74 TYR C C 74 173.637 173.637 177.870 -4.233 25567 11989 1 17 . 1 1 74 74 TYR CA C 74 59.474 59.474 60.266 -0.792 25567 11990 1 17 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.009 -3.287 25567 11991 1 17 . 1 1 74 74 TYR H H 74 7.392 7.392 8.328 -0.936 25567 11992 1 17 . 1 1 75 75 ASN N N 75 109.422 109.422 116.567 -7.145 25567 11993 1 17 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.464 0.462 25567 11994 1 17 . 1 1 75 75 ASN C C 75 172.574 172.574 176.275 -3.701 25567 11995 1 17 . 1 1 75 75 ASN CA C 75 52.761 52.761 56.062 -3.300 25567 11996 1 17 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.266 -2.649 25567 11997 1 17 . 1 1 75 75 ASN H H 75 8.058 8.058 8.421 -0.363 25567 11998 1 17 . 1 1 76 76 ASN N N 76 117.422 117.422 115.170 2.252 25567 11999 1 17 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.583 -0.128 25567 12000 1 17 . 1 1 76 76 ASN C C 76 171.132 171.132 173.783 -2.651 25567 12001 1 17 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.322 -2.155 25567 12002 1 17 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.792 -3.064 25567 12003 1 17 . 1 1 76 76 ASN H H 76 7.768 7.768 7.918 -0.150 25567 12004 1 17 . 1 1 77 77 TYR N N 77 116.873 116.873 118.267 -1.394 25567 12005 1 17 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.744 -0.381 25567 12006 1 17 . 1 1 77 77 TYR C C 77 172.175 172.175 174.938 -2.763 25567 12007 1 17 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.325 -1.961 25567 12008 1 17 . 1 1 77 77 TYR CB C 77 37.165 37.165 39.865 -2.700 25567 12009 1 17 . 1 1 77 77 TYR H H 77 7.825 7.825 7.865 -0.040 25567 12010 1 17 . 1 1 78 78 ASP N N 78 121.271 121.271 123.799 -2.528 25567 12011 1 17 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.879 -0.074 25567 12012 1 17 . 1 1 78 78 ASP C C 78 172.641 172.641 175.512 -2.871 25567 12013 1 17 . 1 1 78 78 ASP CA C 78 53.255 53.255 55.904 -2.649 25567 12014 1 17 . 1 1 78 78 ASP CB C 78 41.075 41.075 41.960 -0.885 25567 12015 1 17 . 1 1 78 78 ASP H H 78 9.058 9.058 8.940 0.118 25567 12016 1 17 . 1 1 79 79 LEU N N 79 122.985 122.985 118.113 4.872 25567 12017 1 17 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.003 0.111 25567 12018 1 17 . 1 1 79 79 LEU C C 79 170.721 170.721 174.512 -3.791 25567 12019 1 17 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.235 -2.919 25567 12020 1 17 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.424 -3.082 25567 12021 1 17 . 1 1 79 79 LEU H H 79 7.893 7.893 7.675 0.218 25567 12022 1 17 . 1 1 80 80 ILE N N 80 126.364 126.364 125.331 1.033 25567 12023 1 17 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.586 0.503 25567 12024 1 17 . 1 1 80 80 ILE C C 80 171.580 171.580 174.054 -2.474 25567 12025 1 17 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.856 -3.439 25567 12026 1 17 . 1 1 80 80 ILE CB C 80 38.136 38.136 39.913 -1.778 25567 12027 1 17 . 1 1 80 80 ILE H H 80 8.717 8.717 9.113 -0.396 25567 12028 1 17 . 1 1 81 81 LEU N N 81 126.199 126.199 127.797 -1.598 25567 12029 1 17 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.388 -0.253 25567 12030 1 17 . 1 1 81 81 LEU C C 81 172.979 172.979 175.698 -2.719 25567 12031 1 17 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.169 -3.535 25567 12032 1 17 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.906 -3.747 25567 12033 1 17 . 1 1 81 81 LEU H H 81 9.230 9.230 8.904 0.326 25567 12034 1 17 . 1 1 82 82 ILE N N 82 120.505 120.505 118.080 2.425 25567 12035 1 17 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.149 -0.233 25567 12036 1 17 . 1 1 82 82 ILE C C 82 173.011 173.011 174.288 -1.277 25567 12037 1 17 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.434 -2.606 25567 12038 1 17 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.665 -4.597 25567 12039 1 17 . 1 1 82 82 ILE H H 82 8.796 8.796 8.004 0.792 25567 12040 1 17 . 1 1 83 83 GLY N N 83 120.857 120.857 109.116 11.741 25567 12041 1 17 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.319 -2.516 25567 12042 1 17 . 1 1 83 83 GLY H H 83 9.525 9.525 7.568 1.957 25567 12043 1 17 . 1 1 84 84 SER N N 84 116.007 116.007 113.636 2.371 25567 12044 1 17 . 1 1 84 84 SER HA H 84 5.476 5.476 5.107 0.369 25567 12045 1 17 . 1 1 84 84 SER CA C 84 51.937 51.937 55.101 -3.164 25567 12046 1 17 . 1 1 84 84 SER CB C 84 64.533 64.533 65.437 -0.904 25567 12047 1 17 . 1 1 84 84 SER H H 84 7.617 7.617 8.274 -0.657 25567 12048 1 17 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.663 0.538 25567 12049 1 17 . 1 1 85 85 PRO C C 85 173.574 173.574 175.507 -1.933 25567 12050 1 17 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.629 -3.141 25567 12051 1 17 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.558 -1.418 25567 12052 1 17 . 1 1 86 86 VAL N N 86 117.603 117.603 118.329 -0.726 25567 12053 1 17 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.423 -0.050 25567 12054 1 17 . 1 1 86 86 VAL C C 86 172.777 172.777 174.605 -1.828 25567 12055 1 17 . 1 1 86 86 VAL CA C 86 59.603 59.603 62.542 -2.939 25567 12056 1 17 . 1 1 86 86 VAL CB C 86 29.573 29.573 33.252 -3.679 25567 12057 1 17 . 1 1 86 86 VAL H H 86 8.194 8.194 8.311 -0.117 25567 12058 1 17 . 1 1 87 87 TRP N N 87 131.187 131.187 127.469 3.718 25567 12059 1 17 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.777 0.421 25567 12060 1 17 . 1 1 87 87 TRP C C 87 173.295 173.295 174.561 -1.266 25567 12061 1 17 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.914 -7.130 25567 12062 1 17 . 1 1 87 87 TRP CB C 87 27.746 27.746 32.001 -4.255 25567 12063 1 17 . 1 1 87 87 TRP H H 87 9.637 9.637 8.391 1.246 25567 12064 1 17 . 1 1 88 88 SER N N 88 119.829 119.829 113.465 6.364 25567 12065 1 17 . 1 1 88 88 SER HA H 88 3.986 3.986 4.820 -0.834 25567 12066 1 17 . 1 1 88 88 SER C C 88 172.375 172.375 174.486 -2.111 25567 12067 1 17 . 1 1 88 88 SER CA C 88 55.932 55.932 57.902 -1.970 25567 12068 1 17 . 1 1 88 88 SER CB C 88 59.178 59.178 63.604 -4.426 25567 12069 1 17 . 1 1 88 88 SER H H 88 9.272 9.272 7.595 1.677 25567 12070 1 17 . 1 1 89 89 GLY N N 89 101.498 101.498 111.208 -9.710 25567 12071 1 17 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.948 -4.277 25567 12072 1 17 . 1 1 89 89 GLY H H 89 7.463 7.463 8.521 -1.058 25567 12073 1 17 . 1 1 90 90 TYR N N 90 121.064 121.064 112.770 8.294 25567 12074 1 17 . 1 1 90 90 TYR HA H 90 4.216 4.216 4.692 -0.476 25567 12075 1 17 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.135 -0.045 25567 12076 1 17 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.333 0.862 25567 12077 1 17 . 1 1 90 90 TYR H H 90 8.064 8.064 7.953 0.111 25567 12078 1 17 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.454 0.478 25567 12079 1 17 . 1 1 91 91 PRO C C 91 171.019 171.019 175.916 -4.897 25567 12080 1 17 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.942 -4.948 25567 12081 1 17 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.529 -6.036 25567 12082 1 17 . 1 1 92 92 ALA N N 92 119.893 119.893 120.134 -0.241 25567 12083 1 17 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.669 -1.218 25567 12084 1 17 . 1 1 92 92 ALA C C 92 176.477 176.477 175.772 0.705 25567 12085 1 17 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.242 -1.675 25567 12086 1 17 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.251 -5.450 25567 12087 1 17 . 1 1 92 92 ALA H H 92 7.278 7.278 7.853 -0.575 25567 12088 1 17 . 1 1 93 93 THR N N 93 112.992 112.992 110.412 2.580 25567 12089 1 17 . 1 1 93 93 THR HA H 93 4.462 4.462 5.014 -0.552 25567 12090 1 17 . 1 1 93 93 THR CA C 93 66.871 66.871 60.026 6.845 25567 12091 1 17 . 1 1 93 93 THR CB C 93 64.362 64.362 68.845 -4.483 25567 12092 1 17 . 1 1 93 93 THR H H 93 6.861 6.861 8.291 -1.431 25567 12093 1 17 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.476 -0.610 25567 12094 1 17 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.674 -0.653 25567 12095 1 17 . 1 1 94 94 PRO CB C 94 29.279 29.279 32.218 -2.939 25567 12096 1 17 . 1 1 95 95 ILE N N 95 111.298 111.298 119.914 -8.616 25567 12097 1 17 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.432 -0.809 25567 12098 1 17 . 1 1 95 95 ILE C C 95 174.264 174.264 175.501 -1.237 25567 12099 1 17 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.103 -1.655 25567 12100 1 17 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.305 -4.376 25567 12101 1 17 . 1 1 95 95 ILE H H 95 7.974 7.974 8.201 -0.227 25567 12102 1 17 . 1 1 96 96 LYS N N 96 123.045 123.045 120.433 2.612 25567 12103 1 17 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.573 -1.461 25567 12104 1 17 . 1 1 96 96 LYS C C 96 174.590 174.590 177.656 -3.066 25567 12105 1 17 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.470 -0.325 25567 12106 1 17 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.756 -4.911 25567 12107 1 17 . 1 1 96 96 LYS H H 96 6.958 6.958 8.050 -1.092 25567 12108 1 17 . 1 1 97 97 THR N N 97 113.412 113.412 116.107 -2.695 25567 12109 1 17 . 1 1 97 97 THR HA H 97 3.461 3.461 3.986 -0.525 25567 12110 1 17 . 1 1 97 97 THR C C 97 173.247 173.247 176.923 -3.676 25567 12111 1 17 . 1 1 97 97 THR CA C 97 62.809 62.809 65.924 -3.115 25567 12112 1 17 . 1 1 97 97 THR CB C 97 65.654 65.654 68.446 -2.792 25567 12113 1 17 . 1 1 97 97 THR H H 97 6.366 6.366 8.167 -1.801 25567 12114 1 17 . 1 1 98 98 LEU N N 98 121.201 121.201 122.370 -1.169 25567 12115 1 17 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.020 -0.386 25567 12116 1 17 . 1 1 98 98 LEU C C 98 174.590 174.590 178.125 -3.535 25567 12117 1 17 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.812 -2.191 25567 12118 1 17 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.140 -1.245 25567 12119 1 17 . 1 1 98 98 LEU H H 98 7.554 7.554 8.163 -0.609 25567 12120 1 17 . 1 1 99 99 LEU N N 99 118.677 118.677 115.974 2.703 25567 12121 1 17 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.832 -0.130 25567 12122 1 17 . 1 1 99 99 LEU C C 99 177.457 177.457 178.098 -0.641 25567 12123 1 17 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.383 -2.204 25567 12124 1 17 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.364 -2.377 25567 12125 1 17 . 1 1 99 99 LEU H H 99 8.160 8.160 7.585 0.575 25567 12126 1 17 . 1 1 100 100 ASP N N 100 118.914 118.914 115.852 3.062 25567 12127 1 17 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.445 -0.216 25567 12128 1 17 . 1 1 100 100 ASP C C 100 176.585 176.585 178.963 -2.378 25567 12129 1 17 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.364 -1.849 25567 12130 1 17 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.107 -3.528 25567 12131 1 17 . 1 1 100 100 ASP H H 100 7.872 7.872 7.598 0.274 25567 12132 1 17 . 1 1 101 101 GLN N N 101 118.135 118.135 118.879 -0.744 25567 12133 1 17 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.291 -0.131 25567 12134 1 17 . 1 1 101 101 GLN C C 101 174.601 174.601 177.857 -3.256 25567 12135 1 17 . 1 1 101 101 GLN CA C 101 54.960 54.960 57.641 -2.681 25567 12136 1 17 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.320 -3.770 25567 12137 1 17 . 1 1 101 101 GLN H H 101 7.673 7.673 7.865 -0.192 25567 12138 1 17 . 1 1 102 102 MET N N 102 118.420 118.420 117.330 1.090 25567 12139 1 17 . 1 1 102 102 MET HA H 102 3.826 3.826 4.380 -0.554 25567 12140 1 17 . 1 1 102 102 MET C C 102 172.780 172.780 176.648 -3.868 25567 12141 1 17 . 1 1 102 102 MET CA C 102 53.428 53.428 56.674 -3.246 25567 12142 1 17 . 1 1 102 102 MET CB C 102 31.221 31.221 31.557 -0.336 25567 12143 1 17 . 1 1 102 102 MET H H 102 7.462 7.462 7.781 -0.319 25567 12144 1 17 . 1 1 103 103 LYS N N 103 116.066 116.066 119.300 -3.234 25567 12145 1 17 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.265 -0.345 25567 12146 1 17 . 1 1 103 103 LYS C C 103 173.922 173.922 177.106 -3.184 25567 12147 1 17 . 1 1 103 103 LYS CA C 103 56.282 56.282 57.979 -1.697 25567 12148 1 17 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.384 -1.893 25567 12149 1 17 . 1 1 103 103 LYS H H 103 6.875 6.875 7.761 -0.886 25567 12150 1 17 . 1 1 104 104 ASN N N 104 114.987 114.987 116.373 -1.386 25567 12151 1 17 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.885 -0.144 25567 12152 1 17 . 1 1 104 104 ASN C C 104 172.587 172.587 174.756 -2.169 25567 12153 1 17 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.420 -1.951 25567 12154 1 17 . 1 1 104 104 ASN CB C 104 35.822 35.822 40.101 -4.279 25567 12155 1 17 . 1 1 104 104 ASN H H 104 8.517 8.517 8.079 0.438 25567 12156 1 17 . 1 1 105 105 TYR N N 105 122.755 122.755 120.312 2.443 25567 12157 1 17 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.447 0.128 25567 12158 1 17 . 1 1 105 105 TYR C C 105 174.260 174.260 175.482 -1.222 25567 12159 1 17 . 1 1 105 105 TYR CA C 105 55.493 55.493 58.736 -3.243 25567 12160 1 17 . 1 1 105 105 TYR CB C 105 36.064 36.064 38.552 -2.488 25567 12161 1 17 . 1 1 105 105 TYR H H 105 8.287 8.287 8.169 0.118 25567 12162 1 17 . 1 1 106 106 ARG N N 106 128.905 128.905 125.342 3.563 25567 12163 1 17 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.452 -0.179 25567 12164 1 17 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.590 -2.569 25567 12165 1 17 . 1 1 106 106 ARG CB C 106 28.130 28.130 30.457 -2.327 25567 12166 1 17 . 1 1 106 106 ARG H H 106 8.841 8.841 9.150 -0.309 25567 12167 1 17 . 1 1 107 107 GLY CA C 107 42.497 42.497 45.666 -3.169 25567 12168 1 17 . 1 1 108 108 GLU N N 108 116.989 116.989 118.173 -1.184 25567 12169 1 17 . 1 1 108 108 GLU HA H 108 4.631 4.631 5.073 -0.442 25567 12170 1 17 . 1 1 108 108 GLU CA C 108 53.676 53.676 54.849 -1.173 25567 12171 1 17 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.998 -3.596 25567 12172 1 17 . 1 1 108 108 GLU H H 108 7.536 7.536 8.366 -0.830 25567 12173 1 17 . 1 1 109 109 VAL N N 109 123.416 123.416 118.864 4.552 25567 12174 1 17 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.239 0.082 25567 12175 1 17 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.393 -2.950 25567 12176 1 17 . 1 1 109 109 VAL CB C 109 32.661 32.661 36.021 -3.360 25567 12177 1 17 . 1 1 109 109 VAL H H 109 8.955 8.955 8.719 0.236 25567 12178 1 17 . 1 1 110 110 ALA N N 110 127.975 127.975 126.213 1.762 25567 12179 1 17 . 1 1 110 110 ALA HA H 110 4.677 4.677 4.943 -0.266 25567 12180 1 17 . 1 1 110 110 ALA CA C 110 47.441 47.441 50.687 -3.246 25567 12181 1 17 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.062 -3.646 25567 12182 1 17 . 1 1 110 110 ALA H H 110 8.860 8.860 8.042 0.818 25567 12183 1 17 . 1 1 111 111 SER N N 111 110.482 110.482 115.443 -4.961 25567 12184 1 17 . 1 1 111 111 SER HA H 111 5.502 5.502 5.133 0.369 25567 12185 1 17 . 1 1 111 111 SER CA C 111 51.630 51.630 57.245 -5.615 25567 12186 1 17 . 1 1 111 111 SER CB C 111 62.267 62.267 63.751 -1.484 25567 12187 1 17 . 1 1 111 111 SER H H 111 7.484 7.484 8.014 -0.530 25567 12188 1 17 . 1 1 112 112 PHE N N 112 125.082 125.082 124.915 0.167 25567 12189 1 17 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.227 1.221 25567 12190 1 17 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.023 -4.589 25567 12191 1 17 . 1 1 112 112 PHE CB C 112 40.500 40.500 39.314 1.186 25567 12192 1 17 . 1 1 112 112 PHE H H 112 8.025 8.025 8.907 -0.882 25567 12193 1 17 . 1 1 113 113 PHE N N 113 115.872 115.872 120.883 -5.011 25567 12194 1 17 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.166 0.758 25567 12195 1 17 . 1 1 113 113 PHE C C 113 173.293 173.293 175.344 -2.051 25567 12196 1 17 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.483 -5.016 25567 12197 1 17 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.252 -2.859 25567 12198 1 17 . 1 1 113 113 PHE H H 113 7.391 7.391 7.200 0.191 25567 12199 1 17 . 1 1 114 114 THR N N 114 108.721 108.721 109.372 -0.651 25567 12200 1 17 . 1 1 114 114 THR HA H 114 4.933 4.933 4.546 0.387 25567 12201 1 17 . 1 1 114 114 THR C C 114 171.891 171.891 174.808 -2.917 25567 12202 1 17 . 1 1 114 114 THR CA C 114 56.815 56.815 61.322 -4.507 25567 12203 1 17 . 1 1 114 114 THR CB C 114 67.899 67.899 69.868 -1.969 25567 12204 1 17 . 1 1 114 114 THR H H 114 7.951 7.951 8.772 -0.821 25567 12205 1 17 . 1 1 115 115 SER N N 115 115.159 115.159 117.655 -2.496 25567 12206 1 17 . 1 1 115 115 SER HA H 115 4.608 4.608 4.712 -0.104 25567 12207 1 17 . 1 1 115 115 SER C C 115 171.403 171.403 173.166 -1.763 25567 12208 1 17 . 1 1 115 115 SER CA C 115 55.570 55.570 58.029 -2.459 25567 12209 1 17 . 1 1 115 115 SER CB C 115 61.418 61.418 64.912 -3.494 25567 12210 1 17 . 1 1 115 115 SER H H 115 8.229 8.229 8.063 0.166 25567 12211 1 17 . 1 1 116 116 ALA N N 116 127.211 127.211 126.660 0.551 25567 12212 1 17 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.808 -0.352 25567 12213 1 17 . 1 1 116 116 ALA C C 116 175.758 175.758 177.572 -1.814 25567 12214 1 17 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.398 -2.582 25567 12215 1 17 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.813 -2.982 25567 12216 1 17 . 1 1 116 116 ALA H H 116 8.813 8.813 8.515 0.298 25567 12217 1 17 . 1 1 117 117 GLY N N 117 108.099 108.099 107.325 0.774 25567 12218 1 17 . 1 1 117 117 GLY C C 117 171.805 171.805 175.494 -3.689 25567 12219 1 17 . 1 1 117 117 GLY CA C 117 42.869 42.869 46.588 -3.719 25567 12220 1 17 . 1 1 117 117 GLY H H 117 8.685 8.685 8.763 -0.078 25567 12221 1 17 . 1 1 118 118 THR N N 118 111.284 111.284 109.760 1.524 25567 12222 1 17 . 1 1 118 118 THR HA H 118 4.343 4.343 4.282 0.061 25567 12223 1 17 . 1 1 118 118 THR C C 118 171.769 171.769 173.451 -1.682 25567 12224 1 17 . 1 1 118 118 THR CA C 118 58.933 58.933 61.696 -2.763 25567 12225 1 17 . 1 1 118 118 THR CB C 118 67.304 67.304 70.008 -2.704 25567 12226 1 17 . 1 1 118 118 THR H H 118 7.998 7.998 7.901 0.097 25567 12227 1 17 . 1 1 119 119 ASN N N 119 120.253 120.253 119.824 0.429 25567 12228 1 17 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.883 -0.180 25567 12229 1 17 . 1 1 119 119 ASN C C 119 172.353 172.353 174.433 -2.080 25567 12230 1 17 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.632 -3.404 25567 12231 1 17 . 1 1 119 119 ASN CB C 119 35.376 35.376 39.473 -4.097 25567 12232 1 17 . 1 1 119 119 ASN H H 119 8.381 8.381 7.851 0.530 25567 12233 1 17 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.547 -0.461 25567 12234 1 17 . 1 1 120 120 HIS C C 120 173.395 173.395 176.444 -3.049 25567 12235 1 17 . 1 1 120 120 HIS CA C 120 55.139 55.139 56.583 -1.444 25567 12236 1 17 . 1 1 120 120 HIS CB C 120 28.422 28.422 30.992 -2.570 25567 12237 1 17 . 1 1 121 121 LYS N N 121 119.527 119.527 121.348 -1.821 25567 12238 1 17 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.839 -0.059 25567 12239 1 17 . 1 1 121 121 LYS C C 121 176.053 176.053 177.884 -1.831 25567 12240 1 17 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.121 -2.158 25567 12241 1 17 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.748 -2.088 25567 12242 1 17 . 1 1 121 121 LYS H H 121 8.106 8.106 8.654 -0.548 25567 12243 1 17 . 1 1 122 122 ALA N N 122 121.585 121.585 121.562 0.023 25567 12244 1 17 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.939 -0.218 25567 12245 1 17 . 1 1 122 122 ALA C C 122 175.128 175.128 178.910 -3.782 25567 12246 1 17 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.469 -2.878 25567 12247 1 17 . 1 1 122 122 ALA CB C 122 15.704 15.704 18.054 -2.350 25567 12248 1 17 . 1 1 122 122 ALA H H 122 7.702 7.702 8.073 -0.371 25567 12249 1 17 . 1 1 123 123 TYR N N 123 118.803 118.803 119.316 -0.513 25567 12250 1 17 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.163 -0.797 25567 12251 1 17 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.108 -1.017 25567 12252 1 17 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.267 -3.165 25567 12253 1 17 . 1 1 123 123 TYR H H 123 7.366 7.366 7.760 -0.394 25567 12254 1 17 . 1 1 124 124 VAL N N 124 117.530 117.530 116.868 0.662 25567 12255 1 17 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.546 -0.347 25567 12256 1 17 . 1 1 124 124 VAL C C 124 175.375 175.375 177.853 -2.478 25567 12257 1 17 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.627 -2.044 25567 12258 1 17 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.751 -1.548 25567 12259 1 17 . 1 1 124 124 VAL H H 124 7.757 7.757 7.551 0.206 25567 12260 1 17 . 1 1 125 125 SER N N 125 114.023 114.023 115.252 -1.229 25567 12261 1 17 . 1 1 125 125 SER HA H 125 4.035 4.035 4.125 -0.090 25567 12262 1 17 . 1 1 125 125 SER C C 125 174.636 174.636 176.278 -1.642 25567 12263 1 17 . 1 1 125 125 SER CA C 125 58.885 58.885 61.660 -2.775 25567 12264 1 17 . 1 1 125 125 SER CB C 125 59.666 59.666 62.822 -3.156 25567 12265 1 17 . 1 1 125 125 SER H H 125 7.622 7.622 7.664 -0.042 25567 12266 1 17 . 1 1 126 126 HIS N N 126 119.457 119.457 122.546 -3.089 25567 12267 1 17 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.964 0.232 25567 12268 1 17 . 1 1 126 126 HIS C C 126 172.942 172.942 177.189 -4.247 25567 12269 1 17 . 1 1 126 126 HIS CA C 126 54.918 54.918 59.632 -4.714 25567 12270 1 17 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.594 -3.515 25567 12271 1 17 . 1 1 126 126 HIS H H 126 8.067 8.067 7.823 0.244 25567 12272 1 17 . 1 1 127 127 PHE N N 127 120.628 120.628 117.386 3.242 25567 12273 1 17 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.585 -0.386 25567 12274 1 17 . 1 1 127 127 PHE C C 127 173.515 173.515 176.538 -3.023 25567 12275 1 17 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.440 1.241 25567 12276 1 17 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.674 -2.307 25567 12277 1 17 . 1 1 127 127 PHE H H 127 9.083 9.083 7.964 1.119 25567 12278 1 17 . 1 1 128 128 ASN N N 128 114.858 114.858 117.379 -2.521 25567 12279 1 17 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.194 -0.116 25567 12280 1 17 . 1 1 128 128 ASN C C 128 175.338 175.338 177.866 -2.528 25567 12281 1 17 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.311 -2.061 25567 12282 1 17 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.408 -2.387 25567 12283 1 17 . 1 1 128 128 ASN H H 128 7.858 7.858 7.576 0.282 25567 12284 1 17 . 1 1 129 129 GLU N N 129 119.811 119.811 119.527 0.284 25567 12285 1 17 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.107 -0.066 25567 12286 1 17 . 1 1 129 129 GLU C C 129 176.941 176.941 177.561 -0.620 25567 12287 1 17 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.879 -2.247 25567 12288 1 17 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.793 -2.855 25567 12289 1 17 . 1 1 129 129 GLU H H 129 7.569 7.569 8.433 -0.864 25567 12290 1 17 . 1 1 130 130 TRP N N 130 120.585 120.585 115.481 5.104 25567 12291 1 17 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.670 -0.198 25567 12292 1 17 . 1 1 130 130 TRP C C 130 174.262 174.262 174.929 -0.667 25567 12293 1 17 . 1 1 130 130 TRP CA C 130 54.673 54.673 55.697 -1.024 25567 12294 1 17 . 1 1 130 130 TRP CB C 130 26.956 26.956 30.178 -3.222 25567 12295 1 17 . 1 1 130 130 TRP H H 130 7.964 7.964 7.345 0.619 25567 12296 1 17 . 1 1 131 131 ALA N N 131 120.522 120.522 118.837 1.685 25567 12297 1 17 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.218 -0.271 25567 12298 1 17 . 1 1 131 131 ALA C C 131 172.489 172.489 176.081 -3.592 25567 12299 1 17 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.876 -3.296 25567 12300 1 17 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.222 -2.683 25567 12301 1 17 . 1 1 131 131 ALA H H 131 8.114 8.114 7.125 0.989 25567 12302 1 17 . 1 1 132 132 ASP N N 132 117.666 117.666 120.506 -2.840 25567 12303 1 17 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.391 -0.185 25567 12304 1 17 . 1 1 132 132 ASP C C 132 173.779 173.779 176.245 -2.466 25567 12305 1 17 . 1 1 132 132 ASP CA C 132 54.313 54.313 54.389 -0.076 25567 12306 1 17 . 1 1 132 132 ASP CB C 132 39.456 39.456 38.915 0.541 25567 12307 1 17 . 1 1 132 132 ASP H H 132 6.768 6.768 8.175 -1.407 25567 12308 1 17 . 1 1 133 133 GLY N N 133 114.922 114.922 108.951 5.971 25567 12309 1 17 . 1 1 133 133 GLY C C 133 172.101 172.101 174.506 -2.405 25567 12310 1 17 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.057 -2.548 25567 12311 1 17 . 1 1 133 133 GLY H H 133 8.645 8.645 7.983 0.662 25567 12312 1 17 . 1 1 134 134 LEU N N 134 120.101 120.101 121.660 -1.559 25567 12313 1 17 . 1 1 134 134 LEU HA H 134 4.462 4.462 3.998 0.464 25567 12314 1 17 . 1 1 134 134 LEU C C 134 174.098 174.098 176.518 -2.420 25567 12315 1 17 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.795 -2.711 25567 12316 1 17 . 1 1 134 134 LEU CB C 134 40.509 40.509 41.914 -1.405 25567 12317 1 17 . 1 1 134 134 LEU H H 134 8.049 8.049 7.313 0.736 25567 12318 1 17 . 1 1 135 135 ASN N N 135 119.258 119.258 119.973 -0.715 25567 12319 1 17 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.705 -0.066 25567 12320 1 17 . 1 1 135 135 ASN C C 135 170.564 170.564 174.478 -3.914 25567 12321 1 17 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.103 -3.850 25567 12322 1 17 . 1 1 135 135 ASN CB C 135 33.618 33.618 37.655 -4.037 25567 12323 1 17 . 1 1 135 135 ASN H H 135 8.567 8.567 8.613 -0.046 25567 12324 1 17 . 1 1 136 136 VAL N N 136 125.460 125.460 123.245 2.215 25567 12325 1 17 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.575 0.021 25567 12326 1 17 . 1 1 136 136 VAL C C 136 175.318 175.318 176.494 -1.176 25567 12327 1 17 . 1 1 136 136 VAL CA C 136 58.722 58.722 63.099 -4.377 25567 12328 1 17 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.271 -2.972 25567 12329 1 17 . 1 1 136 136 VAL H H 136 7.660 7.660 8.058 -0.398 25567 12330 1 17 . 1 1 137 137 ILE N N 137 122.021 122.021 122.554 -0.533 25567 12331 1 17 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.733 -0.305 25567 12332 1 17 . 1 1 137 137 ILE C C 137 173.943 173.943 175.016 -1.073 25567 12333 1 17 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.898 -0.940 25567 12334 1 17 . 1 1 137 137 ILE CB C 137 36.169 36.169 39.162 -2.993 25567 12335 1 17 . 1 1 137 137 ILE H H 137 9.151 9.151 8.687 0.464 25567 12336 1 17 . 1 1 138 138 GLY N N 138 108.192 108.192 109.486 -1.294 25567 12337 1 17 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.547 -2.053 25567 12338 1 17 . 1 1 138 138 GLY H H 138 6.675 6.675 7.576 -0.901 25567 12339 1 17 . 1 1 139 139 VAL N N 139 119.673 119.673 122.018 -2.345 25567 12340 1 17 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.511 0.809 25567 12341 1 17 . 1 1 139 139 VAL C C 139 172.291 172.291 175.479 -3.188 25567 12342 1 17 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.984 -3.775 25567 12343 1 17 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.299 -0.660 25567 12344 1 17 . 1 1 139 139 VAL H H 139 8.158 8.158 8.675 -0.517 25567 12345 1 17 . 1 1 140 140 ALA N N 140 127.104 127.104 129.495 -2.391 25567 12346 1 17 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.056 -0.460 25567 12347 1 17 . 1 1 140 140 ALA C C 140 171.057 171.057 175.208 -4.151 25567 12348 1 17 . 1 1 140 140 ALA CA C 140 48.883 48.883 51.117 -2.234 25567 12349 1 17 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.493 -1.065 25567 12350 1 17 . 1 1 140 140 ALA H H 140 9.145 9.145 8.376 0.769 25567 12351 1 17 . 1 1 141 141 ARG N N 141 118.828 118.828 121.296 -2.468 25567 12352 1 17 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.177 -1.437 25567 12353 1 17 . 1 1 141 141 ARG C C 141 173.524 173.524 176.400 -2.876 25567 12354 1 17 . 1 1 141 141 ARG CA C 141 51.886 51.886 55.745 -3.858 25567 12355 1 17 . 1 1 141 141 ARG CB C 141 28.454 28.454 31.013 -2.559 25567 12356 1 17 . 1 1 141 141 ARG H H 141 7.759 7.759 8.621 -0.862 25567 12357 1 17 . 1 1 142 142 ASP N N 142 125.557 125.557 124.930 0.627 25567 12358 1 17 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.371 -0.592 25567 12359 1 17 . 1 1 142 142 ASP C C 142 169.292 169.292 176.449 -7.157 25567 12360 1 17 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.835 -2.213 25567 12361 1 17 . 1 1 142 142 ASP CB C 142 37.080 37.080 41.004 -3.924 25567 12362 1 17 . 1 1 142 142 ASP H H 142 9.087 9.087 8.035 1.052 25567 12363 1 17 . 1 1 143 143 ASP N N 143 119.094 119.094 118.437 0.657 25567 12364 1 17 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.424 -0.170 25567 12365 1 17 . 1 1 143 143 ASP C C 143 175.557 175.557 177.108 -1.551 25567 12366 1 17 . 1 1 143 143 ASP CA C 143 49.079 49.079 55.010 -5.931 25567 12367 1 17 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.173 -3.731 25567 12368 1 17 . 1 1 143 143 ASP H H 143 8.175 8.175 8.757 -0.582 25567 12369 1 17 . 1 1 144 144 SER N N 144 115.438 115.438 115.378 0.060 25567 12370 1 17 . 1 1 144 144 SER HA H 144 3.745 3.745 4.168 -0.423 25567 12371 1 17 . 1 1 144 144 SER C C 144 172.820 172.820 174.637 -1.817 25567 12372 1 17 . 1 1 144 144 SER CA C 144 59.336 59.336 60.378 -1.042 25567 12373 1 17 . 1 1 144 144 SER CB C 144 60.839 60.839 63.045 -2.206 25567 12374 1 17 . 1 1 144 144 SER H H 144 7.742 7.742 8.251 -0.509 25567 12375 1 17 . 1 1 145 145 GLU N N 145 119.631 119.631 118.035 1.596 25567 12376 1 17 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.132 0.187 25567 12377 1 17 . 1 1 145 145 GLU C C 145 171.927 171.927 176.174 -4.247 25567 12378 1 17 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.339 -3.255 25567 12379 1 17 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.964 -3.190 25567 12380 1 17 . 1 1 145 145 GLU H H 145 7.924 7.924 7.715 0.209 25567 12381 1 17 . 1 1 146 146 VAL N N 146 118.791 118.791 121.961 -3.170 25567 12382 1 17 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.325 -0.369 25567 12383 1 17 . 1 1 146 146 VAL C C 146 174.582 174.582 177.026 -2.444 25567 12384 1 17 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.749 -2.671 25567 12385 1 17 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.372 -2.232 25567 12386 1 17 . 1 1 146 146 VAL H H 146 6.393 6.393 7.972 -1.579 25567 12387 1 17 . 1 1 147 147 ASP N N 147 119.410 119.410 118.503 0.907 25567 12388 1 17 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.300 -0.230 25567 12389 1 17 . 1 1 147 147 ASP C C 147 174.774 174.774 176.549 -1.775 25567 12390 1 17 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.620 -2.298 25567 12391 1 17 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.611 -3.407 25567 12392 1 17 . 1 1 147 147 ASP H H 147 8.393 8.393 8.566 -0.173 25567 12393 1 17 . 1 1 148 148 LYS N N 148 119.422 119.422 116.031 3.391 25567 12394 1 17 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.405 -0.454 25567 12395 1 17 . 1 1 148 148 LYS C C 148 176.410 176.410 177.008 -0.598 25567 12396 1 17 . 1 1 148 148 LYS CA C 148 55.736 55.736 56.302 -0.566 25567 12397 1 17 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.491 -2.915 25567 12398 1 17 . 1 1 148 148 LYS H H 148 7.078 7.078 7.278 -0.200 25567 12399 1 17 . 1 1 149 149 TRP N N 149 118.168 118.168 121.224 -3.056 25567 12400 1 17 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.939 -0.338 25567 12401 1 17 . 