data_18935 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18935 _Entry.PDB_ID 2M2V 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 18935 _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 LEU N N 2 119.937 119.937 120.797 -0.860 18935 2 1 1 . 1 1 2 2 LEU C C 2 175.307 175.307 175.718 -0.411 18935 3 1 1 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.849 0.443 18935 4 1 1 . 1 1 2 2 LEU CB C 2 42.684 42.684 43.905 -1.221 18935 5 1 1 . 1 1 2 2 LEU H H 2 9.251 9.251 7.847 1.404 18935 6 1 1 . 1 1 3 3 THR N N 3 111.335 111.335 114.427 -3.092 18935 7 1 1 . 1 1 3 3 THR C C 3 175.854 175.854 175.557 0.297 18935 8 1 1 . 1 1 3 3 THR CA C 3 60.540 60.540 60.656 -0.116 18935 9 1 1 . 1 1 3 3 THR CB C 3 70.782 70.782 70.131 0.651 18935 10 1 1 . 1 1 3 3 THR H H 3 8.677 8.677 8.224 0.453 18935 11 1 1 . 1 1 4 4 LEU N N 4 120.988 120.988 123.418 -2.430 18935 12 1 1 . 1 1 4 4 LEU C C 4 178.391 178.391 178.252 0.139 18935 13 1 1 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.235 -0.171 18935 14 1 1 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.839 -2.578 18935 15 1 1 . 1 1 4 4 LEU H H 4 7.746 7.746 8.019 -0.273 18935 16 1 1 . 1 1 5 5 ILE N N 5 114.236 114.236 114.498 -0.262 18935 17 1 1 . 1 1 5 5 ILE C C 5 178.339 178.339 177.807 0.532 18935 18 1 1 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.687 -1.105 18935 19 1 1 . 1 1 5 5 ILE CB C 5 36.799 36.799 36.879 -0.080 18935 20 1 1 . 1 1 5 5 ILE H H 5 7.821 7.821 7.908 -0.087 18935 21 1 1 . 1 1 6 6 GLN N N 6 120.399 120.399 120.992 -0.593 18935 22 1 1 . 1 1 6 6 GLN C C 6 178.783 178.783 178.477 0.306 18935 23 1 1 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.268 -1.048 18935 24 1 1 . 1 1 6 6 GLN CB C 6 28.115 28.115 27.915 0.201 18935 25 1 1 . 1 1 6 6 GLN H H 6 7.810 7.810 8.039 -0.229 18935 26 1 1 . 1 1 7 7 GLY N N 7 106.277 106.277 105.429 0.848 18935 27 1 1 . 1 1 7 7 GLY C C 7 174.554 174.554 175.859 -1.305 18935 28 1 1 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.016 -0.082 18935 29 1 1 . 1 1 7 7 GLY H H 7 8.733 8.733 8.156 0.577 18935 30 1 1 . 1 1 8 8 LYS N N 8 119.991 119.991 121.265 -1.274 18935 31 1 1 . 1 1 8 8 LYS C C 8 179.433 179.433 177.904 1.529 18935 32 1 1 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.054 1.838 18935 33 1 1 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.078 -0.746 18935 34 1 1 . 1 1 8 8 LYS H H 8 8.688 8.688 7.056 1.632 18935 35 1 1 . 1 1 9 9 LYS N N 9 119.175 119.175 120.711 -1.536 18935 36 1 1 . 1 1 9 9 LYS CA C 9 59.382 59.382 60.001 -0.619 18935 37 1 1 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.402 -0.967 18935 38 1 1 . 1 1 9 9 LYS H H 9 8.015 8.015 7.841 0.174 18935 39 1 1 . 1 1 10 10 ILE N N 10 120.308 120.308 116.318 3.990 18935 40 1 1 . 1 1 10 10 ILE C C 10 177.766 177.766 177.576 0.190 18935 41 1 1 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.890 -0.214 18935 42 1 1 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.087 -0.774 18935 43 1 1 . 1 1 10 10 ILE H H 10 7.967 7.967 7.973 -0.006 18935 44 1 1 . 1 1 11 11 VAL N N 11 119.130 119.130 121.314 -2.184 18935 45 1 1 . 1 1 11 11 VAL C C 11 176.606 176.606 178.000 -1.394 18935 46 1 1 . 1 1 11 11 VAL CA C 11 67.640 67.640 67.026 0.614 18935 47 1 1 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.112 -0.903 18935 48 1 1 . 1 1 11 11 VAL H H 11 8.128 8.128 7.618 0.510 18935 49 1 1 . 1 1 12 12 ASN N N 12 115.822 115.822 117.195 -1.373 18935 50 1 1 . 1 1 12 12 ASN C C 12 177.375 177.375 177.220 0.155 18935 51 1 1 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.290 -0.320 18935 52 1 1 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.325 -0.762 18935 53 1 1 . 1 1 12 12 ASN H H 12 8.203 8.203 7.952 0.251 18935 54 1 1 . 1 1 13 13 HIS N N 13 117.659 117.659 118.443 -0.784 18935 55 1 1 . 1 1 13 13 HIS C C 13 177.287 177.287 178.220 -0.933 18935 56 1 1 . 1 1 13 13 HIS CA C 13 58.687 58.687 59.876 -1.189 18935 57 1 1 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.361 -0.340 18935 58 1 1 . 1 1 13 13 HIS H H 13 7.861 7.861 7.781 0.080 18935 59 1 1 . 1 1 14 14 LEU N N 14 115.595 115.595 120.045 -4.450 18935 60 1 1 . 1 1 14 14 LEU C C 14 179.092 179.092 178.575 0.517 18935 61 1 1 . 1 1 14 14 LEU CA C 14 56.641 56.641 58.084 -1.443 18935 62 1 1 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.665 -0.645 18935 63 1 1 . 1 1 14 14 LEU H H 14 8.376 8.376 9.000 -0.624 18935 64 1 1 . 1 1 15 15 ARG N N 15 115.006 115.006 116.327 -1.321 18935 65 1 1 . 1 1 15 15 ARG C C 15 176.265 176.265 177.905 -1.640 18935 66 1 1 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.205 1.679 18935 67 1 1 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.711 -0.639 18935 68 1 1 . 1 1 15 15 ARG H H 15 8.074 8.074 8.392 -0.318 18935 69 1 1 . 1 1 16 16 SER N N 16 107.778 107.778 114.354 -6.576 18935 70 1 1 . 1 1 16 16 SER C C 16 176.009 176.009 174.200 1.809 18935 71 1 1 . 1 1 16 16 SER CA C 16 57.244 57.244 59.505 -2.260 18935 72 1 1 . 1 1 16 16 SER CB C 16 63.525 63.525 64.372 -0.847 18935 73 1 1 . 1 1 16 16 SER H H 16 7.136 7.136 8.017 -0.881 18935 74 1 1 . 1 1 17 17 ARG N N 17 121.532 121.532 119.165 2.367 18935 75 1 1 . 1 1 17 17 ARG C C 17 174.482 174.482 175.759 -1.277 18935 76 1 1 . 1 1 17 17 ARG CA C 17 56.322 56.322 54.937 1.385 18935 77 1 1 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.194 0.636 18935 78 1 1 . 1 1 17 17 ARG H H 17 7.913 7.913 7.333 0.580 18935 79 1 1 . 1 1 18 18 LEU N N 18 121.305 121.305 120.682 0.623 18935 80 1 1 . 1 1 18 18 LEU C C 18 176.283 176.283 175.839 0.444 18935 81 1 1 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.236 -0.538 18935 82 1 1 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.026 0.029 18935 83 1 1 . 1 1 18 18 LEU H H 18 8.812 8.812 7.541 1.271 18935 84 1 1 . 1 1 19 19 ALA N N 19 125.293 125.293 122.237 3.056 18935 85 1 1 . 1 1 19 19 ALA C C 19 173.780 173.780 175.200 -1.420 18935 86 1 1 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.847 -1.045 18935 87 1 1 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.068 0.785 18935 88 1 1 . 1 1 19 19 ALA H H 19 8.790 8.790 7.965 0.825 18935 89 1 1 . 1 1 20 20 PHE N N 20 113.117 113.117 115.502 -2.385 18935 90 1 1 . 1 1 20 20 PHE C C 20 172.708 172.708 172.676 0.032 18935 91 1 1 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.767 -1.169 18935 92 1 1 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.884 -0.159 18935 93 1 1 . 1 1 20 20 PHE H H 20 8.925 8.925 8.966 -0.041 18935 94 1 1 . 1 1 21 21 GLU N N 21 121.532 121.532 122.032 -0.500 18935 95 1 1 . 1 1 21 21 GLU C C 21 174.830 174.830 175.037 -0.207 18935 96 1 1 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.308 -0.345 18935 97 1 1 . 1 1 21 21 GLU CB C 21 30.343 30.343 30.666 -0.323 18935 98 1 1 . 1 1 21 21 GLU H H 21 7.972 7.972 8.889 -0.917 18935 99 1 1 . 1 1 22 22 TYR N N 22 125.339 125.339 126.899 -1.560 18935 100 1 1 . 1 1 22 22 TYR C C 22 174.864 174.864 175.368 -0.504 18935 101 1 1 . 1 1 22 22 TYR CA C 22 55.288 55.288 57.115 -1.827 18935 102 1 1 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.796 -0.937 18935 103 1 1 . 1 1 22 22 TYR H H 22 9.016 9.016 8.043 0.973 18935 104 1 1 . 1 1 23 23 ASN N N 23 127.024 127.024 127.269 -0.245 18935 105 1 1 . 1 1 23 23 ASN C C 23 175.410 175.410 174.979 0.431 18935 106 1 1 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.588 -0.534 18935 107 1 1 . 1 1 23 23 ASN CB C 23 36.261 36.261 36.676 -0.415 18935 108 1 1 . 1 1 23 23 ASN H H 23 9.181 9.181 9.373 -0.192 18935 109 1 1 . 