1 1 149 149 TRP C C 149 174.199 174.199 175.869 -1.670 25567 12402 1 17 . 1 1 149 149 TRP CA C 149 53.795 53.795 54.969 -1.174 25567 12403 1 17 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.087 -1.076 25567 12404 1 17 . 1 1 149 149 TRP H H 149 7.914 7.914 7.751 0.163 25567 12405 1 17 . 1 1 150 150 SER N N 150 109.636 109.636 113.071 -3.435 25567 12406 1 17 . 1 1 150 150 SER HA H 150 4.242 4.242 4.557 -0.315 25567 12407 1 17 . 1 1 150 150 SER C C 150 170.173 170.173 174.835 -4.662 25567 12408 1 17 . 1 1 150 150 SER CA C 150 56.912 56.912 58.470 -1.558 25567 12409 1 17 . 1 1 150 150 SER CB C 150 62.087 62.087 64.252 -2.165 25567 12410 1 17 . 1 1 150 150 SER H H 150 7.814 7.814 7.873 -0.059 25567 12411 1 18 . 1 1 2 2 MET HA H 2 4.416 4.416 4.850 -0.434 25567 12412 1 18 . 1 1 2 2 MET CA C 2 52.847 52.847 55.202 -2.355 25567 12413 1 18 . 1 1 2 2 MET CB C 2 30.672 30.672 35.035 -4.363 25567 12414 1 18 . 1 1 3 3 ALA N N 3 125.563 125.563 127.577 -2.014 25567 12415 1 18 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.642 -0.270 25567 12416 1 18 . 1 1 3 3 ALA C C 3 174.728 174.728 176.052 -1.324 25567 12417 1 18 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.152 -2.804 25567 12418 1 18 . 1 1 3 3 ALA CB C 3 16.935 16.935 19.910 -2.975 25567 12419 1 18 . 1 1 3 3 ALA H H 3 8.342 8.342 8.631 -0.289 25567 12420 1 18 . 1 1 4 4 LYS N N 4 121.767 121.767 124.840 -3.073 25567 12421 1 18 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.508 -0.278 25567 12422 1 18 . 1 1 4 4 LYS C C 4 174.577 174.577 175.539 -0.962 25567 12423 1 18 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.064 -1.075 25567 12424 1 18 . 1 1 4 4 LYS CB C 4 31.555 31.555 31.483 0.072 25567 12425 1 18 . 1 1 4 4 LYS H H 4 8.500 8.500 8.410 0.090 25567 12426 1 18 . 1 1 5 5 LYS N N 5 129.654 129.654 122.429 7.225 25567 12427 1 18 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.385 0.141 25567 12428 1 18 . 1 1 5 5 LYS C C 5 174.731 174.731 177.119 -2.388 25567 12429 1 18 . 1 1 5 5 LYS CA C 5 54.746 54.746 56.039 -1.293 25567 12430 1 18 . 1 1 5 5 LYS CB C 5 29.894 29.894 32.997 -3.103 25567 12431 1 18 . 1 1 5 5 LYS H H 5 10.035 10.035 7.773 2.262 25567 12432 1 18 . 1 1 6 6 THR N N 6 126.212 126.212 113.972 12.240 25567 12433 1 18 . 1 1 6 6 THR HA H 6 5.654 5.654 5.212 0.442 25567 12434 1 18 . 1 1 6 6 THR C C 6 169.897 169.897 173.124 -3.227 25567 12435 1 18 . 1 1 6 6 THR CA C 6 60.647 60.647 62.085 -1.438 25567 12436 1 18 . 1 1 6 6 THR CB C 6 68.152 68.152 72.322 -4.170 25567 12437 1 18 . 1 1 6 6 THR H H 6 8.557 8.557 8.237 0.320 25567 12438 1 18 . 1 1 7 7 LEU N N 7 130.776 130.776 125.673 5.103 25567 12439 1 18 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.900 -0.281 25567 12440 1 18 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.863 -3.767 25567 12441 1 18 . 1 1 7 7 LEU CB C 7 41.043 41.043 46.340 -5.297 25567 12442 1 18 . 1 1 7 7 LEU H H 7 8.610 8.610 9.089 -0.479 25567 12443 1 18 . 1 1 8 8 ILE N N 8 127.175 127.175 126.105 1.070 25567 12444 1 18 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.661 0.195 25567 12445 1 18 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.697 -3.305 25567 12446 1 18 . 1 1 8 8 ILE CB C 8 36.864 36.864 38.880 -2.016 25567 12447 1 18 . 1 1 8 8 ILE H H 8 9.263 9.263 8.339 0.924 25567 12448 1 18 . 1 1 9 9 LEU N N 9 127.117 127.117 129.089 -1.972 25567 12449 1 18 . 1 1 9 9 LEU HA H 9 5.696 5.696 4.977 0.719 25567 12450 1 18 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.722 -3.770 25567 12451 1 18 . 1 1 9 9 LEU CB C 9 43.827 43.827 42.373 1.454 25567 12452 1 18 . 1 1 9 9 LEU H H 9 9.262 9.262 8.465 0.797 25567 12453 1 18 . 1 1 10 10 TYR N N 10 113.544 113.544 121.736 -8.192 25567 12454 1 18 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.110 0.421 25567 12455 1 18 . 1 1 10 10 TYR CA C 10 52.829 52.829 54.684 -1.855 25567 12456 1 18 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.375 -1.760 25567 12457 1 18 . 1 1 10 10 TYR H H 10 7.425 7.425 8.364 -0.939 25567 12458 1 18 . 1 1 11 11 TYR N N 11 121.235 121.235 121.744 -0.509 25567 12459 1 18 . 1 1 11 11 TYR HA H 11 4.810 4.810 5.206 -0.396 25567 12460 1 18 . 1 1 11 11 TYR CA C 11 53.889 53.889 58.037 -4.148 25567 12461 1 18 . 1 1 11 11 TYR CB C 11 40.467 40.467 40.481 -0.014 25567 12462 1 18 . 1 1 11 11 TYR H H 11 7.781 7.781 8.119 -0.338 25567 12463 1 18 . 1 1 14 14 SER CA C 14 54.675 54.675 57.176 -2.501 25567 12464 1 18 . 1 1 14 14 SER CB C 14 61.621 61.621 65.753 -4.132 25567 12465 1 18 . 1 1 15 15 GLY N N 15 110.420 110.420 108.360 2.060 25567 12466 1 18 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.977 -2.249 25567 12467 1 18 . 1 1 15 15 GLY H H 15 7.757 7.757 8.787 -1.030 25567 12468 1 18 . 1 1 17 17 THR HA H 17 4.122 4.122 3.824 0.298 25567 12469 1 18 . 1 1 17 17 THR CA C 17 64.748 64.748 64.856 -0.108 25567 12470 1 18 . 1 1 17 17 THR CB C 17 64.532 64.532 67.947 -3.415 25567 12471 1 18 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.309 -0.391 25567 12472 1 18 . 1 1 18 18 LYS C C 18 173.812 173.812 177.907 -4.095 25567 12473 1 18 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.898 -2.894 25567 12474 1 18 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.029 -2.261 25567 12475 1 18 . 1 1 19 19 LYS N N 19 116.699 116.699 117.489 -0.790 25567 12476 1 18 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.942 0.006 25567 12477 1 18 . 1 1 19 19 LYS C C 19 177.221 177.221 179.084 -1.863 25567 12478 1 18 . 1 1 19 19 LYS CA C 19 56.421 56.421 59.384 -2.963 25567 12479 1 18 . 1 1 19 19 LYS CB C 19 29.634 29.634 32.147 -2.513 25567 12480 1 18 . 1 1 19 19 LYS H H 19 7.476 7.476 7.442 0.034 25567 12481 1 18 . 1 1 20 20 MET N N 20 118.946 118.946 118.551 0.395 25567 12482 1 18 . 1 1 20 20 MET HA H 20 4.474 4.474 4.146 0.328 25567 12483 1 18 . 1 1 20 20 MET C C 20 173.826 173.826 178.262 -4.436 25567 12484 1 18 . 1 1 20 20 MET CA C 20 52.285 52.285 58.597 -6.312 25567 12485 1 18 . 1 1 20 20 MET CB C 20 26.921 26.921 32.459 -5.538 25567 12486 1 18 . 1 1 20 20 MET H H 20 7.457 7.457 7.725 -0.268 25567 12487 1 18 . 1 1 21 21 ALA N N 21 123.375 123.375 121.476 1.899 25567 12488 1 18 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.068 -0.516 25567 12489 1 18 . 1 1 21 21 ALA C C 21 176.542 176.542 179.519 -2.977 25567 12490 1 18 . 1 1 21 21 ALA CA C 21 52.651 52.651 55.446 -2.795 25567 12491 1 18 . 1 1 21 21 ALA CB C 21 16.282 16.282 18.133 -1.851 25567 12492 1 18 . 1 1 21 21 ALA H H 21 8.549 8.549 8.059 0.490 25567 12493 1 18 . 1 1 22 22 GLU N N 22 116.906 116.906 118.075 -1.169 25567 12494 1 18 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.955 -0.282 25567 12495 1 18 . 1 1 22 22 GLU C C 22 176.658 176.658 179.190 -2.532 25567 12496 1 18 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.213 -2.608 25567 12497 1 18 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.502 -2.853 25567 12498 1 18 . 1 1 22 22 GLU H H 22 8.085 8.085 8.349 -0.264 25567 12499 1 18 . 1 1 23 23 LYS N N 23 123.301 123.301 120.036 3.265 25567 12500 1 18 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.026 -0.206 25567 12501 1 18 . 1 1 23 23 LYS C C 23 177.363 177.363 179.310 -1.947 25567 12502 1 18 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.258 -2.287 25567 12503 1 18 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.330 -2.799 25567 12504 1 18 . 1 1 23 23 LYS H H 23 7.703 7.703 7.431 0.272 25567 12505 1 18 . 1 1 24 24 ILE N N 24 121.894 121.894 119.091 2.803 25567 12506 1 18 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.575 -0.279 25567 12507 1 18 . 1 1 24 24 ILE C C 24 174.944 174.944 177.906 -2.962 25567 12508 1 18 . 1 1 24 24 ILE CA C 24 63.233 63.233 65.334 -2.101 25567 12509 1 18 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.425 -2.682 25567 12510 1 18 . 1 1 24 24 ILE H H 24 8.458 8.458 7.613 0.845 25567 12511 1 18 . 1 1 25 25 ASN N N 25 118.580 118.580 118.290 0.290 25567 12512 1 18 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.408 -0.174 25567 12513 1 18 . 1 1 25 25 ASN C C 25 173.567 173.567 177.776 -4.209 25567 12514 1 18 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.171 -3.847 25567 12515 1 18 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.503 -0.320 25567 12516 1 18 . 1 1 25 25 ASN H H 25 8.273 8.273 8.107 0.166 25567 12517 1 18 . 1 1 26 26 SER N N 26 112.132 112.132 114.176 -2.044 25567 12518 1 18 . 1 1 26 26 SER HA H 26 4.148 4.148 4.480 -0.332 25567 12519 1 18 . 1 1 26 26 SER C C 26 172.083 172.083 175.218 -3.135 25567 12520 1 18 . 1 1 26 26 SER CA C 26 57.865 57.865 60.191 -2.326 25567 12521 1 18 . 1 1 26 26 SER CB C 26 60.816 60.816 63.083 -2.267 25567 12522 1 18 . 1 1 26 26 SER H H 26 7.444 7.444 8.042 -0.598 25567 12523 1 18 . 1 1 27 27 GLU N N 27 120.080 120.080 120.011 0.069 25567 12524 1 18 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.412 -0.312 25567 12525 1 18 . 1 1 27 27 GLU C C 27 173.647 173.647 175.650 -2.003 25567 12526 1 18 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.648 -2.446 25567 12527 1 18 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.770 -3.886 25567 12528 1 18 . 1 1 27 27 GLU H H 27 7.453 7.453 7.592 -0.139 25567 12529 1 18 . 1 1 28 28 ILE N N 28 118.759 118.759 117.925 0.834 25567 12530 1 18 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.324 -0.120 25567 12531 1 18 . 1 1 28 28 ILE C C 28 172.474 172.474 174.923 -2.449 25567 12532 1 18 . 1 1 28 28 ILE CA C 28 57.747 57.747 59.596 -1.849 25567 12533 1 18 . 1 1 28 28 ILE CB C 28 35.798 35.798 41.245 -5.447 25567 12534 1 18 . 1 1 28 28 ILE H H 28 7.258 7.258 7.193 0.065 25567 12535 1 18 . 1 1 29 29 LYS N N 29 130.618 130.618 124.058 6.560 25567 12536 1 18 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.357 -0.352 25567 12537 1 18 . 1 1 29 29 LYS C C 29 174.375 174.375 176.507 -2.132 25567 12538 1 18 . 1 1 29 29 LYS CA C 29 55.659 55.659 56.491 -0.832 25567 12539 1 18 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.558 -3.998 25567 12540 1 18 . 1 1 29 29 LYS H H 29 8.588 8.588 8.767 -0.179 25567 12541 1 18 . 1 1 30 30 ASP N N 30 119.366 119.366 120.502 -1.136 25567 12542 1 18 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.385 0.017 25567 12543 1 18 . 1 1 30 30 ASP C C 30 172.580 172.580 175.180 -2.600 25567 12544 1 18 . 1 1 30 30 ASP CA C 30 53.624 53.624 54.921 -1.297 25567 12545 1 18 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.691 -3.863 25567 12546 1 18 . 1 1 30 30 ASP H H 30 8.940 8.940 8.784 0.156 25567 12547 1 18 . 1 1 31 31 SER N N 31 114.035 114.035 114.199 -0.164 25567 12548 1 18 . 1 1 31 31 SER HA H 31 4.781 4.781 5.061 -0.280 25567 12549 1 18 . 1 1 31 31 SER C C 31 171.136 171.136 174.548 -3.412 25567 12550 1 18 . 1 1 31 31 SER CA C 31 55.638 55.638 58.254 -2.616 25567 12551 1 18 . 1 1 31 31 SER CB C 31 62.388 62.388 65.141 -2.753 25567 12552 1 18 . 1 1 31 31 SER H H 31 8.030 8.030 8.147 -0.117 25567 12553 1 18 . 1 1 32 32 GLU N N 32 121.406 121.406 120.833 0.573 25567 12554 1 18 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.774 -0.039 25567 12555 1 18 . 1 1 32 32 GLU C C 32 171.205 171.205 174.941 -3.736 25567 12556 1 18 . 1 1 32 32 GLU CA C 32 52.069 52.069 54.811 -2.742 25567 12557 1 18 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.703 -2.813 25567 12558 1 18 . 1 1 32 32 GLU H H 32 8.188 8.188 8.423 -0.235 25567 12559 1 18 . 1 1 33 33 LEU N N 33 126.143 126.143 116.993 9.150 25567 12560 1 18 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.422 -0.137 25567 12561 1 18 . 1 1 33 33 LEU C C 33 173.401 173.401 175.768 -2.367 25567 12562 1 18 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.394 -2.060 25567 12563 1 18 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.476 -0.853 25567 12564 1 18 . 1 1 33 33 LEU H H 33 8.627 8.627 8.389 0.238 25567 12565 1 18 . 1 1 34 34 LYS N N 34 127.122 127.122 124.377 2.745 25567 12566 1 18 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.698 -0.099 25567 12567 1 18 . 1 1 34 34 LYS C C 34 169.644 169.644 174.233 -4.589 25567 12568 1 18 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.043 -1.690 25567 12569 1 18 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.141 -2.969 25567 12570 1 18 . 1 1 34 34 LYS H H 34 9.399 9.399 9.194 0.205 25567 12571 1 18 . 1 1 35 35 GLU N N 35 122.766 122.766 121.842 0.924 25567 12572 1 18 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.479 -1.121 25567 12573 1 18 . 1 1 35 35 GLU C C 35 172.875 172.875 175.691 -2.816 25567 12574 1 18 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.083 -2.443 25567 12575 1 18 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.123 -1.855 25567 12576 1 18 . 1 1 35 35 GLU H H 35 8.166 8.166 8.486 -0.320 25567 12577 1 18 . 1 1 36 36 VAL N N 36 126.674 126.674 125.120 1.554 25567 12578 1 18 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.138 -0.277 25567 12579 1 18 . 1 1 36 36 VAL C C 36 171.451 171.451 175.405 -3.954 25567 12580 1 18 . 1 1 36 36 VAL CA C 36 59.537 59.537 62.241 -2.704 25567 12581 1 18 . 1 1 36 36 VAL CB C 36 29.689 29.689 31.695 -2.006 25567 12582 1 18 . 1 1 36 36 VAL H H 36 8.632 8.632 8.619 0.013 25567 12583 1 18 . 1 1 37 37 LYS N N 37 126.181 126.181 123.162 3.019 25567 12584 1 18 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.787 0.152 25567 12585 1 18 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.617 -2.438 25567 12586 1 18 . 1 1 37 37 LYS CB C 37 32.898 32.898 35.040 -2.142 25567 12587 1 18 . 1 1 37 37 LYS H H 37 7.867 7.867 8.623 -0.756 25567 12588 1 18 . 1 1 38 38 VAL N N 38 113.540 113.540 115.305 -1.765 25567 12589 1 18 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.381 0.305 25567 12590 1 18 . 1 1 38 38 VAL C C 38 173.633 173.633 175.596 -1.963 25567 12591 1 18 . 1 1 38 38 VAL CA C 38 57.284 57.284 61.002 -3.718 25567 12592 1 18 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.166 -1.202 25567 12593 1 18 . 1 1 38 38 VAL H H 38 8.389 8.389 8.294 0.095 25567 12594 1 18 . 1 1 39 39 SER N N 39 118.860 118.860 117.823 1.037 25567 12595 1 18 . 1 1 39 39 SER HA H 39 4.194 4.194 4.544 -0.350 25567 12596 1 18 . 1 1 39 39 SER C C 39 173.059 173.059 174.537 -1.478 25567 12597 1 18 . 1 1 39 39 SER CA C 39 56.227 56.227 58.047 -1.820 25567 12598 1 18 . 1 1 39 39 SER CB C 39 60.771 60.771 64.385 -3.614 25567 12599 1 18 . 1 1 39 39 SER H H 39 8.668 8.668 8.408 0.260 25567 12600 1 18 . 1 1 40 40 GLU N N 40 125.769 125.769 119.171 6.598 25567 12601 1 18 . 1 1 40 40 GLU HA H 40 4.157 4.157 3.873 0.284 25567 12602 1 18 . 1 1 40 40 GLU C C 40 174.484 174.484 176.625 -2.141 25567 12603 1 18 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.281 -0.731 25567 12604 1 18 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.495 -3.441 25567 12605 1 18 . 1 1 40 40 GLU H H 40 8.878 8.878 8.344 0.534 25567 12606 1 18 . 1 1 41 41 GLY N N 41 112.165 112.165 107.807 4.358 25567 12607 1 18 . 1 1 41 41 GLY CA C 41 42.707 42.707 44.732 -2.025 25567 12608 1 18 . 1 1 41 41 GLY H H 41 8.743 8.743 7.744 0.999 25567 12609 1 18 . 1 1 44 44 ASP N N 44 122.324 122.324 119.717 2.607 25567 12610 1 18 . 1 1 44 44 ASP CB C 44 42.156 42.156 40.803 1.353 25567 12611 1 18 . 1 1 44 44 ASP H H 44 7.918 7.918 8.619 -0.701 25567 12612 1 18 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.444 -0.382 25567 12613 1 18 . 1 1 45 45 ALA CA C 45 51.410 51.410 51.034 0.376 25567 12614 1 18 . 1 1 45 45 ALA CB C 45 16.376 16.376 20.988 -4.612 25567 12615 1 18 . 1 1 47 47 MET CA C 47 54.118 54.118 58.387 -4.269 25567 12616 1 18 . 1 1 47 47 MET CB C 47 27.527 27.527 32.950 -5.423 25567 12617 1 18 . 1 1 48 48 TYR N N 48 120.075 120.075 116.515 3.560 25567 12618 1 18 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.731 -0.577 25567 12619 1 18 . 1 1 48 48 TYR C C 48 172.217 172.217 175.445 -3.228 25567 12620 1 18 . 1 1 48 48 TYR CA C 48 57.377 57.377 57.730 -0.353 25567 12621 1 18 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.657 -3.160 25567 12622 1 18 . 1 1 48 48 TYR H H 48 7.810 7.810 8.193 -0.383 25567 12623 1 18 . 1 1 49 49 LYS N N 49 118.369 118.369 121.809 -3.440 25567 12624 1 18 . 1 1 49 49 LYS H H 49 8.116 8.116 8.527 -0.411 25567 12625 1 18 . 1 1 50 50 THR N N 50 116.979 116.979 118.001 -1.022 25567 12626 1 18 . 1 1 50 50 THR CB C 50 66.373 66.373 67.970 -1.597 25567 12627 1 18 . 1 1 50 50 THR H H 50 7.741 7.741 8.447 -0.706 25567 12628 1 18 . 1 1 51 51 SER N N 51 116.155 116.155 120.186 -4.031 25567 12629 1 18 . 1 1 51 51 SER HA H 51 3.771 3.771 4.652 -0.881 25567 12630 1 18 . 1 1 51 51 SER C C 51 170.563 170.563 172.950 -2.387 25567 12631 1 18 . 1 1 51 51 SER CA C 51 54.840 54.840 58.256 -3.416 25567 12632 1 18 . 1 1 51 51 SER CB C 51 60.318 60.318 64.974 -4.656 25567 12633 1 18 . 1 1 51 51 SER H H 51 7.853 7.853 7.927 -0.074 25567 12634 1 18 . 1 1 54 54 ALA N N 54 123.234 123.234 120.715 2.519 25567 12635 1 18 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.712 -0.464 25567 12636 1 18 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.501 -1.233 25567 12637 1 18 . 1 1 54 54 ALA CB C 54 16.434 16.434 20.367 -3.933 25567 12638 1 18 . 1 1 54 54 ALA H H 54 8.207 8.207 8.554 -0.347 25567 12639 1 18 . 1 1 55 55 LEU N N 55 118.603 118.603 119.349 -0.746 25567 12640 1 18 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.557 -0.617 25567 12641 1 18 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.919 -1.208 25567 12642 1 18 . 1 1 55 55 LEU CB C 55 38.913 38.913 42.418 -3.505 25567 12643 1 18 . 1 1 55 55 LEU H H 55 7.960 7.960 8.100 -0.140 25567 12644 1 18 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.040 -0.364 25567 12645 1 18 . 1 1 58 58 ILE CA C 58 61.494 61.494 62.135 -0.640 25567 12646 1 18 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.337 -3.283 25567 12647 1 18 . 1 1 59 59 GLN N N 59 117.579 117.579 120.358 -2.779 25567 12648 1 18 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.293 -0.160 25567 12649 1 18 . 1 1 59 59 GLN CA C 59 54.009 54.009 56.730 -2.721 25567 12650 1 18 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.876 -2.225 25567 12651 1 18 . 1 1 59 59 GLN H H 59 8.268 8.268 7.999 0.269 25567 12652 1 18 . 1 1 60 60 GLY N N 60 107.308 107.308 115.478 -8.170 25567 12653 1 18 . 1 1 60 60 GLY CA C 60 42.979 42.979 46.056 -3.078 25567 12654 1 18 . 1 1 60 60 GLY H H 60 7.780 7.780 8.999 -1.219 25567 12655 1 18 . 1 1 61 61 ASN N N 61 117.747 117.747 119.800 -2.053 25567 12656 1 18 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.768 -0.234 25567 12657 1 18 . 1 1 61 61 ASN CA C 61 51.235 51.235 53.309 -2.074 25567 12658 1 18 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.070 -2.646 25567 12659 1 18 . 1 1 61 61 ASN H H 61 8.108 8.108 8.011 0.097 25567 12660 1 18 . 1 1 64 64 PHE N N 64 120.102 120.102 114.521 5.581 25567 12661 1 18 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.765 -0.386 25567 12662 1 18 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.831 -3.083 25567 12663 1 18 . 1 1 64 64 PHE CB C 64 35.275 35.275 39.305 -4.030 25567 12664 1 18 . 1 1 64 64 PHE H H 64 8.300 8.300 7.090 1.210 25567 12665 1 18 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.609 -0.274 25567 12666 1 18 . 1 1 65 65 PRO C C 65 173.870 173.870 176.465 -2.595 25567 12667 1 18 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.628 -2.611 25567 12668 1 18 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.782 -3.147 25567 12669 1 18 . 1 1 66 66 GLU N N 66 121.258 121.258 118.632 2.626 25567 12670 1 18 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.365 -0.131 25567 12671 1 18 . 1 1 66 66 GLU C C 66 173.981 173.981 175.878 -1.897 25567 12672 1 18 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.314 -2.527 25567 12673 1 18 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.539 -2.764 25567 12674 1 18 . 1 1 66 66 GLU H H 66 8.316 8.316 8.577 -0.261 25567 12675 1 18 . 1 1 67 67 ILE N N 67 114.290 114.290 114.918 -0.628 25567 12676 1 18 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.452 0.677 25567 12677 1 18 . 1 1 67 67 ILE C C 67 172.700 172.700 174.977 -2.277 25567 12678 1 18 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.648 -3.209 25567 12679 1 18 . 1 1 67 67 ILE CB C 67 39.159 39.159 40.561 -1.402 25567 12680 1 18 . 1 1 67 67 ILE H H 67 8.366 8.366 8.086 0.280 25567 12681 1 18 . 1 1 68 68 GLN N N 68 121.422 121.422 117.971 3.451 25567 12682 1 18 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.779 -0.278 25567 12683 1 18 . 1 1 68 68 GLN C C 68 171.675 171.675 173.872 -2.197 25567 12684 1 18 . 1 1 68 68 GLN CA C 68 52.273 52.273 53.919 -1.646 25567 12685 1 18 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.331 -6.188 25567 12686 1 18 . 1 1 68 68 GLN H H 68 8.737 8.737 8.791 -0.054 25567 12687 1 18 . 1 1 69 69 LEU N N 69 125.311 125.311 119.675 5.636 25567 12688 1 18 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.500 0.006 25567 12689 1 18 . 1 1 69 69 LEU C C 69 172.634 172.634 175.173 -2.539 25567 12690 1 18 . 1 1 69 69 LEU CA C 69 51.759 51.759 54.744 -2.985 25567 12691 1 18 . 1 1 69 69 LEU CB C 69 42.404 42.404 44.443 -2.038 25567 12692 1 18 . 1 1 69 69 LEU H H 69 8.051 8.051 8.363 -0.312 25567 12693 1 18 . 1 1 70 70 ASP N N 70 122.763 122.763 120.620 2.143 25567 12694 1 18 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.623 -0.200 25567 12695 1 18 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.586 -1.976 25567 12696 1 18 . 1 1 70 70 ASP CB C 70 38.717 38.717 41.691 -2.974 25567 12697 1 18 . 1 1 70 70 ASP H H 70 8.313 8.313 8.424 -0.111 25567 12698 1 18 . 1 1 71 71 ASN N N 71 117.413 117.413 118.329 -0.916 25567 12699 1 18 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.742 -0.405 25567 12700 1 18 . 1 1 71 71 ASN C C 71 171.770 171.770 174.988 -3.218 25567 12701 1 18 . 1 1 71 71 ASN CA C 71 51.491 51.491 52.974 -1.483 25567 12702 1 18 . 1 1 71 71 ASN CB C 71 35.326 35.326 38.325 -2.999 25567 12703 1 18 . 1 1 71 71 ASN H H 71 8.407 8.407 8.549 -0.142 25567 12704 1 18 . 1 1 72 72 ILE N N 72 123.752 123.752 122.085 1.667 25567 12705 1 18 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.130 -0.190 25567 12706 1 18 . 1 1 72 72 ILE C C 72 171.621 171.621 174.133 -2.512 25567 12707 1 18 . 1 1 72 72 ILE CA C 72 57.332 57.332 61.077 -3.744 25567 12708 1 18 . 1 1 72 72 ILE CB C 72 38.489 38.489 38.977 -0.488 25567 12709 1 18 . 1 1 72 72 ILE H H 72 7.639 7.639 7.398 0.241 25567 12710 1 18 . 1 1 73 73 ASP N N 73 125.252 125.252 122.918 2.334 25567 12711 1 18 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.631 -0.006 25567 12712 1 18 . 1 1 73 73 ASP C C 73 174.034 174.034 175.925 -1.891 25567 12713 1 18 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.361 -4.158 25567 12714 1 18 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.986 -5.962 25567 12715 1 18 . 1 1 73 73 ASP H H 73 8.394 8.394 8.487 -0.093 25567 12716 1 18 . 1 1 74 74 TYR N N 74 123.108 123.108 124.382 -1.274 25567 12717 1 18 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.391 -0.513 25567 12718 1 18 . 1 1 74 74 TYR C C 74 173.637 173.637 177.570 -3.933 25567 12719 1 18 . 1 1 74 74 TYR CA C 74 59.474 59.474 58.350 1.124 25567 12720 1 18 . 1 1 74 74 TYR CB C 74 34.722 34.722 37.936 -3.214 25567 12721 1 18 . 1 1 74 74 TYR H H 74 7.392 7.392 8.433 -1.041 25567 12722 1 18 . 1 1 75 75 ASN N N 75 109.422 109.422 116.909 -7.487 25567 12723 1 18 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.519 0.407 25567 12724 1 18 . 1 1 75 75 ASN C C 75 172.574 172.574 176.160 -3.586 25567 12725 1 18 . 1 1 75 75 ASN CA C 75 52.761 52.761 56.156 -3.395 25567 12726 1 18 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.343 -2.726 25567 12727 1 18 . 1 1 75 75 ASN H H 75 8.058 8.058 7.891 0.167 25567 12728 1 18 . 1 1 76 76 ASN N N 76 117.422 117.422 115.553 1.869 25567 12729 1 18 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.745 -0.290 25567 12730 1 18 . 1 1 76 76 ASN C C 76 171.132 171.132 173.656 -2.524 25567 12731 1 18 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.551 -2.384 25567 12732 1 18 . 1 1 76 76 ASN CB C 76 35.728 35.728 39.035 -3.307 25567 12733 1 18 . 1 1 76 76 ASN H H 76 7.768 7.768 7.993 -0.225 25567 12734 1 18 . 1 1 77 77 TYR N N 77 116.873 116.873 116.334 0.539 25567 12735 1 18 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.598 -0.235 25567 12736 1 18 . 1 1 77 77 TYR C C 77 172.175 172.175 173.912 -1.737 25567 12737 1 18 . 1 1 77 77 TYR CA C 77 55.364 55.364 58.107 -2.743 25567 12738 1 18 . 1 1 77 77 TYR CB C 77 37.165 37.165 42.267 -5.102 25567 12739 1 18 . 1 1 77 77 TYR H H 77 7.825 7.825 7.678 0.147 25567 12740 1 18 . 1 1 78 78 ASP N N 78 121.271 121.271 118.551 2.720 25567 12741 1 18 . 1 1 78 78 ASP HA H 78 4.805 4.805 5.214 -0.409 25567 12742 1 18 . 1 1 78 78 ASP C C 78 172.641 172.641 175.298 -2.657 25567 12743 1 18 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.226 0.029 25567 12744 1 18 . 1 1 78 78 ASP CB C 78 41.075 41.075 44.184 -3.109 25567 12745 1 18 . 1 1 78 78 ASP H H 78 9.058 9.058 8.337 0.721 25567 12746 1 18 . 1 1 79 79 LEU N N 79 122.985 122.985 119.744 3.241 25567 12747 1 18 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.076 0.038 25567 12748 1 18 . 1 1 79 79 LEU C C 79 170.721 170.721 174.281 -3.560 25567 12749 1 18 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.430 -3.114 25567 12750 1 18 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.799 -3.457 25567 12751 1 18 . 1 1 79 79 LEU H H 79 7.893 7.893 7.667 0.226 25567 12752 1 18 . 1 1 80 80 ILE N N 80 126.364 126.364 124.050 2.314 25567 12753 1 18 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.976 0.113 25567 12754 1 18 . 1 1 80 80 ILE C C 80 171.580 171.580 174.035 -2.455 25567 12755 1 18 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.181 -2.764 25567 12756 1 18 . 1 1 80 80 ILE CB C 80 38.136 38.136 41.073 -2.937 25567 12757 1 18 . 1 1 80 80 ILE H H 80 8.717 8.717 9.196 -0.479 25567 12758 1 18 . 1 1 81 81 LEU N N 81 126.199 126.199 127.516 -1.317 25567 12759 1 18 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.125 0.010 25567 12760 1 18 . 1 1 81 81 LEU C C 81 172.979 172.979 175.705 -2.726 25567 12761 1 18 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.196 -3.563 25567 12762 1 18 . 1 1 81 81 LEU CB C 81 42.159 42.159 44.524 -2.365 25567 12763 1 18 . 1 1 81 81 LEU H H 81 9.230 9.230 9.045 0.185 25567 12764 1 18 . 1 1 82 82 ILE N N 82 120.505 120.505 120.174 0.331 25567 12765 1 18 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.013 -0.097 25567 12766 1 18 . 1 1 82 82 ILE C C 82 173.011 173.011 174.953 -1.942 25567 12767 1 18 . 1 1 82 82 ILE CA C 82 56.828 56.828 60.146 -3.318 25567 12768 1 18 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.619 -3.551 25567 12769 1 18 . 1 1 82 82 ILE H H 82 8.796 8.796 8.273 0.523 25567 12770 1 18 . 1 1 83 83 GLY N N 83 120.857 120.857 113.110 7.747 25567 12771 1 18 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.358 -2.555 25567 12772 1 18 . 1 1 83 83 GLY H H 83 9.525 9.525 8.243 1.282 25567 12773 1 18 . 1 1 84 84 SER N N 84 116.007 116.007 115.893 0.114 25567 12774 1 18 . 1 1 84 84 SER HA H 84 5.476 5.476 4.860 0.616 25567 12775 1 18 . 1 1 84 84 SER CA C 84 51.937 51.937 56.014 -4.077 25567 12776 1 18 . 1 1 84 84 SER CB C 84 64.533 64.533 64.440 0.093 25567 12777 1 18 . 1 1 84 84 SER H H 84 7.617 7.617 7.683 -0.066 25567 12778 1 18 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.560 0.641 25567 12779 1 18 . 1 1 85 85 PRO C C 85 173.574 173.574 175.797 -2.223 25567 12780 1 18 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.549 -3.061 25567 12781 1 18 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.451 -1.311 25567 12782 1 18 . 1 1 86 86 VAL N N 86 117.603 117.603 117.033 0.570 25567 12783 1 18 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.479 -0.106 25567 12784 1 18 . 1 1 86 86 VAL C C 86 172.777 172.777 174.418 -1.641 25567 12785 1 18 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.078 -1.475 25567 12786 1 18 . 1 1 86 86 VAL CB C 86 29.573 29.573 33.565 -3.992 25567 12787 1 18 . 1 1 86 86 VAL H H 86 8.194 8.194 7.954 0.240 25567 12788 1 18 . 1 1 87 87 TRP N N 87 131.187 131.187 123.218 7.969 25567 12789 1 18 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.779 0.419 25567 12790 1 18 . 1 1 87 87 TRP C C 87 173.295 173.295 174.351 -1.056 25567 12791 1 18 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.254 -7.470 25567 12792 1 18 . 1 1 87 87 TRP CB C 87 27.746 27.746 32.483 -4.737 25567 12793 1 18 . 1 1 87 87 TRP H H 87 9.637 9.637 8.507 1.130 25567 12794 1 18 . 1 1 88 88 SER N N 88 119.829 119.829 112.120 7.709 25567 12795 1 18 . 1 1 88 88 SER HA H 88 3.986 3.986 5.025 -1.039 25567 12796 1 18 . 1 1 88 88 SER C C 88 172.375 172.375 174.741 -2.366 25567 12797 1 18 . 1 1 88 88 SER CA C 88 55.932 55.932 56.908 -0.976 25567 12798 1 18 . 1 1 88 88 SER CB C 88 59.178 59.178 63.857 -4.679 25567 12799 1 18 . 1 1 88 88 SER H H 88 9.272 9.272 7.869 1.403 25567 12800 1 18 . 1 1 89 89 GLY N N 89 101.498 101.498 112.154 -10.656 25567 12801 1 18 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.770 -4.099 25567 12802 1 18 . 1 1 89 89 GLY H H 89 7.463 7.463 8.779 -1.316 25567 12803 1 18 . 1 1 90 90 TYR N N 90 121.064 121.064 117.581 3.483 25567 12804 1 18 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.040 -0.824 25567 12805 1 18 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.426 -0.336 25567 12806 1 18 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.416 0.779 25567 12807 1 18 . 1 1 90 90 TYR H H 90 8.064 8.064 8.010 0.054 25567 12808 1 18 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.704 0.228 25567 12809 1 18 . 1 1 91 91 PRO C C 91 171.019 171.019 176.101 -5.082 25567 12810 1 18 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.778 -4.784 25567 12811 1 18 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.335 -5.842 25567 12812 1 18 . 1 1 92 92 ALA N N 92 119.893 119.893 121.619 -1.726 25567 12813 1 18 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.760 -1.309 25567 12814 1 18 . 1 1 92 92 ALA C C 92 176.477 176.477 175.534 0.943 25567 12815 1 18 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.479 -1.912 25567 12816 1 18 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.374 -5.573 25567 12817 1 18 . 1 1 92 92 ALA H H 92 7.278 7.278 7.709 -0.431 25567 12818 1 18 . 1 1 93 93 THR N N 93 112.992 112.992 111.037 1.955 25567 12819 1 18 . 1 1 93 93 THR HA H 93 4.462 4.462 4.703 -0.241 25567 12820 1 18 . 1 1 93 93 THR CA C 93 66.871 66.871 58.561 8.310 25567 12821 1 18 . 1 1 93 93 THR CB C 93 64.362 64.362 68.870 -4.508 25567 12822 1 18 . 1 1 93 93 THR H H 93 6.861 6.861 8.335 -1.474 25567 12823 1 18 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.075 -0.209 25567 12824 1 18 . 1 1 94 94 PRO CA C 94 63.021 63.021 64.133 -1.112 25567 12825 1 18 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.028 -1.749 25567 12826 1 18 . 