1 1 24 24 GLY N N 24 102.755 102.755 102.539 0.216 18935 110 1 1 . 1 1 24 24 GLY C C 24 173.626 173.626 174.413 -0.787 18935 111 1 1 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.060 -0.125 18935 112 1 1 . 1 1 24 24 GLY H H 24 8.666 8.666 8.484 0.182 18935 113 1 1 . 1 1 25 25 GLN N N 25 118.722 118.722 120.230 -1.508 18935 114 1 1 . 1 1 25 25 GLN C C 25 173.657 173.657 174.814 -1.157 18935 115 1 1 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.892 -1.659 18935 116 1 1 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.410 0.395 18935 117 1 1 . 1 1 25 25 GLN H H 25 7.708 7.708 7.930 -0.222 18935 118 1 1 . 1 1 26 26 LEU N N 26 123.526 123.526 121.422 2.104 18935 119 1 1 . 1 1 26 26 LEU C C 26 175.842 175.842 176.330 -0.488 18935 120 1 1 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.781 0.205 18935 121 1 1 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.519 -2.712 18935 122 1 1 . 1 1 26 26 LEU H H 26 8.543 8.543 8.358 0.185 18935 123 1 1 . 1 1 27 27 ILE N N 27 129.462 129.462 123.838 5.624 18935 124 1 1 . 1 1 27 27 ILE C C 27 175.085 175.085 174.433 0.652 18935 125 1 1 . 1 1 27 27 ILE CA C 27 58.973 58.973 59.302 -0.329 18935 126 1 1 . 1 1 27 27 ILE CB C 27 35.552 35.552 39.035 -3.482 18935 127 1 1 . 1 1 27 27 ILE H H 27 8.989 8.989 8.952 0.037 18935 128 1 1 . 1 1 28 28 LYS N N 28 125.157 125.157 126.592 -1.435 18935 129 1 1 . 1 1 28 28 LYS C C 28 176.725 176.725 175.480 1.245 18935 130 1 1 . 1 1 28 28 LYS CA C 28 56.810 56.810 56.047 0.763 18935 131 1 1 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.225 -1.409 18935 132 1 1 . 1 1 28 28 LYS H H 28 8.311 8.311 8.431 -0.120 18935 133 1 1 . 1 1 29 29 ILE N N 29 125.565 125.565 119.110 6.455 18935 134 1 1 . 1 1 29 29 ILE C C 29 175.685 175.685 174.564 1.121 18935 135 1 1 . 1 1 29 29 ILE CA C 29 60.405 60.405 60.061 0.344 18935 136 1 1 . 1 1 29 29 ILE CB C 29 37.031 37.031 39.655 -2.624 18935 137 1 1 . 1 1 29 29 ILE H H 29 8.209 8.209 7.930 0.279 18935 138 1 1 . 1 1 30 30 LEU N N 30 127.831 127.831 123.272 4.559 18935 139 1 1 . 1 1 30 30 LEU C C 30 178.794 178.794 178.232 0.562 18935 140 1 1 . 1 1 30 30 LEU CA C 30 54.443 54.443 54.006 0.437 18935 141 1 1 . 1 1 30 30 LEU CB C 30 40.836 40.836 44.657 -3.821 18935 142 1 1 . 1 1 30 30 LEU H H 30 9.027 9.027 8.385 0.642 18935 143 1 1 . 1 1 31 31 SER N N 31 116.864 116.864 120.508 -3.644 18935 144 1 1 . 1 1 31 31 SER C C 31 177.464 177.464 176.757 0.707 18935 145 1 1 . 1 1 31 31 SER CA C 31 61.180 61.180 61.703 -0.523 18935 146 1 1 . 1 1 31 31 SER CB C 31 62.105 62.105 62.785 -0.680 18935 147 1 1 . 1 1 31 31 SER H H 31 8.887 8.887 8.832 0.055 18935 148 1 1 . 1 1 32 32 LYS N N 32 114.825 114.825 120.723 -5.898 18935 149 1 1 . 1 1 32 32 LYS C C 32 176.243 176.243 176.882 -0.639 18935 150 1 1 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.242 -0.950 18935 151 1 1 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.051 -1.785 18935 152 1 1 . 1 1 32 32 LYS H H 32 8.290 8.290 8.281 0.009 18935 153 1 1 . 1 1 33 33 ASN N N 33 117.564 117.564 114.771 2.793 18935 154 1 1 . 1 1 33 33 ASN C C 33 172.253 172.253 174.044 -1.791 18935 155 1 1 . 1 1 33 33 ASN CA C 33 52.091 52.091 52.723 -0.632 18935 156 1 1 . 1 1 33 33 ASN CB C 33 38.339 38.339 39.676 -1.337 18935 157 1 1 . 1 1 33 33 ASN H H 33 8.051 8.051 7.886 0.165 18935 158 1 1 . 1 1 34 34 ILE N N 34 118.949 118.949 121.576 -2.627 18935 159 1 1 . 1 1 34 34 ILE C C 34 175.343 175.343 173.754 1.589 18935 160 1 1 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.939 -0.386 18935 161 1 1 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.179 -2.312 18935 162 1 1 . 1 1 34 34 ILE H H 34 7.670 7.670 8.201 -0.531 18935 163 1 1 . 1 1 35 35 VAL N N 35 128.355 128.355 127.483 0.872 18935 164 1 1 . 1 1 35 35 VAL C C 35 175.543 175.543 174.322 1.221 18935 165 1 1 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.335 -0.321 18935 166 1 1 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.743 -1.512 18935 167 1 1 . 1 1 35 35 VAL H H 35 9.698 9.698 9.207 0.491 18935 168 1 1 . 1 1 36 36 ALA N N 36 129.553 129.553 130.734 -1.181 18935 169 1 1 . 1 1 36 36 ALA C C 36 177.015 177.015 176.372 0.643 18935 170 1 1 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.673 0.723 18935 171 1 1 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.753 -1.131 18935 172 1 1 . 1 1 36 36 ALA H H 36 8.917 8.917 8.436 0.481 18935 173 1 1 . 1 1 37 37 VAL N N 37 115.006 115.006 123.863 -8.857 18935 174 1 1 . 1 1 37 37 VAL C C 37 174.649 174.649 176.082 -1.433 18935 175 1 1 . 1 1 37 37 VAL CA C 37 59.321 59.321 60.846 -1.525 18935 176 1 1 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.543 -1.157 18935 177 1 1 . 1 1 37 37 VAL H H 37 8.214 8.214 7.909 0.305 18935 178 1 1 . 1 1 38 38 GLY N N 38 109.387 109.387 111.963 -2.576 18935 179 1 1 . 1 1 38 38 GLY C C 38 174.152 174.152 175.310 -1.158 18935 180 1 1 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.312 0.185 18935 181 1 1 . 1 1 38 38 GLY H H 38 8.677 8.677 8.566 0.111 18935 182 1 1 . 1 1 39 39 SER N N 39 116.776 116.776 119.051 -2.275 18935 183 1 1 . 1 1 39 39 SER C C 39 175.129 175.129 176.636 -1.507 18935 184 1 1 . 1 1 39 39 SER CA C 39 60.036 60.036 61.332 -1.296 18935 185 1 1 . 1 1 39 39 SER CB C 39 61.522 61.522 62.976 -1.454 18935 186 1 1 . 1 1 39 39 SER H H 39 9.705 9.705 8.556 1.149 18935 187 1 1 . 1 1 40 40 LEU N N 40 113.696 113.696 119.046 -5.350 18935 188 1 1 . 1 1 40 40 LEU C C 40 180.558 180.558 178.714 1.844 18935 189 1 1 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.408 0.965 18935 190 1 1 . 1 1 40 40 LEU CB C 40 41.877 41.877 40.886 0.990 18935 191 1 1 . 1 1 40 40 LEU H H 40 7.311 7.311 8.330 -1.019 18935 192 1 1 . 1 1 41 41 ARG N N 41 121.162 121.162 117.572 3.590 18935 193 1 1 . 1 1 41 41 ARG C C 41 176.964 176.964 177.947 -0.983 18935 194 1 1 . 1 1 41 41 ARG CA C 41 58.451 58.451 57.012 1.439 18935 195 1 1 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.760 -2.555 18935 196 1 1 . 1 1 41 41 ARG H H 41 6.999 6.999 7.640 -0.641 18935 197 1 1 . 1 1 42 42 ARG N N 42 111.109 111.109 117.549 -6.440 18935 198 1 1 . 1 1 42 42 ARG C C 42 172.564 172.564 175.540 -2.976 18935 199 1 1 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.956 0.424 18935 200 1 1 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.912 -2.563 18935 201 1 1 . 1 1 42 42 ARG H H 42 7.041 7.041 8.176 -1.135 18935 202 1 1 . 1 1 43 43 GLU N N 43 111.924 111.924 115.762 -3.838 18935 203 1 1 . 1 1 43 43 GLU C C 43 176.202 176.202 175.696 0.506 18935 204 1 1 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.656 -1.202 18935 205 1 1 . 1 1 43 43 GLU CB C 43 25.301 25.301 26.966 -1.665 18935 206 1 1 . 1 1 43 43 GLU H H 43 7.757 7.757 8.005 -0.248 18935 207 1 1 . 1 1 44 44 GLU N N 44 117.861 117.861 118.985 -1.124 18935 208 1 1 . 1 1 44 44 GLU C C 44 175.197 175.197 176.982 -1.785 18935 209 1 1 . 1 1 44 44 GLU CA C 44 56.128 56.128 57.071 -0.943 18935 210 1 1 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.524 -1.965 18935 211 1 1 . 1 1 44 44 GLU H H 44 7.461 7.461 7.806 -0.345 18935 212 1 1 . 1 1 45 45 LYS N N 45 115.051 115.051 117.737 -2.686 18935 213 1 1 . 1 1 45 45 LYS C C 45 177.733 177.733 175.457 2.276 18935 214 1 1 . 1 1 45 45 LYS CA C 45 59.055 59.055 56.917 2.138 18935 215 1 1 . 1 1 45 45 LYS CB C 45 32.027 32.027 34.035 -2.009 18935 216 1 1 . 1 1 45 45 LYS H H 45 8.123 8.123 8.490 -0.367 18935 217 1 1 . 1 1 46 46 MET N N 46 114.009 114.009 120.089 -6.080 18935 218 1 1 . 1 1 46 46 MET C C 46 174.067 174.067 174.458 -0.391 18935 219 1 1 . 1 1 46 46 MET CA C 46 52.477 52.477 54.080 -1.603 18935 220 1 1 . 1 1 46 46 MET CB C 46 33.974 33.974 34.080 -0.106 18935 221 1 1 . 1 1 46 46 MET H H 46 7.767 7.767 7.543 0.224 18935 222 1 1 . 1 1 47 47 LEU N N 47 120.263 120.263 123.081 -2.818 18935 223 1 1 . 1 1 47 47 LEU C C 47 177.669 177.669 176.188 1.481 18935 224 1 1 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.164 -0.963 18935 225 1 1 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.506 -0.598 18935 226 1 1 . 1 1 47 47 LEU H H 47 9.481 9.481 8.021 1.460 18935 227 1 1 . 1 1 48 48 ASN N N 48 118.632 118.632 116.655 1.977 18935 228 1 1 . 1 1 48 48 ASN C C 48 174.715 174.715 174.717 -0.002 18935 229 1 1 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.910 1.591 18935 230 1 1 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.316 -1.488 18935 231 1 1 . 1 1 48 48 ASN H H 48 9.388 9.388 8.931 0.458 18935 232 1 1 . 1 1 49 49 ASP N N 49 115.867 115.867 116.625 -0.758 18935 233 1 1 . 1 1 49 49 ASP C C 49 174.111 174.111 174.311 -0.200 18935 234 1 1 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.935 -1.734 18935 235 1 1 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.398 -3.321 18935 236 1 1 . 1 1 49 49 ASP H H 49 7.670 7.670 7.566 0.104 18935 237 1 1 . 1 1 50 50 VAL N N 50 119.185 119.185 119.055 0.130 18935 238 1 1 . 1 1 50 50 VAL C C 50 172.333 172.333 174.636 -2.303 18935 239 1 1 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.278 0.637 18935 240 1 1 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.433 -0.468 18935 241 1 1 . 1 1 50 50 VAL H H 50 8.339 8.339 7.951 0.388 18935 242 1 1 . 1 1 51 51 ASP N N 51 124.704 124.704 126.476 -1.772 18935 243 1 1 . 1 1 51 51 ASP C C 51 173.725 173.725 174.850 -1.125 18935 244 1 1 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.169 -0.141 18935 245 1 1 . 1 1 51 51 ASP CB C 51 43.829 43.829 44.445 -0.616 18935 246 1 1 . 1 1 51 51 ASP H H 51 8.984 8.984 8.154 0.830 18935 247 1 1 . 1 1 52 52 LEU N N 52 120.943 120.943 121.748 -0.805 18935 248 1 1 . 1 1 52 52 LEU C C 52 173.045 173.045 173.830 -0.785 18935 249 1 1 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.280 -1.409 18935 250 1 1 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.462 -2.209 18935 251 1 1 . 1 1 52 52 LEU H H 52 9.081 9.081 8.283 0.798 18935 252 1 1 . 1 1 53 53 LEU N N 53 123.027 123.027 126.891 -3.864 18935 253 1 1 . 1 1 53 53 LEU C C 53 173.750 173.750 174.633 -0.883 18935 254 1 1 . 1 1 53 53 LEU CA C 53 52.333 52.333 52.995 -0.662 18935 255 1 1 . 1 1 53 53 LEU CB C 53 45.008 45.008 44.907 0.100 18935 256 1 1 . 1 1 53 53 LEU H H 53 9.146 9.146 9.146 -0.000 18935 257 1 1 . 1 1 54 54 ILE N N 54 126.562 126.562 127.100 -0.538 18935 258 1 1 . 1 1 54 54 ILE C C 54 175.132 175.132 175.469 -0.337 18935 259 1 1 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.777 -1.179 18935 260 1 1 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.820 -1.259 18935 261 1 1 . 1 1 54 54 ILE H H 54 9.440 9.440 9.257 0.183 18935 262 1 1 . 1 1 55 55 ILE N N 55 126.879 126.879 127.369 -0.490 18935 263 1 1 . 1 1 55 55 ILE C C 55 175.655 175.655 175.551 0.104 18935 264 1 1 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.069 -2.508 18935 265 1 1 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.505 -5.199 18935 266 1 1 . 1 1 55 55 ILE H H 55 9.381 9.381 7.856 1.525 18935 267 1 1 . 1 1 56 56 VAL N N 56 128.936 128.936 123.366 5.570 18935 268 1 1 . 1 1 56 56 VAL C C 56 176.389 176.389 174.419 1.970 18935 269 1 1 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.394 0.236 18935 270 1 1 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.509 -0.725 18935 271 1 1 . 1 1 56 56 VAL H H 56 9.227 9.227 8.938 0.289 18935 272 1 1 . 1 1 58 58 GLU N N 58 112.423 112.423 119.089 -6.666 18935 273 1 1 . 1 1 58 58 GLU C C 58 175.946 175.946 176.643 -0.697 18935 274 1 1 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.216 -0.916 18935 275 1 1 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.777 0.320 18935 276 1 1 . 1 1 58 58 GLU H H 58 6.685 6.685 8.067 -1.382 18935 277 1 1 . 1 1 59 59 LYS N N 59 125.293 125.293 120.461 4.832 18935 278 1 1 . 1 1 59 59 LYS C C 59 179.248 179.248 176.312 2.936 18935 279 1 1 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.029 2.745 18935 280 1 1 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.204 -1.127 18935 281 1 1 . 1 1 59 59 LYS H H 59 9.108 9.108 8.591 0.517 18935 282 1 1 . 1 1 60 60 LYS N N 60 117.408 117.408 116.740 0.668 18935 283 1 1 . 1 1 60 60 LYS C C 60 177.198 177.198 177.876 -0.678 18935 284 1 1 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.761 1.452 18935 285 1 1 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.980 -2.397 18935 286 1 1 . 1 1 60 60 LYS H H 60 9.102 9.102 7.580 1.522 18935 287 1 1 . 1 1 61 61 LEU N N 61 114.779 114.779 121.196 -6.417 18935 288 1 1 . 1 1 61 61 LEU C C 61 178.790 178.790 178.623 0.167 18935 289 1 1 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.355 -2.330 18935 290 1 1 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.311 -0.447 18935 291 1 1 . 1 1 61 61 LEU H H 61 7.455 7.455 8.278 -0.823 18935 292 1 1 . 1 1 62 62 LEU N N 62 119.629 119.629 117.931 1.698 18935 293 1 1 . 1 1 62 62 LEU C C 62 177.762 177.762 177.042 0.720 18935 294 1 1 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.580 0.618 18935 295 1 1 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.956 -1.225 18935 296 1 1 . 1 1 62 62 LEU H H 62 7.714 7.714 7.548 0.166 18935 297 1 1 . 1 1 63 63 LYS N N 63 112.921 112.921 115.327 -2.406 18935 298 1 1 . 1 1 63 63 LYS C C 63 175.386 175.386 177.822 -2.436 18935 299 1 1 . 1 1 63 63 LYS CA C 63 57.356 57.356 56.616 0.740 18935 300 1 1 . 1 1 63 63 LYS CB C 63 30.963 30.963 33.112 -2.149 18935 301 1 1 . 1 1 63 63 LYS H H 63 7.751 7.751 8.234 -0.483 18935 302 1 1 . 1 1 64 64 HIS N N 64 112.468 112.468 117.605 -5.137 18935 303 1 1 . 1 1 64 64 HIS C C 64 176.081 176.081 176.521 -0.440 18935 304 1 1 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.768 -1.999 18935 305 1 1 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.503 0.867 18935 306 1 1 . 1 1 64 64 HIS H H 64 7.697 7.697 7.797 -0.100 18935 307 1 1 . 1 1 65 65 VAL N N 65 117.499 117.499 115.760 1.739 18935 308 1 1 . 1 1 65 65 VAL C C 65 174.301 174.301 175.799 -1.498 18935 309 1 1 . 1 1 65 65 VAL CA C 65 66.330 66.330 62.837 3.493 18935 310 1 1 . 1 1 65 65 VAL CB C 65 29.360 29.360 30.932 -1.572 18935 311 1 1 . 1 1 65 65 VAL H H 65 6.917 6.917 7.325 -0.408 18935 312 1 1 . 1 1 66 66 LEU N N 66 113.873 113.873 119.393 -5.520 18935 313 1 1 . 1 1 66 66 LEU CA C 66 57.850 57.850 56.832 1.018 18935 314 1 1 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.409 -3.351 18935 315 1 1 . 1 1 66 66 LEU H H 66 9.102 9.102 7.965 1.137 18935 316 1 1 . 1 1 68 68 ASN N N 68 110.792 110.792 117.034 -6.242 18935 317 1 1 . 1 1 68 68 ASN C C 68 174.877 174.877 173.506 1.371 18935 318 1 1 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.981 -2.166 18935 319 1 1 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.512 -1.201 18935 320 1 1 . 1 1 68 68 ASN H H 68 7.234 7.234 8.404 -1.170 18935 321 1 1 . 1 1 69 69 ILE N N 69 122.348 122.348 124.641 -2.293 18935 322 1 1 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.658 -0.747 18935 323 1 1 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.436 -2.398 18935 324 1 1 . 1 1 69 69 ILE H H 69 7.428 7.428 8.640 -1.212 18935 325 1 1 . 