1 1 95 95 ILE N N 95 111.298 111.298 116.711 -5.413 25567 12827 1 18 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.098 -0.475 25567 12828 1 18 . 1 1 95 95 ILE C C 95 174.264 174.264 174.878 -0.614 25567 12829 1 18 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.650 -2.202 25567 12830 1 18 . 1 1 95 95 ILE CB C 95 31.929 31.929 34.890 -2.961 25567 12831 1 18 . 1 1 95 95 ILE H H 95 7.974 7.974 8.004 -0.030 25567 12832 1 18 . 1 1 96 96 LYS N N 96 123.045 123.045 121.776 1.269 25567 12833 1 18 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.542 -1.430 25567 12834 1 18 . 1 1 96 96 LYS C C 96 174.590 174.590 177.576 -2.986 25567 12835 1 18 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.658 0.487 25567 12836 1 18 . 1 1 96 96 LYS CB C 96 28.845 28.845 34.979 -6.134 25567 12837 1 18 . 1 1 96 96 LYS H H 96 6.958 6.958 8.198 -1.240 25567 12838 1 18 . 1 1 97 97 THR N N 97 113.412 113.412 117.735 -4.323 25567 12839 1 18 . 1 1 97 97 THR HA H 97 3.461 3.461 4.166 -0.705 25567 12840 1 18 . 1 1 97 97 THR C C 97 173.247 173.247 176.610 -3.363 25567 12841 1 18 . 1 1 97 97 THR CA C 97 62.809 62.809 66.544 -3.735 25567 12842 1 18 . 1 1 97 97 THR CB C 97 65.654 65.654 69.129 -3.475 25567 12843 1 18 . 1 1 97 97 THR H H 97 6.366 6.366 7.473 -1.107 25567 12844 1 18 . 1 1 98 98 LEU N N 98 121.201 121.201 123.434 -2.233 25567 12845 1 18 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.129 -0.495 25567 12846 1 18 . 1 1 98 98 LEU C C 98 174.590 174.590 178.686 -4.096 25567 12847 1 18 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.849 -2.228 25567 12848 1 18 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.221 -1.326 25567 12849 1 18 . 1 1 98 98 LEU H H 98 7.554 7.554 7.769 -0.215 25567 12850 1 18 . 1 1 99 99 LEU N N 99 118.677 118.677 117.292 1.385 25567 12851 1 18 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.951 -0.249 25567 12852 1 18 . 1 1 99 99 LEU C C 99 177.457 177.457 178.931 -1.474 25567 12853 1 18 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.647 -2.468 25567 12854 1 18 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.472 -2.484 25567 12855 1 18 . 1 1 99 99 LEU H H 99 8.160 8.160 8.239 -0.079 25567 12856 1 18 . 1 1 100 100 ASP N N 100 118.914 118.914 117.780 1.134 25567 12857 1 18 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.585 -0.356 25567 12858 1 18 . 1 1 100 100 ASP C C 100 176.585 176.585 178.348 -1.763 25567 12859 1 18 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.751 -2.235 25567 12860 1 18 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.233 -3.654 25567 12861 1 18 . 1 1 100 100 ASP H H 100 7.872 7.872 7.805 0.067 25567 12862 1 18 . 1 1 101 101 GLN N N 101 118.135 118.135 118.030 0.105 25567 12863 1 18 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.235 -0.075 25567 12864 1 18 . 1 1 101 101 GLN C C 101 174.601 174.601 177.570 -2.969 25567 12865 1 18 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.000 -3.040 25567 12866 1 18 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.065 -3.515 25567 12867 1 18 . 1 1 101 101 GLN H H 101 7.673 7.673 7.947 -0.274 25567 12868 1 18 . 1 1 102 102 MET N N 102 118.420 118.420 117.172 1.248 25567 12869 1 18 . 1 1 102 102 MET HA H 102 3.826 3.826 4.738 -0.912 25567 12870 1 18 . 1 1 102 102 MET C C 102 172.780 172.780 176.972 -4.192 25567 12871 1 18 . 1 1 102 102 MET CA C 102 53.428 53.428 56.238 -2.810 25567 12872 1 18 . 1 1 102 102 MET CB C 102 31.221 31.221 31.842 -0.621 25567 12873 1 18 . 1 1 102 102 MET H H 102 7.462 7.462 7.356 0.106 25567 12874 1 18 . 1 1 103 103 LYS N N 103 116.066 116.066 119.531 -3.465 25567 12875 1 18 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.333 -0.413 25567 12876 1 18 . 1 1 103 103 LYS C C 103 173.922 173.922 177.020 -3.098 25567 12877 1 18 . 1 1 103 103 LYS CA C 103 56.282 56.282 57.877 -1.595 25567 12878 1 18 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.608 -2.117 25567 12879 1 18 . 1 1 103 103 LYS H H 103 6.875 6.875 7.660 -0.785 25567 12880 1 18 . 1 1 104 104 ASN N N 104 114.987 114.987 117.467 -2.480 25567 12881 1 18 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.986 -0.245 25567 12882 1 18 . 1 1 104 104 ASN C C 104 172.587 172.587 174.256 -1.669 25567 12883 1 18 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.809 -2.341 25567 12884 1 18 . 1 1 104 104 ASN CB C 104 35.822 35.822 40.230 -4.408 25567 12885 1 18 . 1 1 104 104 ASN H H 104 8.517 8.517 8.225 0.292 25567 12886 1 18 . 1 1 105 105 TYR N N 105 122.755 122.755 119.399 3.356 25567 12887 1 18 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.521 0.054 25567 12888 1 18 . 1 1 105 105 TYR C C 105 174.260 174.260 175.454 -1.194 25567 12889 1 18 . 1 1 105 105 TYR CA C 105 55.493 55.493 57.854 -2.361 25567 12890 1 18 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.029 -2.965 25567 12891 1 18 . 1 1 105 105 TYR H H 105 8.287 8.287 8.222 0.065 25567 12892 1 18 . 1 1 106 106 ARG N N 106 128.905 128.905 122.987 5.918 25567 12893 1 18 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.497 -0.224 25567 12894 1 18 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.100 -2.079 25567 12895 1 18 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.481 -3.351 25567 12896 1 18 . 1 1 106 106 ARG H H 106 8.841 8.841 9.018 -0.177 25567 12897 1 18 . 1 1 107 107 GLY CA C 107 42.497 42.497 45.258 -2.761 25567 12898 1 18 . 1 1 108 108 GLU N N 108 116.989 116.989 119.816 -2.827 25567 12899 1 18 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.576 0.055 25567 12900 1 18 . 1 1 108 108 GLU CA C 108 53.676 53.676 56.014 -2.338 25567 12901 1 18 . 1 1 108 108 GLU CB C 108 30.402 30.402 31.827 -1.425 25567 12902 1 18 . 1 1 108 108 GLU H H 108 7.536 7.536 8.208 -0.672 25567 12903 1 18 . 1 1 109 109 VAL N N 109 123.416 123.416 120.801 2.615 25567 12904 1 18 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.956 0.365 25567 12905 1 18 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.420 -2.977 25567 12906 1 18 . 1 1 109 109 VAL CB C 109 32.661 32.661 32.721 -0.060 25567 12907 1 18 . 1 1 109 109 VAL H H 109 8.955 8.955 8.292 0.663 25567 12908 1 18 . 1 1 110 110 ALA N N 110 127.975 127.975 129.458 -1.483 25567 12909 1 18 . 1 1 110 110 ALA HA H 110 4.677 4.677 4.965 -0.288 25567 12910 1 18 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.891 -2.450 25567 12911 1 18 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.333 -3.917 25567 12912 1 18 . 1 1 110 110 ALA H H 110 8.860 8.860 9.115 -0.255 25567 12913 1 18 . 1 1 111 111 SER N N 111 110.482 110.482 114.366 -3.884 25567 12914 1 18 . 1 1 111 111 SER HA H 111 5.502 5.502 5.245 0.257 25567 12915 1 18 . 1 1 111 111 SER CA C 111 51.630 51.630 56.831 -5.201 25567 12916 1 18 . 1 1 111 111 SER CB C 111 62.267 62.267 65.125 -2.858 25567 12917 1 18 . 1 1 111 111 SER H H 111 7.484 7.484 7.776 -0.292 25567 12918 1 18 . 1 1 112 112 PHE N N 112 125.082 125.082 120.905 4.177 25567 12919 1 18 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.675 0.773 25567 12920 1 18 . 1 1 112 112 PHE CA C 112 50.434 50.434 54.846 -4.412 25567 12921 1 18 . 1 1 112 112 PHE CB C 112 40.500 40.500 40.092 0.408 25567 12922 1 18 . 1 1 112 112 PHE H H 112 8.025 8.025 9.065 -1.040 25567 12923 1 18 . 1 1 113 113 PHE N N 113 115.872 115.872 120.135 -4.263 25567 12924 1 18 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.127 0.797 25567 12925 1 18 . 1 1 113 113 PHE C C 113 173.293 173.293 175.799 -2.506 25567 12926 1 18 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.240 -4.772 25567 12927 1 18 . 1 1 113 113 PHE CB C 113 38.393 38.393 40.344 -1.951 25567 12928 1 18 . 1 1 113 113 PHE H H 113 7.391 7.391 7.525 -0.134 25567 12929 1 18 . 1 1 114 114 THR N N 114 108.721 108.721 109.605 -0.884 25567 12930 1 18 . 1 1 114 114 THR HA H 114 4.933 4.933 4.468 0.465 25567 12931 1 18 . 1 1 114 114 THR C C 114 171.891 171.891 173.811 -1.920 25567 12932 1 18 . 1 1 114 114 THR CA C 114 56.815 56.815 61.376 -4.561 25567 12933 1 18 . 1 1 114 114 THR CB C 114 67.899 67.899 69.862 -1.963 25567 12934 1 18 . 1 1 114 114 THR H H 114 7.951 7.951 8.226 -0.275 25567 12935 1 18 . 1 1 115 115 SER N N 115 115.159 115.159 116.623 -1.464 25567 12936 1 18 . 1 1 115 115 SER HA H 115 4.608 4.608 4.717 -0.109 25567 12937 1 18 . 1 1 115 115 SER C C 115 171.403 171.403 173.367 -1.964 25567 12938 1 18 . 1 1 115 115 SER CA C 115 55.570 55.570 58.377 -2.807 25567 12939 1 18 . 1 1 115 115 SER CB C 115 61.418 61.418 65.866 -4.448 25567 12940 1 18 . 1 1 115 115 SER H H 115 8.229 8.229 7.716 0.513 25567 12941 1 18 . 1 1 116 116 ALA N N 116 127.211 127.211 124.983 2.228 25567 12942 1 18 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.593 -0.137 25567 12943 1 18 . 1 1 116 116 ALA C C 116 175.758 175.758 178.507 -2.749 25567 12944 1 18 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.251 -2.434 25567 12945 1 18 . 1 1 116 116 ALA CB C 116 16.831 16.831 20.111 -3.280 25567 12946 1 18 . 1 1 116 116 ALA H H 116 8.813 8.813 8.264 0.549 25567 12947 1 18 . 1 1 117 117 GLY N N 117 108.099 108.099 110.903 -2.804 25567 12948 1 18 . 1 1 117 117 GLY C C 117 171.805 171.805 175.757 -3.952 25567 12949 1 18 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.318 -4.449 25567 12950 1 18 . 1 1 117 117 GLY H H 117 8.685 8.685 8.738 -0.053 25567 12951 1 18 . 1 1 118 118 THR N N 118 111.284 111.284 110.654 0.630 25567 12952 1 18 . 1 1 118 118 THR HA H 118 4.343 4.343 4.299 0.044 25567 12953 1 18 . 1 1 118 118 THR C C 118 171.769 171.769 174.697 -2.928 25567 12954 1 18 . 1 1 118 118 THR CA C 118 58.933 58.933 62.238 -3.305 25567 12955 1 18 . 1 1 118 118 THR CB C 118 67.304 67.304 68.809 -1.505 25567 12956 1 18 . 1 1 118 118 THR H H 118 7.998 7.998 8.048 -0.050 25567 12957 1 18 . 1 1 119 119 ASN N N 119 120.253 120.253 120.147 0.106 25567 12958 1 18 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.855 -0.152 25567 12959 1 18 . 1 1 119 119 ASN C C 119 172.353 172.353 173.930 -1.577 25567 12960 1 18 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.693 -3.465 25567 12961 1 18 . 1 1 119 119 ASN CB C 119 35.376 35.376 39.695 -4.319 25567 12962 1 18 . 1 1 119 119 ASN H H 119 8.381 8.381 7.550 0.831 25567 12963 1 18 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.387 -0.301 25567 12964 1 18 . 1 1 120 120 HIS C C 120 173.395 173.395 176.110 -2.715 25567 12965 1 18 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.730 -2.591 25567 12966 1 18 . 1 1 120 120 HIS CB C 120 28.422 28.422 30.382 -1.960 25567 12967 1 18 . 1 1 121 121 LYS N N 121 119.527 119.527 120.707 -1.180 25567 12968 1 18 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.694 0.086 25567 12969 1 18 . 1 1 121 121 LYS C C 121 176.053 176.053 178.071 -2.018 25567 12970 1 18 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.508 -2.545 25567 12971 1 18 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.912 -2.252 25567 12972 1 18 . 1 1 121 121 LYS H H 121 8.106 8.106 8.626 -0.520 25567 12973 1 18 . 1 1 122 122 ALA N N 122 121.585 121.585 121.499 0.086 25567 12974 1 18 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.736 -0.015 25567 12975 1 18 . 1 1 122 122 ALA C C 122 175.128 175.128 178.778 -3.650 25567 12976 1 18 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.174 -2.583 25567 12977 1 18 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.773 -2.069 25567 12978 1 18 . 1 1 122 122 ALA H H 122 7.702 7.702 7.941 -0.239 25567 12979 1 18 . 1 1 123 123 TYR N N 123 118.803 118.803 119.563 -0.760 25567 12980 1 18 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.963 -0.597 25567 12981 1 18 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.401 -1.310 25567 12982 1 18 . 1 1 123 123 TYR CB C 123 35.102 35.102 37.861 -2.759 25567 12983 1 18 . 1 1 123 123 TYR H H 123 7.366 7.366 7.511 -0.145 25567 12984 1 18 . 1 1 124 124 VAL N N 124 117.530 117.530 117.563 -0.033 25567 12985 1 18 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.508 -0.309 25567 12986 1 18 . 1 1 124 124 VAL C C 124 175.375 175.375 178.044 -2.669 25567 12987 1 18 . 1 1 124 124 VAL CA C 124 64.583 64.583 67.324 -2.741 25567 12988 1 18 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.193 -1.990 25567 12989 1 18 . 1 1 124 124 VAL H H 124 7.757 7.757 7.556 0.201 25567 12990 1 18 . 1 1 125 125 SER N N 125 114.023 114.023 115.074 -1.051 25567 12991 1 18 . 1 1 125 125 SER HA H 125 4.035 4.035 4.066 -0.031 25567 12992 1 18 . 1 1 125 125 SER C C 125 174.636 174.636 176.769 -2.133 25567 12993 1 18 . 1 1 125 125 SER CA C 125 58.885 58.885 62.065 -3.180 25567 12994 1 18 . 1 1 125 125 SER CB C 125 59.666 59.666 62.816 -3.151 25567 12995 1 18 . 1 1 125 125 SER H H 125 7.622 7.622 7.446 0.176 25567 12996 1 18 . 1 1 126 126 HIS N N 126 119.457 119.457 120.840 -1.383 25567 12997 1 18 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.857 0.339 25567 12998 1 18 . 1 1 126 126 HIS C C 126 172.942 172.942 177.558 -4.616 25567 12999 1 18 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.415 -3.497 25567 13000 1 18 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.405 -3.326 25567 13001 1 18 . 1 1 126 126 HIS H H 126 8.067 8.067 7.943 0.124 25567 13002 1 18 . 1 1 127 127 PHE N N 127 120.628 120.628 119.392 1.236 25567 13003 1 18 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.970 -0.771 25567 13004 1 18 . 1 1 127 127 PHE C C 127 173.515 173.515 176.722 -3.207 25567 13005 1 18 . 1 1 127 127 PHE CA C 127 60.681 60.681 60.049 0.632 25567 13006 1 18 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.755 -2.388 25567 13007 1 18 . 1 1 127 127 PHE H H 127 9.083 9.083 8.343 0.740 25567 13008 1 18 . 1 1 128 128 ASN N N 128 114.858 114.858 117.967 -3.109 25567 13009 1 18 . 1 1 128 128 ASN HA H 128 4.078 4.078 3.984 0.094 25567 13010 1 18 . 1 1 128 128 ASN C C 128 175.338 175.338 177.302 -1.964 25567 13011 1 18 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.825 -2.575 25567 13012 1 18 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.406 -2.385 25567 13013 1 18 . 1 1 128 128 ASN H H 128 7.858 7.858 7.678 0.180 25567 13014 1 18 . 1 1 129 129 GLU N N 129 119.811 119.811 118.717 1.094 25567 13015 1 18 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.160 -0.119 25567 13016 1 18 . 1 1 129 129 GLU C C 129 176.941 176.941 179.287 -2.346 25567 13017 1 18 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.695 -2.063 25567 13018 1 18 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.203 -2.265 25567 13019 1 18 . 1 1 129 129 GLU H H 129 7.569 7.569 7.790 -0.221 25567 13020 1 18 . 1 1 130 130 TRP N N 130 120.585 120.585 118.831 1.754 25567 13021 1 18 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.582 -0.110 25567 13022 1 18 . 1 1 130 130 TRP C C 130 174.262 174.262 176.721 -2.459 25567 13023 1 18 . 1 1 130 130 TRP CA C 130 54.673 54.673 57.588 -2.915 25567 13024 1 18 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.962 -2.006 25567 13025 1 18 . 1 1 130 130 TRP H H 130 7.964 7.964 7.705 0.259 25567 13026 1 18 . 1 1 131 131 ALA N N 131 120.522 120.522 118.475 2.047 25567 13027 1 18 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.283 -0.336 25567 13028 1 18 . 1 1 131 131 ALA C C 131 172.489 172.489 177.672 -5.183 25567 13029 1 18 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.552 -2.972 25567 13030 1 18 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.248 -2.709 25567 13031 1 18 . 1 1 131 131 ALA H H 131 8.114 8.114 7.230 0.884 25567 13032 1 18 . 1 1 132 132 ASP N N 132 117.666 117.666 120.934 -3.268 25567 13033 1 18 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.357 -0.151 25567 13034 1 18 . 1 1 132 132 ASP C C 132 173.779 173.779 176.373 -2.594 25567 13035 1 18 . 1 1 132 132 ASP CA C 132 54.313 54.313 54.783 -0.470 25567 13036 1 18 . 1 1 132 132 ASP CB C 132 39.456 39.456 38.849 0.607 25567 13037 1 18 . 1 1 132 132 ASP H H 132 6.768 6.768 7.965 -1.197 25567 13038 1 18 . 1 1 133 133 GLY N N 133 114.922 114.922 107.100 7.822 25567 13039 1 18 . 1 1 133 133 GLY C C 133 172.101 172.101 174.242 -2.141 25567 13040 1 18 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.269 -2.760 25567 13041 1 18 . 1 1 133 133 GLY H H 133 8.645 8.645 8.027 0.618 25567 13042 1 18 . 1 1 134 134 LEU N N 134 120.101 120.101 121.753 -1.652 25567 13043 1 18 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.508 -0.046 25567 13044 1 18 . 1 1 134 134 LEU C C 134 174.098 174.098 175.307 -1.209 25567 13045 1 18 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.336 -2.252 25567 13046 1 18 . 1 1 134 134 LEU CB C 134 40.509 40.509 43.491 -2.982 25567 13047 1 18 . 1 1 134 134 LEU H H 134 8.049 8.049 7.657 0.392 25567 13048 1 18 . 1 1 135 135 ASN N N 135 119.258 119.258 121.550 -2.292 25567 13049 1 18 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.684 -0.045 25567 13050 1 18 . 1 1 135 135 ASN C C 135 170.564 170.564 174.542 -3.978 25567 13051 1 18 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.180 -3.927 25567 13052 1 18 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.411 -4.793 25567 13053 1 18 . 1 1 135 135 ASN H H 135 8.567 8.567 8.168 0.399 25567 13054 1 18 . 1 1 136 136 VAL N N 136 125.460 125.460 125.252 0.208 25567 13055 1 18 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.458 0.138 25567 13056 1 18 . 1 1 136 136 VAL C C 136 175.318 175.318 176.574 -1.256 25567 13057 1 18 . 1 1 136 136 VAL CA C 136 58.722 58.722 62.648 -3.925 25567 13058 1 18 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.453 -3.154 25567 13059 1 18 . 1 1 136 136 VAL H H 136 7.660 7.660 8.151 -0.491 25567 13060 1 18 . 1 1 137 137 ILE N N 137 122.021 122.021 121.169 0.852 25567 13061 1 18 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.616 -0.188 25567 13062 1 18 . 1 1 137 137 ILE C C 137 173.943 173.943 174.752 -0.809 25567 13063 1 18 . 1 1 137 137 ILE CA C 137 58.958 58.958 60.155 -1.197 25567 13064 1 18 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.920 -2.751 25567 13065 1 18 . 1 1 137 137 ILE H H 137 9.151 9.151 9.055 0.096 25567 13066 1 18 . 1 1 138 138 GLY N N 138 108.192 108.192 108.556 -0.364 25567 13067 1 18 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.141 -1.647 25567 13068 1 18 . 1 1 138 138 GLY H H 138 6.675 6.675 7.461 -0.786 25567 13069 1 18 . 1 1 139 139 VAL N N 139 119.673 119.673 124.352 -4.679 25567 13070 1 18 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.962 0.358 25567 13071 1 18 . 1 1 139 139 VAL C C 139 172.291 172.291 174.629 -2.338 25567 13072 1 18 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.380 -3.171 25567 13073 1 18 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.649 -1.010 25567 13074 1 18 . 1 1 139 139 VAL H H 139 8.158 8.158 8.734 -0.576 25567 13075 1 18 . 1 1 140 140 ALA N N 140 127.104 127.104 128.156 -1.052 25567 13076 1 18 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.098 -0.502 25567 13077 1 18 . 1 1 140 140 ALA C C 140 171.057 171.057 174.769 -3.712 25567 13078 1 18 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.471 -1.588 25567 13079 1 18 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.713 -1.285 25567 13080 1 18 . 1 1 140 140 ALA H H 140 9.145 9.145 8.282 0.863 25567 13081 1 18 . 1 1 141 141 ARG N N 141 118.828 118.828 119.830 -1.002 25567 13082 1 18 . 1 1 141 141 ARG HA H 141 2.740 2.740 3.804 -1.064 25567 13083 1 18 . 1 1 141 141 ARG C C 141 173.524 173.524 176.525 -3.001 25567 13084 1 18 . 1 1 141 141 ARG CA C 141 51.886 51.886 55.575 -3.689 25567 13085 1 18 . 1 1 141 141 ARG CB C 141 28.454 28.454 30.587 -2.133 25567 13086 1 18 . 1 1 141 141 ARG H H 141 7.759 7.759 8.176 -0.417 25567 13087 1 18 . 1 1 142 142 ASP N N 142 125.557 125.557 121.442 4.115 25567 13088 1 18 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.319 -0.540 25567 13089 1 18 . 1 1 142 142 ASP C C 142 169.292 169.292 175.980 -6.688 25567 13090 1 18 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.771 -3.149 25567 13091 1 18 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.814 -3.734 25567 13092 1 18 . 1 1 142 142 ASP H H 142 9.087 9.087 8.213 0.874 25567 13093 1 18 . 1 1 143 143 ASP N N 143 119.094 119.094 118.962 0.132 25567 13094 1 18 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.635 -0.381 25567 13095 1 18 . 1 1 143 143 ASP C C 143 175.557 175.557 176.915 -1.358 25567 13096 1 18 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.832 -4.753 25567 13097 1 18 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.770 -4.328 25567 13098 1 18 . 1 1 143 143 ASP H H 143 8.175 8.175 8.607 -0.432 25567 13099 1 18 . 1 1 144 144 SER N N 144 115.438 115.438 116.913 -1.475 25567 13100 1 18 . 1 1 144 144 SER HA H 144 3.745 3.745 4.045 -0.300 25567 13101 1 18 . 1 1 144 144 SER C C 144 172.820 172.820 174.879 -2.059 25567 13102 1 18 . 1 1 144 144 SER CA C 144 59.336 59.336 60.843 -1.507 25567 13103 1 18 . 1 1 144 144 SER CB C 144 60.839 60.839 63.184 -2.345 25567 13104 1 18 . 1 1 144 144 SER H H 144 7.742 7.742 7.999 -0.257 25567 13105 1 18 . 1 1 145 145 GLU N N 145 119.631 119.631 118.134 1.497 25567 13106 1 18 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.065 0.254 25567 13107 1 18 . 1 1 145 145 GLU C C 145 171.927 171.927 176.022 -4.095 25567 13108 1 18 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.370 -3.287 25567 13109 1 18 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.201 -2.427 25567 13110 1 18 . 1 1 145 145 GLU H H 145 7.924 7.924 7.907 0.017 25567 13111 1 18 . 1 1 146 146 VAL N N 146 118.791 118.791 120.994 -2.203 25567 13112 1 18 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.600 -0.644 25567 13113 1 18 . 1 1 146 146 VAL C C 146 174.582 174.582 177.461 -2.879 25567 13114 1 18 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.893 -2.815 25567 13115 1 18 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.362 -2.222 25567 13116 1 18 . 1 1 146 146 VAL H H 146 6.393 6.393 7.308 -0.915 25567 13117 1 18 . 1 1 147 147 ASP N N 147 119.410 119.410 116.846 2.564 25567 13118 1 18 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.285 -0.215 25567 13119 1 18 . 1 1 147 147 ASP C C 147 174.774 174.774 175.901 -1.127 25567 13120 1 18 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.926 -2.604 25567 13121 1 18 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.602 -3.398 25567 13122 1 18 . 1 1 147 147 ASP H H 147 8.393 8.393 8.688 -0.295 25567 13123 1 18 . 1 1 148 148 LYS N N 148 119.422 119.422 114.423 4.999 25567 13124 1 18 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.546 -0.595 25567 13125 1 18 . 1 1 148 148 LYS C C 148 176.410 176.410 176.435 -0.025 25567 13126 1 18 . 1 1 148 148 LYS CA C 148 55.736 55.736 55.942 -0.206 25567 13127 1 18 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.994 -3.418 25567 13128 1 18 . 1 1 148 148 LYS H H 148 7.078 7.078 7.478 -0.400 25567 13129 1 18 . 1 1 149 149 TRP N N 149 118.168 118.168 121.093 -2.925 25567 13130 1 18 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.980 -0.379 25567 13131 1 18 . 1 1 149 149 TRP C C 149 174.199 174.199 175.550 -1.351 25567 13132 1 18 . 1 1 149 149 TRP CA C 149 53.795 53.795 54.981 -1.187 25567 13133 1 18 . 1 1 149 149 TRP CB C 149 27.011 27.011 29.192 -2.181 25567 13134 1 18 . 1 1 149 149 TRP H H 149 7.914 7.914 7.498 0.416 25567 13135 1 18 . 1 1 150 150 SER N N 150 109.636 109.636 112.128 -2.492 25567 13136 1 18 . 1 1 150 150 SER HA H 150 4.242 4.242 4.568 -0.326 25567 13137 1 18 . 1 1 150 150 SER C C 150 170.173 170.173 174.751 -4.578 25567 13138 1 18 . 1 1 150 150 SER CA C 150 56.912 56.912 58.293 -1.381 25567 13139 1 18 . 1 1 150 150 SER CB C 150 62.087 62.087 63.641 -1.554 25567 13140 1 18 . 1 1 150 150 SER H H 150 7.814 7.814 7.983 -0.169 25567 13141 1 19 . 1 1 2 2 MET HA H 2 4.416 4.416 5.129 -0.713 25567 13142 1 19 . 1 1 2 2 MET CA C 2 52.847 52.847 54.632 -1.785 25567 13143 1 19 . 1 1 2 2 MET CB C 2 30.672 30.672 35.496 -4.824 25567 13144 1 19 . 1 1 3 3 ALA N N 3 125.563 125.563 125.506 0.057 25567 13145 1 19 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.612 -0.240 25567 13146 1 19 . 1 1 3 3 ALA C C 3 174.728 174.728 175.760 -1.032 25567 13147 1 19 . 1 1 3 3 ALA CA C 3 49.348 49.348 51.752 -2.405 25567 13148 1 19 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.370 -3.435 25567 13149 1 19 . 1 1 3 3 ALA H H 3 8.342 8.342 8.596 -0.254 25567 13150 1 19 . 1 1 4 4 LYS N N 4 121.767 121.767 124.643 -2.876 25567 13151 1 19 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.330 -0.100 25567 13152 1 19 . 1 1 4 4 LYS C C 4 174.577 174.577 176.021 -1.444 25567 13153 1 19 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.870 -1.881 25567 13154 1 19 . 1 1 4 4 LYS CB C 4 31.555 31.555 31.911 -0.356 25567 13155 1 19 . 1 1 4 4 LYS H H 4 8.500 8.500 8.546 -0.046 25567 13156 1 19 . 1 1 5 5 LYS N N 5 129.654 129.654 122.640 7.014 25567 13157 1 19 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.510 0.016 25567 13158 1 19 . 1 1 5 5 LYS C C 5 174.731 174.731 176.866 -2.135 25567 13159 1 19 . 1 1 5 5 LYS CA C 5 54.746 54.746 56.746 -2.000 25567 13160 1 19 . 1 1 5 5 LYS CB C 5 29.894 29.894 33.269 -3.375 25567 13161 1 19 . 1 1 5 5 LYS H H 5 10.035 10.035 7.911 2.124 25567 13162 1 19 . 1 1 6 6 THR N N 6 126.212 126.212 113.264 12.948 25567 13163 1 19 . 1 1 6 6 THR HA H 6 5.654 5.654 5.262 0.392 25567 13164 1 19 . 1 1 6 6 THR C C 6 169.897 169.897 172.917 -3.020 25567 13165 1 19 . 1 1 6 6 THR CA C 6 60.647 60.647 61.928 -1.281 25567 13166 1 19 . 1 1 6 6 THR CB C 6 68.152 68.152 72.633 -4.481 25567 13167 1 19 . 1 1 6 6 THR H H 6 8.557 8.557 8.273 0.284 25567 13168 1 19 . 1 1 7 7 LEU N N 7 130.776 130.776 124.573 6.203 25567 13169 1 19 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.895 -0.276 25567 13170 1 19 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.158 -3.062 25567 13171 1 19 . 1 1 7 7 LEU CB C 7 41.043 41.043 45.943 -4.900 25567 13172 1 19 . 1 1 7 7 LEU H H 7 8.610 8.610 8.731 -0.121 25567 13173 1 19 . 1 1 8 8 ILE N N 8 127.175 127.175 124.772 2.403 25567 13174 1 19 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.381 0.475 25567 13175 1 19 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.343 -2.951 25567 13176 1 19 . 1 1 8 8 ILE CB C 8 36.864 36.864 37.715 -0.851 25567 13177 1 19 . 1 1 8 8 ILE H H 8 9.263 9.263 8.566 0.697 25567 13178 1 19 . 1 1 9 9 LEU N N 9 127.117 127.117 128.102 -0.985 25567 13179 1 19 . 1 1 9 9 LEU HA H 9 5.696 5.696 4.791 0.905 25567 13180 1 19 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.982 -4.030 25567 13181 1 19 . 1 1 9 9 LEU CB C 9 43.827 43.827 42.285 1.542 25567 13182 1 19 . 1 1 9 9 LEU H H 9 9.262 9.262 7.942 1.320 25567 13183 1 19 . 1 1 10 10 TYR N N 10 113.544 113.544 115.723 -2.179 25567 13184 1 19 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.139 0.392 25567 13185 1 19 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.782 -2.953 25567 13186 1 19 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.987 -2.372 25567 13187 1 19 . 1 1 10 10 TYR H H 10 7.425 7.425 8.054 -0.629 25567 13188 1 19 . 1 1 11 11 TYR N N 11 121.235 121.235 125.442 -4.207 25567 13189 1 19 . 1 1 11 11 TYR HA H 11 4.810 4.810 5.159 -0.349 25567 13190 1 19 . 1 1 11 11 TYR CA C 11 53.889 53.889 55.371 -1.482 25567 13191 1 19 . 1 1 11 11 TYR CB C 11 40.467 40.467 37.268 3.199 25567 13192 1 19 . 1 1 11 11 TYR H H 11 7.781 7.781 9.065 -1.284 25567 13193 1 19 . 1 1 14 14 SER CA C 14 54.675 54.675 58.855 -4.181 25567 13194 1 19 . 1 1 14 14 SER CB C 14 61.621 61.621 63.298 -1.677 25567 13195 1 19 . 1 1 15 15 GLY N N 15 110.420 110.420 108.828 1.592 25567 13196 1 19 . 1 1 15 15 GLY CA C 15 43.727 43.727 46.106 -2.379 25567 13197 1 19 . 1 1 15 15 GLY H H 15 7.757 7.757 8.508 -0.751 25567 13198 1 19 . 1 1 17 17 THR HA H 17 4.122 4.122 4.330 -0.208 25567 13199 1 19 . 1 1 17 17 THR CA C 17 64.748 64.748 62.424 2.324 25567 13200 1 19 . 1 1 17 17 THR CB C 17 64.532 64.532 69.161 -4.629 25567 13201 1 19 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.834 -0.916 25567 13202 1 19 . 1 1 18 18 LYS C C 18 173.812 173.812 178.042 -4.230 25567 13203 1 19 . 1 1 18 18 LYS CA C 18 57.003 57.003 57.946 -0.943 25567 13204 1 19 . 1 1 18 18 LYS CB C 18 29.768 29.768 33.084 -3.316 25567 13205 1 19 . 1 1 19 19 LYS N N 19 116.699 116.699 120.466 -3.767 25567 13206 1 19 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.881 0.067 25567 13207 1 19 . 1 1 19 19 LYS C C 19 177.221 177.221 177.202 0.019 25567 13208 1 19 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.975 -2.554 25567 13209 1 19 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.123 -1.489 25567 13210 1 19 . 1 1 19 19 LYS H H 19 7.476 7.476 8.794 -1.318 25567 13211 1 19 . 1 1 20 20 MET N N 20 118.946 118.946 117.075 1.871 25567 13212 1 19 . 1 1 20 20 MET HA H 20 4.474 4.474 4.300 0.174 25567 13213 1 19 . 1 1 20 20 MET C C 20 173.826 173.826 175.409 -1.583 25567 13214 1 19 . 1 1 20 20 MET CA C 20 52.285 52.285 55.448 -3.163 25567 13215 1 19 . 1 1 20 20 MET CB C 20 26.921 26.921 30.769 -3.848 25567 13216 1 19 . 1 1 20 20 MET H H 20 7.457 7.457 8.022 -0.565 25567 13217 1 19 . 1 1 21 21 ALA N N 21 123.375 123.375 120.634 2.741 25567 13218 1 19 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.145 -0.593 25567 13219 1 19 . 1 1 21 21 ALA C C 21 176.542 176.542 178.355 -1.813 25567 13220 1 19 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.271 -0.620 25567 13221 1 19 . 1 1 21 21 ALA CB C 21 16.282 16.282 20.068 -3.786 25567 13222 1 19 . 1 1 21 21 ALA H H 21 8.549 8.549 7.860 0.689 25567 13223 1 19 . 1 1 22 22 GLU N N 22 116.906 116.906 120.501 -3.595 25567 13224 1 19 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.925 -0.252 25567 13225 1 19 . 1 1 22 22 GLU C C 22 176.658 176.658 178.782 -2.124 25567 13226 1 19 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.536 -2.931 25567 13227 1 19 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.335 -2.686 25567 13228 1 19 . 1 1 22 22 GLU H H 22 8.085 8.085 8.465 -0.380 25567 13229 1 19 . 1 1 23 23 LYS N N 23 123.301 123.301 119.402 3.899 25567 13230 1 19 . 1 1 23 23 LYS HA H 23 3.820 3.820 3.976 -0.156 25567 13231 1 19 . 1 1 23 23 LYS C C 23 177.363 177.363 179.032 -1.669 25567 13232 1 19 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.318 -2.347 25567 13233 1 19 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.042 -2.511 25567 13234 1 19 . 1 1 23 23 LYS H H 23 7.703 7.703 7.792 -0.089 25567 13235 1 19 . 1 1 24 24 ILE N N 24 121.894 121.894 117.095 4.799 25567 13236 1 19 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.596 -0.300 25567 13237 1 19 . 1 1 24 24 ILE C C 24 174.944 174.944 178.140 -3.196 25567 13238 1 19 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.977 -1.744 25567 13239 1 19 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.470 -2.726 25567 13240 1 19 . 1 1 24 24 ILE H H 24 8.458 8.458 7.958 0.500 25567 13241 1 19 . 1 1 25 25 ASN N N 25 118.580 118.580 117.663 0.917 25567 13242 1 19 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.394 -0.160 25567 13243 1 19 . 1 1 25 25 ASN C C 25 173.567 173.567 176.981 -3.414 25567 13244 1 19 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.451 -4.127 25567 13245 1 19 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.569 -0.387 25567 13246 1 19 . 1 1 25 25 ASN H H 25 8.273 8.273 7.840 0.433 25567 13247 1 19 . 1 1 26 26 SER N N 26 112.132 112.132 112.324 -0.192 25567 13248 1 19 . 1 1 26 26 SER HA H 26 4.148 4.148 4.485 -0.337 25567 13249 1 19 . 1 1 26 26 SER C C 26 172.083 172.083 174.401 -2.318 25567 13250 1 19 . 1 1 26 26 SER CA C 26 57.865 57.865 59.590 -1.725 25567 13251 1 19 . 1 1 26 26 SER CB C 26 60.816 60.816 63.461 -2.645 25567 13252 1 19 . 1 1 26 26 SER H H 26 7.444 7.444 7.723 -0.279 25567 13253 1 19 . 1 1 27 27 GLU N N 27 120.080 120.080 118.916 1.164 25567 13254 1 19 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.492 -0.392 25567 13255 1 19 . 1 1 27 27 GLU C C 27 173.647 173.647 176.347 -2.700 25567 13256 1 19 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.076 -1.874 25567 13257 1 19 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.949 -4.065 25567 13258 1 19 . 1 1 27 27 GLU H H 27 7.453 7.453 7.696 -0.243 25567 13259 1 19 . 1 1 28 28 ILE N N 28 118.759 118.759 118.474 0.285 25567 13260 1 19 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.251 -0.047 25567 13261 1 19 . 1 1 28 28 ILE C C 28 172.474 172.474 174.809 -2.335 25567 13262 1 19 . 1 1 28 28 ILE CA C 28 57.747 57.747 59.784 -2.037 25567 13263 1 19 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.536 -4.738 25567 13264 1 19 . 1 1 28 28 ILE H H 28 7.258 7.258 7.297 -0.039 25567 13265 1 19 . 1 1 29 29 LYS N N 29 130.618 130.618 122.733 7.885 25567 13266 1 19 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.440 -0.435 25567 13267 1 19 . 1 1 29 29 LYS C C 29 174.375 174.375 176.156 -1.781 25567 13268 1 19 . 1 1 29 29 LYS CA C 29 55.659 55.659 55.750 -0.091 25567 13269 1 19 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.246 -3.687 25567 13270 1 19 . 1 1 29 29 LYS H H 29 8.588 8.588 8.647 -0.059 25567 13271 1 19 . 1 1 30 30 ASP N N 30 119.366 119.366 120.909 -1.543 25567 13272 1 19 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.318 0.084 25567 13273 1 19 . 1 1 30 30 ASP C C 30 172.580 172.580 175.067 -2.487 25567 13274 1 19 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.271 -1.647 25567 13275 1 19 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.449 -3.621 25567 13276 1 19 . 1 1 30 30 ASP H H 30 8.940 8.940 8.874 0.066 25567 13277 1 19 . 1 1 31 31 SER N N 31 114.035 114.035 113.051 0.984 25567 13278 1 19 . 1 1 31 31 SER HA H 31 4.781 4.781 4.745 0.036 25567 13279 1 19 . 1 1 31 31 SER C C 31 171.136 171.136 174.687 -3.551 25567 13280 1 19 . 1 1 31 31 SER CA C 31 55.638 55.638 58.494 -2.856 25567 13281 1 19 . 1 1 31 31 SER CB C 31 62.388 62.388 64.346 -1.958 25567 13282 1 19 . 1 1 31 31 SER H H 31 8.030 8.030 7.943 0.087 25567 13283 1 19 . 1 1 32 32 GLU N N 32 121.406 121.406 124.381 -2.975 25567 13284 1 19 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.641 0.094 25567 13285 1 19 . 1 1 32 32 GLU C C 32 171.205 171.205 175.418 -4.213 25567 13286 1 19 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.818 -3.749 25567 13287 1 19 . 1 1 32 32 GLU CB C 32 30.890 30.890 32.822 -1.931 25567 13288 1 19 . 1 1 32 32 GLU H H 32 8.188 8.188 8.941 -0.753 25567 13289 1 19 . 1 1 33 33 LEU N N 33 126.143 126.143 116.799 9.344 25567 13290 1 19 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.419 -0.134 25567 13291 1 19 . 1 1 33 33 LEU C C 33 173.401 173.401 175.279 -1.878 25567 13292 1 19 . 1 1 33 33 LEU CA C 33 51.334 51.334 52.819 -1.485 25567 13293 1 19 . 1 1 33 33 LEU CB C 33 43.623 43.623 46.370 -2.747 25567 13294 1 19 . 1 1 33 33 LEU H H 33 8.627 8.627 8.155 0.472 25567 13295 1 19 . 1 1 34 34 LYS N N 34 127.122 127.122 119.705 7.417 25567 13296 1 19 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.637 -0.038 25567 13297 1 19 . 1 1 34 34 LYS C C 34 169.644 169.644 173.595 -3.951 25567 13298 1 19 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.780 -2.427 25567 13299 1 19 . 1 1 34 34 LYS CB C 34 34.172 34.172 35.863 -1.691 25567 13300 1 19 . 1 1 34 34 LYS H H 34 9.399 9.399 8.982 0.417 25567 13301 1 19 . 1 1 35 35 GLU N N 35 122.766 122.766 121.905 0.861 25567 13302 1 19 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.609 -1.251 25567 13303 1 19 . 1 1 35 35 GLU C C 35 172.875 172.875 176.012 -3.137 25567 13304 1 19 . 1 1 35 35 GLU CA C 35 52.640 52.640 54.601 -1.961 25567 13305 1 19 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.052 -1.784 25567 13306 1 19 . 1 1 35 35 GLU H H 35 8.166 8.166 8.339 -0.173 25567 13307 1 19 . 1 1 36 36 VAL N N 36 126.674 126.674 125.241 1.433 25567 13308 1 19 . 1 1 36 36 VAL HA H 36 3.861 3.861 3.811 0.050 25567 13309 1 19 . 1 1 36 36 VAL C C 36 171.451 171.451 175.705 -4.254 25567 13310 1 19 . 1 1 36 36 VAL CA C 36 59.537 59.537 62.529 -2.992 25567 13311 1 19 . 1 1 36 36 VAL CB C 36 29.689 29.689 31.513 -1.824 25567 13312 1 19 . 1 1 36 36 VAL H H 36 8.632 8.632 8.738 -0.106 25567 13313 1 19 . 1 1 37 37 LYS N N 37 126.181 126.181 127.485 -1.304 25567 13314 1 19 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.627 0.312 25567 13315 1 19 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.857 -2.678 25567 13316 1 19 . 1 1 37 37 LYS CB C 37 32.898 32.898 34.224 -1.326 25567 13317 1 19 . 1 1 37 37 LYS H H 37 7.867 7.867 8.668 -0.801 25567 13318 1 19 . 1 1 38 38 VAL N N 38 113.540 113.540 116.513 -2.973 25567 13319 1 19 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.441 0.245 25567 13320 1 19 . 1 1 38 38 VAL C C 38 173.633 173.633 175.477 -1.844 25567 13321 1 19 . 1 1 38 38 VAL CA C 38 57.284 57.284 60.150 -2.866 25567 13322 1 19 . 1 1 38 38 VAL CB C 38 31.964 31.964 32.321 -0.357 25567 13323 1 19 . 1 1 38 38 VAL H H 38 8.389 8.389 8.349 0.040 25567 13324 1 19 . 1 1 39 39 SER N N 39 118.860 118.860 115.271 3.589 25567 13325 1 19 . 1 1 39 39 SER HA H 39 4.194 4.194 4.750 -0.556 25567 13326 1 19 . 1 1 39 39 SER C C 39 173.059 173.059 173.232 -0.173 25567 13327 1 19 . 1 1 39 39 SER CA C 39 56.227 56.227 56.655 -0.428 25567 13328 1 19 . 1 1 39 39 SER CB C 39 60.771 60.771 64.702 -3.931 25567 13329 1 19 . 1 1 39 39 SER H H 39 8.668 8.668 8.470 0.198 25567 13330 1 19 . 1 1 40 40 GLU N N 40 125.769 125.769 119.234 6.535 25567 13331 1 19 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.365 -0.208 25567 13332 1 19 . 1 1 40 40 GLU C C 40 174.484 174.484 176.112 -1.628 25567 13333 1 19 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.721 -1.171 25567 13334 1 19 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.259 -3.205 25567 13335 1 19 . 1 1 40 40 GLU H H 40 8.878 8.878 8.510 0.368 25567 13336 1 19 . 1 1 41 41 GLY N N 41 112.165 112.165 109.818 2.347 25567 13337 1 19 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.343 -2.636 25567 13338 1 19 . 1 1 41 41 GLY H H 41 8.743 8.743 8.683 0.060 25567 13339 1 19 . 1 1 44 44 ASP N N 44 122.324 122.324 119.547 2.777 25567 13340 1 19 . 1 1 44 44 ASP CB C 44 42.156 42.156 41.819 0.337 25567 13341 1 19 . 1 1 44 44 ASP H H 44 7.918 7.918 7.892 0.026 25567 13342 1 19 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.438 -0.376 25567 13343 1 19 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.044 -0.634 25567 13344 1 19 . 1 1 45 45 ALA CB C 45 16.376 16.376 19.781 -3.405 25567 13345 1 19 . 1 1 47 47 MET CA C 47 54.118 54.118 55.289 -1.171 25567 13346 1 19 . 1 1 47 47 MET CB C 47 27.527 27.527 33.682 -6.155 25567 13347 1 19 . 1 1 48 48 TYR N N 48 120.075 120.075 119.416 0.659 25567 13348 1 19 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.165 -0.011 25567 13349 1 19 . 1 1 48 48 TYR C C 48 172.217 172.217 174.512 -2.295 25567 13350 1 19 . 1 1 48 48 TYR CA C 48 57.377 57.377 59.364 -1.987 25567 13351 1 19 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.714 -3.217 25567 13352 1 19 . 1 1 48 48 TYR H H 48 7.810 7.810 8.493 -0.683 25567 13353 1 19 . 1 1 49 49 LYS N N 49 118.369 118.369 120.286 -1.917 25567 13354 1 19 . 1 1 49 49 LYS H H 49 8.116 8.116 7.907 0.209 25567 13355 1 19 . 1 1 50 50 THR N N 50 116.979 116.979 114.648 2.331 25567 13356 1 19 . 1 1 50 50 THR CB C 50 66.373 66.373 69.703 -3.330 25567 13357 1 19 . 1 1 50 50 THR H H 50 7.741 7.741 7.614 0.127 25567 13358 1 19 . 1 1 51 51 SER N N 51 116.155 116.155 118.300 -2.145 25567 13359 1 19 . 1 1 51 51 SER HA H 51 3.771 3.771 4.608 -0.837 25567 13360 1 19 . 1 1 51 51 SER C C 51 170.563 170.563 173.644 -3.081 25567 13361 1 19 . 1 1 51 51 SER CA C 51 54.840 54.840 57.473 -2.633 25567 13362 1 19 . 1 1 51 51 SER CB C 51 60.318 60.318 63.993 -3.675 25567 13363 1 19 . 1 1 51 51 SER H H 51 7.853 7.853 8.253 -0.400 25567 13364 1 19 . 1 1 54 54 ALA N N 54 123.234 123.234 121.004 2.230 25567 13365 1 19 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.573 -0.325 25567 13366 1 19 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.459 -1.191 25567 13367 1 19 . 1 1 54 54 ALA CB C 54 16.434 16.434 20.224 -3.790 25567 13368 1 19 . 1 1 54 54 ALA H H 54 8.207 8.207 8.147 0.060 25567 13369 1 19 . 1 1 55 55 LEU N N 55 118.603 118.603 121.159 -2.556 25567 13370 1 19 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.307 -0.367 25567 13371 1 19 . 1 1 55 55 LEU CA C 55 54.711 54.711 56.477 -1.766 25567 13372 1 19 . 1 1 55 55 LEU CB C 55 38.913 38.913 41.838 -2.925 25567 13373 1 19 . 1 1 55 55 LEU H H 55 7.960 7.960 8.035 -0.075 25567 13374 1 19 . 1 1 58 58 ILE HA H 58 3.676 3.676 3.800 -0.124 25567 13375 1 19 . 1 1 58 58 ILE CA C 58 61.494 61.494 62.891 -1.397 25567 13376 1 19 . 1 1 58 58 ILE CB C 58 36.054 36.054 38.378 -2.324 25567 13377 1 19 . 1 1 59 59 GLN N N 59 117.579 117.579 118.353 -0.774 25567 13378 1 19 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.435 -0.302 25567 13379 1 19 . 1 1 59 59 GLN CA C 59 54.009 54.009 54.973 -0.964 25567 13380 1 19 . 1 1 59 59 GLN CB C 59 26.651 26.651 29.778 -3.127 25567 13381 1 19 . 1 1 59 59 GLN H H 59 8.268 8.268 7.375 0.893 25567 13382 1 19 . 1 1 60 60 GLY N N 60 107.308 107.308 112.514 -5.206 25567 13383 1 19 . 1 1 60 60 GLY CA C 60 42.979 42.979 46.092 -3.113 25567 13384 1 19 . 1 1 60 60 GLY H H 60 7.780 7.780 8.732 -0.952 25567 13385 1 19 . 1 1 61 61 ASN N N 61 117.747 117.747 119.863 -2.116 25567 13386 1 19 . 1 1 61 61 ASN HA H 61 4.534 4.534 5.118 -0.584 25567 13387 1 19 . 1 1 61 61 ASN CA C 61 51.235 51.235 51.702 -0.467 25567 13388 1 19 . 1 1 61 61 ASN CB C 61 36.424 36.424 41.190 -4.766 25567 13389 1 19 . 1 1 61 61 ASN H H 61 8.108 8.108 7.984 0.124 25567 13390 1 19 . 1 1 64 64 PHE N N 64 120.102 120.102 122.093 -1.991 25567 13391 1 19 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.917 -0.538 25567 13392 1 19 . 1 1 64 64 PHE CA C 64 51.748 51.748 53.624 -1.876 25567 13393 1 19 . 1 1 64 64 PHE CB C 64 35.275 35.275 39.089 -3.814 25567 13394 1 19 . 1 1 64 64 PHE H H 64 8.300 8.300 7.439 0.861 25567 13395 1 19 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.611 -0.276 25567 13396 1 19 . 1 1 65 65 PRO C C 65 173.870 173.870 176.264 -2.394 25567 13397 1 19 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.698 -2.681 25567 13398 1 19 . 1 1 65 65 PRO CB C 65 29.635 29.635 33.020 -3.385 25567 13399 1 19 . 1 1 66 66 GLU N N 66 121.258 121.258 118.565 2.693 25567 13400 1 19 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.346 -0.112 25567 13401 1 19 . 1 1 66 66 GLU C C 66 173.981 173.981 176.330 -2.349 25567 13402 1 19 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.090 -2.303 25567 13403 1 19 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.603 -2.828 25567 13404 1 19 . 1 1 66 66 GLU H H 66 8.316 8.316 8.154 0.162 25567 13405 1 19 . 1 1 67 67 ILE N N 67 114.290 114.290 112.226 2.064 25567 13406 1 19 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.683 0.446 25567 13407 1 19 . 1 1 67 67 ILE C C 67 172.700 172.700 174.641 -1.941 25567 13408 1 19 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.272 -2.833 25567 13409 1 19 . 1 1 67 67 ILE CB C 67 39.159 39.159 41.406 -2.247 25567 13410 1 19 . 1 1 67 67 ILE H H 67 8.366 8.366 7.980 0.386 25567 13411 1 19 . 1 1 68 68 GLN N N 68 121.422 121.422 119.279 2.143 25567 13412 1 19 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.709 -0.208 25567 13413 1 19 . 1 1 68 68 GLN C C 68 171.675 171.675 174.218 -2.543 25567 13414 1 19 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.761 -2.488 25567 13415 1 19 . 1 1 68 68 GLN CB C 68 27.143 27.143 33.144 -6.001 25567 13416 1 19 . 1 1 68 68 GLN H H 68 8.737 8.737 8.439 0.298 25567 13417 1 19 . 1 1 69 69 LEU N N 69 125.311 125.311 116.960 8.351 25567 13418 1 19 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.820 -0.314 25567 13419 1 19 . 1 1 69 69 LEU C C 69 172.634 172.634 175.011 -2.377 25567 13420 1 19 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.787 -2.028 25567 13421 1 19 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.317 -0.913 25567 13422 1 19 . 1 1 69 69 LEU H H 69 8.051 8.051 8.199 -0.148 25567 13423 1 19 . 1 1 70 70 ASP N N 70 122.763 122.763 118.909 3.854 25567 13424 1 19 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.728 -0.305 25567 13425 1 19 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.547 -1.937 25567 13426 1 19 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.882 -4.165 25567 13427 1 19 . 1 1 70 70 ASP H H 70 8.313 8.313 8.285 0.028 25567 13428 1 19 . 1 1 71 71 ASN N N 71 117.413 117.413 118.446 -1.033 25567 13429 1 19 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.686 -0.349 25567 13430 1 19 . 1 1 71 71 ASN C C 71 171.770 171.770 174.658 -2.888 25567 13431 1 19 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.290 -1.799 25567 13432 1 19 . 1 1 71 71 ASN CB C 71 35.326 35.326 38.197 -2.871 25567 13433 1 19 . 1 1 71 71 ASN H H 71 8.407 8.407 8.383 0.024 25567 13434 1 19 . 1 1 72 72 ILE N N 72 123.752 123.752 123.473 0.279 25567 13435 1 19 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.153 -0.213 25567 13436 1 19 . 1 1 72 72 ILE C C 72 171.621 171.621 174.431 -2.810 25567 13437 1 19 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.453 -3.121 25567 13438 1 19 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.216 -0.727 25567 13439 1 19 . 1 1 72 72 ILE H H 72 7.639 7.639 7.532 0.107 25567 13440 1 19 . 1 1 73 73 ASP N N 73 125.252 125.252 122.698 2.554 25567 13441 1 19 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.657 -0.032 25567 13442 1 19 . 1 1 73 73 ASP C C 73 174.034 174.034 176.246 -2.212 25567 13443 1 19 . 1 1 73 73 ASP CA C 73 49.203 49.203 52.919 -3.716 25567 13444 1 19 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.833 -5.809 25567 13445 1 19 . 1 1 73 73 ASP H H 73 8.394 8.394 8.473 -0.079 25567 13446 1 19 . 1 1 74 74 TYR N N 74 123.108 123.108 125.206 -2.098 25567 13447 1 19 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.491 -0.613 25567 13448 1 19 . 1 1 74 74 TYR C C 74 173.637 173.637 177.429 -3.792 25567 13449 1 19 . 1 1 74 74 TYR CA C 74 59.474 59.474 59.179 0.295 25567 13450 1 19 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.172 -3.450 25567 13451 1 19 . 1 1 74 74 TYR H H 74 7.392 7.392 8.452 -1.060 25567 13452 1 19 . 1 1 75 75 ASN N N 75 109.422 109.422 117.181 -7.759 25567 13453 1 19 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.673 0.253 25567 13454 1 19 . 1 1 75 75 ASN C C 75 172.574 172.574 175.651 -3.077 25567 13455 1 19 . 1 1 75 75 ASN CA C 75 52.761 52.761 56.052 -3.291 25567 13456 1 19 . 1 1 75 75 ASN CB C 75 35.617 35.617 39.029 -3.412 25567 13457 1 19 . 1 1 75 75 ASN H H 75 8.058 8.058 8.236 -0.178 25567 13458 1 19 . 1 1 76 76 ASN N N 76 117.422 117.422 115.557 1.865 25567 13459 1 19 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.624 -0.169 25567 13460 1 19 . 1 1 76 76 ASN C C 76 171.132 171.132 174.486 -3.354 25567 13461 1 19 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.012 -1.845 25567 13462 1 19 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.210 -2.482 25567 13463 1 19 . 1 1 76 76 ASN H H 76 7.768 7.768 7.609 0.159 25567 13464 1 19 . 1 1 77 77 TYR N N 77 116.873 116.873 118.341 -1.468 25567 13465 1 19 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.711 -0.348 25567 13466 1 19 . 1 1 77 77 TYR C C 77 172.175 172.175 174.615 -2.440 25567 13467 1 19 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.755 -2.391 25567 13468 1 19 . 1 1 77 77 TYR CB C 77 37.165 37.165 41.658 -4.493 25567 13469 1 19 . 1 1 77 77 TYR H H 77 7.825 7.825 7.542 0.283 25567 13470 1 19 . 1 1 78 78 ASP N N 78 121.271 121.271 122.956 -1.685 25567 13471 1 19 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.664 0.141 25567 13472 1 19 . 1 1 78 78 ASP C C 78 172.641 172.641 175.319 -2.678 25567 13473 1 19 . 1 1 78 78 ASP CA C 78 53.255 53.255 55.934 -2.679 25567 13474 1 19 . 1 1 78 78 ASP CB C 78 41.075 41.075 41.990 -0.915 25567 13475 1 19 . 1 1 78 78 ASP H H 78 9.058 9.058 8.929 0.129 25567 13476 1 19 . 1 1 79 79 LEU N N 79 122.985 122.985 118.201 4.784 25567 13477 1 19 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.107 0.007 25567 13478 1 19 . 1 1 79 79 LEU C C 79 170.721 170.721 174.695 -3.974 25567 13479 1 19 . 1 1 79 79 LEU CA C 79 51.316 51.316 53.921 -2.605 25567 13480 1 19 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.767 -3.425 25567 13481 1 19 . 1 1 79 79 LEU H H 79 7.893 7.893 7.617 0.276 25567 13482 1 19 . 1 1 80 80 ILE N N 80 126.364 126.364 124.505 1.859 25567 13483 1 19 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.639 0.450 25567 13484 1 19 . 1 1 80 80 ILE C C 80 171.580 171.580 174.590 -3.010 25567 13485 1 19 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.317 -2.900 25567 13486 1 19 . 1 1 80 80 ILE CB C 80 38.136 38.136 39.692 -1.556 25567 13487 1 19 . 1 1 80 80 ILE H H 80 8.717 8.717 9.147 -0.430 25567 13488 1 19 . 1 1 81 81 LEU N N 81 126.199 126.199 127.583 -1.384 25567 13489 1 19 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.020 0.115 25567 13490 1 19 . 1 1 81 81 LEU C C 81 172.979 172.979 176.508 -3.529 25567 13491 1 19 . 1 1 81 81 LEU CA C 81 49.633 49.633 54.334 -4.701 25567 13492 1 19 . 1 1 81 81 LEU CB C 81 42.159 42.159 43.417 -1.258 25567 13493 1 19 . 1 1 81 81 LEU H H 81 9.230 9.230 8.997 0.233 25567 13494 1 19 . 1 1 82 82 ILE N N 82 120.505 120.505 119.287 1.218 25567 13495 1 19 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.323 0.593 25567 13496 1 19 . 1 1 82 82 ILE C C 82 173.011 173.011 173.730 -0.719 25567 13497 1 19 . 1 1 82 82 ILE CA C 82 56.828 56.828 60.530 -3.702 25567 13498 1 19 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.704 -3.636 25567 13499 1 19 . 1 1 82 82 ILE H H 82 8.796 8.796 8.296 0.500 25567 13500 1 19 . 1 1 83 83 GLY N N 83 120.857 120.857 112.450 8.407 25567 13501 1 19 . 1 1 83 83 GLY CA C 83 40.803 40.803 42.637 -1.834 25567 13502 1 19 . 1 1 83 83 GLY H H 83 9.525 9.525 8.044 1.481 25567 13503 1 19 . 1 1 84 84 SER N N 84 116.007 116.007 116.105 -0.098 25567 13504 1 19 . 1 1 84 84 SER HA H 84 5.476 5.476 4.994 0.482 25567 13505 1 19 . 1 1 84 84 SER CA C 84 51.937 51.937 55.348 -3.411 25567 13506 1 19 . 1 1 84 84 SER CB C 84 64.533 64.533 65.242 -0.709 25567 13507 1 19 . 1 1 84 84 SER H H 84 7.617 7.617 7.614 0.003 25567 13508 1 19 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.623 0.578 25567 13509 1 19 . 1 1 85 85 PRO C C 85 173.574 173.574 175.611 -2.037 25567 13510 1 19 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.817 -3.329 25567 13511 1 19 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.474 -1.334 25567 13512 1 19 . 1 1 86 86 VAL N N 86 117.603 117.603 115.554 2.049 25567 13513 1 19 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.341 0.032 25567 13514 1 19 . 1 1 86 86 VAL C C 86 172.777 172.777 174.501 -1.724 25567 13515 1 19 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.730 -2.127 25567 13516 1 19 . 1 1 86 86 VAL CB C 86 29.573 29.573 35.680 -6.107 25567 13517 1 19 . 1 1 86 86 VAL H H 86 8.194 8.194 8.113 0.081 25567 13518 1 19 . 1 1 87 87 TRP N N 87 131.187 131.187 121.631 9.556 25567 13519 1 19 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.901 0.297 25567 13520 1 19 . 1 1 87 87 TRP C C 87 173.295 173.295 175.278 -1.983 25567 13521 1 19 . 1 1 87 87 TRP CA C 87 50.784 50.784 58.404 -7.620 25567 13522 1 19 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.575 -3.829 25567 13523 1 19 . 1 1 87 87 TRP H H 87 9.637 9.637 8.471 1.166 25567 13524 1 19 . 1 1 88 88 SER N N 88 119.829 119.829 116.900 2.929 25567 13525 1 19 . 1 1 88 88 SER HA H 88 3.986 3.986 5.031 -1.045 25567 13526 1 19 . 1 1 88 88 SER C C 88 172.375 172.375 175.179 -2.804 25567 13527 1 19 . 1 1 88 88 SER CA C 88 55.932 55.932 56.925 -0.993 25567 13528 1 19 . 1 1 88 88 SER CB C 88 59.178 59.178 62.824 -3.646 25567 13529 1 19 . 1 1 88 88 SER H H 88 9.272 9.272 8.031 1.241 25567 13530 1 19 . 1 1 89 89 GLY N N 89 101.498 101.498 112.605 -11.107 25567 13531 1 19 . 1 1 89 89 GLY CA C 89 42.671 42.671 47.069 -4.398 25567 13532 1 19 . 1 1 89 89 GLY H H 89 7.463 7.463 9.247 -1.784 25567 13533 1 19 . 1 1 90 90 TYR N N 90 121.064 121.064 115.611 5.453 25567 13534 1 19 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.009 -0.793 25567 13535 1 19 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.183 -0.093 25567 13536 1 19 . 1 1 90 90 TYR CB C 90 37.195 37.195 35.871 1.324 25567 13537 1 19 . 1 1 90 90 TYR H H 90 8.064 8.064 8.285 -0.221 25567 13538 1 19 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.630 0.302 25567 13539 1 19 . 1 1 91 91 PRO C C 91 171.019 171.019 176.361 -5.342 25567 13540 1 19 . 1 1 91 91 PRO CA C 91 58.994 58.994 64.355 -5.361 25567 13541 1 19 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.368 -5.875 25567 13542 1 19 . 1 1 92 92 ALA N N 92 119.893 119.893 121.669 -1.776 25567 13543 1 19 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.655 -1.204 25567 13544 1 19 . 1 1 92 92 ALA C C 92 176.477 176.477 176.814 -0.337 25567 13545 1 19 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.209 -1.642 25567 13546 1 19 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.249 -5.448 25567 13547 1 19 . 1 1 92 92 ALA H H 92 7.278 7.278 7.966 -0.688 25567 13548 1 19 . 1 1 93 93 THR N N 93 112.992 112.992 111.567 1.425 25567 13549 1 19 . 1 1 93 93 THR HA H 93 4.462 4.462 4.805 -0.343 25567 13550 1 19 . 1 1 93 93 THR CA C 93 66.871 66.871 59.441 7.430 25567 13551 1 19 . 1 1 93 93 THR CB C 93 64.362 64.362 68.169 -3.807 25567 13552 1 19 . 1 1 93 93 THR H H 93 6.861 6.861 8.577 -1.716 25567 13553 1 19 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.369 -0.503 25567 13554 1 19 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.809 -0.787 25567 13555 1 19 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.920 -2.641 25567 13556 1 19 . 1 1 95 95 ILE N N 95 111.298 111.298 120.121 -8.823 25567 13557 1 19 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.319 -0.696 25567 13558 1 19 . 1 1 95 95 ILE C C 95 174.264 174.264 175.340 -1.076 25567 13559 1 19 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.275 -1.827 25567 13560 1 19 . 1 1 95 95 ILE CB C 95 31.929 31.929 35.493 -3.564 25567 13561 1 19 . 1 1 95 95 ILE H H 95 7.974 7.974 8.207 -0.233 25567 13562 1 19 . 1 1 96 96 LYS N N 96 123.045 123.045 120.284 2.761 25567 13563 1 19 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.621 -1.509 25567 13564 1 19 . 1 1 96 96 LYS C C 96 174.590 174.590 177.512 -2.922 25567 13565 1 19 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.908 0.237 25567 13566 1 19 . 1 1 96 96 LYS CB C 96 28.845 28.845 34.021 -5.176 25567 13567 1 19 . 1 1 96 96 LYS H H 96 6.958 6.958 7.650 -0.692 25567 13568 1 19 . 1 1 97 97 THR N N 97 113.412 113.412 116.650 -3.238 25567 13569 1 19 . 1 1 97 97 THR HA H 97 3.461 3.461 3.919 -0.458 25567 13570 1 19 . 1 1 97 97 THR C C 97 173.247 173.247 176.296 -3.049 25567 13571 1 19 . 1 1 97 97 THR CA C 97 62.809 62.809 65.951 -3.142 25567 13572 1 19 . 1 1 97 97 THR CB C 97 65.654 65.654 68.112 -2.458 25567 13573 1 19 . 1 1 97 97 THR H H 97 6.366 6.366 7.858 -1.492 25567 13574 1 19 . 1 1 98 98 LEU N N 98 121.201 121.201 122.428 -1.227 25567 13575 1 19 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.008 -0.374 25567 13576 1 19 . 1 1 98 98 LEU C C 98 174.590 174.590 178.389 -3.799 25567 13577 1 19 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.259 -1.638 25567 13578 1 19 . 1 1 98 98 LEU CB C 98 39.895 39.895 40.854 -0.959 25567 13579 1 19 . 1 1 98 98 LEU H H 98 7.554 7.554 7.604 -0.050 25567 13580 1 19 . 1 1 99 99 LEU N N 99 118.677 118.677 118.300 0.377 25567 13581 1 19 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.787 -0.085 25567 13582 1 19 . 1 1 99 99 LEU C C 99 177.457 177.457 178.602 -1.145 25567 13583 1 19 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.829 -2.650 25567 13584 1 19 . 1 1 99 99 LEU CB C 99 38.988 38.988 41.639 -2.651 25567 13585 1 19 . 1 1 99 99 LEU H H 99 8.160 8.160 7.924 0.236 25567 13586 1 19 . 1 1 100 100 ASP N N 100 118.914 118.914 115.072 3.842 25567 13587 1 19 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.361 -0.132 25567 13588 1 19 . 1 1 100 100 ASP C C 100 176.585 176.585 178.514 -1.929 25567 13589 1 19 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.284 -1.768 25567 13590 1 19 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.128 -3.549 25567 13591 1 19 . 1 1 100 100 ASP H H 100 7.872 7.872 7.804 0.068 25567 13592 1 19 . 1 1 101 101 GLN N N 101 118.135 118.135 118.635 -0.500 25567 13593 1 19 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.152 0.008 25567 13594 1 19 . 1 1 101 101 GLN C C 101 174.601 174.601 178.404 -3.803 25567 13595 1 19 . 1 1 101 101 GLN CA C 101 54.960 54.960 58.323 -3.363 25567 13596 1 19 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.085 -3.535 25567 13597 1 19 . 1 1 101 101 GLN H H 101 7.673 7.673 7.584 0.089 25567 13598 1 19 . 1 1 102 102 MET N N 102 118.420 118.420 117.170 1.250 25567 13599 1 19 . 1 1 102 102 MET HA H 102 3.826 3.826 4.162 -0.336 25567 13600 1 19 . 1 1 102 102 MET C C 102 172.780 172.780 176.325 -3.545 25567 13601 1 19 . 1 1 102 102 MET CA C 102 53.428 53.428 55.702 -2.274 25567 13602 1 19 . 1 1 102 102 MET CB C 102 31.221 31.221 30.123 1.098 25567 13603 1 19 . 1 1 102 102 MET H H 102 7.462 7.462 7.633 -0.171 25567 13604 1 19 . 1 1 103 103 LYS N N 103 116.066 116.066 121.256 -5.190 25567 13605 1 19 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.068 -0.148 25567 13606 1 19 . 1 1 103 103 LYS C C 103 173.922 173.922 177.631 -3.709 25567 13607 1 19 . 1 1 103 103 LYS CA C 103 56.282 56.282 59.127 -2.845 25567 13608 1 19 . 1 1 103 103 LYS CB C 103 29.491 29.491 32.285 -2.794 25567 13609 1 19 . 1 1 103 103 LYS H H 103 6.875 6.875 7.793 -0.918 25567 13610 1 19 . 1 1 104 104 ASN N N 104 114.987 114.987 113.617 1.370 25567 13611 1 19 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.790 -0.049 25567 13612 1 19 . 1 1 104 104 ASN C C 104 172.587 172.587 175.297 -2.710 25567 13613 1 19 . 1 1 104 104 ASN CA C 104 50.469 50.469 53.343 -2.874 25567 13614 1 19 . 1 1 104 104 ASN CB C 104 35.822 35.822 38.800 -2.978 25567 13615 1 19 . 1 1 104 104 ASN H H 104 8.517 8.517 8.644 -0.127 25567 13616 1 19 . 1 1 105 105 TYR N N 105 122.755 122.755 119.483 3.272 25567 13617 1 19 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.581 -0.006 25567 13618 1 19 . 1 1 105 105 TYR C C 105 174.260 174.260 175.072 -0.812 25567 13619 1 19 . 1 1 105 105 TYR CA C 105 55.493 55.493 58.053 -2.559 25567 13620 1 19 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.621 -3.558 25567 13621 1 19 . 1 1 105 105 TYR H H 105 8.287 8.287 7.602 0.685 25567 13622 1 19 . 1 1 106 106 ARG N N 106 128.905 128.905 120.866 8.039 25567 13623 1 19 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.642 -0.369 25567 13624 1 19 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.614 -2.593 25567 13625 1 19 . 1 1 106 106 ARG CB C 106 28.130 28.130 32.305 -4.175 25567 13626 1 19 . 1 1 106 106 ARG H H 106 8.841 8.841 8.899 -0.058 25567 13627 1 19 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.769 -2.272 25567 13628 1 19 . 1 1 108 108 GLU N N 108 116.989 116.989 120.450 -3.461 25567 13629 1 19 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.571 0.060 25567 13630 1 19 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.882 -2.206 25567 13631 1 19 . 1 1 108 108 GLU CB C 108 30.402 30.402 32.880 -2.478 25567 13632 1 19 . 1 1 108 108 GLU H H 108 7.536 7.536 8.418 -0.882 25567 13633 1 19 . 1 1 109 109 VAL N N 109 123.416 123.416 121.225 2.191 25567 13634 1 19 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.954 0.367 25567 13635 1 19 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.619 -3.176 25567 13636 1 19 . 1 1 109 109 VAL CB C 109 32.661 32.661 34.260 -1.599 25567 13637 1 19 . 1 1 109 109 VAL H H 109 8.955 8.955 8.819 0.136 25567 13638 1 19 . 1 1 110 110 ALA N N 110 127.975 127.975 128.570 -0.595 25567 13639 1 19 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.017 -0.340 25567 13640 1 19 . 1 1 110 110 ALA CA C 110 47.441 47.441 50.059 -2.618 25567 13641 1 19 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.224 -3.808 25567 13642 1 19 . 1 1 110 110 ALA H H 110 8.860 8.860 8.689 0.171 25567 13643 1 19 . 1 1 111 111 SER N N 111 110.482 110.482 114.759 -4.277 25567 13644 1 19 . 1 1 111 111 SER HA H 111 5.502 5.502 5.495 0.007 25567 13645 1 19 . 1 1 111 111 SER CA C 111 51.630 51.630 56.208 -4.578 25567 13646 1 19 . 1 1 111 111 SER CB C 111 62.267 62.267 65.581 -3.314 25567 13647 1 19 . 1 1 111 111 SER H H 111 7.484 7.484 8.269 -0.785 25567 13648 1 19 . 1 1 112 112 PHE N N 112 125.082 125.082 120.579 4.503 25567 13649 1 19 . 1 1 112 112 PHE HA H 112 6.448 6.448 6.146 0.302 25567 13650 1 19 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.539 -5.105 25567 13651 1 19 . 1 1 112 112 PHE CB C 112 40.500 40.500 42.895 -2.394 25567 13652 1 19 . 1 1 112 112 PHE H H 112 8.025 8.025 8.707 -0.682 25567 13653 1 19 . 1 1 113 113 PHE N N 113 115.872 115.872 117.124 -1.252 25567 13654 1 19 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.144 0.780 25567 13655 1 19 . 1 1 113 113 PHE C C 113 173.293 173.293 173.563 -0.270 25567 13656 1 19 . 1 1 113 113 PHE CA C 113 50.468 50.468 56.791 -6.323 25567 13657 1 19 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.811 -3.418 25567 13658 1 19 . 1 1 113 113 PHE H H 113 7.391 7.391 8.495 -1.104 25567 13659 1 19 . 1 1 114 114 THR N N 114 108.721 108.721 114.029 -5.308 25567 13660 1 19 . 1 1 114 114 THR HA H 114 4.933 4.933 4.242 0.691 25567 13661 1 19 . 1 1 114 114 THR C C 114 171.891 171.891 173.110 -1.219 25567 13662 1 19 . 1 1 114 114 THR CA C 114 56.815 56.815 61.854 -5.039 25567 13663 1 19 . 1 1 114 114 THR CB C 114 67.899 67.899 68.475 -0.576 25567 13664 1 19 . 1 1 114 114 THR H H 114 7.951 7.951 8.886 -0.935 25567 13665 1 19 . 