1 1 70 70 ARG N N 70 125.701 125.701 125.405 0.296 18935 326 1 1 . 1 1 70 70 ARG C C 70 174.596 174.596 173.902 0.694 18935 327 1 1 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.615 -1.454 18935 328 1 1 . 1 1 70 70 ARG CB C 70 32.453 32.453 31.767 0.686 18935 329 1 1 . 1 1 70 70 ARG H H 70 9.083 9.083 8.764 0.319 18935 330 1 1 . 1 1 71 71 ILE N N 71 118.496 118.496 118.196 0.300 18935 331 1 1 . 1 1 71 71 ILE C C 71 175.625 175.625 176.608 -0.983 18935 332 1 1 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.977 -0.201 18935 333 1 1 . 1 1 71 71 ILE CB C 71 37.967 37.967 39.425 -1.458 18935 334 1 1 . 1 1 71 71 ILE H H 71 7.864 7.864 8.065 -0.201 18935 335 1 1 . 1 1 72 72 LYS N N 72 127.423 127.423 123.345 4.078 18935 336 1 1 . 1 1 72 72 LYS C C 72 177.659 177.659 176.994 0.665 18935 337 1 1 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.861 1.567 18935 338 1 1 . 1 1 72 72 LYS CB C 72 31.374 31.374 31.830 -0.456 18935 339 1 1 . 1 1 72 72 LYS H H 72 8.720 8.720 8.694 0.026 18935 340 1 1 . 1 1 73 73 GLY N N 73 112.604 112.604 114.324 -1.720 18935 341 1 1 . 1 1 73 73 GLY C C 73 173.729 173.729 173.891 -0.162 18935 342 1 1 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.922 -0.091 18935 343 1 1 . 1 1 73 73 GLY H H 73 8.930 8.930 8.659 0.271 18935 344 1 1 . 1 1 74 74 LEU N N 74 119.538 119.538 119.728 -0.190 18935 345 1 1 . 1 1 74 74 LEU C C 74 175.802 175.802 175.916 -0.114 18935 346 1 1 . 1 1 74 74 LEU CA C 74 53.661 53.661 52.788 0.873 18935 347 1 1 . 1 1 74 74 LEU CB C 74 44.053 44.053 45.410 -1.357 18935 348 1 1 . 1 1 74 74 LEU H H 74 7.547 7.547 7.516 0.031 18935 349 1 1 . 1 1 75 75 SER N N 75 118.994 118.994 117.709 1.285 18935 350 1 1 . 1 1 75 75 SER C C 75 173.111 173.111 172.778 0.333 18935 351 1 1 . 1 1 75 75 SER CA C 75 57.696 57.696 58.053 -0.357 18935 352 1 1 . 1 1 75 75 SER CB C 75 63.073 63.073 62.576 0.497 18935 353 1 1 . 1 1 75 75 SER H H 75 9.076 9.076 8.583 0.493 18935 354 1 1 . 1 1 76 76 PHE N N 76 117.802 117.802 121.574 -3.772 18935 355 1 1 . 1 1 76 76 PHE C C 76 173.564 173.564 174.742 -1.178 18935 356 1 1 . 1 1 76 76 PHE CA C 76 55.409 55.409 54.947 0.462 18935 357 1 1 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.072 -0.229 18935 358 1 1 . 1 1 76 76 PHE H H 76 8.119 8.119 7.296 0.823 18935 359 1 1 . 1 1 77 77 SER N N 77 113.918 113.918 117.698 -3.780 18935 360 1 1 . 1 1 77 77 SER C C 77 173.194 173.194 173.537 -0.343 18935 361 1 1 . 1 1 77 77 SER CA C 77 55.999 55.999 57.514 -1.516 18935 362 1 1 . 1 1 77 77 SER CB C 77 65.218 65.218 65.387 -0.169 18935 363 1 1 . 1 1 77 77 SER H H 77 8.989 8.989 8.588 0.401 18935 364 1 1 . 1 1 78 78 VAL N N 78 123.662 123.662 126.971 -3.309 18935 365 1 1 . 1 1 78 78 VAL C C 78 176.057 176.057 176.230 -0.173 18935 366 1 1 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.626 -0.535 18935 367 1 1 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.850 0.444 18935 368 1 1 . 1 1 78 78 VAL H H 78 8.995 8.995 8.833 0.162 18935 369 1 1 . 1 1 79 79 LYS N N 79 129.417 129.417 128.456 0.961 18935 370 1 1 . 1 1 79 79 LYS C C 79 176.436 176.436 174.559 1.877 18935 371 1 1 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.727 2.925 18935 372 1 1 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.803 -4.330 18935 373 1 1 . 1 1 79 79 LYS H H 79 9.425 9.425 8.802 0.623 18935 374 1 1 . 1 1 80 80 VAL N N 80 108.616 108.616 121.489 -12.873 18935 375 1 1 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.554 -2.457 18935 376 1 1 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.447 0.635 18935 377 1 1 . 1 1 80 80 VAL H H 80 7.380 7.380 8.466 -1.086 18935 378 1 1 . 1 1 81 81 CYS N N 81 123.254 123.254 128.825 -5.571 18935 379 1 1 . 1 1 81 81 CYS C C 81 172.053 172.053 174.035 -1.982 18935 380 1 1 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.704 2.035 18935 381 1 1 . 1 1 81 81 CYS CB C 81 27.332 27.332 29.277 -1.945 18935 382 1 1 . 1 1 81 81 CYS H H 81 9.759 9.759 8.379 1.380 18935 383 1 1 . 1 1 82 82 GLY N N 82 118.450 118.450 116.680 1.770 18935 384 1 1 . 1 1 82 82 GLY C C 82 171.814 171.814 174.688 -2.874 18935 385 1 1 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.500 -2.147 18935 386 1 1 . 1 1 82 82 GLY H H 82 8.537 8.537 8.806 -0.269 18935 387 1 1 . 1 1 83 83 GLU N N 83 113.964 113.964 121.603 -7.639 18935 388 1 1 . 1 1 83 83 GLU C C 83 179.320 179.320 177.690 1.630 18935 389 1 1 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.383 0.292 18935 390 1 1 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.163 -0.256 18935 391 1 1 . 1 1 83 83 GLU H H 83 8.473 8.473 8.750 -0.277 18935 392 1 1 . 1 1 84 84 ARG N N 84 117.544 117.544 117.459 0.085 18935 393 1 1 . 1 1 84 84 ARG C C 84 177.252 177.252 176.604 0.648 18935 394 1 1 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.310 -0.806 18935 395 1 1 . 1 1 84 84 ARG CB C 84 31.546 31.546 30.687 0.859 18935 396 1 1 . 1 1 84 84 ARG H H 84 9.760 9.760 8.354 1.406 18935 397 1 1 . 1 1 85 85 LYS N N 85 124.160 124.160 121.246 2.914 18935 398 1 1 . 1 1 85 85 LYS C C 85 173.379 173.379 175.586 -2.207 18935 399 1 1 . 1 1 85 85 LYS CA C 85 55.232 55.232 57.203 -1.971 18935 400 1 1 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.212 0.000 18935 401 1 1 . 1 1 85 85 LYS H H 85 8.494 8.494 7.841 0.653 18935 402 1 1 . 1 1 86 86 CYS N N 86 126.472 126.472 118.290 8.182 18935 403 1 1 . 1 1 86 86 CYS C C 86 171.935 171.935 172.887 -0.952 18935 404 1 1 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.997 -2.119 18935 405 1 1 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.738 -0.434 18935 406 1 1 . 1 1 86 86 CYS H H 86 9.221 9.221 8.382 0.839 18935 407 1 1 . 1 1 87 87 VAL N N 87 126.426 126.426 123.143 3.283 18935 408 1 1 . 1 1 87 87 VAL C C 87 173.760 173.760 173.065 0.695 18935 409 1 1 . 1 1 87 87 VAL CA C 87 61.333 61.333 59.285 2.048 18935 410 1 1 . 1 1 87 87 VAL CB C 87 33.338 33.338 35.030 -1.692 18935 411 1 1 . 1 1 87 87 VAL H H 87 8.623 8.623 8.870 -0.247 18935 412 1 1 . 1 1 88 88 LEU N N 88 125.701 125.701 127.423 -1.722 18935 413 1 1 . 1 1 88 88 LEU C C 88 175.424 175.424 175.203 0.221 18935 414 1 1 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.084 -0.999 18935 415 1 1 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.693 -2.149 18935 416 1 1 . 1 1 88 88 LEU H H 88 9.592 9.592 9.088 0.504 18935 417 1 1 . 1 1 89 89 PHE N N 89 118.314 118.314 122.439 -4.125 18935 418 1 1 . 1 1 89 89 PHE C C 89 177.068 177.068 175.854 1.214 18935 419 1 1 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.780 -0.905 18935 420 1 1 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.103 -0.266 18935 421 1 1 . 1 1 89 89 PHE H H 89 8.979 8.979 8.729 0.250 18935 422 1 1 . 1 1 90 90 ILE N N 90 119.039 119.039 121.656 -2.617 18935 423 1 1 . 1 1 90 90 ILE C C 90 173.692 173.692 174.568 -0.876 18935 424 1 1 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.229 -0.557 18935 425 1 1 . 1 1 90 90 ILE CB C 90 40.183 40.183 40.323 -0.140 18935 426 1 1 . 1 1 90 90 ILE H H 90 9.447 9.447 8.124 1.323 18935 427 1 1 . 1 1 91 91 GLU N N 91 122.801 122.801 122.159 0.642 18935 428 1 1 . 1 1 91 91 GLU C C 91 175.565 175.565 174.964 0.601 18935 429 1 1 . 1 1 91 91 GLU CA C 91 54.465 54.465 54.374 0.091 18935 430 1 1 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.145 -3.483 18935 431 1 1 . 1 1 91 91 GLU H H 91 8.360 8.360 7.896 0.464 18935 432 1 1 . 1 1 92 92 TRP N N 92 126.018 126.018 124.715 1.303 18935 433 1 1 . 