1 1 115 115 SER N N 115 115.159 115.159 116.574 -1.415 25567 13666 1 19 . 1 1 115 115 SER HA H 115 4.608 4.608 4.642 -0.034 25567 13667 1 19 . 1 1 115 115 SER C C 115 171.403 171.403 173.470 -2.067 25567 13668 1 19 . 1 1 115 115 SER CA C 115 55.570 55.570 58.126 -2.556 25567 13669 1 19 . 1 1 115 115 SER CB C 115 61.418 61.418 64.181 -2.763 25567 13670 1 19 . 1 1 115 115 SER H H 115 8.229 8.229 7.571 0.658 25567 13671 1 19 . 1 1 116 116 ALA N N 116 127.211 127.211 123.346 3.865 25567 13672 1 19 . 1 1 116 116 ALA HA H 116 4.456 4.456 5.139 -0.683 25567 13673 1 19 . 1 1 116 116 ALA C C 116 175.758 175.758 179.457 -3.699 25567 13674 1 19 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.414 -1.598 25567 13675 1 19 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.002 -2.171 25567 13676 1 19 . 1 1 116 116 ALA H H 116 8.813 8.813 7.838 0.975 25567 13677 1 19 . 1 1 117 117 GLY N N 117 108.099 108.099 109.119 -1.020 25567 13678 1 19 . 1 1 117 117 GLY C C 117 171.805 171.805 175.170 -3.365 25567 13679 1 19 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.518 -4.649 25567 13680 1 19 . 1 1 117 117 GLY H H 117 8.685 8.685 8.990 -0.305 25567 13681 1 19 . 1 1 118 118 THR N N 118 111.284 111.284 111.471 -0.187 25567 13682 1 19 . 1 1 118 118 THR HA H 118 4.343 4.343 4.378 -0.035 25567 13683 1 19 . 1 1 118 118 THR C C 118 171.769 171.769 172.933 -1.164 25567 13684 1 19 . 1 1 118 118 THR CA C 118 58.933 58.933 61.423 -2.490 25567 13685 1 19 . 1 1 118 118 THR CB C 118 67.304 67.304 69.941 -2.636 25567 13686 1 19 . 1 1 118 118 THR H H 118 7.998 7.998 8.242 -0.244 25567 13687 1 19 . 1 1 119 119 ASN N N 119 120.253 120.253 120.422 -0.169 25567 13688 1 19 . 1 1 119 119 ASN HA H 119 4.703 4.703 5.040 -0.337 25567 13689 1 19 . 1 1 119 119 ASN C C 119 172.353 172.353 173.330 -0.977 25567 13690 1 19 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.542 -3.314 25567 13691 1 19 . 1 1 119 119 ASN CB C 119 35.376 35.376 41.129 -5.753 25567 13692 1 19 . 1 1 119 119 ASN H H 119 8.381 8.381 8.094 0.287 25567 13693 1 19 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.662 -0.576 25567 13694 1 19 . 1 1 120 120 HIS C C 120 173.395 173.395 176.165 -2.770 25567 13695 1 19 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.568 -2.429 25567 13696 1 19 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.583 -3.161 25567 13697 1 19 . 1 1 121 121 LYS N N 121 119.527 119.527 120.158 -0.631 25567 13698 1 19 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.647 0.133 25567 13699 1 19 . 1 1 121 121 LYS C C 121 176.053 176.053 178.310 -2.257 25567 13700 1 19 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.666 -2.703 25567 13701 1 19 . 1 1 121 121 LYS CB C 121 29.660 29.660 32.422 -2.762 25567 13702 1 19 . 1 1 121 121 LYS H H 121 8.106 8.106 8.507 -0.401 25567 13703 1 19 . 1 1 122 122 ALA N N 122 121.585 121.585 119.964 1.621 25567 13704 1 19 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.698 0.023 25567 13705 1 19 . 1 1 122 122 ALA C C 122 175.128 175.128 178.774 -3.646 25567 13706 1 19 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.328 -2.737 25567 13707 1 19 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.779 -2.075 25567 13708 1 19 . 1 1 122 122 ALA H H 122 7.702 7.702 7.948 -0.246 25567 13709 1 19 . 1 1 123 123 TYR N N 123 118.803 118.803 120.304 -1.501 25567 13710 1 19 . 1 1 123 123 TYR HA H 123 3.366 3.366 3.906 -0.540 25567 13711 1 19 . 1 1 123 123 TYR CA C 123 60.091 60.091 60.830 -0.739 25567 13712 1 19 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.079 -2.977 25567 13713 1 19 . 1 1 123 123 TYR H H 123 7.366 7.366 7.406 -0.040 25567 13714 1 19 . 1 1 124 124 VAL N N 124 117.530 117.530 117.046 0.484 25567 13715 1 19 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.728 -0.529 25567 13716 1 19 . 1 1 124 124 VAL C C 124 175.375 175.375 177.668 -2.293 25567 13717 1 19 . 1 1 124 124 VAL CA C 124 64.583 64.583 65.791 -1.208 25567 13718 1 19 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.129 -1.926 25567 13719 1 19 . 1 1 124 124 VAL H H 124 7.757 7.757 7.726 0.031 25567 13720 1 19 . 1 1 125 125 SER N N 125 114.023 114.023 113.774 0.249 25567 13721 1 19 . 1 1 125 125 SER HA H 125 4.035 4.035 4.281 -0.246 25567 13722 1 19 . 1 1 125 125 SER C C 125 174.636 174.636 175.838 -1.202 25567 13723 1 19 . 1 1 125 125 SER CA C 125 58.885 58.885 60.778 -1.893 25567 13724 1 19 . 1 1 125 125 SER CB C 125 59.666 59.666 63.641 -3.975 25567 13725 1 19 . 1 1 125 125 SER H H 125 7.622 7.622 7.643 -0.021 25567 13726 1 19 . 1 1 126 126 HIS N N 126 119.457 119.457 121.463 -2.006 25567 13727 1 19 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.925 0.271 25567 13728 1 19 . 1 1 126 126 HIS C C 126 172.942 172.942 177.532 -4.590 25567 13729 1 19 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.569 -3.651 25567 13730 1 19 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.468 -3.389 25567 13731 1 19 . 1 1 126 126 HIS H H 126 8.067 8.067 8.008 0.059 25567 13732 1 19 . 1 1 127 127 PHE N N 127 120.628 120.628 118.812 1.816 25567 13733 1 19 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.914 -0.715 25567 13734 1 19 . 1 1 127 127 PHE C C 127 173.515 173.515 176.659 -3.144 25567 13735 1 19 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.620 1.062 25567 13736 1 19 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.753 -2.386 25567 13737 1 19 . 1 1 127 127 PHE H H 127 9.083 9.083 8.376 0.707 25567 13738 1 19 . 1 1 128 128 ASN N N 128 114.858 114.858 115.545 -0.687 25567 13739 1 19 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.180 -0.102 25567 13740 1 19 . 1 1 128 128 ASN C C 128 175.338 175.338 177.548 -2.210 25567 13741 1 19 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.659 -2.409 25567 13742 1 19 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.037 -2.016 25567 13743 1 19 . 1 1 128 128 ASN H H 128 7.858 7.858 7.907 -0.049 25567 13744 1 19 . 1 1 129 129 GLU N N 129 119.811 119.811 119.512 0.299 25567 13745 1 19 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.242 -0.201 25567 13746 1 19 . 1 1 129 129 GLU C C 129 176.941 176.941 177.891 -0.950 25567 13747 1 19 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.267 -1.635 25567 13748 1 19 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.293 -2.355 25567 13749 1 19 . 1 1 129 129 GLU H H 129 7.569 7.569 7.806 -0.237 25567 13750 1 19 . 1 1 130 130 TRP N N 130 120.585 120.585 117.764 2.821 25567 13751 1 19 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.768 -0.296 25567 13752 1 19 . 1 1 130 130 TRP C C 130 174.262 174.262 175.901 -1.639 25567 13753 1 19 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.274 -1.601 25567 13754 1 19 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.789 -2.833 25567 13755 1 19 . 1 1 130 130 TRP H H 130 7.964 7.964 7.587 0.377 25567 13756 1 19 . 1 1 131 131 ALA N N 131 120.522 120.522 119.457 1.065 25567 13757 1 19 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.428 -0.481 25567 13758 1 19 . 1 1 131 131 ALA C C 131 172.489 172.489 175.705 -3.216 25567 13759 1 19 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.566 -2.986 25567 13760 1 19 . 1 1 131 131 ALA CB C 131 16.539 16.539 20.347 -3.808 25567 13761 1 19 . 1 1 131 131 ALA H H 131 8.114 8.114 7.201 0.913 25567 13762 1 19 . 1 1 132 132 ASP N N 132 117.666 117.666 120.117 -2.451 25567 13763 1 19 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.407 -0.201 25567 13764 1 19 . 1 1 132 132 ASP C C 132 173.779 173.779 176.569 -2.790 25567 13765 1 19 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.700 -1.387 25567 13766 1 19 . 1 1 132 132 ASP CB C 132 39.456 39.456 41.175 -1.719 25567 13767 1 19 . 1 1 132 132 ASP H H 132 6.768 6.768 7.678 -0.910 25567 13768 1 19 . 1 1 133 133 GLY N N 133 114.922 114.922 112.066 2.856 25567 13769 1 19 . 1 1 133 133 GLY C C 133 172.101 172.101 173.723 -1.622 25567 13770 1 19 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.709 -2.200 25567 13771 1 19 . 1 1 133 133 GLY H H 133 8.645 8.645 8.449 0.196 25567 13772 1 19 . 1 1 134 134 LEU N N 134 120.101 120.101 122.151 -2.050 25567 13773 1 19 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.601 -0.139 25567 13774 1 19 . 1 1 134 134 LEU C C 134 174.098 174.098 176.006 -1.908 25567 13775 1 19 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.526 -2.442 25567 13776 1 19 . 1 1 134 134 LEU CB C 134 40.509 40.509 43.871 -3.362 25567 13777 1 19 . 1 1 134 134 LEU H H 134 8.049 8.049 7.580 0.469 25567 13778 1 19 . 1 1 135 135 ASN N N 135 119.258 119.258 122.373 -3.115 25567 13779 1 19 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.654 -0.015 25567 13780 1 19 . 1 1 135 135 ASN C C 135 170.564 170.564 174.782 -4.218 25567 13781 1 19 . 1 1 135 135 ASN CA C 135 49.253 49.253 52.851 -3.598 25567 13782 1 19 . 1 1 135 135 ASN CB C 135 33.618 33.618 37.971 -4.353 25567 13783 1 19 . 1 1 135 135 ASN H H 135 8.567 8.567 8.726 -0.159 25567 13784 1 19 . 1 1 136 136 VAL N N 136 125.460 125.460 124.776 0.684 25567 13785 1 19 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.142 0.454 25567 13786 1 19 . 1 1 136 136 VAL C C 136 175.318 175.318 176.406 -1.088 25567 13787 1 19 . 1 1 136 136 VAL CA C 136 58.722 58.722 63.837 -5.115 25567 13788 1 19 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.050 -2.751 25567 13789 1 19 . 1 1 136 136 VAL H H 136 7.660 7.660 8.034 -0.373 25567 13790 1 19 . 1 1 137 137 ILE N N 137 122.021 122.021 120.950 1.071 25567 13791 1 19 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.668 -0.240 25567 13792 1 19 . 1 1 137 137 ILE C C 137 173.943 173.943 174.903 -0.960 25567 13793 1 19 . 1 1 137 137 ILE CA C 137 58.958 58.958 60.023 -1.065 25567 13794 1 19 . 1 1 137 137 ILE CB C 137 36.169 36.169 39.247 -3.078 25567 13795 1 19 . 1 1 137 137 ILE H H 137 9.151 9.151 9.017 0.134 25567 13796 1 19 . 1 1 138 138 GLY N N 138 108.192 108.192 107.770 0.422 25567 13797 1 19 . 1 1 138 138 GLY CA C 138 43.494 43.494 44.693 -1.198 25567 13798 1 19 . 1 1 138 138 GLY H H 138 6.675 6.675 7.385 -0.710 25567 13799 1 19 . 1 1 139 139 VAL N N 139 119.673 119.673 123.375 -3.702 25567 13800 1 19 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.932 0.388 25567 13801 1 19 . 1 1 139 139 VAL C C 139 172.291 172.291 173.261 -0.970 25567 13802 1 19 . 1 1 139 139 VAL CA C 139 58.209 58.209 62.453 -4.244 25567 13803 1 19 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.922 -1.283 25567 13804 1 19 . 1 1 139 139 VAL H H 139 8.158 8.158 8.964 -0.806 25567 13805 1 19 . 1 1 140 140 ALA N N 140 127.104 127.104 129.277 -2.173 25567 13806 1 19 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.434 -0.838 25567 13807 1 19 . 1 1 140 140 ALA C C 140 171.057 171.057 175.444 -4.387 25567 13808 1 19 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.191 -1.308 25567 13809 1 19 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.482 -1.054 25567 13810 1 19 . 1 1 140 140 ALA H H 140 9.145 9.145 8.285 0.860 25567 13811 1 19 . 1 1 141 141 ARG N N 141 118.828 118.828 120.464 -1.636 25567 13812 1 19 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.628 -1.888 25567 13813 1 19 . 1 1 141 141 ARG C C 141 173.524 173.524 177.139 -3.615 25567 13814 1 19 . 1 1 141 141 ARG CA C 141 51.886 51.886 55.634 -3.748 25567 13815 1 19 . 1 1 141 141 ARG CB C 141 28.454 28.454 31.125 -2.671 25567 13816 1 19 . 1 1 141 141 ARG H H 141 7.759 7.759 8.600 -0.841 25567 13817 1 19 . 1 1 142 142 ASP N N 142 125.557 125.557 123.632 1.925 25567 13818 1 19 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.206 -0.427 25567 13819 1 19 . 1 1 142 142 ASP C C 142 169.292 169.292 175.013 -5.721 25567 13820 1 19 . 1 1 142 142 ASP CA C 142 53.622 53.622 55.561 -1.939 25567 13821 1 19 . 1 1 142 142 ASP CB C 142 37.080 37.080 39.974 -2.894 25567 13822 1 19 . 1 1 142 142 ASP H H 142 9.087 9.087 9.068 0.019 25567 13823 1 19 . 1 1 143 143 ASP N N 143 119.094 119.094 116.818 2.276 25567 13824 1 19 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.680 -0.426 25567 13825 1 19 . 1 1 143 143 ASP C C 143 175.557 175.557 177.672 -2.115 25567 13826 1 19 . 1 1 143 143 ASP CA C 143 49.079 49.079 52.885 -3.806 25567 13827 1 19 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.409 -3.967 25567 13828 1 19 . 1 1 143 143 ASP H H 143 8.175 8.175 8.542 -0.367 25567 13829 1 19 . 1 1 144 144 SER N N 144 115.438 115.438 117.139 -1.701 25567 13830 1 19 . 1 1 144 144 SER HA H 144 3.745 3.745 4.068 -0.323 25567 13831 1 19 . 1 1 144 144 SER C C 144 172.820 172.820 175.192 -2.372 25567 13832 1 19 . 1 1 144 144 SER CA C 144 59.336 59.336 61.094 -1.758 25567 13833 1 19 . 1 1 144 144 SER CB C 144 60.839 60.839 63.333 -2.494 25567 13834 1 19 . 1 1 144 144 SER H H 144 7.742 7.742 7.780 -0.038 25567 13835 1 19 . 1 1 145 145 GLU N N 145 119.631 119.631 118.672 0.959 25567 13836 1 19 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.163 0.156 25567 13837 1 19 . 1 1 145 145 GLU C C 145 171.927 171.927 176.436 -4.509 25567 13838 1 19 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.641 -3.557 25567 13839 1 19 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.331 -2.557 25567 13840 1 19 . 1 1 145 145 GLU H H 145 7.924 7.924 8.121 -0.197 25567 13841 1 19 . 1 1 146 146 VAL N N 146 118.791 118.791 119.702 -0.911 25567 13842 1 19 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.617 -0.661 25567 13843 1 19 . 1 1 146 146 VAL C C 146 174.582 174.582 177.166 -2.584 25567 13844 1 19 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.543 -2.465 25567 13845 1 19 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.235 -2.095 25567 13846 1 19 . 1 1 146 146 VAL H H 146 6.393 6.393 7.077 -0.684 25567 13847 1 19 . 1 1 147 147 ASP N N 147 119.410 119.410 119.333 0.077 25567 13848 1 19 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.309 -0.239 25567 13849 1 19 . 1 1 147 147 ASP C C 147 174.774 174.774 177.447 -2.673 25567 13850 1 19 . 1 1 147 147 ASP CA C 147 54.322 54.322 57.381 -3.059 25567 13851 1 19 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.871 -3.667 25567 13852 1 19 . 1 1 147 147 ASP H H 147 8.393 8.393 8.672 -0.279 25567 13853 1 19 . 1 1 148 148 LYS N N 148 119.422 119.422 118.388 1.034 25567 13854 1 19 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.136 -0.185 25567 13855 1 19 . 1 1 148 148 LYS C C 148 176.410 176.410 178.605 -2.195 25567 13856 1 19 . 1 1 148 148 LYS CA C 148 55.736 55.736 58.748 -3.012 25567 13857 1 19 . 1 1 148 148 LYS CB C 148 29.576 29.576 31.814 -2.238 25567 13858 1 19 . 1 1 148 148 LYS H H 148 7.078 7.078 7.607 -0.529 25567 13859 1 19 . 1 1 149 149 TRP N N 149 118.168 118.168 117.520 0.648 25567 13860 1 19 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.980 -0.379 25567 13861 1 19 . 1 1 149 149 TRP C C 149 174.199 174.199 176.867 -2.668 25567 13862 1 19 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.651 -1.856 25567 13863 1 19 . 1 1 149 149 TRP CB C 149 27.011 27.011 27.892 -0.881 25567 13864 1 19 . 1 1 149 149 TRP H H 149 7.914 7.914 7.299 0.615 25567 13865 1 19 . 1 1 150 150 SER N N 150 109.636 109.636 114.263 -4.627 25567 13866 1 19 . 1 1 150 150 SER HA H 150 4.242 4.242 4.685 -0.443 25567 13867 1 19 . 1 1 150 150 SER C C 150 170.173 170.173 173.355 -3.182 25567 13868 1 19 . 1 1 150 150 SER CA C 150 56.912 56.912 58.736 -1.824 25567 13869 1 19 . 1 1 150 150 SER CB C 150 62.087 62.087 64.603 -2.516 25567 13870 1 19 . 1 1 150 150 SER H H 150 7.814 7.814 8.292 -0.478 25567 13871 1 20 . 1 1 2 2 MET HA H 2 4.416 4.416 4.675 -0.259 25567 13872 1 20 . 1 1 2 2 MET CA C 2 52.847 52.847 54.776 -1.929 25567 13873 1 20 . 1 1 2 2 MET CB C 2 30.672 30.672 32.812 -2.140 25567 13874 1 20 . 1 1 3 3 ALA N N 3 125.563 125.563 124.343 1.220 25567 13875 1 20 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.650 -0.278 25567 13876 1 20 . 1 1 3 3 ALA C C 3 174.728 174.728 176.030 -1.302 25567 13877 1 20 . 1 1 3 3 ALA CA C 3 49.348 49.348 51.934 -2.586 25567 13878 1 20 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.423 -3.488 25567 13879 1 20 . 1 1 3 3 ALA H H 3 8.342 8.342 7.881 0.461 25567 13880 1 20 . 1 1 4 4 LYS N N 4 121.767 121.767 122.734 -0.967 25567 13881 1 20 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.531 -0.301 25567 13882 1 20 . 1 1 4 4 LYS C C 4 174.577 174.577 175.956 -1.379 25567 13883 1 20 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.435 -1.446 25567 13884 1 20 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.745 -1.190 25567 13885 1 20 . 1 1 4 4 LYS H H 4 8.500 8.500 8.436 0.064 25567 13886 1 20 . 1 1 5 5 LYS N N 5 129.654 129.654 123.838 5.816 25567 13887 1 20 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.600 -0.074 25567 13888 1 20 . 1 1 5 5 LYS C C 5 174.731 174.731 177.029 -2.298 25567 13889 1 20 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.509 -0.763 25567 13890 1 20 . 1 1 5 5 LYS CB C 5 29.894 29.894 33.514 -3.620 25567 13891 1 20 . 1 1 5 5 LYS H H 5 10.035 10.035 8.506 1.529 25567 13892 1 20 . 1 1 6 6 THR N N 6 126.212 126.212 113.926 12.286 25567 13893 1 20 . 1 1 6 6 THR HA H 6 5.654 5.654 5.157 0.497 25567 13894 1 20 . 1 1 6 6 THR C C 6 169.897 169.897 172.630 -2.733 25567 13895 1 20 . 1 1 6 6 THR CA C 6 60.647 60.647 61.846 -1.199 25567 13896 1 20 . 1 1 6 6 THR CB C 6 68.152 68.152 72.405 -4.253 25567 13897 1 20 . 1 1 6 6 THR H H 6 8.557 8.557 8.287 0.270 25567 13898 1 20 . 1 1 7 7 LEU N N 7 130.776 130.776 125.421 5.355 25567 13899 1 20 . 1 1 7 7 LEU HA H 7 4.619 4.619 5.471 -0.852 25567 13900 1 20 . 1 1 7 7 LEU CA C 7 50.096 50.096 52.426 -2.330 25567 13901 1 20 . 1 1 7 7 LEU CB C 7 41.043 41.043 45.684 -4.641 25567 13902 1 20 . 1 1 7 7 LEU H H 7 8.610 8.610 8.565 0.045 25567 13903 1 20 . 1 1 8 8 ILE N N 8 127.175 127.175 123.694 3.481 25567 13904 1 20 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.800 0.056 25567 13905 1 20 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.486 -3.094 25567 13906 1 20 . 1 1 8 8 ILE CB C 8 36.864 36.864 40.896 -4.032 25567 13907 1 20 . 1 1 8 8 ILE H H 8 9.263 9.263 8.173 1.090 25567 13908 1 20 . 1 1 9 9 LEU N N 9 127.117 127.117 127.885 -0.768 25567 13909 1 20 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.202 0.494 25567 13910 1 20 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.542 -3.590 25567 13911 1 20 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.203 0.624 25567 13912 1 20 . 1 1 9 9 LEU H H 9 9.262 9.262 8.845 0.417 25567 13913 1 20 . 1 1 10 10 TYR N N 10 113.544 113.544 120.867 -7.323 25567 13914 1 20 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.096 0.435 25567 13915 1 20 . 1 1 10 10 TYR CA C 10 52.829 52.829 54.941 -2.112 25567 13916 1 20 . 1 1 10 10 TYR CB C 10 38.615 38.615 39.599 -0.984 25567 13917 1 20 . 1 1 10 10 TYR H H 10 7.425 7.425 7.742 -0.317 25567 13918 1 20 . 1 1 11 11 TYR N N 11 121.235 121.235 124.170 -2.935 25567 13919 1 20 . 1 1 11 11 TYR HA H 11 4.810 4.810 5.245 -0.435 25567 13920 1 20 . 1 1 11 11 TYR CA C 11 53.889 53.889 55.695 -1.806 25567 13921 1 20 . 1 1 11 11 TYR CB C 11 40.467 40.467 39.938 0.529 25567 13922 1 20 . 1 1 11 11 TYR H H 11 7.781 7.781 8.582 -0.801 25567 13923 1 20 . 1 1 14 14 SER CA C 14 54.675 54.675 59.904 -5.229 25567 13924 1 20 . 1 1 14 14 SER CB C 14 61.621 61.621 63.230 -1.609 25567 13925 1 20 . 1 1 15 15 GLY N N 15 110.420 110.420 109.613 0.807 25567 13926 1 20 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.597 -1.870 25567 13927 1 20 . 1 1 15 15 GLY H H 15 7.757 7.757 8.182 -0.425 25567 13928 1 20 . 1 1 17 17 THR HA H 17 4.122 4.122 4.583 -0.461 25567 13929 1 20 . 1 1 17 17 THR CA C 17 64.748 64.748 60.472 4.276 25567 13930 1 20 . 1 1 17 17 THR CB C 17 64.532 64.532 69.607 -5.075 25567 13931 1 20 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.901 -0.983 25567 13932 1 20 . 1 1 18 18 LYS C C 18 173.812 173.812 177.463 -3.651 25567 13933 1 20 . 1 1 18 18 LYS CA C 18 57.003 57.003 58.124 -1.121 25567 13934 1 20 . 1 1 18 18 LYS CB C 18 29.768 29.768 33.178 -3.410 25567 13935 1 20 . 1 1 19 19 LYS N N 19 116.699 116.699 120.974 -4.275 25567 13936 1 20 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.851 0.097 25567 13937 1 20 . 1 1 19 19 LYS C C 19 177.221 177.221 177.827 -0.606 25567 13938 1 20 . 1 1 19 19 LYS CA C 19 56.421 56.421 59.154 -2.733 25567 13939 1 20 . 1 1 19 19 LYS CB C 19 29.634 29.634 30.949 -1.315 25567 13940 1 20 . 1 1 19 19 LYS H H 19 7.476 7.476 8.673 -1.197 25567 13941 1 20 . 1 1 20 20 MET N N 20 118.946 118.946 119.303 -0.357 25567 13942 1 20 . 1 1 20 20 MET HA H 20 4.474 4.474 4.316 0.158 25567 13943 1 20 . 1 1 20 20 MET C C 20 173.826 173.826 177.004 -3.178 25567 13944 1 20 . 1 1 20 20 MET CA C 20 52.285 52.285 56.880 -4.595 25567 13945 1 20 . 1 1 20 20 MET CB C 20 26.921 26.921 32.672 -5.751 25567 13946 1 20 . 1 1 20 20 MET H H 20 7.457 7.457 8.026 -0.569 25567 13947 1 20 . 1 1 21 21 ALA N N 21 123.375 123.375 120.492 2.883 25567 13948 1 20 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.496 -0.944 25567 13949 1 20 . 1 1 21 21 ALA C C 21 176.542 176.542 178.767 -2.225 25567 13950 1 20 . 1 1 21 21 ALA CA C 21 52.651 52.651 53.736 -1.085 25567 13951 1 20 . 1 1 21 21 ALA CB C 21 16.282 16.282 19.309 -3.027 25567 13952 1 20 . 1 1 21 21 ALA H H 21 8.549 8.549 8.303 0.246 25567 13953 1 20 . 1 1 22 22 GLU N N 22 116.906 116.906 119.624 -2.718 25567 13954 1 20 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.952 -0.279 25567 13955 1 20 . 1 1 22 22 GLU C C 22 176.658 176.658 178.798 -2.140 25567 13956 1 20 . 1 1 22 22 GLU CA C 22 56.605 56.605 58.925 -2.320 25567 13957 1 20 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.193 -2.544 25567 13958 1 20 . 1 1 22 22 GLU H H 22 8.085 8.085 7.739 0.346 25567 13959 1 20 . 1 1 23 23 LYS N N 23 123.301 123.301 119.011 4.290 25567 13960 1 20 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.021 -0.201 25567 13961 1 20 . 1 1 23 23 LYS C C 23 177.363 177.363 178.972 -1.609 25567 13962 1 20 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.207 -2.236 25567 13963 1 20 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.092 -2.561 25567 13964 1 20 . 1 1 23 23 LYS H H 23 7.703 7.703 7.851 -0.148 25567 13965 1 20 . 1 1 24 24 ILE N N 24 121.894 121.894 118.106 3.788 25567 13966 1 20 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.882 -0.586 25567 13967 1 20 . 1 1 24 24 ILE C C 24 174.944 174.944 178.902 -3.958 25567 13968 1 20 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.460 -1.228 25567 13969 1 20 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.666 -2.922 25567 13970 1 20 . 1 1 24 24 ILE H H 24 8.458 8.458 7.906 0.552 25567 13971 1 20 . 1 1 25 25 ASN N N 25 118.580 118.580 119.270 -0.690 25567 13972 1 20 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.270 -0.036 25567 13973 1 20 . 1 1 25 25 ASN C C 25 173.567 173.567 177.176 -3.609 25567 13974 1 20 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.793 -4.469 25567 13975 1 20 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.464 -0.281 25567 13976 1 20 . 1 1 25 25 ASN H H 25 8.273 8.273 7.875 0.398 25567 13977 1 20 . 1 1 26 26 SER N N 26 112.132 112.132 114.361 -2.229 25567 13978 1 20 . 1 1 26 26 SER HA H 26 4.148 4.148 4.370 -0.222 25567 13979 1 20 . 1 1 26 26 SER C C 26 172.083 172.083 175.167 -3.084 25567 13980 1 20 . 1 1 26 26 SER CA C 26 57.865 57.865 60.755 -2.890 25567 13981 1 20 . 1 1 26 26 SER CB C 26 60.816 60.816 63.354 -2.538 25567 13982 1 20 . 1 1 26 26 SER H H 26 7.444 7.444 8.085 -0.641 25567 13983 1 20 . 1 1 27 27 GLU N N 27 120.080 120.080 118.196 1.884 25567 13984 1 20 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.407 -0.307 25567 13985 1 20 . 1 1 27 27 GLU C C 27 173.647 173.647 175.963 -2.316 25567 13986 1 20 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.139 -1.938 25567 13987 1 20 . 1 1 27 27 GLU CB C 27 26.884 26.884 31.227 -4.343 25567 13988 1 20 . 1 1 27 27 GLU H H 27 7.453 7.453 7.735 -0.282 25567 13989 1 20 . 1 1 28 28 ILE N N 28 118.759 118.759 120.867 -2.108 25567 13990 1 20 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.257 -0.053 25567 13991 1 20 . 1 1 28 28 ILE C C 28 172.474 172.474 174.578 -2.104 25567 13992 1 20 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.208 -2.461 25567 13993 1 20 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.120 -4.322 25567 13994 1 20 . 1 1 28 28 ILE H H 28 7.258 7.258 7.304 -0.046 25567 13995 1 20 . 1 1 29 29 LYS N N 29 130.618 130.618 126.965 3.653 25567 13996 1 20 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.175 -0.170 25567 13997 1 20 . 1 1 29 29 LYS C C 29 174.375 174.375 176.943 -2.568 25567 13998 1 20 . 1 1 29 29 LYS CA C 29 55.659 55.659 57.609 -1.950 25567 13999 1 20 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.184 -3.624 25567 14000 1 20 . 1 1 29 29 LYS H H 29 8.588 8.588 8.612 -0.024 25567 14001 1 20 . 1 1 30 30 ASP N N 30 119.366 119.366 120.980 -1.614 25567 14002 1 20 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.359 0.043 25567 14003 1 20 . 1 1 30 30 ASP C C 30 172.580 172.580 175.919 -3.339 25567 14004 1 20 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.154 -1.530 25567 14005 1 20 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.197 -3.369 25567 14006 1 20 . 1 1 30 30 ASP H H 30 8.940 8.940 8.813 0.127 25567 14007 1 20 . 1 1 31 31 SER N N 31 114.035 114.035 113.492 0.543 25567 14008 1 20 . 1 1 31 31 SER HA H 31 4.781 4.781 4.900 -0.119 25567 14009 1 20 . 1 1 31 31 SER C C 31 171.136 171.136 174.829 -3.693 25567 14010 1 20 . 1 1 31 31 SER CA C 31 55.638 55.638 58.460 -2.822 25567 14011 1 20 . 1 1 31 31 SER CB C 31 62.388 62.388 64.712 -2.324 25567 14012 1 20 . 1 1 31 31 SER H H 31 8.030 8.030 7.762 0.268 25567 14013 1 20 . 1 1 32 32 GLU N N 32 121.406 121.406 120.459 0.947 25567 14014 1 20 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.738 -0.003 25567 14015 1 20 . 1 1 32 32 GLU C C 32 171.205 171.205 174.435 -3.230 25567 14016 1 20 . 1 1 32 32 GLU CA C 32 52.069 52.069 56.042 -3.973 25567 14017 1 20 . 1 1 32 32 GLU CB C 32 30.890 30.890 34.195 -3.305 25567 14018 1 20 . 1 1 32 32 GLU H H 32 8.188 8.188 8.559 -0.371 25567 14019 1 20 . 1 1 33 33 LEU N N 33 126.143 126.143 120.294 5.849 25567 14020 1 20 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.412 -0.127 25567 14021 1 20 . 1 1 33 33 LEU C C 33 173.401 173.401 175.371 -1.970 25567 14022 1 20 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.475 -2.141 25567 14023 1 20 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.196 -0.573 25567 14024 1 20 . 1 1 33 33 LEU H H 33 8.627 8.627 8.460 0.167 25567 14025 1 20 . 1 1 34 34 LYS N N 34 127.122 127.122 123.650 3.472 25567 14026 1 20 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.683 -0.084 25567 14027 1 20 . 1 1 34 34 LYS C C 34 169.644 169.644 174.195 -4.551 25567 14028 1 20 . 1 1 34 34 LYS CA C 34 52.353 52.353 53.846 -1.493 25567 14029 1 20 . 1 1 34 34 LYS CB C 34 34.172 34.172 37.438 -3.266 25567 14030 1 20 . 1 1 34 34 LYS H H 34 9.399 9.399 9.101 0.298 25567 14031 1 20 . 1 1 35 35 GLU N N 35 122.766 122.766 119.122 3.644 25567 14032 1 20 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.476 -1.118 25567 14033 1 20 . 1 1 35 35 GLU C C 35 172.875 172.875 174.639 -1.764 25567 14034 1 20 . 1 1 35 35 GLU CA C 35 52.640 52.640 54.266 -1.626 25567 14035 1 20 . 1 1 35 35 GLU CB C 35 29.268 29.268 32.432 -3.164 25567 14036 1 20 . 1 1 35 35 GLU H H 35 8.166 8.166 8.303 -0.137 25567 14037 1 20 . 1 1 36 36 VAL N N 36 126.674 126.674 120.729 5.945 25567 14038 1 20 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.456 -0.595 25567 14039 1 20 . 1 1 36 36 VAL C C 36 171.451 171.451 174.749 -3.298 25567 14040 1 20 . 1 1 36 36 VAL CA C 36 59.537 59.537 59.427 0.110 25567 14041 1 20 . 1 1 36 36 VAL CB C 36 29.689 29.689 34.965 -5.276 25567 14042 1 20 . 1 1 36 36 VAL H H 36 8.632 8.632 8.041 0.591 25567 14043 1 20 . 1 1 37 37 LYS N N 37 126.181 126.181 124.676 1.505 25567 14044 1 20 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.775 0.164 25567 14045 1 20 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.563 -2.384 25567 14046 1 20 . 1 1 37 37 LYS CB C 37 32.898 32.898 36.179 -3.281 25567 14047 1 20 . 1 1 37 37 LYS H H 37 7.867 7.867 8.998 -1.131 25567 14048 1 20 . 1 1 38 38 VAL N N 38 113.540 113.540 117.239 -3.699 25567 14049 1 20 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.660 0.026 25567 14050 1 20 . 1 1 38 38 VAL C C 38 173.633 173.633 175.714 -2.081 25567 14051 1 20 . 1 1 38 38 VAL CA C 38 57.284 57.284 60.733 -3.449 25567 14052 1 20 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.046 -1.082 25567 14053 1 20 . 1 1 38 38 VAL H H 38 8.389 8.389 8.691 -0.302 25567 14054 1 20 . 1 1 39 39 SER N N 39 118.860 118.860 118.142 0.718 25567 14055 1 20 . 1 1 39 39 SER HA H 39 4.194 4.194 4.726 -0.532 25567 14056 1 20 . 1 1 39 39 SER C C 39 173.059 173.059 173.530 -0.471 25567 14057 1 20 . 1 1 39 39 SER CA C 39 56.227 56.227 58.280 -2.053 25567 14058 1 20 . 1 1 39 39 SER CB C 39 60.771 60.771 64.003 -3.232 25567 14059 1 20 . 1 1 39 39 SER H H 39 8.668 8.668 8.819 -0.151 25567 14060 1 20 . 1 1 40 40 GLU N N 40 125.769 125.769 118.085 7.684 25567 14061 1 20 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.763 -0.606 25567 14062 1 20 . 1 1 40 40 GLU C C 40 174.484 174.484 176.180 -1.696 25567 14063 1 20 . 1 1 40 40 GLU CA C 40 55.550 55.550 55.016 0.534 25567 14064 1 20 . 1 1 40 40 GLU CB C 40 27.054 27.054 31.676 -4.622 25567 14065 1 20 . 1 1 40 40 GLU H H 40 8.878 8.878 8.195 0.683 25567 14066 1 20 . 1 1 41 41 GLY N N 41 112.165 112.165 107.548 4.617 25567 14067 1 20 . 1 1 41 41 GLY CA C 41 42.707 42.707 46.317 -3.610 25567 14068 1 20 . 1 1 41 41 GLY H H 41 8.743 8.743 8.895 -0.152 25567 14069 1 20 . 1 1 44 44 ASP N N 44 122.324 122.324 125.281 -2.957 25567 14070 1 20 . 1 1 44 44 ASP CB C 44 42.156 42.156 41.958 0.198 25567 14071 1 20 . 1 1 44 44 ASP H H 44 7.918 7.918 8.123 -0.205 25567 14072 1 20 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.185 -0.123 25567 14073 1 20 . 1 1 45 45 ALA CA C 45 51.410 51.410 51.394 0.016 25567 14074 1 20 . 1 1 45 45 ALA CB C 45 16.376 16.376 20.361 -3.985 25567 14075 1 20 . 1 1 47 47 MET CA C 47 54.118 54.118 56.069 -1.951 25567 14076 1 20 . 1 1 47 47 MET CB C 47 27.527 27.527 33.038 -5.511 25567 14077 1 20 . 1 1 48 48 TYR N N 48 120.075 120.075 123.466 -3.391 25567 14078 1 20 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.506 -0.352 25567 14079 1 20 . 1 1 48 48 TYR C C 48 172.217 172.217 174.397 -2.180 25567 14080 1 20 . 1 1 48 48 TYR CA C 48 57.377 57.377 58.736 -1.359 25567 14081 1 20 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.219 -2.723 25567 14082 1 20 . 1 1 48 48 TYR H H 48 7.810 7.810 8.096 -0.286 25567 14083 1 20 . 1 1 49 49 LYS N N 49 118.369 118.369 125.221 -6.852 25567 14084 1 20 . 1 1 49 49 LYS H H 49 8.116 8.116 7.535 0.581 25567 14085 1 20 . 1 1 50 50 THR N N 50 116.979 116.979 115.560 1.419 25567 14086 1 20 . 1 1 50 50 THR CB C 50 66.373 66.373 68.212 -1.839 25567 14087 1 20 . 1 1 50 50 THR H H 50 7.741 7.741 7.897 -0.156 25567 14088 1 20 . 1 1 51 51 SER N N 51 116.155 116.155 118.661 -2.506 25567 14089 1 20 . 1 1 51 51 SER HA H 51 3.771 3.771 4.636 -0.865 25567 14090 1 20 . 1 1 51 51 SER C C 51 170.563 170.563 173.013 -2.450 25567 14091 1 20 . 1 1 51 51 SER CA C 51 54.840 54.840 57.346 -2.506 25567 14092 1 20 . 1 1 51 51 SER CB C 51 60.318 60.318 65.884 -5.566 25567 14093 1 20 . 1 1 51 51 SER H H 51 7.853 7.853 7.945 -0.092 25567 14094 1 20 . 1 1 54 54 ALA N N 54 123.234 123.234 120.193 3.041 25567 14095 1 20 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.560 -0.312 25567 14096 1 20 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.592 -1.324 25567 14097 1 20 . 1 1 54 54 ALA CB C 54 16.434 16.434 19.905 -3.471 25567 14098 1 20 . 1 1 54 54 ALA H H 54 8.207 8.207 7.961 0.246 25567 14099 1 20 . 1 1 55 55 LEU N N 55 118.603 118.603 121.408 -2.805 25567 14100 1 20 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.448 -0.508 25567 14101 1 20 . 1 1 55 55 LEU CA C 55 54.711 54.711 54.824 -0.113 25567 14102 1 20 . 1 1 55 55 LEU CB C 55 38.913 38.913 40.612 -1.699 25567 14103 1 20 . 1 1 55 55 LEU H H 55 7.960 7.960 8.325 -0.365 25567 14104 1 20 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.189 -0.513 25567 14105 1 20 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.746 -0.252 25567 14106 1 20 . 1 1 58 58 ILE CB C 58 36.054 36.054 40.064 -4.010 25567 14107 1 20 . 1 1 59 59 GLN N N 59 117.579 117.579 121.207 -3.628 25567 14108 1 20 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.487 -0.354 25567 14109 1 20 . 1 1 59 59 GLN CA C 59 54.009 54.009 55.652 -1.643 25567 14110 1 20 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.337 -1.686 25567 14111 1 20 . 1 1 59 59 GLN H H 59 8.268 8.268 8.271 -0.003 25567 14112 1 20 . 1 1 60 60 GLY N N 60 107.308 107.308 110.931 -3.623 25567 14113 1 20 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.129 -2.150 25567 14114 1 20 . 1 1 60 60 GLY H H 60 7.780 7.780 8.888 -1.108 25567 14115 1 20 . 1 1 61 61 ASN N N 61 117.747 117.747 118.832 -1.085 25567 14116 1 20 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.635 -0.101 25567 14117 1 20 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.838 -1.603 25567 14118 1 20 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.599 -3.175 25567 14119 1 20 . 1 1 61 61 ASN H H 61 8.108 8.108 8.026 0.082 25567 14120 1 20 . 1 1 64 64 PHE N N 64 120.102 120.102 116.262 3.840 25567 14121 1 20 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.814 -0.435 25567 14122 1 20 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.707 -2.959 25567 14123 1 20 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.836 -3.561 25567 14124 1 20 . 1 1 64 64 PHE H H 64 8.300 8.300 7.197 1.103 25567 14125 1 20 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.418 -0.083 25567 14126 1 20 . 1 1 65 65 PRO C C 65 173.870 173.870 176.550 -2.680 25567 14127 1 20 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.636 -2.619 25567 14128 1 20 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.791 -3.156 25567 14129 1 20 . 1 1 66 66 GLU N N 66 121.258 121.258 117.986 3.272 25567 14130 1 20 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.339 -0.105 25567 14131 1 20 . 1 1 66 66 GLU C C 66 173.981 173.981 177.024 -3.043 25567 14132 1 20 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.726 -2.939 25567 14133 1 20 . 1 1 66 66 GLU CB C 66 27.775 27.775 31.043 -3.268 25567 14134 1 20 . 1 1 66 66 GLU H H 66 8.316 8.316 8.637 -0.321 25567 14135 1 20 . 1 1 67 67 ILE N N 67 114.290 114.290 114.028 0.262 25567 14136 1 20 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.744 0.385 25567 14137 1 20 . 1 1 67 67 ILE C C 67 172.700 172.700 175.674 -2.974 25567 14138 1 20 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.407 -2.968 25567 14139 1 20 . 1 1 67 67 ILE CB C 67 39.159 39.159 40.274 -1.115 25567 14140 1 20 . 1 1 67 67 ILE H H 67 8.366 8.366 8.245 0.121 25567 14141 1 20 . 1 1 68 68 GLN N N 68 121.422 121.422 120.712 0.710 25567 14142 1 20 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.852 -0.351 25567 14143 1 20 . 1 1 68 68 GLN C C 68 171.675 171.675 174.097 -2.422 25567 14144 1 20 . 1 1 68 68 GLN CA C 68 52.273 52.273 53.725 -1.452 25567 14145 1 20 . 1 1 68 68 GLN CB C 68 27.143 27.143 32.178 -5.035 25567 14146 1 20 . 1 1 68 68 GLN H H 68 8.737 8.737 8.641 0.096 25567 14147 1 20 . 1 1 69 69 LEU N N 69 125.311 125.311 117.165 8.146 25567 14148 1 20 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.819 -0.313 25567 14149 1 20 . 1 1 69 69 LEU C C 69 172.634 172.634 175.231 -2.597 25567 14150 1 20 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.985 -2.226 25567 14151 1 20 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.844 -1.440 25567 14152 1 20 . 1 1 69 69 LEU H H 69 8.051 8.051 8.206 -0.155 25567 14153 1 20 . 1 1 70 70 ASP N N 70 122.763 122.763 118.864 3.899 25567 14154 1 20 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.813 -0.390 25567 14155 1 20 . 1 1 70 70 ASP CA C 70 51.610 51.610 52.895 -1.285 25567 14156 1 20 . 1 1 70 70 ASP CB C 70 38.717 38.717 43.165 -4.448 25567 14157 1 20 . 1 1 70 70 ASP H H 70 8.313 8.313 8.427 -0.114 25567 14158 1 20 . 1 1 71 71 ASN N N 71 117.413 117.413 118.632 -1.219 25567 14159 1 20 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.762 -0.425 25567 14160 1 20 . 1 1 71 71 ASN C C 71 171.770 171.770 174.670 -2.900 25567 14161 1 20 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.470 -1.979 25567 14162 1 20 . 1 1 71 71 ASN CB C 71 35.326 35.326 38.286 -2.960 25567 14163 1 20 . 1 1 71 71 ASN H H 71 8.407 8.407 8.422 -0.015 25567 14164 1 20 . 1 1 72 72 ILE N N 72 123.752 123.752 123.184 0.568 25567 14165 1 20 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.306 -0.366 25567 14166 1 20 . 1 1 72 72 ILE C C 72 171.621 171.621 174.421 -2.800 25567 14167 1 20 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.343 -3.011 25567 14168 1 20 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.624 -1.135 25567 14169 1 20 . 1 1 72 72 ILE H H 72 7.639 7.639 7.725 -0.086 25567 14170 1 20 . 1 1 73 73 ASP N N 73 125.252 125.252 121.976 3.276 25567 14171 1 20 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.608 0.017 25567 14172 1 20 . 1 1 73 73 ASP C C 73 174.034 174.034 176.335 -2.301 25567 14173 1 20 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.069 -3.866 25567 14174 1 20 . 1 1 73 73 ASP CB C 73 37.024 37.024 43.153 -6.128 25567 14175 1 20 . 1 1 73 73 ASP H H 73 8.394 8.394 8.575 -0.181 25567 14176 1 20 . 1 1 74 74 TYR N N 74 123.108 123.108 124.691 -1.583 25567 14177 1 20 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.518 -0.640 25567 14178 1 20 . 1 1 74 74 TYR C C 74 173.637 173.637 177.212 -3.575 25567 14179 1 20 . 1 1 74 74 TYR CA C 74 59.474 59.474 58.428 1.046 25567 14180 1 20 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.431 -3.709 25567 14181 1 20 . 1 1 74 74 TYR H H 74 7.392 7.392 8.324 -0.932 25567 14182 1 20 . 1 1 75 75 ASN N N 75 109.422 109.422 117.560 -8.138 25567 14183 1 20 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.673 0.253 25567 14184 1 20 . 1 1 75 75 ASN C C 75 172.574 172.574 175.773 -3.199 25567 14185 1 20 . 1 1 75 75 ASN CA C 75 52.761 52.761 56.300 -3.539 25567 14186 1 20 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.987 -3.370 25567 14187 1 20 . 1 1 75 75 ASN H H 75 8.058 8.058 8.792 -0.734 25567 14188 1 20 . 1 1 76 76 ASN N N 76 117.422 117.422 115.450 1.972 25567 14189 1 20 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.596 -0.141 25567 14190 1 20 . 1 1 76 76 ASN C C 76 171.132 171.132 175.094 -3.962 25567 14191 1 20 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.951 -2.784 25567 14192 1 20 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.428 -2.700 25567 14193 1 20 . 1 1 76 76 ASN H H 76 7.768 7.768 8.086 -0.318 25567 14194 1 20 . 1 1 77 77 TYR N N 77 116.873 116.873 117.682 -0.809 25567 14195 1 20 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.493 -0.130 25567 14196 1 20 . 1 1 77 77 TYR C C 77 172.175 172.175 174.978 -2.803 25567 14197 1 20 . 1 1 77 77 TYR CA C 77 55.364 55.364 59.289 -3.925 25567 14198 1 20 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.099 -2.934 25567 14199 1 20 . 1 1 77 77 TYR H H 77 7.825 7.825 7.776 0.049 25567 14200 1 20 . 1 1 78 78 ASP N N 78 121.271 121.271 118.062 3.209 25567 14201 1 20 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.873 -0.068 25567 14202 1 20 . 1 1 78 78 ASP C C 78 172.641 172.641 175.404 -2.763 25567 14203 1 20 . 1 1 78 78 ASP CA C 78 53.255 53.255 53.763 -0.508 25567 14204 1 20 . 1 1 78 78 ASP CB C 78 41.075 41.075 44.124 -3.049 25567 14205 1 20 . 1 1 78 78 ASP H H 78 9.058 9.058 8.482 0.576 25567 14206 1 20 . 1 1 79 79 LEU N N 79 122.985 122.985 118.369 4.616 25567 14207 1 20 . 1 1 79 79 LEU HA H 79 5.114 5.114 4.804 0.310 25567 14208 1 20 . 1 1 79 79 LEU C C 79 170.721 170.721 174.472 -3.751 25567 14209 1 20 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.634 -3.318 25567 14210 1 20 . 1 1 79 79 LEU CB C 79 42.342 42.342 46.769 -4.427 25567 14211 1 20 . 1 1 79 79 LEU H H 79 7.893 7.893 7.647 0.246 25567 14212 1 20 . 1 1 80 80 ILE N N 80 126.364 126.364 120.733 5.631 25567 14213 1 20 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.673 0.416 25567 14214 1 20 . 1 1 80 80 ILE C C 80 171.580 171.580 174.214 -2.634 25567 14215 1 20 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.546 -3.129 25567 14216 1 20 . 1 1 80 80 ILE CB C 80 38.136 38.136 41.007 -2.871 25567 14217 1 20 . 1 1 80 80 ILE H H 80 8.717 8.717 8.083 0.634 25567 14218 1 20 . 1 1 81 81 LEU N N 81 126.199 126.199 127.222 -1.023 25567 14219 1 20 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.471 -0.336 25567 14220 1 20 . 1 1 81 81 LEU C C 81 172.979 172.979 175.950 -2.971 25567 14221 1 20 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.246 -3.613 25567 14222 1 20 . 1 1 81 81 LEU CB C 81 42.159 42.159 45.667 -3.509 25567 14223 1 20 . 1 1 81 81 LEU H H 81 9.230 9.230 8.875 0.355 25567 14224 1 20 . 1 1 82 82 ILE N N 82 120.505 120.505 118.463 2.042 25567 14225 1 20 . 1 1 82 82 ILE HA H 82 4.916 4.916 5.119 -0.203 25567 14226 1 20 . 1 1 82 82 ILE C C 82 173.011 173.011 174.550 -1.539 25567 14227 1 20 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.955 -3.127 25567 14228 1 20 . 1 1 82 82 ILE CB C 82 38.068 38.068 42.629 -4.561 25567 14229 1 20 . 1 1 82 82 ILE H H 82 8.796 8.796 8.091 0.705 25567 14230 1 20 . 1 1 83 83 GLY N N 83 120.857 120.857 110.118 10.739 25567 14231 1 20 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.349 -2.546 25567 14232 1 20 . 1 1 83 83 GLY H H 83 9.525 9.525 7.887 1.638 25567 14233 1 20 . 1 1 84 84 SER N N 84 116.007 116.007 113.220 2.787 25567 14234 1 20 . 1 1 84 84 SER HA H 84 5.476 5.476 5.079 0.397 25567 14235 1 20 . 1 1 84 84 SER CA C 84 51.937 51.937 56.711 -4.774 25567 14236 1 20 . 1 1 84 84 SER CB C 84 64.533 64.533 65.896 -1.363 25567 14237 1 20 . 1 1 84 84 SER H H 84 7.617 7.617 7.661 -0.044 25567 14238 1 20 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.536 0.665 25567 14239 1 20 . 1 1 85 85 PRO C C 85 173.574 173.574 175.134 -1.560 25567 14240 1 20 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.219 -2.731 25567 14241 1 20 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.911 -1.771 25567 14242 1 20 . 1 1 86 86 VAL N N 86 117.603 117.603 118.643 -1.040 25567 14243 1 20 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.404 -0.031 25567 14244 1 20 . 1 1 86 86 VAL C C 86 172.777 172.777 173.958 -1.181 25567 14245 1 20 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.939 -2.336 25567 14246 1 20 . 1 1 86 86 VAL CB C 86 29.573 29.573 33.608 -4.035 25567 14247 1 20 . 1 1 86 86 VAL H H 86 8.194 8.194 8.160 0.034 25567 14248 1 20 . 1 1 87 87 TRP N N 87 131.187 131.187 128.496 2.691 25567 14249 1 20 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.890 0.308 25567 14250 1 20 . 1 1 87 87 TRP C C 87 173.295 173.295 175.044 -1.749 25567 14251 1 20 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.653 -6.869 25567 14252 1 20 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.422 -3.675 25567 14253 1 20 . 1 1 87 87 TRP H H 87 9.637 9.637 8.649 0.988 25567 14254 1 20 . 1 1 88 88 SER N N 88 119.829 119.829 111.452 8.377 25567 14255 1 20 . 1 1 88 88 SER HA H 88 3.986 3.986 4.636 -0.650 25567 14256 1 20 . 1 1 88 88 SER C C 88 172.375 172.375 174.444 -2.069 25567 14257 1 20 . 1 1 88 88 SER CA C 88 55.932 55.932 57.875 -1.943 25567 14258 1 20 . 1 1 88 88 SER CB C 88 59.178 59.178 64.989 -5.811 25567 14259 1 20 . 1 1 88 88 SER H H 88 9.272 9.272 7.984 1.288 25567 14260 1 20 . 1 1 89 89 GLY N N 89 101.498 101.498 109.660 -8.162 25567 14261 1 20 . 1 1 89 89 GLY CA C 89 42.671 42.671 45.853 -3.182 25567 14262 1 20 . 1 1 89 89 GLY H H 89 7.463 7.463 9.028 -1.565 25567 14263 1 20 . 1 1 90 90 TYR N N 90 121.064 121.064 115.360 5.704 25567 14264 1 20 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.028 -0.812 25567 14265 1 20 . 1 1 90 90 TYR CA C 90 54.090 54.090 53.496 0.594 25567 14266 1 20 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.065 1.130 25567 14267 1 20 . 1 1 90 90 TYR H H 90 8.064 8.064 8.144 -0.080 25567 14268 1 20 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.845 0.087 25567 14269 1 20 . 1 1 91 91 PRO C C 91 171.019 171.019 175.802 -4.783 25567 14270 1 20 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.717 -4.723 25567 14271 1 20 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.744 -6.251 25567 14272 1 20 . 1 1 92 92 ALA N N 92 119.893 119.893 121.095 -1.202 25567 14273 1 20 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.788 -1.337 25567 14274 1 20 . 1 1 92 92 ALA C C 92 176.477 176.477 176.260 0.217 25567 14275 1 20 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.223 -1.656 25567 14276 1 20 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.583 -5.782 25567 14277 1 20 . 1 1 92 92 ALA H H 92 7.278 7.278 7.920 -0.642 25567 14278 1 20 . 1 1 93 93 THR N N 93 112.992 112.992 110.154 2.838 25567 14279 1 20 . 1 1 93 93 THR HA H 93 4.462 4.462 4.790 -0.328 25567 14280 1 20 . 1 1 93 93 THR CA C 93 66.871 66.871 59.002 7.869 25567 14281 1 20 . 1 1 93 93 THR CB C 93 64.362 64.362 68.861 -4.498 25567 14282 1 20 . 1 1 93 93 THR H H 93 6.861 6.861 8.585 -1.724 25567 14283 1 20 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.330 -0.464 25567 14284 1 20 . 1 1 94 94 PRO CA C 94 63.021 63.021 64.033 -1.012 25567 14285 1 20 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.565 -2.286 25567 14286 1 20 . 1 1 95 95 ILE N N 95 111.298 111.298 119.517 -8.219 25567 14287 1 20 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.212 -0.589 25567 14288 1 20 . 1 1 95 95 ILE C C 95 174.264 174.264 175.190 -0.926 25567 14289 1 20 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.042 -1.594 25567 14290 1 20 . 1 1 95 95 ILE CB C 95 31.929 31.929 35.047 -3.118 25567 14291 1 20 . 1 1 95 95 ILE H H 95 7.974 7.974 8.016 -0.042 25567 14292 1 20 . 1 1 96 96 LYS N N 96 123.045 123.045 121.295 1.750 25567 14293 1 20 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.370 -1.258 25567 14294 1 20 . 1 1 96 96 LYS C C 96 174.590 174.590 177.499 -2.909 25567 14295 1 20 . 1 1 96 96 LYS CA C 96 57.145 57.145 56.824 0.321 25567 14296 1 20 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.984 -5.139 25567 14297 1 20 . 1 1 96 96 LYS H H 96 6.958 6.958 7.786 -0.828 25567 14298 1 20 . 1 1 97 97 THR N N 97 113.412 113.412 118.054 -4.642 25567 14299 1 20 . 1 1 97 97 THR HA H 97 3.461 3.461 4.025 -0.564 25567 14300 1 20 . 1 1 97 97 THR C C 97 173.247 173.247 176.434 -3.187 25567 14301 1 20 . 1 1 97 97 THR CA C 97 62.809 62.809 65.955 -3.146 25567 14302 1 20 . 1 1 97 97 THR CB C 97 65.654 65.654 68.589 -2.935 25567 14303 1 20 . 1 1 97 97 THR H H 97 6.366 6.366 7.758 -1.392 25567 14304 1 20 . 1 1 98 98 LEU N N 98 121.201 121.201 122.182 -0.981 25567 14305 1 20 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.053 -0.419 25567 14306 1 20 . 1 1 98 98 LEU C C 98 174.590 174.590 178.176 -3.586 25567 14307 1 20 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.935 -2.314 25567 14308 1 20 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.063 -1.168 25567 14309 1 20 . 1 1 98 98 LEU H H 98 7.554 7.554 7.695 -0.141 25567 14310 1 20 . 1 1 99 99 LEU N N 99 118.677 118.677 115.609 3.068 25567 14311 1 20 . 1 1 99 99 LEU HA H 99 3.702 3.702 4.046 -0.344 25567 14312 1 20 . 1 1 99 99 LEU C C 99 177.457 177.457 178.006 -0.549 25567 14313 1 20 . 1 1 99 99 LEU CA C 99 55.179 55.179 56.500 -1.321 25567 14314 1 20 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.558 -1.570 25567 14315 1 20 . 1 1 99 99 LEU H H 99 8.160 8.160 7.697 0.463 25567 14316 1 20 . 1 1 100 100 ASP N N 100 118.914 118.914 116.216 2.698 25567 14317 1 20 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.570 -0.341 25567 14318 1 20 . 1 1 100 100 ASP C C 100 176.585 176.585 178.629 -2.044 25567 14319 1 20 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.230 -1.714 25567 14320 1 20 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.489 -3.910 25567 14321 1 20 . 1 1 100 100 ASP H H 100 7.872 7.872 7.527 0.345 25567 14322 1 20 . 1 1 101 101 GLN N N 101 118.135 118.135 118.373 -0.238 25567 14323 1 20 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.364 -0.204 25567 14324 1 20 . 1 1 101 101 GLN C C 101 174.601 174.601 177.806 -3.205 25567 14325 1 20 . 1 1 101 101 GLN CA C 101 54.960 54.960 57.304 -2.344 25567 14326 1 20 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.379 -3.829 25567 14327 1 20 . 1 1 101 101 GLN H H 101 7.673 7.673 7.784 -0.111 25567 14328 1 20 . 1 1 102 102 MET N N 102 118.420 118.420 117.969 0.451 25567 14329 1 20 . 1 1 102 102 MET HA H 102 3.826 3.826 4.591 -0.765 25567 14330 1 20 . 1 1 102 102 MET C C 102 172.780 172.780 176.814 -4.034 25567 14331 1 20 . 1 1 102 102 MET CA C 102 53.428 53.428 56.042 -2.614 25567 14332 1 20 . 1 1 102 102 MET CB C 102 31.221 31.221 32.299 -1.078 25567 14333 1 20 . 1 1 102 102 MET H H 102 7.462 7.462 7.971 -0.509 25567 14334 1 20 . 1 1 103 103 LYS N N 103 116.066 116.066 120.153 -4.087 25567 14335 1 20 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.109 -0.189 25567 14336 1 20 . 1 1 103 103 LYS C C 103 173.922 173.922 177.784 -3.862 25567 14337 1 20 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.868 -2.586 25567 14338 1 20 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.878 -2.387 25567 14339 1 20 . 1 1 103 103 LYS H H 103 6.875 6.875 8.008 -1.133 25567 14340 1 20 . 1 1 104 104 ASN N N 104 114.987 114.987 116.056 -1.069 25567 14341 1 20 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.861 -0.120 25567 14342 1 20 . 1 1 104 104 ASN C C 104 172.587 172.587 174.469 -1.882 25567 14343 1 20 . 1 1 104 104 ASN CA C 104 50.469 50.469 53.006 -2.537 25567 14344 1 20 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.874 -4.053 25567 14345 1 20 . 1 1 104 104 ASN H H 104 8.517 8.517 8.226 0.291 25567 14346 1 20 . 1 1 105 105 TYR N N 105 122.755 122.755 122.338 0.417 25567 14347 1 20 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.469 0.106 25567 14348 1 20 . 1 1 105 105 TYR C C 105 174.260 174.260 174.901 -0.641 25567 14349 1 20 . 1 1 105 105 TYR CA C 105 55.493 55.493 59.213 -3.720 25567 14350 1 20 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.182 -3.118 25567 14351 1 20 . 1 1 105 105 TYR H H 105 8.287 8.287 7.896 0.391 25567 14352 1 20 . 1 1 106 106 ARG N N 106 128.905 128.905 126.553 2.352 25567 14353 1 20 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.302 -0.029 25567 14354 1 20 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.009 -1.988 25567 14355 1 20 . 1 1 106 106 ARG CB C 106 28.130 28.130 30.919 -2.788 25567 14356 1 20 . 1 1 106 106 ARG H H 106 8.841 8.841 8.117 0.724 25567 14357 1 20 . 1 1 107 107 GLY CA C 107 42.497 42.497 45.081 -2.584 25567 14358 1 20 . 1 1 108 108 GLU N N 108 116.989 116.989 119.204 -2.215 25567 14359 1 20 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.914 -0.283 25567 14360 1 20 . 1 1 108 108 GLU CA C 108 53.676 53.676 54.999 -1.323 25567 14361 1 20 . 1 1 108 108 GLU CB C 108 30.402 30.402 34.512 -4.110 25567 14362 1 20 . 1 1 108 108 GLU H H 108 7.536 7.536 8.392 -0.856 25567 14363 1 20 . 1 1 109 109 VAL N N 109 123.416 123.416 119.472 3.944 25567 14364 1 20 . 1 1 109 109 VAL HA H 109 5.321 5.321 4.784 0.537 25567 14365 1 20 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.762 -3.319 25567 14366 1 20 . 1 1 109 109 VAL CB C 109 32.661 32.661 33.967 -1.306 25567 14367 1 20 . 1 1 109 109 VAL H H 109 8.955 8.955 8.796 0.159 25567 14368 1 20 . 1 1 110 110 ALA N N 110 127.975 127.975 129.027 -1.052 25567 14369 1 20 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.041 -0.364 25567 14370 1 20 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.722 -2.281 25567 14371 1 20 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.372 -3.956 25567 14372 1 20 . 1 1 110 110 ALA H H 110 8.860 8.860 8.248 0.612 25567 14373 1 20 . 1 1 111 111 SER N N 111 110.482 110.482 114.656 -4.174 25567 14374 1 20 . 1 1 111 111 SER HA H 111 5.502 5.502 5.577 -0.075 25567 14375 1 20 . 1 1 111 111 SER CA C 111 51.630 51.630 56.539 -4.909 25567 14376 1 20 . 1 1 111 111 SER CB C 111 62.267 62.267 65.503 -3.236 25567 14377 1 20 . 1 1 111 111 SER H H 111 7.484 7.484 7.971 -0.487 25567 14378 1 20 . 1 1 112 112 PHE N N 112 125.082 125.082 121.537 3.545 25567 14379 1 20 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.574 0.874 25567 14380 1 20 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.667 -5.233 25567 14381 1 20 . 1 1 112 112 PHE CB C 112 40.500 40.500 40.165 0.335 25567 14382 1 20 . 1 1 112 112 PHE H H 112 8.025 8.025 8.511 -0.486 25567 14383 1 20 . 1 1 113 113 PHE N N 113 115.872 115.872 118.424 -2.552 25567 14384 1 20 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.210 0.714 25567 14385 1 20 . 1 1 113 113 PHE C C 113 173.293 173.293 175.678 -2.385 25567 14386 1 20 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.147 -4.679 25567 14387 1 20 . 1 1 113 113 PHE CB C 113 38.393 38.393 41.228 -2.835 25567 14388 1 20 . 1 1 113 113 PHE H H 113 7.391 7.391 7.699 -0.308 25567 14389 1 20 . 1 1 114 114 THR N N 114 108.721 108.721 109.855 -1.134 25567 14390 1 20 . 1 1 114 114 THR HA H 114 4.933 4.933 4.642 0.291 25567 14391 1 20 . 1 1 114 114 THR C C 114 171.891 171.891 174.870 -2.979 25567 14392 1 20 . 1 1 114 114 THR CA C 114 56.815 56.815 61.568 -4.753 25567 14393 1 20 . 1 1 114 114 THR CB C 114 67.899 67.899 69.921 -2.022 25567 14394 1 20 . 1 1 114 114 THR H H 114 7.951 7.951 8.336 -0.385 25567 14395 1 20 . 1 1 115 115 SER N N 115 115.159 115.159 118.503 -3.344 25567 14396 1 20 . 1 1 115 115 SER HA H 115 4.608 4.608 4.719 -0.111 25567 14397 1 20 . 1 1 115 115 SER C C 115 171.403 171.403 172.965 -1.562 25567 14398 1 20 . 1 1 115 115 SER CA C 115 55.570 55.570 57.894 -2.324 25567 14399 1 20 . 1 1 115 115 SER CB C 115 61.418 61.418 64.397 -2.979 25567 14400 1 20 . 1 1 115 115 SER H H 115 8.229 8.229 8.168 0.061 25567 14401 1 20 . 1 1 116 116 ALA N N 116 127.211 127.211 127.511 -0.300 25567 14402 1 20 . 1 1 116 116 ALA HA H 116 4.456 4.456 5.158 -0.702 25567 14403 1 20 . 1 1 116 116 ALA C C 116 175.758 175.758 178.058 -2.300 25567 14404 1 20 . 1 1 116 116 ALA CA C 116 49.816 49.816 51.491 -1.675 25567 14405 1 20 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.811 -2.981 25567 14406 1 20 . 1 1 116 116 ALA H H 116 8.813 8.813 8.580 0.233 25567 14407 1 20 . 1 1 117 117 GLY N N 117 108.099 108.099 108.995 -0.896 25567 14408 1 20 . 1 1 117 117 GLY C C 117 171.805 171.805 175.721 -3.916 25567 14409 1 20 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.041 -4.172 25567 14410 1 20 . 1 1 117 117 GLY H H 117 8.685 8.685 8.678 0.007 25567 14411 1 20 . 1 1 118 118 THR N N 118 111.284 111.284 112.296 -1.012 25567 14412 1 20 . 1 1 118 118 THR HA H 118 4.343 4.343 4.242 0.101 25567 14413 1 20 . 1 1 118 118 THR C C 118 171.769 171.769 173.279 -1.510 25567 14414 1 20 . 1 1 118 118 THR CA C 118 58.933 58.933 61.570 -2.637 25567 14415 1 20 . 1 1 118 118 THR CB C 118 67.304 67.304 69.473 -2.169 25567 14416 1 20 . 1 1 118 118 THR H H 118 7.998 7.998 8.232 -0.234 25567 14417 1 20 . 1 1 119 119 ASN N N 119 120.253 120.253 118.190 2.063 25567 14418 1 20 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.952 -0.249 25567 14419 1 20 . 1 1 119 119 ASN C C 119 172.353 172.353 173.412 -1.059 25567 14420 1 20 . 1 1 119 119 ASN CA C 119 50.228 50.228 52.536 -2.308 25567 14421 1 20 . 1 1 119 119 ASN CB C 119 35.376 35.376 41.205 -5.829 25567 14422 1 20 . 1 1 119 119 ASN H H 119 8.381 8.381 7.895 0.486 25567 14423 1 20 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.654 -0.568 25567 14424 1 20 . 1 1 120 120 HIS C C 120 173.395 173.395 175.790 -2.395 25567 14425 1 20 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.255 -2.116 25567 14426 1 20 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.881 -3.459 25567 14427 1 20 . 1 1 121 121 LYS N N 121 119.527 119.527 121.088 -1.561 25567 14428 1 20 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.944 -0.164 25567 14429 1 20 . 1 1 121 121 LYS C C 121 176.053 176.053 177.835 -1.782 25567 14430 1 20 . 1 1 121 121 LYS CA C 121 56.963 56.963 58.274 -1.311 25567 14431 1 20 . 1 1 121 121 LYS CB C 121 29.660 29.660 32.228 -2.568 25567 14432 1 20 . 1 1 121 121 LYS H H 121 8.106 8.106 8.535 -0.429 25567 14433 1 20 . 1 1 122 122 ALA N N 122 121.585 121.585 122.483 -0.898 25567 14434 1 20 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.828 -0.107 25567 14435 1 20 . 1 1 122 122 ALA C C 122 175.128 175.128 179.056 -3.928 25567 14436 1 20 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.469 -2.878 25567 14437 1 20 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.865 -2.161 25567 14438 1 20 . 1 1 122 122 ALA H H 122 7.702 7.702 7.934 -0.232 25567 14439 1 20 . 1 1 123 123 TYR N N 123 118.803 118.803 120.154 -1.351 25567 14440 1 20 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.250 -0.884 25567 14441 1 20 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.358 -1.267 25567 14442 1 20 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.208 -3.106 25567 14443 1 20 . 1 1 123 123 TYR H H 123 7.366 7.366 7.581 -0.215 25567 14444 1 20 . 1 1 124 124 VAL N N 124 117.530 117.530 117.644 -0.114 25567 14445 1 20 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.642 -0.443 25567 14446 1 20 . 1 1 124 124 VAL C C 124 175.375 175.375 177.973 -2.598 25567 14447 1 20 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.741 -2.158 25567 14448 1 20 . 1 1 124 124 VAL CB C 124 29.203 29.203 31.210 -2.007 25567 14449 1 20 . 1 1 124 124 VAL H H 124 7.757 7.757 7.658 0.099 25567 14450 1 20 . 1 1 125 125 SER N N 125 114.023 114.023 114.963 -0.940 25567 14451 1 20 . 1 1 125 125 SER HA H 125 4.035 4.035 4.010 0.025 25567 14452 1 20 . 1 1 125 125 SER C C 125 174.636 174.636 176.171 -1.535 25567 14453 1 20 . 1 1 125 125 SER CA C 125 58.885 58.885 61.191 -2.306 25567 14454 1 20 . 1 1 125 125 SER CB C 125 59.666 59.666 62.640 -2.974 25567 14455 1 20 . 1 1 125 125 SER H H 125 7.622 7.622 7.466 0.156 25567 14456 1 20 . 1 1 126 126 HIS N N 126 119.457 119.457 120.253 -0.796 25567 14457 1 20 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.936 0.260 25567 14458 1 20 . 1 1 126 126 HIS C C 126 172.942 172.942 177.621 -4.679 25567 14459 1 20 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.450 -3.533 25567 14460 1 20 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.520 -3.441 25567 14461 1 20 . 1 1 126 126 HIS H H 126 8.067 8.067 7.770 0.297 25567 14462 1 20 . 1 1 127 127 PHE N N 127 120.628 120.628 119.847 0.781 25567 14463 1 20 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.847 -0.648 25567 14464 1 20 . 1 1 127 127 PHE C C 127 173.515 173.515 176.575 -3.060 25567 14465 1 20 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.366 1.315 25567 14466 1 20 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.935 -2.568 25567 14467 1 20 . 1 1 127 127 PHE H H 127 9.083 9.083 8.434 0.649 25567 14468 1 20 . 1 1 128 128 ASN N N 128 114.858 114.858 117.334 -2.476 25567 14469 1 20 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.050 0.028 25567 14470 1 20 . 1 1 128 128 ASN C C 128 175.338 175.338 177.650 -2.312 25567 14471 1 20 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.542 -2.292 25567 14472 1 20 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.115 -2.094 25567 14473 1 20 . 1 1 128 128 ASN H H 128 7.858 7.858 7.623 0.235 25567 14474 1 20 . 1 1 129 129 GLU N N 129 119.811 119.811 118.685 1.126 25567 14475 1 20 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.119 -0.078 25567 14476 1 20 . 1 1 129 129 GLU C C 129 176.941 176.941 178.461 -1.520 25567 14477 1 20 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.734 -2.102 25567 14478 1 20 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.243 -2.305 25567 14479 1 20 . 1 1 129 129 GLU H H 129 7.569 7.569 7.797 -0.228 25567 14480 1 20 . 1 1 130 130 TRP N N 130 120.585 120.585 119.200 1.385 25567 14481 1 20 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.524 -0.052 25567 14482 1 20 . 1 1 130 130 TRP C C 130 174.262 174.262 177.340 -3.078 25567 14483 1 20 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.820 -2.147 25567 14484 1 20 . 1 1 130 130 TRP CB C 130 26.956 26.956 28.836 -1.880 25567 14485 1 20 . 1 1 130 130 TRP H H 130 7.964 7.964 7.545 0.419 25567 14486 1 20 . 1 1 131 131 ALA N N 131 120.522 120.522 120.087 0.435 25567 14487 1 20 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.181 -0.234 25567 14488 1 20 . 1 1 131 131 ALA C C 131 172.489 172.489 176.210 -3.721 25567 14489 1 20 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.488 -2.908 25567 14490 1 20 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.520 -2.981 25567 14491 1 20 . 1 1 131 131 ALA H H 131 8.114 8.114 7.327 0.787 25567 14492 1 20 . 1 1 132 132 ASP N N 132 117.666 117.666 118.644 -0.978 25567 14493 1 20 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.199 0.007 25567 14494 1 20 . 1 1 132 132 ASP C C 132 173.779 173.779 176.929 -3.150 25567 14495 1 20 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.980 -1.667 25567 14496 1 20 . 1 1 132 132 ASP CB C 132 39.456 39.456 41.027 -1.571 25567 14497 1 20 . 1 1 132 132 ASP H H 132 6.768 6.768 7.785 -1.017 25567 14498 1 20 . 1 1 133 133 GLY N N 133 114.922 114.922 111.770 3.152 25567 14499 1 20 . 1 1 133 133 GLY C C 133 172.101 172.101 173.755 -1.654 25567 14500 1 20 . 1 1 133 133 GLY CA C 133 42.509 42.509 44.806 -2.297 25567 14501 1 20 . 1 1 133 133 GLY H H 133 8.645 8.645 8.446 0.199 25567 14502 1 20 . 