1 1 92 92 TRP C C 92 175.070 175.070 176.193 -1.123 18935 434 1 1 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.757 -0.567 18935 435 1 1 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.978 -1.396 18935 436 1 1 . 1 1 92 92 TRP H H 92 9.425 9.425 9.004 0.421 18935 437 1 1 . 1 1 93 93 GLU N N 93 126.381 126.381 123.253 3.128 18935 438 1 1 . 1 1 93 93 GLU C C 93 175.637 175.637 175.784 -0.147 18935 439 1 1 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.283 -0.514 18935 440 1 1 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.176 -2.232 18935 441 1 1 . 1 1 93 93 GLU H H 93 8.914 8.914 8.958 -0.044 18935 442 1 1 . 1 1 94 94 LYS N N 94 107.891 107.891 110.924 -3.033 18935 443 1 1 . 1 1 94 94 LYS C C 94 175.359 175.359 176.230 -0.871 18935 444 1 1 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.133 0.297 18935 445 1 1 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.699 -2.057 18935 446 1 1 . 1 1 94 94 LYS H H 94 8.634 8.634 8.398 0.236 18935 447 1 1 . 1 1 95 95 LYS N N 95 120.490 120.490 119.099 1.391 18935 448 1 1 . 1 1 95 95 LYS C C 95 174.369 174.369 174.482 -0.113 18935 449 1 1 . 1 1 95 95 LYS CA C 95 54.353 54.353 55.006 -0.653 18935 450 1 1 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.946 -1.483 18935 451 1 1 . 1 1 95 95 LYS H H 95 7.924 7.924 7.627 0.297 18935 452 1 1 . 1 1 96 96 THR N N 96 115.278 115.278 113.551 1.727 18935 453 1 1 . 1 1 96 96 THR C C 96 174.317 174.317 173.397 0.920 18935 454 1 1 . 1 1 96 96 THR CA C 96 61.203 61.203 59.930 1.273 18935 455 1 1 . 1 1 96 96 THR CB C 96 69.348 69.348 70.654 -1.306 18935 456 1 1 . 1 1 96 96 THR H H 96 7.967 7.967 7.889 0.078 18935 457 1 1 . 1 1 97 97 TYR N N 97 123.254 123.254 124.422 -1.168 18935 458 1 1 . 1 1 97 97 TYR C C 97 173.320 173.320 174.470 -1.150 18935 459 1 1 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.196 -0.312 18935 460 1 1 . 1 1 97 97 TYR CB C 97 41.136 41.136 42.271 -1.135 18935 461 1 1 . 1 1 97 97 TYR H H 97 9.232 9.232 9.015 0.217 18935 462 1 1 . 1 1 98 98 GLN N N 98 122.574 122.574 119.498 3.076 18935 463 1 1 . 1 1 98 98 GLN C C 98 172.781 172.781 174.256 -1.475 18935 464 1 1 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.056 0.115 18935 465 1 1 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.680 -2.281 18935 466 1 1 . 1 1 98 98 GLN H H 98 9.000 9.000 8.876 0.124 18935 467 1 1 . 1 1 99 99 LEU N N 99 130.218 130.218 126.163 4.055 18935 468 1 1 . 1 1 99 99 LEU C C 99 172.806 172.806 174.376 -1.570 18935 469 1 1 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.272 -1.222 18935 470 1 1 . 1 1 99 99 LEU CB C 99 44.752 44.752 44.926 -0.174 18935 471 1 1 . 1 1 99 99 LEU H H 99 9.246 9.246 9.076 0.170 18935 472 1 1 . 1 1 100 100 ASP N N 100 124.931 124.931 127.424 -2.493 18935 473 1 1 . 1 1 100 100 ASP C C 100 172.626 172.626 174.376 -1.750 18935 474 1 1 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.037 -2.607 18935 475 1 1 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.276 -5.948 18935 476 1 1 . 1 1 100 100 ASP H H 100 9.253 9.253 8.357 0.896 18935 477 1 1 . 1 1 101 101 LEU N N 101 119.402 119.402 120.242 -0.840 18935 478 1 1 . 1 1 101 101 LEU C C 101 173.869 173.869 174.522 -0.653 18935 479 1 1 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.816 -1.161 18935 480 1 1 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.566 0.600 18935 481 1 1 . 1 1 101 101 LEU H H 101 8.726 8.726 7.743 0.983 18935 482 1 1 . 1 1 102 102 PHE N N 102 117.952 117.952 117.851 0.101 18935 483 1 1 . 1 1 102 102 PHE C C 102 175.853 175.853 175.013 0.840 18935 484 1 1 . 1 1 102 102 PHE CA C 102 53.282 53.282 56.027 -2.745 18935 485 1 1 . 1 1 102 102 PHE CB C 102 41.824 41.824 41.076 0.748 18935 486 1 1 . 1 1 102 102 PHE H H 102 8.236 8.236 8.711 -0.475 18935 487 1 1 . 1 1 103 103 THR N N 103 106.853 106.853 118.041 -11.188 18935 488 1 1 . 1 1 103 103 THR C C 103 175.154 175.154 174.061 1.093 18935 489 1 1 . 1 1 103 103 THR CA C 103 57.685 57.685 60.336 -2.651 18935 490 1 1 . 1 1 103 103 THR CB C 103 71.037 71.037 69.415 1.622 18935 491 1 1 . 1 1 103 103 THR H H 103 7.917 7.917 8.516 -0.599 18935 492 1 1 . 1 1 104 104 ALA N N 104 122.348 122.348 128.213 -5.865 18935 493 1 1 . 1 1 104 104 ALA C C 104 175.947 175.947 174.891 1.056 18935 494 1 1 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.763 -0.956 18935 495 1 1 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.364 0.064 18935 496 1 1 . 1 1 104 104 ALA H H 104 8.930 8.930 8.845 0.085 18935 497 1 1 . 1 1 105 105 LEU N N 105 119.855 119.855 119.008 0.847 18935 498 1 1 . 1 1 105 105 LEU C C 105 179.628 179.628 179.097 0.531 18935 499 1 1 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.324 -1.201 18935 500 1 1 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.163 -1.829 18935 501 1 1 . 1 1 105 105 LEU H H 105 8.316 8.316 9.401 -1.085 18935 502 1 1 . 1 1 106 106 ALA N N 106 123.662 123.662 125.311 -1.649 18935 503 1 1 . 1 1 106 106 ALA C C 106 181.056 181.056 179.235 1.821 18935 504 1 1 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.248 1.101 18935 505 1 1 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.514 -1.199 18935 506 1 1 . 1 1 106 106 ALA H H 106 8.306 8.306 8.405 -0.099 18935 507 1 1 . 1 1 107 107 GLU N N 107 114.825 114.825 115.571 -0.746 18935 508 1 1 . 1 1 107 107 GLU C C 107 177.854 177.854 177.000 0.854 18935 509 1 1 . 1 1 107 107 GLU CA C 107 58.386 58.386 58.129 0.257 18935 510 1 1 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.517 -0.673 18935 511 1 1 . 1 1 107 107 GLU H H 107 9.754 9.754 8.824 0.930 18935 512 1 1 . 1 1 108 108 GLU N N 108 115.097 115.097 118.217 -3.120 18935 513 1 1 . 1 1 108 108 GLU C C 108 178.001 178.001 177.160 0.841 18935 514 1 1 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.090 -1.164 18935 515 1 1 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.694 0.307 18935 516 1 1 . 1 1 108 108 GLU H H 108 7.859 7.859 7.729 0.130 18935 517 1 1 . 1 1 109 109 LYS N N 109 118.360 118.360 121.922 -3.562 18935 518 1 1 . 1 1 109 109 LYS C C 109 172.691 172.691 176.205 -3.514 18935 519 1 1 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.460 0.442 18935 520 1 1 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.789 -0.248 18935 521 1 1 . 1 1 109 109 LYS H H 109 7.660 7.660 7.428 0.232 18935 522 1 1 . 1 1 111 111 TYR N N 111 114.054 114.054 118.816 -4.762 18935 523 1 1 . 1 1 111 111 TYR C C 111 179.764 179.764 177.898 1.866 18935 524 1 1 . 1 1 111 111 TYR CA C 111 58.998 58.998 61.020 -2.022 18935 525 1 1 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.454 -1.498 18935 526 1 1 . 1 1 111 111 TYR H H 111 6.583 6.583 8.301 -1.718 18935 527 1 1 . 1 1 112 112 ALA N N 112 124.749 124.749 122.628 2.121 18935 528 1 1 . 1 1 112 112 ALA C C 112 179.430 179.430 179.655 -0.225 18935 529 1 1 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.875 0.094 18935 530 1 1 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.883 -0.071 18935 531 1 1 . 1 1 112 112 ALA H H 112 8.753 8.753 8.816 -0.063 18935 532 1 1 . 1 1 113 113 ILE N N 113 119.130 119.130 119.577 -0.447 18935 533 1 1 . 1 1 113 113 ILE C C 113 178.646 178.646 178.481 0.165 18935 534 1 1 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.123 2.278 18935 535 1 1 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.494 0.743 18935 536 1 1 . 1 1 113 113 ILE H H 113 8.946 8.946 8.360 0.586 18935 537 1 1 . 1 1 114 114 PHE N N 114 121.758 121.758 121.235 0.523 18935 538 1 1 . 1 1 114 114 PHE C C 114 177.954 177.954 176.803 1.151 18935 539 1 1 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.991 -2.214 18935 540 1 1 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.489 0.575 18935 541 1 1 . 1 1 114 114 PHE H H 114 7.940 7.940 8.325 -0.385 18935 542 1 1 . 1 1 115 115 HIS N N 115 116.547 116.547 119.272 -2.725 18935 543 1 1 . 1 1 115 115 HIS C C 115 176.161 176.161 176.401 -0.240 18935 544 1 1 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.521 -0.402 18935 545 1 1 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.603 1.464 18935 546 1 1 . 1 1 115 115 HIS H H 115 7.767 7.767 8.019 -0.252 18935 547 1 1 . 1 1 116 116 PHE N N 116 109.387 109.387 112.338 -2.951 18935 548 1 1 . 1 1 116 116 PHE C C 116 177.282 177.282 176.196 1.086 18935 549 1 1 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.730 1.704 18935 550 1 1 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.083 -1.827 18935 551 1 1 . 1 1 116 116 PHE H H 116 8.989 8.989 8.296 0.693 18935 552 1 1 . 1 1 117 117 THR N N 117 116.864 116.864 114.525 2.339 18935 553 1 1 . 1 1 117 117 THR C C 117 172.889 172.889 174.790 -1.901 18935 554 1 1 . 1 1 117 117 THR CA C 117 66.997 66.997 64.875 2.122 18935 555 1 1 . 1 1 117 117 THR CB C 117 67.948 67.948 69.563 -1.615 18935 556 1 1 . 1 1 117 117 THR H H 117 7.988 7.988 7.652 0.336 18935 557 1 1 . 1 1 118 118 GLY N N 118 103.320 103.320 109.062 -5.742 18935 558 1 1 . 1 1 118 118 GLY C C 118 176.912 176.912 171.559 5.353 18935 559 1 1 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.544 1.639 18935 560 1 1 . 1 1 118 118 GLY H H 118 6.550 6.550 7.354 -0.804 18935 561 1 1 . 1 1 120 120 VAL N N 120 120.671 120.671 126.370 -5.699 18935 562 1 1 . 1 1 120 120 VAL C C 120 176.283 176.283 177.387 -1.104 18935 563 1 1 . 1 1 120 120 VAL CA C 120 66.940 66.940 66.382 0.558 18935 564 1 1 . 1 1 120 120 VAL CB C 120 29.852 29.852 32.047 -2.195 18935 565 1 1 . 1 1 120 120 VAL H H 120 8.408 8.408 8.467 -0.059 18935 566 1 1 . 1 1 121 121 SER N N 121 111.789 111.789 114.397 -2.608 18935 567 1 1 . 1 1 121 121 SER C C 121 175.658 175.658 176.459 -0.801 18935 568 1 1 . 1 1 121 121 SER CA C 121 60.814 60.814 61.245 -0.431 18935 569 1 1 . 1 1 121 121 SER CB C 121 60.253 60.253 62.154 -1.901 18935 570 1 1 . 1 1 121 121 SER H H 121 8.290 8.290 8.315 -0.025 18935 571 1 1 . 1 1 122 122 TYR N N 122 123.254 123.254 123.527 -0.273 18935 572 1 1 . 1 1 122 122 TYR C C 122 174.611 174.611 177.338 -2.727 18935 573 1 1 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.378 -1.832 18935 574 1 1 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.368 -0.230 18935 575 1 1 . 1 1 122 122 TYR H H 122 6.303 6.303 7.403 -1.100 18935 576 1 1 . 1 1 123 123 LEU N N 123 114.825 114.825 119.484 -4.659 18935 577 1 1 . 1 1 123 123 LEU C C 123 178.891 178.891 178.859 0.032 18935 578 1 1 . 1 1 123 123 LEU CA C 123 56.779 56.779 58.147 -1.368 18935 579 1 1 . 1 1 123 123 LEU CB C 123 40.638 40.638 41.463 -0.825 18935 580 1 1 . 1 1 123 123 LEU H H 123 6.965 6.965 7.633 -0.668 18935 581 1 1 . 1 1 124 124 ILE N N 124 114.915 114.915 117.040 -2.125 18935 582 1 1 . 1 1 124 124 ILE C C 124 177.187 177.187 177.644 -0.457 18935 583 1 1 . 1 1 124 124 ILE CA C 124 64.431 64.431 64.837 -0.406 18935 584 1 1 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.167 -0.612 18935 585 1 1 . 1 1 124 124 ILE H H 124 7.531 7.531 7.894 -0.363 18935 586 1 1 . 1 1 125 125 ARG N N 125 115.278 115.278 119.747 -4.469 18935 587 1 1 . 1 1 125 125 ARG C C 125 178.473 178.473 178.547 -0.074 18935 588 1 1 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.810 -0.351 18935 589 1 1 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.528 -2.449 18935 590 1 1 . 1 1 125 125 ARG H H 125 6.809 6.809 7.694 -0.885 18935 591 1 1 . 1 1 126 126 ILE N N 126 124.160 124.160 118.237 5.923 18935 592 1 1 . 1 1 126 126 ILE C C 126 178.172 178.172 177.281 0.891 18935 593 1 1 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.290 -1.363 18935 594 1 1 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.587 -3.122 18935 595 1 1 . 1 1 126 126 ILE H H 126 7.408 7.408 6.912 0.496 18935 596 1 1 . 1 1 127 127 ARG N N 127 117.136 117.136 120.704 -3.568 18935 597 1 1 . 1 1 127 127 ARG C C 127 179.227 179.227 178.508 0.719 18935 598 1 1 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.767 0.449 18935 599 1 1 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.457 -1.668 18935 600 1 1 . 1 1 127 127 ARG H H 127 8.230 8.230 8.164 0.066 18935 601 1 1 . 1 1 128 128 ALA N N 128 121.305 121.305 120.856 0.449 18935 602 1 1 . 1 1 128 128 ALA C C 128 179.933 179.933 178.951 0.982 18935 603 1 1 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.167 -0.461 18935 604 1 1 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.144 0.194 18935 605 1 1 . 1 1 128 128 ALA H H 128 8.666 8.666 8.110 0.556 18935 606 1 1 . 1 1 129 129 ALA N N 129 120.943 120.943 121.296 -0.353 18935 607 1 1 . 1 1 129 129 ALA C C 129 181.336 181.336 179.666 1.670 18935 608 1 1 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.788 -0.081 18935 609 1 1 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.240 -1.380 18935 610 1 1 . 1 1 129 129 ALA H H 129 7.837 7.837 7.615 0.222 18935 611 1 1 . 1 1 130 130 LEU N N 130 117.726 117.726 117.407 0.319 18935 612 1 1 . 1 1 130 130 LEU C C 130 179.432 179.432 179.622 -0.190 18935 613 1 1 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.720 -0.544 18935 614 1 1 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.956 -1.390 18935 615 1 1 . 1 1 130 130 LEU H H 130 8.114 8.114 8.139 -0.025 18935 616 1 1 . 1 1 131 131 LYS N N 131 124.115 124.115 121.918 2.197 18935 617 1 1 . 1 1 131 131 LYS C C 131 181.452 181.452 179.446 2.006 18935 618 1 1 . 1 1 131 131 LYS CA C 131 58.886 58.886 59.017 -0.131 18935 619 1 1 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.880 0.318 18935 620 1 1 . 1 1 131 131 LYS H H 131 8.849 8.849 8.163 0.686 18935 621 1 1 . 1 1 132 132 LYS N N 132 119.447 119.447 118.305 1.142 18935 622 1 1 . 1 1 132 132 LYS C C 132 177.607 177.607 178.043 -0.436 18935 623 1 1 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.630 -0.678 18935 624 1 1 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.873 -0.448 18935 625 1 1 . 1 1 132 132 LYS H H 132 7.778 7.778 8.124 -0.346 18935 626 1 1 . 1 1 133 133 LYS N N 133 116.638 116.638 115.552 1.086 18935 627 1 1 . 1 1 133 133 LYS C C 133 174.681 174.681 175.591 -0.910 18935 628 1 1 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.389 -0.311 18935 629 1 1 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.709 -1.069 18935 630 1 1 . 1 1 133 133 LYS H H 133 7.617 7.617 7.751 -0.134 18935 631 1 1 . 1 1 134 134 ASN N N 134 110.792 110.792 116.436 -5.644 18935 632 1 1 . 1 1 134 134 ASN C C 134 174.034 174.034 173.201 0.833 18935 633 1 1 . 1 1 134 134 ASN CA C 134 54.615 54.615 53.889 0.726 18935 634 1 1 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.205 -1.153 18935 635 1 1 . 1 1 134 134 ASN H H 134 8.123 8.123 8.428 -0.305 18935 636 1 1 . 1 1 135 135 TYR N N 135 115.867 115.867 116.387 -0.520 18935 637 1 1 . 1 1 135 135 TYR C C 135 175.122 175.122 174.174 0.948 18935 638 1 1 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.753 -0.001 18935 639 1 1 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.228 -1.312 18935 640 1 1 . 1 1 135 135 TYR H H 135 8.133 8.133 7.678 0.455 18935 641 1 1 . 1 1 136 136 LYS N N 136 119.870 119.870 123.859 -3.989 18935 642 1 1 . 1 1 136 136 LYS C C 136 174.324 174.324 174.556 -0.232 18935 643 1 1 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.660 0.521 18935 644 1 1 . 