1 1 134 134 LEU N N 134 120.101 120.101 120.557 -0.456 25567 14503 1 20 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.607 -0.145 25567 14504 1 20 . 1 1 134 134 LEU C C 134 174.098 174.098 175.445 -1.347 25567 14505 1 20 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.242 -2.158 25567 14506 1 20 . 1 1 134 134 LEU CB C 134 40.509 40.509 44.547 -4.038 25567 14507 1 20 . 1 1 134 134 LEU H H 134 8.049 8.049 7.374 0.675 25567 14508 1 20 . 1 1 135 135 ASN N N 135 119.258 119.258 120.801 -1.543 25567 14509 1 20 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.757 -0.118 25567 14510 1 20 . 1 1 135 135 ASN C C 135 170.564 170.564 174.271 -3.707 25567 14511 1 20 . 1 1 135 135 ASN CA C 135 49.253 49.253 52.923 -3.670 25567 14512 1 20 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.229 -4.611 25567 14513 1 20 . 1 1 135 135 ASN H H 135 8.567 8.567 8.853 -0.286 25567 14514 1 20 . 1 1 136 136 VAL N N 136 125.460 125.460 126.131 -0.671 25567 14515 1 20 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.692 -0.096 25567 14516 1 20 . 1 1 136 136 VAL C C 136 175.318 175.318 175.832 -0.514 25567 14517 1 20 . 1 1 136 136 VAL CA C 136 58.722 58.722 61.997 -3.275 25567 14518 1 20 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.312 -3.013 25567 14519 1 20 . 1 1 136 136 VAL H H 136 7.660 7.660 8.011 -0.351 25567 14520 1 20 . 1 1 137 137 ILE N N 137 122.021 122.021 126.601 -4.580 25567 14521 1 20 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.776 -0.348 25567 14522 1 20 . 1 1 137 137 ILE C C 137 173.943 173.943 174.775 -0.832 25567 14523 1 20 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.938 -0.980 25567 14524 1 20 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.935 -2.766 25567 14525 1 20 . 1 1 137 137 ILE H H 137 9.151 9.151 8.846 0.305 25567 14526 1 20 . 1 1 138 138 GLY N N 138 108.192 108.192 108.587 -0.395 25567 14527 1 20 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.210 -1.716 25567 14528 1 20 . 1 1 138 138 GLY H H 138 6.675 6.675 7.561 -0.886 25567 14529 1 20 . 1 1 139 139 VAL N N 139 119.673 119.673 125.030 -5.357 25567 14530 1 20 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.706 0.614 25567 14531 1 20 . 1 1 139 139 VAL C C 139 172.291 172.291 174.462 -2.171 25567 14532 1 20 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.468 -3.259 25567 14533 1 20 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.147 -0.508 25567 14534 1 20 . 1 1 139 139 VAL H H 139 8.158 8.158 8.765 -0.607 25567 14535 1 20 . 1 1 140 140 ALA N N 140 127.104 127.104 128.933 -1.829 25567 14536 1 20 . 1 1 140 140 ALA HA H 140 4.596 4.596 4.961 -0.365 25567 14537 1 20 . 1 1 140 140 ALA C C 140 171.057 171.057 174.915 -3.858 25567 14538 1 20 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.467 -1.584 25567 14539 1 20 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.558 -1.130 25567 14540 1 20 . 1 1 140 140 ALA H H 140 9.145 9.145 8.262 0.883 25567 14541 1 20 . 1 1 141 141 ARG N N 141 118.828 118.828 118.077 0.751 25567 14542 1 20 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.667 -1.927 25567 14543 1 20 . 1 1 141 141 ARG C C 141 173.524 173.524 176.065 -2.541 25567 14544 1 20 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.317 -2.431 25567 14545 1 20 . 1 1 141 141 ARG CB C 141 28.454 28.454 32.622 -4.168 25567 14546 1 20 . 1 1 141 141 ARG H H 141 7.759 7.759 8.229 -0.470 25567 14547 1 20 . 1 1 142 142 ASP N N 142 125.557 125.557 120.851 4.706 25567 14548 1 20 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.270 -0.491 25567 14549 1 20 . 1 1 142 142 ASP C C 142 169.292 169.292 176.201 -6.909 25567 14550 1 20 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.401 -2.779 25567 14551 1 20 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.743 -3.663 25567 14552 1 20 . 1 1 142 142 ASP H H 142 9.087 9.087 8.436 0.651 25567 14553 1 20 . 1 1 143 143 ASP N N 143 119.094 119.094 120.091 -0.997 25567 14554 1 20 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.524 -0.270 25567 14555 1 20 . 1 1 143 143 ASP C C 143 175.557 175.557 177.216 -1.659 25567 14556 1 20 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.895 -4.816 25567 14557 1 20 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.514 -4.072 25567 14558 1 20 . 1 1 143 143 ASP H H 143 8.175 8.175 8.624 -0.449 25567 14559 1 20 . 1 1 144 144 SER N N 144 115.438 115.438 116.802 -1.364 25567 14560 1 20 . 1 1 144 144 SER HA H 144 3.745 3.745 4.070 -0.325 25567 14561 1 20 . 1 1 144 144 SER C C 144 172.820 172.820 175.336 -2.516 25567 14562 1 20 . 1 1 144 144 SER CA C 144 59.336 59.336 61.254 -1.918 25567 14563 1 20 . 1 1 144 144 SER CB C 144 60.839 60.839 62.819 -1.980 25567 14564 1 20 . 1 1 144 144 SER H H 144 7.742 7.742 7.704 0.038 25567 14565 1 20 . 1 1 145 145 GLU N N 145 119.631 119.631 118.666 0.965 25567 14566 1 20 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.103 0.216 25567 14567 1 20 . 1 1 145 145 GLU C C 145 171.927 171.927 176.704 -4.777 25567 14568 1 20 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.740 -3.656 25567 14569 1 20 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.132 -2.358 25567 14570 1 20 . 1 1 145 145 GLU H H 145 7.924 7.924 8.109 -0.185 25567 14571 1 20 . 1 1 146 146 VAL N N 146 118.791 118.791 120.524 -1.733 25567 14572 1 20 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.479 -0.523 25567 14573 1 20 . 1 1 146 146 VAL C C 146 174.582 174.582 177.371 -2.789 25567 14574 1 20 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.662 -2.584 25567 14575 1 20 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.534 -2.394 25567 14576 1 20 . 1 1 146 146 VAL H H 146 6.393 6.393 7.078 -0.685 25567 14577 1 20 . 1 1 147 147 ASP N N 147 119.410 119.410 115.864 3.546 25567 14578 1 20 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.405 -0.335 25567 14579 1 20 . 1 1 147 147 ASP C C 147 174.774 174.774 175.836 -1.062 25567 14580 1 20 . 1 1 147 147 ASP CA C 147 54.322 54.322 55.679 -1.357 25567 14581 1 20 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.321 -3.117 25567 14582 1 20 . 1 1 147 147 ASP H H 147 8.393 8.393 8.599 -0.206 25567 14583 1 20 . 1 1 148 148 LYS N N 148 119.422 119.422 113.384 6.038 25567 14584 1 20 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.577 -0.626 25567 14585 1 20 . 1 1 148 148 LYS C C 148 176.410 176.410 177.192 -0.782 25567 14586 1 20 . 1 1 148 148 LYS CA C 148 55.736 55.736 55.866 -0.130 25567 14587 1 20 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.877 -3.301 25567 14588 1 20 . 1 1 148 148 LYS H H 148 7.078 7.078 7.235 -0.157 25567 14589 1 20 . 1 1 149 149 TRP N N 149 118.168 118.168 121.530 -3.362 25567 14590 1 20 . 1 1 149 149 TRP HA H 149 4.601 4.601 5.088 -0.487 25567 14591 1 20 . 1 1 149 149 TRP C C 149 174.199 174.199 176.275 -2.076 25567 14592 1 20 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.560 -1.765 25567 14593 1 20 . 1 1 149 149 TRP CB C 149 27.011 27.011 29.501 -2.490 25567 14594 1 20 . 1 1 149 149 TRP H H 149 7.914 7.914 8.062 -0.148 25567 14595 1 20 . 1 1 150 150 SER N N 150 109.636 109.636 112.312 -2.676 25567 14596 1 20 . 1 1 150 150 SER HA H 150 4.242 4.242 4.563 -0.321 25567 14597 1 20 . 1 1 150 150 SER C C 150 170.173 170.173 174.262 -4.089 25567 14598 1 20 . 1 1 150 150 SER CA C 150 56.912 56.912 58.778 -1.866 25567 14599 1 20 . 1 1 150 150 SER CB C 150 62.087 62.087 64.506 -2.419 25567 14600 1 20 . 1 1 150 150 SER H H 150 7.814 7.814 7.988 -0.174 25567 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 124 3.274 -0.182 3.282 25567 2 1 1 "Average Difference" HA 123 0.430 0.196 0.384 25567 3 1 1 "Average Difference" C 98 2.811 2.587 1.107 25567 4 1 1 "Average Difference" CA 134 2.815 2.337 1.575 25567 5 1 1 "Average Difference" CB 127 3.121 2.726 1.527 25567 6 1 1 "Average Difference" HN 124 0.583 0.040 0.584 25567 7 1 2 "Average Difference" N 124 3.171 -0.234 3.175 25567 8 1 2 "Average Difference" HA 123 0.429 0.175 0.393 25567 9 1 2 "Average Difference" C 98 2.853 2.574 1.236 25567 10 1 2 "Average Difference" CA 134 2.817 2.330 1.590 25567 11 1 2 "Average Difference" CB 127 3.204 2.821 1.524 25567 12 1 2 "Average Difference" HN 124 0.620 0.029 0.622 25567 13 1 3 "Average Difference" N 124 3.762 -0.164 3.773 25567 14 1 3 "Average Difference" HA 123 0.425 0.181 0.386 25567 15 1 3 "Average Difference" C 98 2.930 2.684 1.182 25567 16 1 3 "Average Difference" CA 134 2.761 2.355 1.447 25567 17 1 3 "Average Difference" CB 127 3.200 2.786 1.580 25567 18 1 3 "Average Difference" HN 124 0.616 0.058 0.616 25567 19 1 4 "Average Difference" N 124 3.737 -0.368 3.734 25567 20 1 4 "Average Difference" HA 123 0.405 0.178 0.366 25567 21 1 4 "Average Difference" C 98 2.846 2.618 1.122 25567 22 1 4 "Average Difference" CA 134 2.792 2.356 1.504 25567 23 1 4 "Average Difference" CB 127 3.218 2.819 1.557 25567 24 1 4 "Average Difference" HN 124 0.615 0.017 0.617 25567 25 1 5 "Average Difference" N 124 3.780 -0.416 3.772 25567 26 1 5 "Average Difference" HA 123 0.454 0.179 0.419 25567 27 1 5 "Average Difference" C 98 2.945 2.721 1.131 25567 28 1 5 "Average Difference" CA 134 2.873 2.422 1.551 25567 29 1 5 "Average Difference" CB 127 3.089 2.747 1.417 25567 30 1 5 "Average Difference" HN 124 0.597 0.073 0.595 25567 31 1 6 "Average Difference" N 124 3.766 -0.263 3.772 25567 32 1 6 "Average Difference" HA 123 0.484 0.204 0.441 25567 33 1 6 "Average Difference" C 98 2.828 2.605 1.109 25567 34 1 6 "Average Difference" CA 134 2.870 2.374 1.619 25567 35 1 6 "Average Difference" CB 127 3.183 2.740 1.627 25567 36 1 6 "Average Difference" HN 124 0.628 0.057 0.628 25567 37 1 7 "Average Difference" N 124 3.705 -0.710 3.651 25567 38 1 7 "Average Difference" HA 123 0.432 0.155 0.405 25567 39 1 7 "Average Difference" C 98 2.819 2.591 1.116 25567 40 1 7 "Average Difference" CA 134 2.825 2.398 1.498 25567 41 1 7 "Average Difference" CB 127 3.178 2.897 1.310 25567 42 1 7 "Average Difference" HN 124 0.630 0.043 0.631 25567 43 1 8 "Average Difference" N 124 3.481 -0.311 3.481 25567 44 1 8 "Average Difference" HA 123 0.455 0.201 0.409 25567 45 1 8 "Average Difference" C 98 2.742 2.531 1.060 25567 46 1 8 "Average Difference" CA 134 2.732 2.242 1.567 25567 47 1 8 "Average Difference" CB 127 3.219 2.878 1.448 25567 48 1 8 "Average Difference" HN 124 0.529 0.041 0.530 25567 49 1 9 "Average Difference" N 124 3.569 -0.300 3.571 25567 50 1 9 "Average Difference" HA 123 0.434 0.209 0.382 25567 51 1 9 "Average Difference" C 98 2.879 2.631 1.173 25567 52 1 9 "Average Difference" CA 134 2.821 2.370 1.535 25567 53 1 9 "Average Difference" CB 127 3.241 2.838 1.571 25567 54 1 9 "Average Difference" HN 124 0.593 0.087 0.589 25567 55 1 10 "Average Difference" N 124 3.339 -0.457 3.321 25567 56 1 10 "Average Difference" HA 123 0.481 0.210 0.434 25567 57 1 10 "Average Difference" C 98 2.803 2.554 1.160 25567 58 1 10 "Average Difference" CA 134 2.762 2.289 1.552 25567 59 1 10 "Average Difference" CB 127 3.287 2.958 1.439 25567 60 1 10 "Average Difference" HN 124 0.620 0.048 0.620 25567 61 1 11 "Average Difference" N 124 3.405 -0.294 3.406 25567 62 1 11 "Average Difference" HA 123 0.471 0.201 0.428 25567 63 1 11 "Average Difference" C 98 2.804 2.572 1.123 25567 64 1 11 "Average Difference" CA 134 2.832 2.379 1.542 25567 65 1 11 "Average Difference" CB 127 3.210 2.803 1.571 25567 66 1 11 "Average Difference" HN 124 0.598 0.052 0.598 25567 67 1 12 "Average Difference" N 124 3.794 -0.206 3.804 25567 68 1 12 "Average Difference" HA 123 0.512 0.184 0.480 25567 69 1 12 "Average Difference" C 98 2.802 2.532 1.207 25567 70 1 12 "Average Difference" CA 134 2.826 2.344 1.585 25567 71 1 12 "Average Difference" CB 127 3.131 2.744 1.514 25567 72 1 12 "Average Difference" HN 124 0.620 0.030 0.622 25567 73 1 13 "Average Difference" N 124 3.449 -0.630 3.404 25567 74 1 13 "Average Difference" HA 123 0.419 0.175 0.383 25567 75 1 13 "Average Difference" C 98 2.885 2.654 1.135 25567 76 1 13 "Average Difference" CA 134 2.890 2.426 1.575 25567 77 1 13 "Average Difference" CB 127 3.195 2.881 1.385 25567 78 1 13 "Average Difference" HN 124 0.597 0.036 0.599 25567 79 1 14 "Average Difference" N 124 3.357 -0.185 3.365 25567 80 1 14 "Average Difference" HA 123 0.422 0.193 0.377 25567 81 1 14 "Average Difference" C 98 2.799 2.549 1.164 25567 82 1 14 "Average Difference" CA 134 2.830 2.331 1.610 25567 83 1 14 "Average Difference" CB 127 3.259 2.850 1.588 25567 84 1 14 "Average Difference" HN 124 0.574 0.060 0.573 25567 85 1 15 "Average Difference" N 124 3.543 -0.206 3.551 25567 86 1 15 "Average Difference" HA 123 0.438 0.177 0.402 25567 87 1 15 "Average Difference" C 98 2.789 2.552 1.131 25567 88 1 15 "Average Difference" CA 134 2.870 2.374 1.619 25567 89 1 15 "Average Difference" CB 127 3.204 2.832 1.506 25567 90 1 15 "Average Difference" HN 124 0.570 0.052 0.570 25567 91 1 16 "Average Difference" N 124 3.708 -0.524 3.686 25567 92 1 16 "Average Difference" HA 123 0.441 0.191 0.399 25567 93 1 16 "Average Difference" C 98 2.740 2.524 1.072 25567 94 1 16 "Average Difference" CA 134 2.749 2.313 1.491 25567 95 1 16 "Average Difference" CB 127 3.267 2.828 1.642 25567 96 1 16 "Average Difference" HN 124 0.603 0.013 0.605 25567 97 1 17 "Average Difference" N 124 3.629 -0.488 3.611 25567 98 1 17 "Average Difference" HA 123 0.475 0.183 0.440 25567 99 1 17 "Average Difference" C 98 2.869 2.607 1.204 25567 100 1 17 "Average Difference" CA 134 2.903 2.437 1.583 25567 101 1 17 "Average Difference" CB 127 3.180 2.821 1.475 25567 102 1 17 "Average Difference" HN 124 0.658 0.074 0.656 25567 103 1 18 "Average Difference" N 124 3.597 -0.512 3.575 25567 104 1 18 "Average Difference" HA 123 0.439 0.174 0.404 25567 105 1 18 "Average Difference" C 98 2.859 2.614 1.164 25567 106 1 18 "Average Difference" CA 134 2.913 2.435 1.604 25567 107 1 18 "Average Difference" CB 127 3.185 2.798 1.529 25567 108 1 18 "Average Difference" HN 124 0.600 0.027 0.602 25567 109 1 19 "Average Difference" N 124 3.714 -0.581 3.683 25567 110 1 19 "Average Difference" HA 123 0.474 0.187 0.437 25567 111 1 19 "Average Difference" C 98 2.760 2.514 1.146 25567 112 1 19 "Average Difference" CA 134 2.822 2.335 1.590 25567 113 1 19 "Average Difference" CB 127 3.194 2.793 1.555 25567 114 1 19 "Average Difference" HN 124 0.627 0.065 0.626 25567 115 1 20 "Average Difference" N 124 3.663 -0.427 3.653 25567 116 1 20 "Average Difference" HA 123 0.478 0.227 0.422 25567 117 1 20 "Average Difference" C 98 2.791 2.542 1.157 25567 118 1 20 "Average Difference" CA 134 2.773 2.216 1.674 25567 119 1 20 "Average Difference" CB 127 3.302 2.965 1.460 25567 120 1 20 "Average Difference" HN 124 0.584 0.032 0.586 25567 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 25567 _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 MET HA H 2 4.416 4.416 4.945 -0.529 25567 2 1 . 1 1 2 2 MET CA C 2 52.847 52.847 55.252 -2.405 25567 3 1 . 1 1 2 2 MET CB C 2 30.672 30.672 34.049 -3.377 25567 4 1 . 1 1 3 3 ALA N N 3 125.563 125.563 126.468 -0.905 25567 5 1 . 1 1 3 3 ALA HA H 3 4.372 4.372 4.548 -0.176 25567 6 1 . 1 1 3 3 ALA C C 3 174.728 174.728 175.887 -1.159 25567 7 1 . 1 1 3 3 ALA CA C 3 49.348 49.348 52.091 -2.743 25567 8 1 . 1 1 3 3 ALA CB C 3 16.935 16.935 20.389 -3.454 25567 9 1 . 1 1 3 3 ALA H H 3 8.342 8.342 8.332 0.010 25567 10 1 . 1 1 4 4 LYS N N 4 121.767 121.767 124.245 -2.478 25567 11 1 . 1 1 4 4 LYS HA H 4 4.230 4.230 4.426 -0.196 25567 12 1 . 1 1 4 4 LYS C C 4 174.577 174.577 175.962 -1.385 25567 13 1 . 1 1 4 4 LYS CA C 4 53.989 53.989 55.825 -1.836 25567 14 1 . 1 1 4 4 LYS CB C 4 31.555 31.555 32.511 -0.956 25567 15 1 . 1 1 4 4 LYS H H 4 8.500 8.500 8.472 0.028 25567 16 1 . 1 1 5 5 LYS N N 5 129.654 129.654 123.211 6.443 25567 17 1 . 1 1 5 5 LYS HA H 5 4.526 4.526 4.675 -0.149 25567 18 1 . 1 1 5 5 LYS C C 5 174.731 174.731 176.266 -1.535 25567 19 1 . 1 1 5 5 LYS CA C 5 54.746 54.746 55.631 -0.885 25567 20 1 . 1 1 5 5 LYS CB C 5 29.894 29.894 34.622 -4.728 25567 21 1 . 1 1 5 5 LYS H H 5 10.035 10.035 8.282 1.753 25567 22 1 . 1 1 6 6 THR N N 6 126.212 126.212 114.795 11.417 25567 23 1 . 1 1 6 6 THR HA H 6 5.654 5.654 5.293 0.361 25567 24 1 . 1 1 6 6 THR C C 6 169.897 169.897 173.091 -3.194 25567 25 1 . 1 1 6 6 THR CA C 6 60.647 60.647 61.707 -1.060 25567 26 1 . 1 1 6 6 THR CB C 6 68.152 68.152 71.958 -3.806 25567 27 1 . 1 1 6 6 THR H H 6 8.557 8.557 8.406 0.151 25567 28 1 . 1 1 7 7 LEU N N 7 130.776 130.776 125.447 5.329 25567 29 1 . 1 1 7 7 LEU HA H 7 4.619 4.619 4.915 -0.296 25567 30 1 . 1 1 7 7 LEU CA C 7 50.096 50.096 53.299 -3.203 25567 31 1 . 1 1 7 7 LEU CB C 7 41.043 41.043 45.997 -4.954 25567 32 1 . 1 1 7 7 LEU H H 7 8.610 8.610 8.593 0.017 25567 33 1 . 1 1 8 8 ILE N N 8 127.175 127.175 123.961 3.214 25567 34 1 . 1 1 8 8 ILE HA H 8 4.856 4.856 4.674 0.182 25567 35 1 . 1 1 8 8 ILE CA C 8 57.392 57.392 60.653 -3.261 25567 36 1 . 1 1 8 8 ILE CB C 8 36.864 36.864 39.620 -2.756 25567 37 1 . 1 1 8 8 ILE H H 8 9.263 9.263 8.326 0.937 25567 38 1 . 1 1 9 9 LEU N N 9 127.117 127.117 128.207 -1.090 25567 39 1 . 1 1 9 9 LEU HA H 9 5.696 5.696 5.073 0.623 25567 40 1 . 1 1 9 9 LEU CA C 9 49.952 49.952 53.649 -3.697 25567 41 1 . 1 1 9 9 LEU CB C 9 43.827 43.827 43.456 0.371 25567 42 1 . 1 1 9 9 LEU H H 9 9.262 9.262 8.533 0.729 25567 43 1 . 1 1 10 10 TYR N N 10 113.544 113.544 120.947 -7.403 25567 44 1 . 1 1 10 10 TYR HA H 10 5.531 5.531 5.059 0.472 25567 45 1 . 1 1 10 10 TYR CA C 10 52.829 52.829 55.392 -2.563 25567 46 1 . 1 1 10 10 TYR CB C 10 38.615 38.615 40.348 -1.733 25567 47 1 . 1 1 10 10 TYR H H 10 7.425 7.425 8.130 -0.705 25567 48 1 . 1 1 11 11 TYR N N 11 121.235 121.235 124.909 -3.674 25567 49 1 . 1 1 11 11 TYR HA H 11 4.810 4.810 4.914 -0.104 25567 50 1 . 1 1 11 11 TYR CA C 11 53.889 53.889 57.392 -3.503 25567 51 1 . 1 1 11 11 TYR CB C 11 40.467 40.467 39.390 1.077 25567 52 1 . 1 1 11 11 TYR H H 11 7.781 7.781 8.409 -0.628 25567 53 1 . 1 1 14 14 SER CA C 14 54.675 54.675 58.622 -3.947 25567 54 1 . 1 1 14 14 SER CB C 14 61.621 61.621 63.453 -1.832 25567 55 1 . 1 1 15 15 GLY N N 15 110.420 110.420 110.966 -0.546 25567 56 1 . 1 1 15 15 GLY CA C 15 43.727 43.727 45.713 -1.986 25567 57 1 . 1 1 15 15 GLY H H 15 7.757 7.757 8.356 -0.599 25567 58 1 . 1 1 17 17 THR HA H 17 4.122 4.122 4.155 -0.033 25567 59 1 . 1 1 17 17 THR CA C 17 64.748 64.748 63.814 0.934 25567 60 1 . 1 1 17 17 THR CB C 17 64.532 64.532 68.721 -4.189 25567 61 1 . 1 1 18 18 LYS HA H 18 2.918 2.918 3.648 -0.730 25567 62 1 . 1 1 18 18 LYS C C 18 173.812 173.812 178.006 -4.194 25567 63 1 . 1 1 18 18 LYS CA C 18 57.003 57.003 59.486 -2.483 25567 64 1 . 1 1 18 18 LYS CB C 18 29.768 29.768 32.287 -2.519 25567 65 1 . 1 1 19 19 LYS N N 19 116.699 116.699 118.075 -1.376 25567 66 1 . 1 1 19 19 LYS HA H 19 3.948 3.948 3.994 -0.046 25567 67 1 . 1 1 19 19 LYS C C 19 177.221 177.221 178.514 -1.293 25567 68 1 . 1 1 19 19 LYS CA C 19 56.421 56.421 58.870 -2.450 25567 69 1 . 1 1 19 19 LYS CB C 19 29.634 29.634 31.900 -2.266 25567 70 1 . 1 1 19 19 LYS H H 19 7.476 7.476 7.866 -0.390 25567 71 1 . 1 1 20 20 MET N N 20 118.946 118.946 116.820 2.126 25567 72 1 . 1 1 20 20 MET HA H 20 4.474 4.474 4.394 0.080 25567 73 1 . 1 1 20 20 MET C C 20 173.826 173.826 176.726 -2.900 25567 74 1 . 1 1 20 20 MET CA C 20 52.285 52.285 55.942 -3.657 25567 75 1 . 1 1 20 20 MET CB C 20 26.921 26.921 31.727 -4.806 25567 76 1 . 1 1 20 20 MET H H 20 7.457 7.457 7.904 -0.447 25567 77 1 . 1 1 21 21 ALA N N 21 123.375 123.375 121.581 1.794 25567 78 1 . 1 1 21 21 ALA HA H 21 3.552 3.552 4.318 -0.766 25567 79 1 . 1 1 21 21 ALA C C 21 176.542 176.542 179.076 -2.534 25567 80 1 . 1 1 21 21 ALA CA C 21 52.651 52.651 54.229 -1.578 25567 81 1 . 1 1 21 21 ALA CB C 21 16.282 16.282 19.206 -2.924 25567 82 1 . 1 1 21 21 ALA H H 21 8.549 8.549 7.941 0.608 25567 83 1 . 1 1 22 22 GLU N N 22 116.906 116.906 118.939 -2.033 25567 84 1 . 1 1 22 22 GLU HA H 22 3.673 3.673 3.993 -0.320 25567 85 1 . 1 1 22 22 GLU C C 22 176.658 176.658 179.129 -2.471 25567 86 1 . 1 1 22 22 GLU CA C 22 56.605 56.605 59.200 -2.595 25567 87 1 . 1 1 22 22 GLU CB C 22 26.649 26.649 29.439 -2.790 25567 88 1 . 1 1 22 22 GLU H H 22 8.085 8.085 8.068 0.017 25567 89 1 . 1 1 23 23 LYS N N 23 123.301 123.301 119.797 3.504 25567 90 1 . 1 1 23 23 LYS HA H 23 3.820 3.820 4.018 -0.198 25567 91 1 . 1 1 23 23 LYS C C 23 177.363 177.363 179.172 -1.809 25567 92 1 . 1 1 23 23 LYS CA C 23 56.971 56.971 59.282 -2.310 25567 93 1 . 1 1 23 23 LYS CB C 23 29.531 29.531 32.109 -2.578 25567 94 1 . 1 1 23 23 LYS H H 23 7.703 7.703 7.842 -0.139 25567 95 1 . 1 1 24 24 ILE N N 24 121.894 121.894 118.903 2.990 25567 96 1 . 1 1 24 24 ILE HA H 24 3.296 3.296 3.668 -0.372 25567 97 1 . 1 1 24 24 ILE C C 24 174.944 174.944 177.958 -3.014 25567 98 1 . 1 1 24 24 ILE CA C 24 63.233 63.233 64.742 -1.509 25567 99 1 . 1 1 24 24 ILE CB C 24 34.744 34.744 37.490 -2.746 25567 100 1 . 1 1 24 24 ILE H H 24 8.458 8.458 7.797 0.661 25567 101 1 . 1 1 25 25 ASN N N 25 118.580 118.580 117.970 0.610 25567 102 1 . 1 1 25 25 ASN HA H 25 4.234 4.234 4.355 -0.121 25567 103 1 . 1 1 25 25 ASN C C 25 173.567 173.567 177.156 -3.589 25567 104 1 . 1 1 25 25 ASN CA C 25 52.324 52.324 56.229 -3.905 25567 105 1 . 1 1 25 25 ASN CB C 25 38.183 38.183 38.576 -0.393 25567 106 1 . 1 1 25 25 ASN H H 25 8.273 8.273 8.125 0.148 25567 107 1 . 1 1 26 26 SER N N 26 112.132 112.132 113.674 -1.542 25567 108 1 . 1 1 26 26 SER HA H 26 4.148 4.148 4.388 -0.240 25567 109 1 . 1 1 26 26 SER C C 26 172.083 172.083 175.045 -2.962 25567 110 1 . 1 1 26 26 SER CA C 26 57.865 57.865 60.228 -2.363 25567 111 1 . 1 1 26 26 SER CB C 26 60.816 60.816 63.333 -2.517 25567 112 1 . 1 1 26 26 SER H H 26 7.444 7.444 7.875 -0.431 25567 113 1 . 1 1 27 27 GLU N N 27 120.080 120.080 118.904 1.176 25567 114 1 . 1 1 27 27 GLU HA H 27 4.100 4.100 4.394 -0.294 25567 115 1 . 1 1 27 27 GLU C C 27 173.647 173.647 176.326 -2.679 25567 116 1 . 1 1 27 27 GLU CA C 27 54.202 54.202 56.419 -2.217 25567 117 1 . 1 1 27 27 GLU CB C 27 26.884 26.884 30.610 -3.726 25567 118 1 . 1 1 27 27 GLU H H 27 7.453 7.453 7.710 -0.257 25567 119 1 . 1 1 28 28 ILE N N 28 118.759 118.759 120.025 -1.266 25567 120 1 . 1 1 28 28 ILE HA H 28 4.204 4.204 4.271 -0.067 25567 121 1 . 1 1 28 28 ILE C C 28 172.474 172.474 174.998 -2.524 25567 122 1 . 1 1 28 28 ILE CA C 28 57.747 57.747 60.167 -2.420 25567 123 1 . 1 1 28 28 ILE CB C 28 35.798 35.798 40.526 -4.728 25567 124 1 . 1 1 28 28 ILE H H 28 7.258 7.258 7.341 -0.083 25567 125 1 . 1 1 29 29 LYS N N 29 130.618 130.618 126.098 4.520 25567 126 1 . 1 1 29 29 LYS HA H 29 4.005 4.005 4.290 -0.285 25567 127 1 . 1 1 29 29 LYS C C 29 174.375 174.375 176.602 -2.227 25567 128 1 . 1 1 29 29 LYS CA C 29 55.659 55.659 56.894 -1.235 25567 129 1 . 1 1 29 29 LYS CB C 29 29.560 29.560 33.088 -3.529 25567 130 1 . 1 1 29 29 LYS H H 29 8.588 8.588 8.691 -0.103 25567 131 1 . 1 1 30 30 ASP N N 30 119.366 119.366 121.061 -1.695 25567 132 1 . 1 1 30 30 ASP HA H 30 4.402 4.402 4.364 0.038 25567 133 1 . 1 1 30 30 ASP C C 30 172.580 172.580 175.472 -2.892 25567 134 1 . 1 1 30 30 ASP CA C 30 53.624 53.624 55.270 -1.646 25567 135 1 . 1 1 30 30 ASP CB C 30 36.828 36.828 40.519 -3.691 25567 136 1 . 1 1 30 30 ASP H H 30 8.940 8.940 8.830 0.110 25567 137 1 . 1 1 31 31 SER N N 31 114.035 114.035 113.510 0.525 25567 138 1 . 1 1 31 31 SER HA H 31 4.781 4.781 4.725 0.056 25567 139 1 . 1 1 31 31 SER C C 31 171.136 171.136 174.372 -3.236 25567 140 1 . 1 1 31 31 SER CA C 31 55.638 55.638 58.633 -2.995 25567 141 1 . 1 1 31 31 SER CB C 31 62.388 62.388 64.606 -2.218 25567 142 1 . 1 1 31 31 SER H H 31 8.030 8.030 7.830 0.200 25567 143 1 . 1 1 32 32 GLU N N 32 121.406 121.406 120.811 0.595 25567 144 1 . 1 1 32 32 GLU HA H 32 4.735 4.735 4.674 0.061 25567 145 1 . 1 1 32 32 GLU C C 32 171.205 171.205 174.584 -3.379 25567 146 1 . 1 1 32 32 GLU CA C 32 52.069 52.069 55.402 -3.333 25567 147 1 . 1 1 32 32 GLU CB C 32 30.890 30.890 33.627 -2.737 25567 148 1 . 1 1 32 32 GLU H H 32 8.188 8.188 8.451 -0.263 25567 149 1 . 1 1 33 33 LEU N N 33 126.143 126.143 118.962 7.181 25567 150 1 . 1 1 33 33 LEU HA H 33 5.285 5.285 5.262 0.023 25567 151 1 . 1 1 33 33 LEU C C 33 173.401 173.401 175.721 -2.320 25567 152 1 . 1 1 33 33 LEU CA C 33 51.334 51.334 53.479 -2.145 25567 153 1 . 1 1 33 33 LEU CB C 33 43.623 43.623 44.844 -1.221 25567 154 1 . 1 1 33 33 LEU H H 33 8.627 8.627 8.402 0.225 25567 155 1 . 1 1 34 34 LYS N N 34 127.122 127.122 122.384 4.738 25567 156 1 . 1 1 34 34 LYS HA H 34 4.599 4.599 4.690 -0.091 25567 157 1 . 1 1 34 34 LYS C C 34 169.644 169.644 174.494 -4.850 25567 158 1 . 1 1 34 34 LYS CA C 34 52.353 52.353 54.544 -2.191 25567 159 1 . 1 1 34 34 LYS CB C 34 34.172 34.172 36.845 -2.673 25567 160 1 . 1 1 34 34 LYS H H 34 9.399 9.399 8.879 0.520 25567 161 1 . 1 1 35 35 GLU N N 35 122.766 122.766 121.135 1.631 25567 162 1 . 1 1 35 35 GLU HA H 35 3.358 3.358 4.400 -1.042 25567 163 1 . 1 1 35 35 GLU C C 35 172.875 172.875 175.372 -2.497 25567 164 1 . 1 1 35 35 GLU CA C 35 52.640 52.640 55.063 -2.423 25567 165 1 . 1 1 35 35 GLU CB C 35 29.268 29.268 31.309 -2.041 25567 166 1 . 1 1 35 35 GLU H H 35 8.166 8.166 8.403 -0.237 25567 167 1 . 1 1 36 36 VAL N N 36 126.674 126.674 121.765 4.909 25567 168 1 . 1 1 36 36 VAL HA H 36 3.861 3.861 4.357 -0.496 25567 169 1 . 1 1 36 36 VAL C C 36 171.451 171.451 175.385 -3.934 25567 170 1 . 1 1 36 36 VAL CA C 36 59.537 59.537 61.134 -1.597 25567 171 1 . 1 1 36 36 VAL CB C 36 29.689 29.689 33.375 -3.686 25567 172 1 . 1 1 36 36 VAL H H 36 8.632 8.632 8.243 0.389 25567 173 1 . 1 1 37 37 LYS N N 37 126.181 126.181 124.856 1.325 25567 174 1 . 1 1 37 37 LYS HA H 37 4.939 4.939 4.790 0.149 25567 175 1 . 1 1 37 37 LYS CA C 37 52.179 52.179 54.434 -2.255 25567 176 1 . 1 1 37 37 LYS CB C 37 32.898 32.898 35.660 -2.762 25567 177 1 . 1 1 37 37 LYS H H 37 7.867 7.867 8.751 -0.884 25567 178 1 . 1 1 38 38 VAL N N 38 113.540 113.540 115.844 -2.304 25567 179 1 . 1 1 38 38 VAL HA H 38 4.686 4.686 4.642 0.044 25567 180 1 . 1 1 38 38 VAL C C 38 173.633 173.633 175.472 -1.839 25567 181 1 . 1 1 38 38 VAL CA C 38 57.284 57.284 60.056 -2.772 25567 182 1 . 1 1 38 38 VAL CB C 38 31.964 31.964 33.791 -1.827 25567 183 1 . 1 1 38 38 VAL H H 38 8.389 8.389 8.332 0.057 25567 184 1 . 1 1 39 39 SER N N 39 118.860 118.860 117.940 0.920 25567 185 1 . 1 1 39 39 SER HA H 39 4.194 4.194 4.574 -0.380 25567 186 1 . 1 1 39 39 SER C C 39 173.059 173.059 174.108 -1.049 25567 187 1 . 1 1 39 39 SER CA C 39 56.227 56.227 58.221 -1.994 25567 188 1 . 1 1 39 39 SER CB C 39 60.771 60.771 64.232 -3.461 25567 189 1 . 1 1 39 39 SER H H 39 8.668 8.668 8.466 0.202 25567 190 1 . 1 1 40 40 GLU N N 40 125.769 125.769 120.843 4.926 25567 191 1 . 1 1 40 40 GLU HA H 40 4.157 4.157 4.385 -0.228 25567 192 1 . 1 1 40 40 GLU C C 40 174.484 174.484 176.148 -1.664 25567 193 1 . 1 1 40 40 GLU CA C 40 55.550 55.550 56.386 -0.836 25567 194 1 . 1 1 40 40 GLU CB C 40 27.054 27.054 30.609 -3.555 25567 195 1 . 1 1 40 40 GLU H H 40 8.878 8.878 8.402 0.476 25567 196 1 . 1 1 41 41 GLY N N 41 112.165 112.165 108.413 3.752 25567 197 1 . 1 1 41 41 GLY CA C 41 42.707 42.707 45.228 -2.521 25567 198 1 . 1 1 41 41 GLY H H 41 8.743 8.743 8.511 0.232 25567 199 1 . 1 1 44 44 ASP N N 44 122.324 122.324 120.631 1.693 25567 200 1 . 1 1 44 44 ASP CB C 44 42.156 42.156 41.457 0.699 25567 201 1 . 1 1 44 44 ASP H H 44 7.918 7.918 8.278 -0.360 25567 202 1 . 1 1 45 45 ALA HA H 45 4.062 4.062 4.238 -0.176 25567 203 1 . 1 1 45 45 ALA CA C 45 51.410 51.410 52.505 -1.095 25567 204 1 . 1 1 45 45 ALA CB C 45 16.376 16.376 19.549 -3.173 25567 205 1 . 1 1 47 47 MET CA C 47 54.118 54.118 55.624 -1.506 25567 206 1 . 1 1 47 47 MET CB C 47 27.527 27.527 33.729 -6.202 25567 207 1 . 1 1 48 48 TYR N N 48 120.075 120.075 118.961 1.114 25567 208 1 . 1 1 48 48 TYR HA H 48 4.154 4.154 4.444 -0.290 25567 209 1 . 1 1 48 48 TYR C C 48 172.217 172.217 175.405 -3.188 25567 210 1 . 1 1 48 48 TYR CA C 48 57.377 57.377 58.702 -1.325 25567 211 1 . 1 1 48 48 TYR CB C 48 34.496 34.496 37.985 -3.489 25567 212 1 . 1 1 48 48 TYR H H 48 7.810 7.810 8.215 -0.405 25567 213 1 . 1 1 49 49 LYS N N 49 118.369 118.369 122.356 -3.987 25567 214 1 . 1 1 49 49 LYS H H 49 8.116 8.116 8.430 -0.314 25567 215 1 . 1 1 50 50 THR N N 50 116.979 116.979 115.441 1.538 25567 216 1 . 1 1 50 50 THR CB C 50 66.373 66.373 68.953 -2.580 25567 217 1 . 1 1 50 50 THR H H 50 7.741 7.741 8.190 -0.449 25567 218 1 . 1 1 51 51 SER N N 51 116.155 116.155 116.457 -0.302 25567 219 1 . 1 1 51 51 SER HA H 51 3.771 3.771 4.676 -0.905 25567 220 1 . 1 1 51 51 SER C C 51 170.563 170.563 173.584 -3.021 25567 221 1 . 1 1 51 51 SER CA C 51 54.840 54.840 57.957 -3.117 25567 222 1 . 1 1 51 51 SER CB C 51 60.318 60.318 64.383 -4.065 25567 223 1 . 1 1 51 51 SER H H 51 7.853 7.853 7.932 -0.079 25567 224 1 . 1 1 54 54 ALA N N 54 123.234 123.234 123.637 -0.403 25567 225 1 . 1 1 54 54 ALA HA H 54 4.248 4.248 4.465 -0.217 25567 226 1 . 1 1 54 54 ALA CA C 54 51.268 51.268 52.412 -1.143 25567 227 1 . 1 1 54 54 ALA CB C 54 16.434 16.434 19.595 -3.161 25567 228 1 . 1 1 54 54 ALA H H 54 8.207 8.207 8.172 0.035 25567 229 1 . 1 1 55 55 LEU N N 55 118.603 118.603 120.499 -1.896 25567 230 1 . 1 1 55 55 LEU HA H 55 3.940 3.940 4.239 -0.299 25567 231 1 . 1 1 55 55 LEU CA C 55 54.711 54.711 55.636 -0.925 25567 232 1 . 1 1 55 55 LEU CB C 55 38.913 38.913 41.184 -2.271 25567 233 1 . 1 1 55 55 LEU H H 55 7.960 7.960 8.371 -0.411 25567 234 1 . 1 1 58 58 ILE HA H 58 3.676 3.676 4.097 -0.421 25567 235 1 . 1 1 58 58 ILE CA C 58 61.494 61.494 61.642 -0.147 25567 236 1 . 1 1 58 58 ILE CB C 58 36.054 36.054 39.420 -3.366 25567 237 1 . 1 1 59 59 GLN N N 59 117.579 117.579 120.647 -3.068 25567 238 1 . 1 1 59 59 GLN HA H 59 4.133 4.133 4.350 -0.217 25567 239 1 . 1 1 59 59 GLN CA C 59 54.009 54.009 55.968 -1.959 25567 240 1 . 1 1 59 59 GLN CB C 59 26.651 26.651 28.727 -2.076 25567 241 1 . 1 1 59 59 GLN H H 59 8.268 8.268 8.191 0.077 25567 242 1 . 1 1 60 60 GLY N N 60 107.308 107.308 112.770 -5.462 25567 243 1 . 1 1 60 60 GLY CA C 60 42.979 42.979 45.362 -2.383 25567 244 1 . 1 1 60 60 GLY H H 60 7.780 7.780 8.703 -0.923 25567 245 1 . 1 1 61 61 ASN N N 61 117.747 117.747 119.668 -1.921 25567 246 1 . 1 1 61 61 ASN HA H 61 4.534 4.534 4.813 -0.279 25567 247 1 . 1 1 61 61 ASN CA C 61 51.235 51.235 52.716 -1.481 25567 248 1 . 1 1 61 61 ASN CB C 61 36.424 36.424 39.445 -3.022 25567 249 1 . 1 1 61 61 ASN H H 61 8.108 8.108 7.997 0.111 25567 250 1 . 1 1 64 64 PHE N N 64 120.102 120.102 118.830 1.272 25567 251 1 . 1 1 64 64 PHE HA H 64 4.379 4.379 4.732 -0.353 25567 252 1 . 1 1 64 64 PHE CA C 64 51.748 51.748 54.712 -2.964 25567 253 1 . 1 1 64 64 PHE CB C 64 35.275 35.275 38.831 -3.556 25567 254 1 . 1 1 64 64 PHE H H 64 8.300 8.300 7.520 0.780 25567 255 1 . 1 1 65 65 PRO HA H 65 4.335 4.335 4.536 -0.201 25567 256 1 . 1 1 65 65 PRO C C 65 173.870 173.870 176.289 -2.419 25567 257 1 . 1 1 65 65 PRO CA C 65 60.017 60.017 62.708 -2.690 25567 258 1 . 1 1 65 65 PRO CB C 65 29.635 29.635 32.718 -3.083 25567 259 1 . 1 1 66 66 GLU N N 66 121.258 121.258 119.504 1.754 25567 260 1 . 1 1 66 66 GLU HA H 66 4.234 4.234 4.372 -0.138 25567 261 1 . 1 1 66 66 GLU C C 66 173.981 173.981 176.705 -2.724 25567 262 1 . 1 1 66 66 GLU CA C 66 53.787 53.787 56.122 -2.335 25567 263 1 . 1 1 66 66 GLU CB C 66 27.775 27.775 30.921 -3.146 25567 264 1 . 1 1 66 66 GLU H H 66 8.316 8.316 8.470 -0.154 25567 265 1 . 1 1 67 67 ILE N N 67 114.290 114.290 114.977 -0.687 25567 266 1 . 1 1 67 67 ILE HA H 67 5.129 5.129 4.670 0.459 25567 267 1 . 1 1 67 67 ILE C C 67 172.700 172.700 175.313 -2.613 25567 268 1 . 1 1 67 67 ILE CA C 67 56.439 56.439 59.509 -3.071 25567 269 1 . 1 1 67 67 ILE CB C 67 39.159 39.159 40.587 -1.428 25567 270 1 . 1 1 67 67 ILE H H 67 8.366 8.366 8.186 0.180 25567 271 1 . 1 1 68 68 GLN N N 68 121.422 121.422 119.776 1.646 25567 272 1 . 1 1 68 68 GLN HA H 68 4.501 4.501 4.743 -0.242 25567 273 1 . 1 1 68 68 GLN C C 68 171.675 171.675 174.078 -2.403 25567 274 1 . 1 1 68 68 GLN CA C 68 52.273 52.273 54.740 -2.467 25567 275 1 . 1 1 68 68 GLN CB C 68 27.143 27.143 32.770 -5.627 25567 276 1 . 1 1 68 68 GLN H H 68 8.737 8.737 8.497 0.240 25567 277 1 . 1 1 69 69 LEU N N 69 125.311 125.311 117.606 7.705 25567 278 1 . 1 1 69 69 LEU HA H 69 4.506 4.506 4.795 -0.289 25567 279 1 . 1 1 69 69 LEU C C 69 172.634 172.634 175.078 -2.444 25567 280 1 . 1 1 69 69 LEU CA C 69 51.759 51.759 53.978 -2.219 25567 281 1 . 1 1 69 69 LEU CB C 69 42.404 42.404 43.734 -1.330 25567 282 1 . 1 1 69 69 LEU H H 69 8.051 8.051 8.243 -0.192 25567 283 1 . 1 1 70 70 ASP N N 70 122.763 122.763 119.629 3.134 25567 284 1 . 1 1 70 70 ASP HA H 70 4.423 4.423 4.673 -0.250 25567 285 1 . 1 1 70 70 ASP CA C 70 51.610 51.610 53.821 -2.211 25567 286 1 . 1 1 70 70 ASP CB C 70 38.717 38.717 42.341 -3.624 25567 287 1 . 1 1 70 70 ASP H H 70 8.313 8.313 8.520 -0.207 25567 288 1 . 1 1 71 71 ASN N N 71 117.413 117.413 118.638 -1.225 25567 289 1 . 1 1 71 71 ASN HA H 71 4.337 4.337 4.684 -0.347 25567 290 1 . 1 1 71 71 ASN C C 71 171.770 171.770 174.652 -2.882 25567 291 1 . 1 1 71 71 ASN CA C 71 51.491 51.491 53.268 -1.777 25567 292 1 . 1 1 71 71 ASN CB C 71 35.326 35.326 37.903 -2.577 25567 293 1 . 1 1 71 71 ASN H H 71 8.407 8.407 8.488 -0.081 25567 294 1 . 1 1 72 72 ILE N N 72 123.752 123.752 123.468 0.284 25567 295 1 . 1 1 72 72 ILE HA H 72 3.940 3.940 4.174 -0.234 25567 296 1 . 1 1 72 72 ILE C C 72 171.621 171.621 174.759 -3.138 25567 297 1 . 1 1 72 72 ILE CA C 72 57.332 57.332 60.856 -3.524 25567 298 1 . 1 1 72 72 ILE CB C 72 38.489 38.489 39.274 -0.785 25567 299 1 . 1 1 72 72 ILE H H 72 7.639 7.639 7.592 0.047 25567 300 1 . 1 1 73 73 ASP N N 73 125.252 125.252 124.682 0.570 25567 301 1 . 1 1 73 73 ASP HA H 73 4.625 4.625 4.603 0.022 25567 302 1 . 1 1 73 73 ASP C C 73 174.034 174.034 176.012 -1.978 25567 303 1 . 1 1 73 73 ASP CA C 73 49.203 49.203 53.035 -3.832 25567 304 1 . 1 1 73 73 ASP CB C 73 37.024 37.024 42.164 -5.140 25567 305 1 . 1 1 73 73 ASP H H 73 8.394 8.394 8.491 -0.097 25567 306 1 . 1 1 74 74 TYR N N 74 123.108 123.108 124.047 -0.939 25567 307 1 . 1 1 74 74 TYR HA H 74 3.878 3.878 4.486 -0.608 25567 308 1 . 1 1 74 74 TYR C C 74 173.637 173.637 177.250 -3.613 25567 309 1 . 1 1 74 74 TYR CA C 74 59.474 59.474 59.284 0.190 25567 310 1 . 1 1 74 74 TYR CB C 74 34.722 34.722 38.105 -3.383 25567 311 1 . 1 1 74 74 TYR H H 74 7.392 7.392 8.379 -0.987 25567 312 1 . 1 1 75 75 ASN N N 75 109.422 109.422 116.820 -7.398 25567 313 1 . 1 1 75 75 ASN HA H 75 4.926 4.926 4.659 0.267 25567 314 1 . 1 1 75 75 ASN C C 75 172.574 172.574 176.014 -3.440 25567 315 1 . 1 1 75 75 ASN CA C 75 52.761 52.761 55.667 -2.906 25567 316 1 . 1 1 75 75 ASN CB C 75 35.617 35.617 38.688 -3.071 25567 317 1 . 1 1 75 75 ASN H H 75 8.058 8.058 8.485 -0.427 25567 318 1 . 1 1 76 76 ASN N N 76 117.422 117.422 116.070 1.352 25567 319 1 . 1 1 76 76 ASN HA H 76 4.455 4.455 4.603 -0.148 25567 320 1 . 1 1 76 76 ASN C C 76 171.132 171.132 174.286 -3.154 25567 321 1 . 1 1 76 76 ASN CA C 76 51.167 51.167 53.495 -2.328 25567 322 1 . 1 1 76 76 ASN CB C 76 35.728 35.728 38.500 -2.772 25567 323 1 . 1 1 76 76 ASN H H 76 7.768 7.768 7.997 -0.229 25567 324 1 . 1 1 77 77 TYR N N 77 116.873 116.873 117.337 -0.464 25567 325 1 . 1 1 77 77 TYR HA H 77 4.363 4.363 4.634 -0.271 25567 326 1 . 1 1 77 77 TYR C C 77 172.175 172.175 174.593 -2.418 25567 327 1 . 1 1 77 77 TYR CA C 77 55.364 55.364 57.868 -2.504 25567 328 1 . 1 1 77 77 TYR CB C 77 37.165 37.165 40.926 -3.761 25567 329 1 . 1 1 77 77 TYR H H 77 7.825 7.825 7.610 0.215 25567 330 1 . 1 1 78 78 ASP N N 78 121.271 121.271 120.051 1.220 25567 331 1 . 1 1 78 78 ASP HA H 78 4.805 4.805 4.964 -0.159 25567 332 1 . 1 1 78 78 ASP C C 78 172.641 172.641 175.417 -2.776 25567 333 1 . 1 1 78 78 ASP CA C 78 53.255 53.255 54.259 -1.004 25567 334 1 . 1 1 78 78 ASP CB C 78 41.075 41.075 43.570 -2.495 25567 335 1 . 1 1 78 78 ASP H H 78 9.058 9.058 8.594 0.464 25567 336 1 . 1 1 79 79 LEU N N 79 122.985 122.985 119.327 3.658 25567 337 1 . 1 1 79 79 LEU HA H 79 5.114 5.114 5.086 0.028 25567 338 1 . 1 1 79 79 LEU C C 79 170.721 170.721 174.538 -3.817 25567 339 1 . 1 1 79 79 LEU CA C 79 51.316 51.316 54.331 -3.015 25567 340 1 . 1 1 79 79 LEU CB C 79 42.342 42.342 45.998 -3.656 25567 341 1 . 1 1 79 79 LEU H H 79 7.893 7.893 7.898 -0.005 25567 342 1 . 1 1 80 80 ILE N N 80 126.364 126.364 123.444 2.920 25567 343 1 . 1 1 80 80 ILE HA H 80 5.089 5.089 4.751 0.338 25567 344 1 . 1 1 80 80 ILE C C 80 171.580 171.580 174.159 -2.579 25567 345 1 . 1 1 80 80 ILE CA C 80 57.417 57.417 60.345 -2.928 25567 346 1 . 1 1 80 80 ILE CB C 80 38.136 38.136 40.938 -2.802 25567 347 1 . 1 1 80 80 ILE H H 80 8.717 8.717 8.940 -0.223 25567 348 1 . 1 1 81 81 LEU N N 81 126.199 126.199 127.027 -0.828 25567 349 1 . 1 1 81 81 LEU HA H 81 5.135 5.135 5.213 -0.078 25567 350 1 . 1 1 81 81 LEU C C 81 172.979 172.979 175.872 -2.893 25567 351 1 . 1 1 81 81 LEU CA C 81 49.633 49.633 53.370 -3.737 25567 352 1 . 1 1 81 81 LEU CB C 81 42.159 42.159 44.785 -2.626 25567 353 1 . 1 1 81 81 LEU H H 81 9.230 9.230 8.941 0.289 25567 354 1 . 1 1 82 82 ILE N N 82 120.505 120.505 119.647 0.857 25567 355 1 . 1 1 82 82 ILE HA H 82 4.916 4.916 4.959 -0.043 25567 356 1 . 1 1 82 82 ILE C C 82 173.011 173.011 174.547 -1.536 25567 357 1 . 1 1 82 82 ILE CA C 82 56.828 56.828 59.922 -3.094 25567 358 1 . 1 1 82 82 ILE CB C 82 38.068 38.068 41.918 -3.850 25567 359 1 . 1 1 82 82 ILE H H 82 8.796 8.796 8.220 0.576 25567 360 1 . 1 1 83 83 GLY N N 83 120.857 120.857 111.695 9.162 25567 361 1 . 1 1 83 83 GLY CA C 83 40.803 40.803 43.130 -2.327 25567 362 1 . 1 1 83 83 GLY H H 83 9.525 9.525 8.163 1.362 25567 363 1 . 1 1 84 84 SER N N 84 116.007 116.007 114.811 1.196 25567 364 1 . 1 1 84 84 SER HA H 84 5.476 5.476 5.113 0.363 25567 365 1 . 1 1 84 84 SER CA C 84 51.937 51.937 55.921 -3.984 25567 366 1 . 1 1 84 84 SER CB C 84 64.533 64.533 65.401 -0.868 25567 367 1 . 1 1 84 84 SER H H 84 7.617 7.617 7.838 -0.221 25567 368 1 . 1 1 85 85 PRO HA H 85 5.201 5.201 4.609 0.592 25567 369 1 . 1 1 85 85 PRO C C 85 173.574 173.574 175.628 -2.054 25567 370 1 . 1 1 85 85 PRO CA C 85 59.488 59.488 62.510 -3.022 25567 371 1 . 1 1 85 85 PRO CB C 85 31.140 31.140 32.667 -1.527 25567 372 1 . 1 1 86 86 VAL N N 86 117.603 117.603 117.449 0.154 25567 373 1 . 1 1 86 86 VAL HA H 86 4.373 4.373 4.382 -0.009 25567 374 1 . 1 1 86 86 VAL C C 86 172.777 172.777 174.140 -1.363 25567 375 1 . 1 1 86 86 VAL CA C 86 59.603 59.603 61.693 -2.090 25567 376 1 . 1 1 86 86 VAL CB C 86 29.573 29.573 34.691 -5.118 25567 377 1 . 1 1 86 86 VAL H H 86 8.194 8.194 7.970 0.224 25567 378 1 . 1 1 87 87 TRP N N 87 131.187 131.187 126.753 4.434 25567 379 1 . 1 1 87 87 TRP HA H 87 5.198 5.198 4.916 0.282 25567 380 1 . 1 1 87 87 TRP C C 87 173.295 173.295 174.717 -1.422 25567 381 1 . 1 1 87 87 TRP CA C 87 50.784 50.784 57.930 -7.146 25567 382 1 . 1 1 87 87 TRP CB C 87 27.746 27.746 31.887 -4.141 25567 383 1 . 1 1 87 87 TRP H H 87 9.637 9.637 8.517 1.120 25567 384 1 . 1 1 88 88 SER N N 88 119.829 119.829 113.656 6.173 25567 385 1 . 1 1 88 88 SER HA H 88 3.986 3.986 4.787 -0.801 25567 386 1 . 1 1 88 88 SER C C 88 172.375 172.375 174.675 -2.301 25567 387 1 . 1 1 88 88 SER CA C 88 55.932 55.932 57.459 -1.527 25567 388 1 . 1 1 88 88 SER CB C 88 59.178 59.178 63.794 -4.616 25567 389 1 . 1 1 88 88 SER H H 88 9.272 9.272 7.873 1.399 25567 390 1 . 1 1 89 89 GLY N N 89 101.498 101.498 111.468 -9.970 25567 391 1 . 1 1 89 89 GLY CA C 89 42.671 42.671 46.297 -3.626 25567 392 1 . 1 1 89 89 GLY H H 89 7.463 7.463 8.812 -1.349 25567 393 1 . 1 1 90 90 TYR N N 90 121.064 121.064 116.197 4.867 25567 394 1 . 1 1 90 90 TYR HA H 90 4.216 4.216 5.005 -0.789 25567 395 1 . 1 1 90 90 TYR CA C 90 54.090 54.090 54.134 -0.044 25567 396 1 . 1 1 90 90 TYR CB C 90 37.195 37.195 36.910 0.285 25567 397 1 . 1 1 90 90 TYR H H 90 8.064 8.064 7.905 0.159 25567 398 1 . 1 1 91 91 PRO HA H 91 4.932 4.932 4.588 0.344 25567 399 1 . 1 1 91 91 PRO C C 91 171.019 171.019 175.975 -4.956 25567 400 1 . 1 1 91 91 PRO CA C 91 58.994 58.994 63.775 -4.781 25567 401 1 . 1 1 91 91 PRO CB C 91 26.493 26.493 32.214 -5.721 25567 402 1 . 1 1 92 92 ALA N N 92 119.893 119.893 121.208 -1.315 25567 403 1 . 1 1 92 92 ALA HA H 92 3.451 3.451 4.713 -1.262 25567 404 1 . 1 1 92 92 ALA C C 92 176.477 176.477 176.114 0.363 25567 405 1 . 1 1 92 92 ALA CA C 92 49.567 49.567 51.462 -1.895 25567 406 1 . 1 1 92 92 ALA CB C 92 15.801 15.801 21.430 -5.629 25567 407 1 . 1 1 92 92 ALA H H 92 7.278 7.278 7.893 -0.615 25567 408 1 . 1 1 93 93 THR N N 93 112.992 112.992 110.402 2.590 25567 409 1 . 1 1 93 93 THR HA H 93 4.462 4.462 4.743 -0.281 25567 410 1 . 1 1 93 93 THR CA C 93 66.871 66.871 59.408 7.463 25567 411 1 . 1 1 93 93 THR CB C 93 64.362 64.362 68.343 -3.981 25567 412 1 . 1 1 93 93 THR H H 93 6.861 6.861 8.303 -1.442 25567 413 1 . 1 1 94 94 PRO HA H 94 3.866 3.866 4.315 -0.449 25567 414 1 . 1 1 94 94 PRO CA C 94 63.021 63.021 63.676 -0.655 25567 415 1 . 1 1 94 94 PRO CB C 94 29.279 29.279 31.661 -2.382 25567 416 1 . 1 1 95 95 ILE N N 95 111.298 111.298 118.647 -7.349 25567 417 1 . 1 1 95 95 ILE HA H 95 3.623 3.623 4.320 -0.697 25567 418 1 . 1 1 95 95 ILE C C 95 174.264 174.264 175.494 -1.230 25567 419 1 . 1 1 95 95 ILE CA C 95 57.448 57.448 59.350 -1.902 25567 420 1 . 1 1 95 95 ILE CB C 95 31.929 31.929 36.038 -4.109 25567 421 1 . 1 1 95 95 ILE H H 95 7.974 7.974 7.981 -0.007 25567 422 1 . 1 1 96 96 LYS N N 96 123.045 123.045 121.427 1.618 25567 423 1 . 1 1 96 96 LYS HA H 96 3.112 3.112 4.498 -1.386 25567 424 1 . 1 1 96 96 LYS C C 96 174.590 174.590 177.681 -3.091 25567 425 1 . 1 1 96 96 LYS CA C 96 57.145 57.145 57.312 -0.167 25567 426 1 . 1 1 96 96 LYS CB C 96 28.845 28.845 33.637 -4.792 25567 427 1 . 1 1 96 96 LYS H H 96 6.958 6.958 7.871 -0.913 25567 428 1 . 1 1 97 97 THR N N 97 113.412 113.412 117.035 -3.623 25567 429 1 . 1 1 97 97 THR HA H 97 3.461 3.461 4.036 -0.576 25567 430 1 . 1 1 97 97 THR C C 97 173.247 173.247 176.436 -3.189 25567 431 1 . 1 1 97 97 THR CA C 97 62.809 62.809 66.098 -3.289 25567 432 1 . 1 1 97 97 THR CB C 97 65.654 65.654 68.584 -2.930 25567 433 1 . 1 1 97 97 THR H H 97 6.366 6.366 7.968 -1.602 25567 434 1 . 1 1 98 98 LEU N N 98 121.201 121.201 122.396 -1.195 25567 435 1 . 1 1 98 98 LEU HA H 98 3.634 3.634 4.069 -0.435 25567 436 1 . 1 1 98 98 LEU C C 98 174.590 174.590 178.426 -3.836 25567 437 1 . 1 1 98 98 LEU CA C 98 55.621 55.621 57.764 -2.143 25567 438 1 . 1 1 98 98 LEU CB C 98 39.895 39.895 41.061 -1.166 25567 439 1 . 1 1 98 98 LEU H H 98 7.554 7.554 7.858 -0.304 25567 440 1 . 1 1 99 99 LEU N N 99 118.677 118.677 117.569 1.108 25567 441 1 . 1 1 99 99 LEU HA H 99 3.702 3.702 3.897 -0.195 25567 442 1 . 1 1 99 99 LEU C C 99 177.457 177.457 178.862 -1.405 25567 443 1 . 1 1 99 99 LEU CA C 99 55.179 55.179 57.439 -2.260 25567 444 1 . 1 1 99 99 LEU CB C 99 38.988 38.988 40.953 -1.965 25567 445 1 . 1 1 99 99 LEU H H 99 8.160 8.160 7.875 0.285 25567 446 1 . 1 1 100 100 ASP N N 100 118.914 118.914 116.694 2.220 25567 447 1 . 1 1 100 100 ASP HA H 100 4.229 4.229 4.494 -0.265 25567 448 1 . 1 1 100 100 ASP C C 100 176.585 176.585 178.347 -1.762 25567 449 1 . 1 1 100 100 ASP CA C 100 54.516 54.516 56.364 -1.848 25567 450 1 . 1 1 100 100 ASP CB C 100 37.579 37.579 41.062 -3.483 25567 451 1 . 1 1 100 100 ASP H H 100 7.872 7.872 7.789 0.083 25567 452 1 . 1 1 101 101 GLN N N 101 118.135 118.135 118.222 -0.087 25567 453 1 . 1 1 101 101 GLN HA H 101 4.160 4.160 4.277 -0.117 25567 454 1 . 1 1 101 101 GLN C C 101 174.601 174.601 177.784 -3.183 25567 455 1 . 1 1 101 101 GLN CA C 101 54.960 54.960 57.697 -2.737 25567 456 1 . 1 1 101 101 GLN CB C 101 25.550 25.550 29.317 -3.767 25567 457 1 . 1 1 101 101 GLN H H 101 7.673 7.673 7.776 -0.103 25567 458 1 . 1 1 102 102 MET N N 102 118.420 118.420 117.512 0.908 25567 459 1 . 1 1 102 102 MET HA H 102 3.826 3.826 4.455 -0.629 25567 460 1 . 1 1 102 102 MET C C 102 172.780 172.780 176.734 -3.954 25567 461 1 . 1 1 102 102 MET CA C 102 53.428 53.428 56.039 -2.611 25567 462 1 . 1 1 102 102 MET CB C 102 31.221 31.221 31.494 -0.273 25567 463 1 . 1 1 102 102 MET H H 102 7.462 7.462 7.711 -0.249 25567 464 1 . 1 1 103 103 LYS N N 103 116.066 116.066 119.795 -3.729 25567 465 1 . 1 1 103 103 LYS HA H 103 3.920 3.920 4.180 -0.260 25567 466 1 . 1 1 103 103 LYS C C 103 173.922 173.922 177.350 -3.428 25567 467 1 . 1 1 103 103 LYS CA C 103 56.282 56.282 58.358 -2.076 25567 468 1 . 1 1 103 103 LYS CB C 103 29.491 29.491 31.829 -2.338 25567 469 1 . 1 1 103 103 LYS H H 103 6.875 6.875 7.941 -1.066 25567 470 1 . 1 1 104 104 ASN N N 104 114.987 114.987 115.709 -0.722 25567 471 1 . 1 1 104 104 ASN HA H 104 4.741 4.741 4.886 -0.145 25567 472 1 . 1 1 104 104 ASN C C 104 172.587 172.587 174.543 -1.956 25567 473 1 . 1 1 104 104 ASN CA C 104 50.469 50.469 52.755 -2.286 25567 474 1 . 1 1 104 104 ASN CB C 104 35.822 35.822 39.602 -3.780 25567 475 1 . 1 1 104 104 ASN H H 104 8.517 8.517 8.150 0.367 25567 476 1 . 1 1 105 105 TYR N N 105 122.755 122.755 121.562 1.193 25567 477 1 . 1 1 105 105 TYR HA H 105 4.575 4.575 4.521 0.054 25567 478 1 . 1 1 105 105 TYR C C 105 174.260 174.260 175.128 -0.868 25567 479 1 . 1 1 105 105 TYR CA C 105 55.493 55.493 58.807 -3.314 25567 480 1 . 1 1 105 105 TYR CB C 105 36.064 36.064 39.256 -3.192 25567 481 1 . 1 1 105 105 TYR H H 105 8.287 8.287 7.922 0.365 25567 482 1 . 1 1 106 106 ARG N N 106 128.905 128.905 123.779 5.126 25567 483 1 . 1 1 106 106 ARG HA H 106 4.273 4.273 4.392 -0.119 25567 484 1 . 1 1 106 106 ARG CA C 106 53.021 53.021 55.269 -2.248 25567 485 1 . 1 1 106 106 ARG CB C 106 28.130 28.130 31.920 -3.790 25567 486 1 . 1 1 106 106 ARG H H 106 8.841 8.841 8.573 0.268 25567 487 1 . 1 1 107 107 GLY CA C 107 42.497 42.497 44.881 -2.384 25567 488 1 . 1 1 108 108 GLU N N 108 116.989 116.989 120.205 -3.216 25567 489 1 . 1 1 108 108 GLU HA H 108 4.631 4.631 4.825 -0.194 25567 490 1 . 1 1 108 108 GLU CA C 108 53.676 53.676 55.431 -1.755 25567 491 1 . 1 1 108 108 GLU CB C 108 30.402 30.402 33.322 -2.920 25567 492 1 . 1 1 108 108 GLU H H 108 7.536 7.536 8.322 -0.786 25567 493 1 . 1 1 109 109 VAL N N 109 123.416 123.416 121.917 1.499 25567 494 1 . 1 1 109 109 VAL HA H 109 5.321 5.321 5.009 0.312 25567 495 1 . 1 1 109 109 VAL CA C 109 57.443 57.443 60.770 -3.327 25567 496 1 . 1 1 109 109 VAL CB C 109 32.661 32.661 34.201 -1.540 25567 497 1 . 1 1 109 109 VAL H H 109 8.955 8.955 8.778 0.177 25567 498 1 . 1 1 110 110 ALA N N 110 127.975 127.975 128.311 -0.336 25567 499 1 . 1 1 110 110 ALA HA H 110 4.677 4.677 5.100 -0.423 25567 500 1 . 1 1 110 110 ALA CA C 110 47.441 47.441 49.812 -2.371 25567 501 1 . 1 1 110 110 ALA CB C 110 18.416 18.416 22.180 -3.764 25567 502 1 . 1 1 110 110 ALA H H 110 8.860 8.860 8.597 0.263 25567 503 1 . 1 1 111 111 SER N N 111 110.482 110.482 114.558 -4.076 25567 504 1 . 1 1 111 111 SER HA H 111 5.502 5.502 5.293 0.209 25567 505 1 . 1 1 111 111 SER CA C 111 51.630 51.630 56.712 -5.082 25567 506 1 . 1 1 111 111 SER CB C 111 62.267 62.267 64.834 -2.567 25567 507 1 . 1 1 111 111 SER H H 111 7.484 7.484 7.986 -0.501 25567 508 1 . 1 1 112 112 PHE N N 112 125.082 125.082 121.719 3.363 25567 509 1 . 1 1 112 112 PHE HA H 112 6.448 6.448 5.604 0.844 25567 510 1 . 1 1 112 112 PHE CA C 112 50.434 50.434 55.328 -4.894 25567 511 1 . 1 1 112 112 PHE CB C 112 40.500 40.500 40.449 0.051 25567 512 1 . 1 1 112 112 PHE H H 112 8.025 8.025 8.557 -0.533 25567 513 1 . 1 1 113 113 PHE N N 113 115.872 115.872 119.223 -3.351 25567 514 1 . 1 1 113 113 PHE HA H 113 5.924 5.924 5.189 0.735 25567 515 1 . 1 1 113 113 PHE C C 113 173.293 173.293 175.392 -2.099 25567 516 1 . 1 1 113 113 PHE CA C 113 50.468 50.468 55.367 -4.899 25567 517 1 . 1 1 113 113 PHE CB C 113 38.393 38.393 40.923 -2.530 25567 518 1 . 1 1 113 113 PHE H H 113 7.391 7.391 7.917 -0.526 25567 519 1 . 1 1 114 114 THR N N 114 108.721 108.721 111.495 -2.774 25567 520 1 . 1 1 114 114 THR HA H 114 4.933 4.933 4.518 0.415 25567 521 1 . 1 1 114 114 THR C C 114 171.891 171.891 174.454 -2.563 25567 522 1 . 1 1 114 114 THR CA C 114 56.815 56.815 61.558 -4.743 25567 523 1 . 1 1 114 114 THR CB C 114 67.899 67.899 69.404 -1.505 25567 524 1 . 1 1 114 114 THR H H 114 7.951 7.951 8.463 -0.512 25567 525 1 . 1 1 115 115 SER N N 115 115.159 115.159 117.462 -2.303 25567 526 1 . 1 1 115 115 SER HA H 115 4.608 4.608 4.670 -0.062 25567 527 1 . 1 1 115 115 SER C C 115 171.403 171.403 173.434 -2.031 25567 528 1 . 1 1 115 115 SER CA C 115 55.570 55.570 58.171 -2.601 25567 529 1 . 1 1 115 115 SER CB C 115 61.418 61.418 64.728 -3.311 25567 530 1 . 1 1 115 115 SER H H 115 8.229 8.229 7.963 0.266 25567 531 1 . 1 1 116 116 ALA N N 116 127.211 127.211 125.476 1.735 25567 532 1 . 1 1 116 116 ALA HA H 116 4.456 4.456 4.796 -0.340 25567 533 1 . 1 1 116 116 ALA C C 116 175.758 175.758 178.304 -2.546 25567 534 1 . 1 1 116 116 ALA CA C 116 49.816 49.816 52.186 -2.370 25567 535 1 . 1 1 116 116 ALA CB C 116 16.831 16.831 19.517 -2.687 25567 536 1 . 1 1 116 116 ALA H H 116 8.813 8.813 8.321 0.492 25567 537 1 . 1 1 117 117 GLY N N 117 108.099 108.099 108.993 -0.894 25567 538 1 . 1 1 117 117 GLY C C 117 171.805 171.805 175.475 -3.670 25567 539 1 . 1 1 117 117 GLY CA C 117 42.869 42.869 47.071 -4.202 25567 540 1 . 1 1 117 117 GLY H H 117 8.685 8.685 8.760 -0.075 25567 541 1 . 1 1 118 118 THR N N 118 111.284 111.284 111.113 0.171 25567 542 1 . 1 1 118 118 THR HA H 118 4.343 4.343 4.359 -0.016 25567 543 1 . 1 1 118 118 THR C C 118 171.769 171.769 173.577 -1.808 25567 544 1 . 1 1 118 118 THR CA C 118 58.933 58.933 61.929 -2.996 25567 545 1 . 1 1 118 118 THR CB C 118 67.304 67.304 69.884 -2.580 25567 546 1 . 1 1 118 118 THR H H 118 7.998 7.998 8.108 -0.110 25567 547 1 . 1 1 119 119 ASN N N 119 120.253 120.253 119.549 0.704 25567 548 1 . 1 1 119 119 ASN HA H 119 4.703 4.703 4.934 -0.231 25567 549 1 . 1 1 119 119 ASN C C 119 172.353 172.353 173.844 -1.491 25567 550 1 . 1 1 119 119 ASN CA C 119 50.228 50.228 53.355 -3.127 25567 551 1 . 1 1 119 119 ASN CB C 119 35.376 35.376 40.383 -5.007 25567 552 1 . 1 1 119 119 ASN H H 119 8.381 8.381 7.863 0.518 25567 553 1 . 1 1 120 120 HIS HA H 120 4.086 4.086 4.490 -0.404 25567 554 1 . 1 1 120 120 HIS C C 120 173.395 173.395 176.070 -2.675 25567 555 1 . 1 1 120 120 HIS CA C 120 55.139 55.139 57.352 -2.213 25567 556 1 . 1 1 120 120 HIS CB C 120 28.422 28.422 31.267 -2.845 25567 557 1 . 1 1 121 121 LYS N N 121 119.527 119.527 120.627 -1.100 25567 558 1 . 1 1 121 121 LYS HA H 121 3.780 3.780 3.765 0.015 25567 559 1 . 1 1 121 121 LYS C C 121 176.053 176.053 178.024 -1.971 25567 560 1 . 1 1 121 121 LYS CA C 121 56.963 56.963 59.010 -2.047 25567 561 1 . 1 1 121 121 LYS CB C 121 29.660 29.660 31.784 -2.124 25567 562 1 . 1 1 121 121 LYS H H 121 8.106 8.106 8.531 -0.425 25567 563 1 . 1 1 122 122 ALA N N 122 121.585 121.585 121.493 0.092 25567 564 1 . 1 1 122 122 ALA HA H 122 3.721 3.721 3.773 -0.052 25567 565 1 . 1 1 122 122 ALA C C 122 175.128 175.128 178.912 -3.784 25567 566 1 . 1 1 122 122 ALA CA C 122 51.591 51.591 54.348 -2.756 25567 567 1 . 1 1 122 122 ALA CB C 122 15.704 15.704 17.806 -2.102 25567 568 1 . 1 1 122 122 ALA H H 122 7.702 7.702 7.906 -0.204 25567 569 1 . 1 1 123 123 TYR N N 123 118.803 118.803 119.980 -1.177 25567 570 1 . 1 1 123 123 TYR HA H 123 3.366 3.366 4.010 -0.644 25567 571 1 . 1 1 123 123 TYR CA C 123 60.091 60.091 61.321 -1.230 25567 572 1 . 1 1 123 123 TYR CB C 123 35.102 35.102 38.114 -3.012 25567 573 1 . 1 1 123 123 TYR H H 123 7.366 7.366 7.665 -0.299 25567 574 1 . 1 1 124 124 VAL N N 124 117.530 117.530 117.418 0.112 25567 575 1 . 1 1 124 124 VAL HA H 124 3.199 3.199 3.611 -0.412 25567 576 1 . 1 1 124 124 VAL C C 124 175.375 175.375 178.020 -2.645 25567 577 1 . 1 1 124 124 VAL CA C 124 64.583 64.583 66.665 -2.082 25567 578 1 . 1 1 124 124 VAL CB C 124 29.203 29.203 30.965 -1.762 25567 579 1 . 1 1 124 124 VAL H H 124 7.757 7.757 7.617 0.140 25567 580 1 . 1 1 125 125 SER N N 125 114.023 114.023 114.862 -0.839 25567 581 1 . 1 1 125 125 SER HA H 125 4.035 4.035 4.119 -0.084 25567 582 1 . 1 1 125 125 SER C C 125 174.636 174.636 176.402 -1.766 25567 583 1 . 1 1 125 125 SER CA C 125 58.885 58.885 61.395 -2.510 25567 584 1 . 1 1 125 125 SER CB C 125 59.666 59.666 63.004 -3.338 25567 585 1 . 1 1 125 125 SER H H 125 7.622 7.622 7.575 0.047 25567 586 1 . 1 1 126 126 HIS N N 126 119.457 119.457 120.850 -1.393 25567 587 1 . 1 1 126 126 HIS HA H 126 4.196 4.196 3.989 0.207 25567 588 1 . 1 1 126 126 HIS C C 126 172.942 172.942 177.462 -4.520 25567 589 1 . 1 1 126 126 HIS CA C 126 54.918 54.918 58.453 -3.535 25567 590 1 . 1 1 126 126 HIS CB C 126 26.079 26.079 29.327 -3.248 25567 591 1 . 1 1 126 126 HIS H H 126 8.067 8.067 7.970 0.097 25567 592 1 . 1 1 127 127 PHE N N 127 120.628 120.628 119.804 0.823 25567 593 1 . 1 1 127 127 PHE HA H 127 3.199 3.199 3.919 -0.720 25567 594 1 . 1 1 127 127 PHE C C 127 173.515 173.515 176.871 -3.356 25567 595 1 . 1 1 127 127 PHE CA C 127 60.681 60.681 59.799 0.882 25567 596 1 . 1 1 127 127 PHE CB C 127 36.367 36.367 38.747 -2.380 25567 597 1 . 1 1 127 127 PHE H H 127 9.083 9.083 8.329 0.754 25567 598 1 . 1 1 128 128 ASN N N 128 114.858 114.858 117.094 -2.236 25567 599 1 . 1 1 128 128 ASN HA H 128 4.078 4.078 4.090 -0.012 25567 600 1 . 1 1 128 128 ASN C C 128 175.338 175.338 177.349 -2.011 25567 601 1 . 1 1 128 128 ASN CA C 128 54.250 54.250 56.410 -2.160 25567 602 1 . 1 1 128 128 ASN CB C 128 36.021 36.021 38.116 -2.095 25567 603 1 . 1 1 128 128 ASN H H 128 7.858 7.858 7.852 0.006 25567 604 1 . 1 1 129 129 GLU N N 129 119.811 119.811 118.842 0.969 25567 605 1 . 1 1 129 129 GLU HA H 129 4.041 4.041 4.173 -0.132 25567 606 1 . 1 1 129 129 GLU C C 129 176.941 176.941 178.631 -1.690 25567 607 1 . 1 1 129 129 GLU CA C 129 56.632 56.632 58.634 -2.002 25567 608 1 . 1 1 129 129 GLU CB C 129 26.938 26.938 29.496 -2.558 25567 609 1 . 1 1 129 129 GLU H H 129 7.569 7.569 7.819 -0.250 25567 610 1 . 1 1 130 130 TRP N N 130 120.585 120.585 118.367 2.218 25567 611 1 . 1 1 130 130 TRP HA H 130 4.472 4.472 4.650 -0.178 25567 612 1 . 1 1 130 130 TRP C C 130 174.262 174.262 176.305 -2.043 25567 613 1 . 1 1 130 130 TRP CA C 130 54.673 54.673 56.655 -1.982 25567 614 1 . 1 1 130 130 TRP CB C 130 26.956 26.956 29.199 -2.242 25567 615 1 . 1 1 130 130 TRP H H 130 7.964 7.964 7.775 0.189 25567 616 1 . 1 1 131 131 ALA N N 131 120.522 120.522 119.082 1.440 25567 617 1 . 1 1 131 131 ALA HA H 131 3.947 3.947 4.375 -0.428 25567 618 1 . 1 1 131 131 ALA C C 131 172.489 172.489 175.952 -3.463 25567 619 1 . 1 1 131 131 ALA CA C 131 48.580 48.580 51.298 -2.718 25567 620 1 . 1 1 131 131 ALA CB C 131 16.539 16.539 19.542 -3.003 25567 621 1 . 1 1 131 131 ALA H H 131 8.114 8.114 7.404 0.710 25567 622 1 . 1 1 132 132 ASP N N 132 117.666 117.666 120.541 -2.875 25567 623 1 . 1 1 132 132 ASP HA H 132 4.206 4.206 4.353 -0.147 25567 624 1 . 1 1 132 132 ASP C C 132 173.779 173.779 176.636 -2.857 25567 625 1 . 1 1 132 132 ASP CA C 132 54.313 54.313 55.268 -0.955 25567 626 1 . 1 1 132 132 ASP CB C 132 39.456 39.456 39.897 -0.441 25567 627 1 . 1 1 132 132 ASP H H 132 6.768 6.768 7.837 -1.069 25567 628 1 . 1 1 133 133 GLY N N 133 114.922 114.922 111.154 3.768 25567 629 1 . 1 1 133 133 GLY C C 133 172.101 172.101 174.021 -1.920 25567 630 1 . 1 1 133 133 GLY CA C 133 42.509 42.509 45.038 -2.530 25567 631 1 . 1 1 133 133 GLY H H 133 8.645 8.645 8.186 0.459 25567 632 1 . 1 1 134 134 LEU N N 134 120.101 120.101 121.453 -1.352 25567 633 1 . 1 1 134 134 LEU HA H 134 4.462 4.462 4.496 -0.034 25567 634 1 . 1 1 134 134 LEU C C 134 174.098 174.098 175.901 -1.803 25567 635 1 . 1 1 134 134 LEU CA C 134 51.084 51.084 53.683 -2.599 25567 636 1 . 1 1 134 134 LEU CB C 134 40.509 40.509 43.329 -2.820 25567 637 1 . 1 1 134 134 LEU H H 134 8.049 8.049 7.527 0.522 25567 638 1 . 1 1 135 135 ASN N N 135 119.258 119.258 121.147 -1.889 25567 639 1 . 1 1 135 135 ASN HA H 135 4.639 4.639 4.696 -0.057 25567 640 1 . 1 1 135 135 ASN C C 135 170.564 170.564 174.381 -3.817 25567 641 1 . 1 1 135 135 ASN CA C 135 49.253 49.253 53.184 -3.931 25567 642 1 . 1 1 135 135 ASN CB C 135 33.618 33.618 38.409 -4.791 25567 643 1 . 1 1 135 135 ASN H H 135 8.567 8.567 8.649 -0.082 25567 644 1 . 1 1 136 136 VAL N N 136 125.460 125.460 124.872 0.588 25567 645 1 . 1 1 136 136 VAL HA H 136 4.596 4.596 4.631 -0.035 25567 646 1 . 1 1 136 136 VAL C C 136 175.318 175.318 176.261 -0.943 25567 647 1 . 1 1 136 136 VAL CA C 136 58.722 58.722 62.294 -3.572 25567 648 1 . 1 1 136 136 VAL CB C 136 29.299 29.299 32.856 -3.557 25567 649 1 . 1 1 136 136 VAL H H 136 7.660 7.660 8.160 -0.500 25567 650 1 . 1 1 137 137 ILE N N 137 122.021 122.021 122.464 -0.443 25567 651 1 . 1 1 137 137 ILE HA H 137 4.428 4.428 4.711 -0.283 25567 652 1 . 1 1 137 137 ILE C C 137 173.943 173.943 174.956 -1.013 25567 653 1 . 1 1 137 137 ILE CA C 137 58.958 58.958 59.895 -0.937 25567 654 1 . 1 1 137 137 ILE CB C 137 36.169 36.169 38.835 -2.666 25567 655 1 . 1 1 137 137 ILE H H 137 9.151 9.151 8.775 0.376 25567 656 1 . 1 1 138 138 GLY N N 138 108.192 108.192 108.398 -0.206 25567 657 1 . 1 1 138 138 GLY CA C 138 43.494 43.494 45.700 -2.206 25567 658 1 . 1 1 138 138 GLY H H 138 6.675 6.675 7.468 -0.793 25567 659 1 . 1 1 139 139 VAL N N 139 119.673 119.673 121.234 -1.561 25567 660 1 . 1 1 139 139 VAL HA H 139 5.320 5.320 4.792 0.528 25567 661 1 . 1 1 139 139 VAL C C 139 172.291 172.291 174.842 -2.551 25567 662 1 . 1 1 139 139 VAL CA C 139 58.209 58.209 61.696 -3.487 25567 663 1 . 1 1 139 139 VAL CB C 139 32.639 32.639 33.386 -0.748 25567 664 1 . 1 1 139 139 VAL H H 139 8.158 8.158 8.705 -0.547 25567 665 1 . 1 1 140 140 ALA N N 140 127.104 127.104 129.331 -2.227 25567 666 1 . 1 1 140 140 ALA HA H 140 4.596 4.596 5.026 -0.430 25567 667 1 . 1 1 140 140 ALA C C 140 171.057 171.057 175.128 -4.071 25567 668 1 . 1 1 140 140 ALA CA C 140 48.883 48.883 50.601 -1.718 25567 669 1 . 1 1 140 140 ALA CB C 140 21.428 21.428 22.406 -0.978 25567 670 1 . 1 1 140 140 ALA H H 140 9.145 9.145 8.542 0.603 25567 671 1 . 1 1 141 141 ARG N N 141 118.828 118.828 119.168 -0.340 25567 672 1 . 1 1 141 141 ARG HA H 141 2.740 2.740 4.073 -1.333 25567 673 1 . 1 1 141 141 ARG C C 141 173.524 173.524 176.363 -2.839 25567 674 1 . 1 1 141 141 ARG CA C 141 51.886 51.886 54.991 -3.105 25567 675 1 . 1 1 141 141 ARG CB C 141 28.454 28.454 31.312 -2.858 25567 676 1 . 1 1 141 141 ARG H H 141 7.759 7.759 8.363 -0.604 25567 677 1 . 1 1 142 142 ASP N N 142 125.557 125.557 122.073 3.484 25567 678 1 . 1 1 142 142 ASP HA H 142 3.779 3.779 4.250 -0.471 25567 679 1 . 1 1 142 142 ASP C C 142 169.292 169.292 175.671 -6.379 25567 680 1 . 1 1 142 142 ASP CA C 142 53.622 53.622 56.152 -2.530 25567 681 1 . 1 1 142 142 ASP CB C 142 37.080 37.080 40.436 -3.356 25567 682 1 . 1 1 142 142 ASP H H 142 9.087 9.087 8.486 0.601 25567 683 1 . 1 1 143 143 ASP N N 143 119.094 119.094 118.269 0.825 25567 684 1 . 1 1 143 143 ASP HA H 143 4.254 4.254 4.583 -0.329 25567 685 1 . 1 1 143 143 ASP C C 143 175.557 175.557 176.804 -1.247 25567 686 1 . 1 1 143 143 ASP CA C 143 49.079 49.079 53.994 -4.915 25567 687 1 . 1 1 143 143 ASP CB C 143 36.442 36.442 40.336 -3.894 25567 688 1 . 1 1 143 143 ASP H H 143 8.175 8.175 8.509 -0.334 25567 689 1 . 1 1 144 144 SER N N 144 115.438 115.438 116.257 -0.819 25567 690 1 . 1 1 144 144 SER HA H 144 3.745 3.745 4.201 -0.456 25567 691 1 . 1 1 144 144 SER C C 144 172.820 172.820 174.689 -1.869 25567 692 1 . 1 1 144 144 SER CA C 144 59.336 59.336 60.250 -0.914 25567 693 1 . 1 1 144 144 SER CB C 144 60.839 60.839 63.251 -2.412 25567 694 1 . 1 1 144 144 SER H H 144 7.742 7.742 7.926 -0.184 25567 695 1 . 1 1 145 145 GLU N N 145 119.631 119.631 119.051 0.580 25567 696 1 . 1 1 145 145 GLU HA H 145 4.319 4.319 4.155 0.164 25567 697 1 . 1 1 145 145 GLU C C 145 171.927 171.927 176.032 -4.105 25567 698 1 . 1 1 145 145 GLU CA C 145 52.084 52.084 55.455 -3.371 25567 699 1 . 1 1 145 145 GLU CB C 145 26.774 26.774 29.713 -2.939 25567 700 1 . 1 1 145 145 GLU H H 145 7.924 7.924 7.941 -0.017 25567 701 1 . 1 1 146 146 VAL N N 146 118.791 118.791 120.639 -1.848 25567 702 1 . 1 1 146 146 VAL HA H 146 2.956 2.956 3.496 -0.540 25567 703 1 . 1 1 146 146 VAL C C 146 174.582 174.582 176.986 -2.404 25567 704 1 . 1 1 146 146 VAL CA C 146 64.078 64.078 66.193 -2.115 25567 705 1 . 1 1 146 146 VAL CB C 146 29.140 29.140 31.433 -2.293 25567 706 1 . 1 1 146 146 VAL H H 146 6.393 6.393 7.350 -0.957 25567 707 1 . 1 1 147 147 ASP N N 147 119.410 119.410 117.662 1.748 25567 708 1 . 1 1 147 147 ASP HA H 147 4.070 4.070 4.316 -0.246 25567 709 1 . 1 1 147 147 ASP C C 147 174.774 174.774 177.000 -2.226 25567 710 1 . 1 1 147 147 ASP CA C 147 54.322 54.322 56.872 -2.550 25567 711 1 . 1 1 147 147 ASP CB C 147 37.204 37.204 40.555 -3.351 25567 712 1 . 1 1 147 147 ASP H H 147 8.393 8.393 8.544 -0.151 25567 713 1 . 1 1 148 148 LYS N N 148 119.422 119.422 116.809 2.613 25567 714 1 . 1 1 148 148 LYS HA H 148 3.951 3.951 4.326 -0.375 25567 715 1 . 1 1 148 148 LYS C C 148 176.410 176.410 177.943 -1.533 25567 716 1 . 1 1 148 148 LYS CA C 148 55.736 55.736 57.416 -1.680 25567 717 1 . 1 1 148 148 LYS CB C 148 29.576 29.576 32.527 -2.951 25567 718 1 . 1 1 148 148 LYS H H 148 7.078 7.078 7.405 -0.327 25567 719 1 . 1 1 149 149 TRP N N 149 118.168 118.168 120.233 -2.065 25567 720 1 . 1 1 149 149 TRP HA H 149 4.601 4.601 4.919 -0.318 25567 721 1 . 1 1 149 149 TRP C C 149 174.199 174.199 176.267 -2.068 25567 722 1 . 1 1 149 149 TRP CA C 149 53.795 53.795 55.723 -1.928 25567 723 1 . 1 1 149 149 TRP CB C 149 27.011 27.011 28.096 -1.085 25567 724 1 . 1 1 149 149 TRP H H 149 7.914 7.914 7.539 0.375 25567 725 1 . 1 1 150 150 SER N N 150 109.636 109.636 113.015 -3.379 25567 726 1 . 1 1 150 150 SER HA H 150 4.242 4.242 4.641 -0.399 25567 727 1 . 1 1 150 150 SER C C 150 170.173 170.173 174.197 -4.024 25567 728 1 . 1 1 150 150 SER CA C 150 56.912 56.912 58.493 -1.581 25567 729 1 . 1 1 150 150 SER CB C 150 62.087 62.087 64.379 -2.292 25567 730 1 . 1 1 150 150 SER H H 150 7.814 7.814 7.958 -0.144 25567 stop_ save_