1 1 136 136 LYS CB C 136 34.073 34.073 35.348 -1.275 18935 645 1 1 . 1 1 136 136 LYS H H 136 9.234 9.234 9.141 0.093 18935 646 1 1 . 1 1 137 137 LEU N N 137 129.708 129.708 129.268 0.440 18935 647 1 1 . 1 1 137 137 LEU C C 137 173.798 173.798 174.776 -0.978 18935 648 1 1 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.757 -1.923 18935 649 1 1 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.347 1.635 18935 650 1 1 . 1 1 137 137 LEU H H 137 8.959 8.959 8.893 0.066 18935 651 1 1 . 1 1 140 140 TYR N N 140 120.580 120.580 112.576 8.004 18935 652 1 1 . 1 1 140 140 TYR C C 140 174.705 174.705 176.200 -1.495 18935 653 1 1 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.394 -0.942 18935 654 1 1 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.808 -0.507 18935 655 1 1 . 1 1 140 140 TYR H H 140 8.962 8.962 7.025 1.937 18935 656 1 1 . 1 1 141 141 GLY N N 141 104.986 104.986 105.973 -0.987 18935 657 1 1 . 1 1 141 141 GLY C C 141 181.854 181.854 172.069 9.785 18935 658 1 1 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.687 -0.565 18935 659 1 1 . 1 1 141 141 GLY H H 141 7.555 7.555 7.448 0.107 18935 660 1 1 . 1 1 142 142 LEU N N 142 118.269 118.269 121.038 -2.769 18935 661 1 1 . 1 1 142 142 LEU C C 142 174.067 174.067 175.288 -1.221 18935 662 1 1 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.250 -0.748 18935 663 1 1 . 1 1 142 142 LEU CB C 142 44.542 44.542 44.187 0.355 18935 664 1 1 . 1 1 142 142 LEU H H 142 7.794 7.794 8.272 -0.478 18935 665 1 1 . 1 1 143 143 PHE N N 143 122.076 122.076 125.276 -3.200 18935 666 1 1 . 1 1 143 143 PHE C C 143 175.199 175.199 175.138 0.061 18935 667 1 1 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.264 -1.232 18935 668 1 1 . 1 1 143 143 PHE CB C 143 42.070 42.070 40.352 1.718 18935 669 1 1 . 1 1 143 143 PHE H H 143 9.522 9.522 9.688 -0.166 18935 670 1 1 . 1 1 144 144 LYS N N 144 121.305 121.305 125.366 -4.061 18935 671 1 1 . 1 1 144 144 LYS C C 144 176.917 176.917 176.217 0.700 18935 672 1 1 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.233 1.123 18935 673 1 1 . 1 1 144 144 LYS CB C 144 33.679 33.679 32.902 0.777 18935 674 1 1 . 1 1 144 144 LYS H H 144 9.076 9.076 9.049 0.027 18935 675 1 1 . 1 1 145 145 ASN N N 145 126.834 126.834 122.811 4.023 18935 676 1 1 . 1 1 145 145 ASN C C 145 175.070 175.070 175.530 -0.460 18935 677 1 1 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.460 0.304 18935 678 1 1 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.922 -1.492 18935 679 1 1 . 1 1 145 145 ASN H H 145 9.618 9.618 9.304 0.314 18935 680 1 1 . 1 1 146 146 GLN N N 146 110.112 110.112 109.646 0.466 18935 681 1 1 . 1 1 146 146 GLN C C 146 175.198 175.198 175.257 -0.059 18935 682 1 1 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.636 -0.740 18935 683 1 1 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.410 -1.042 18935 684 1 1 . 1 1 146 146 GLN H H 146 9.140 9.140 8.815 0.325 18935 685 1 1 . 1 1 147 147 THR N N 147 116.003 116.003 116.835 -0.832 18935 686 1 1 . 1 1 147 147 THR C C 147 173.224 173.224 173.559 -0.335 18935 687 1 1 . 1 1 147 147 THR CA C 147 61.450 61.450 62.386 -0.936 18935 688 1 1 . 1 1 147 147 THR CB C 147 70.285 70.285 69.450 0.835 18935 689 1 1 . 1 1 147 147 THR H H 147 8.069 8.069 7.655 0.414 18935 690 1 1 . 1 1 148 148 LEU N N 148 129.281 129.281 130.561 -1.280 18935 691 1 1 . 1 1 148 148 LEU C C 148 176.703 176.703 175.600 1.103 18935 692 1 1 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.242 0.224 18935 693 1 1 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.858 -1.133 18935 694 1 1 . 1 1 148 148 LEU H H 148 8.831 8.831 8.875 -0.044 18935 695 1 1 . 1 1 149 149 VAL N N 149 130.189 130.189 127.462 2.727 18935 696 1 1 . 1 1 149 149 VAL C C 149 175.012 175.012 174.021 0.991 18935 697 1 1 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.538 0.731 18935 698 1 1 . 1 1 149 149 VAL CB C 149 31.456 31.456 34.524 -3.068 18935 699 1 1 . 1 1 149 149 VAL H H 149 9.243 9.243 8.971 0.272 18935 700 1 1 . 1 1 151 151 LEU N N 151 123.481 123.481 115.718 7.763 18935 701 1 1 . 1 1 151 151 LEU C C 151 177.679 177.679 176.647 1.032 18935 702 1 1 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.090 0.907 18935 703 1 1 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.248 1.371 18935 704 1 1 . 1 1 151 151 LEU H H 151 8.080 8.080 8.107 -0.027 18935 705 1 1 . 1 1 152 152 LYS N N 152 126.381 126.381 121.221 5.160 18935 706 1 1 . 1 1 152 152 LYS C C 152 175.115 175.115 175.423 -0.308 18935 707 1 1 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.292 -1.696 18935 708 1 1 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.300 -3.235 18935 709 1 1 . 1 1 152 152 LYS H H 152 9.112 9.112 8.829 0.283 18935 710 1 1 . 1 1 153 153 ILE N N 153 113.737 113.737 116.380 -2.643 18935 711 1 1 . 1 1 153 153 ILE C C 153 175.748 175.748 173.795 1.953 18935 712 1 1 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.549 -1.160 18935 713 1 1 . 1 1 153 153 ILE CB C 153 41.803 41.803 41.032 0.771 18935 714 1 1 . 1 1 153 153 ILE H H 153 7.304 7.304 7.620 -0.316 18935 715 1 1 . 1 1 154 154 THR N N 154 110.656 110.656 113.872 -3.216 18935 716 1 1 . 1 1 154 154 THR C C 154 174.864 174.864 173.601 1.263 18935 717 1 1 . 1 1 154 154 THR CA C 154 62.141 62.141 61.481 0.660 18935 718 1 1 . 1 1 154 154 THR CB C 154 70.413 70.413 69.491 0.922 18935 719 1 1 . 1 1 154 154 THR H H 154 9.382 9.382 8.344 1.038 18935 720 1 1 . 1 1 155 155 THR N N 155 110.746 110.746 115.613 -4.867 18935 721 1 1 . 1 1 155 155 THR C C 155 174.718 174.718 175.062 -0.344 18935 722 1 1 . 1 1 155 155 THR CA C 155 58.785 58.785 60.299 -1.514 18935 723 1 1 . 1 1 155 155 THR CB C 155 72.277 72.277 71.540 0.737 18935 724 1 1 . 1 1 155 155 THR H H 155 7.746 7.746 7.606 0.140 18935 725 1 1 . 1 1 156 156 GLU N N 156 122.302 122.302 124.041 -1.739 18935 726 1 1 . 1 1 156 156 GLU C C 156 177.289 177.289 178.014 -0.725 18935 727 1 1 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.361 -1.536 18935 728 1 1 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.391 -1.010 18935 729 1 1 . 1 1 156 156 GLU H H 156 9.490 9.490 9.085 0.405 18935 730 1 1 . 1 1 157 157 LYS N N 157 118.905 118.905 116.454 2.451 18935 731 1 1 . 1 1 157 157 LYS C C 157 178.241 178.241 178.851 -0.610 18935 732 1 1 . 1 1 157 157 LYS CA C 157 59.765 59.765 57.942 1.823 18935 733 1 1 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.934 -0.656 18935 734 1 1 . 1 1 157 157 LYS H H 157 8.329 8.329 8.358 -0.029 18935 735 1 1 . 1 1 158 158 GLU N N 158 116.230 116.230 121.128 -4.898 18935 736 1 1 . 1 1 158 158 GLU C C 158 178.988 178.988 178.459 0.529 18935 737 1 1 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.809 -0.553 18935 738 1 1 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.351 -0.293 18935 739 1 1 . 1 1 158 158 GLU H H 158 7.611 7.611 7.351 0.260 18935 740 1 1 . 1 1 159 159 LEU N N 159 118.978 118.978 121.234 -2.256 18935 741 1 1 . 1 1 159 159 LEU C C 159 176.347 176.347 178.327 -1.980 18935 742 1 1 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.366 -5.127 18935 743 1 1 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.849 -2.306 18935 744 1 1 . 1 1 159 159 LEU H H 159 7.704 7.704 8.326 -0.622 18935 745 1 1 . 1 1 160 160 ILE N N 160 117.227 117.227 114.236 2.991 18935 746 1 1 . 1 1 160 160 ILE C C 160 177.219 177.219 177.186 0.033 18935 747 1 1 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.973 0.642 18935 748 1 1 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.128 0.429 18935 749 1 1 . 1 1 160 160 ILE H H 160 7.886 7.886 7.412 0.474 18935 750 1 1 . 1 1 161 161 LYS N N 161 115.912 115.912 119.513 -3.601 18935 751 1 1 . 1 1 161 161 LYS C C 161 180.990 180.990 178.827 2.163 18935 752 1 1 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.621 0.010 18935 753 1 1 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.065 -1.317 18935 754 1 1 . 1 1 161 161 LYS H H 161 7.536 7.536 7.497 0.039 18935 755 1 1 . 1 1 162 162 GLU N N 162 120.852 120.852 120.635 0.217 18935 756 1 1 . 1 1 162 162 GLU C C 162 178.793 178.793 177.983 0.810 18935 757 1 1 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.431 -0.449 18935 758 1 1 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.351 -1.559 18935 759 1 1 . 1 1 162 162 GLU H H 162 8.392 8.392 7.938 0.454 18935 760 1 1 . 1 1 163 163 LEU N N 163 115.912 115.912 116.308 -0.396 18935 761 1 1 . 1 1 163 163 LEU C C 163 176.370 176.370 176.743 -0.373 18935 762 1 1 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.431 -0.337 18935 763 1 1 . 1 1 163 163 LEU CB C 163 41.174 41.174 43.025 -1.851 18935 764 1 1 . 1 1 163 163 LEU H H 163 8.031 8.031 7.742 0.289 18935 765 1 1 . 1 1 164 164 GLY N N 164 103.160 103.160 104.942 -1.782 18935 766 1 1 . 1 1 164 164 GLY C C 164 174.240 174.240 173.958 0.282 18935 767 1 1 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.775 -0.473 18935 768 1 1 . 1 1 164 164 GLY H H 164 7.625 7.625 7.818 -0.193 18935 769 1 1 . 1 1 165 165 PHE N N 165 117.952 117.952 118.458 -0.506 18935 770 1 1 . 1 1 165 165 PHE C C 165 174.556 174.556 174.511 0.045 18935 771 1 1 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.284 -0.819 18935 772 1 1 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.938 -1.176 18935 773 1 1 . 1 1 165 165 PHE H H 165 7.283 7.283 7.982 -0.699 18935 774 1 1 . 1 1 166 166 THR N N 166 118.178 118.178 112.782 5.396 18935 775 1 1 . 1 1 166 166 THR C C 166 175.306 175.306 173.956 1.350 18935 776 1 1 . 1 1 166 166 THR CA C 166 63.466 63.466 60.883 2.583 18935 777 1 1 . 1 1 166 166 THR CB C 166 68.721 68.721 70.404 -1.683 18935 778 1 1 . 1 1 166 166 THR H H 166 9.678 9.678 8.684 0.994 18935 779 1 1 . 1 1 167 167 TYR N N 167 128.239 128.239 123.383 4.856 18935 780 1 1 . 1 1 167 167 TYR C C 167 173.297 173.297 175.657 -2.360 18935 781 1 1 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.695 0.717 18935 782 1 1 . 1 1 167 167 TYR CB C 167 36.722 36.722 38.923 -2.201 18935 783 1 1 . 1 1 167 167 TYR H H 167 9.264 9.264 8.542 0.722 18935 784 1 1 . 1 1 168 168 ARG N N 168 126.789 126.789 126.985 -0.196 18935 785 1 1 . 1 1 168 168 ARG C C 168 175.297 175.297 174.572 0.725 18935 786 1 1 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.386 -1.621 18935 787 1 1 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.895 -1.569 18935 788 1 1 . 1 1 168 168 ARG H H 168 7.030 7.030 8.133 -1.103 18935 789 1 1 . 1 1 169 169 ILE N N 169 119.221 119.221 116.435 2.786 18935 790 1 1 . 1 1 169 169 ILE C C 169 174.522 174.522 174.549 -0.027 18935 791 1 1 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.262 3.017 18935 792 1 1 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.526 -4.879 18935 793 1 1 . 1 1 169 169 ILE H H 169 8.349 8.349 8.216 0.133 18935 794 1 1 . 1 1 171 171 LYS N N 171 111.335 111.335 116.201 -4.866 18935 795 1 1 . 1 1 171 171 LYS C C 171 176.638 176.638 178.089 -1.451 18935 796 1 1 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.945 -1.407 18935 797 1 1 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.550 0.417 18935 798 1 1 . 1 1 171 171 LYS H H 171 8.198 8.198 8.545 -0.347 18935 799 1 1 . 1 1 172 172 LYS N N 172 116.411 116.411 116.192 0.219 18935 800 1 1 . 1 1 172 172 LYS C C 172 175.331 175.331 176.414 -1.083 18935 801 1 1 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.168 -1.167 18935 802 1 1 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.852 -2.034 18935 803 1 1 . 1 1 172 172 LYS H H 172 7.843 7.843 7.510 0.333 18935 804 1 1 . 1 1 173 173 ARG N N 173 120.490 120.490 118.876 1.614 18935 805 1 1 . 1 1 173 173 ARG C C 173 172.830 172.830 174.906 -2.076 18935 806 1 1 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.959 0.216 18935 807 1 1 . 1 1 173 173 ARG CB C 173 28.829 28.829 29.397 -0.568 18935 808 1 1 . 1 1 173 173 ARG H H 173 6.917 6.917 7.548 -0.631 18935 809 1 2 . 1 1 2 2 LEU N N 2 119.937 119.937 115.112 4.825 18935 810 1 2 . 1 1 2 2 LEU C C 2 175.307 175.307 174.890 0.417 18935 811 1 2 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.968 0.324 18935 812 1 2 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.943 -2.259 18935 813 1 2 . 1 1 2 2 LEU H H 2 9.251 9.251 7.823 1.428 18935 814 1 2 . 1 1 3 3 THR N N 3 111.335 111.335 109.382 1.953 18935 815 1 2 . 1 1 3 3 THR C C 3 175.854 175.854 175.628 0.226 18935 816 1 2 . 1 1 3 3 THR CA C 3 60.540 60.540 59.740 0.800 18935 817 1 2 . 1 1 3 3 THR CB C 3 70.782 70.782 70.646 0.136 18935 818 1 2 . 1 1 3 3 THR H H 3 8.677 8.677 8.158 0.519 18935 819 1 2 . 1 1 4 4 LEU N N 4 120.988 120.988 123.203 -2.215 18935 820 1 2 . 1 1 4 4 LEU C C 4 178.391 178.391 178.302 0.089 18935 821 1 2 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.792 0.272 18935 822 1 2 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.044 -2.783 18935 823 1 2 . 1 1 4 4 LEU H H 4 7.746 7.746 7.989 -0.243 18935 824 1 2 . 1 1 5 5 ILE N N 5 114.236 114.236 114.298 -0.062 18935 825 1 2 . 1 1 5 5 ILE C C 5 178.339 178.339 177.730 0.609 18935 826 1 2 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.466 -0.884 18935 827 1 2 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.189 -0.390 18935 828 1 2 . 1 1 5 5 ILE H H 5 7.821 7.821 7.814 0.007 18935 829 1 2 . 1 1 6 6 GLN N N 6 120.399 120.399 120.889 -0.490 18935 830 1 2 . 1 1 6 6 GLN C C 6 178.783 178.783 178.439 0.344 18935 831 1 2 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.897 -0.676 18935 832 1 2 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.075 0.040 18935 833 1 2 . 1 1 6 6 GLN H H 6 7.810 7.810 7.834 -0.024 18935 834 1 2 . 1 1 7 7 GLY N N 7 106.277 106.277 106.392 -0.115 18935 835 1 2 . 1 1 7 7 GLY C C 7 174.554 174.554 176.146 -1.592 18935 836 1 2 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.157 -0.223 18935 837 1 2 . 1 1 7 7 GLY H H 7 8.733 8.733 8.171 0.562 18935 838 1 2 . 1 1 8 8 LYS N N 8 119.991 119.991 121.834 -1.843 18935 839 1 2 . 1 1 8 8 LYS C C 8 179.433 179.433 178.153 1.280 18935 840 1 2 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.037 1.855 18935 841 1 2 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.106 -0.774 18935 842 1 2 . 1 1 8 8 LYS H H 8 8.688 8.688 7.490 1.198 18935 843 1 2 . 1 1 9 9 LYS N N 9 119.175 119.175 120.838 -1.663 18935 844 1 2 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.892 -0.510 18935 845 1 2 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.299 -0.864 18935 846 1 2 . 1 1 9 9 LYS H H 9 8.015 8.015 7.864 0.150 18935 847 1 2 . 1 1 10 10 ILE N N 10 120.308 120.308 115.961 4.347 18935 848 1 2 . 1 1 10 10 ILE C C 10 177.766 177.766 177.502 0.264 18935 849 1 2 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.777 -0.101 18935 850 1 2 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.724 -1.411 18935 851 1 2 . 1 1 10 10 ILE H H 10 7.967 7.967 8.257 -0.290 18935 852 1 2 . 1 1 11 11 VAL N N 11 119.130 119.130 120.442 -1.312 18935 853 1 2 . 1 1 11 11 VAL C C 11 176.606 176.606 178.577 -1.971 18935 854 1 2 . 1 1 11 11 VAL CA C 11 67.640 67.640 65.886 1.754 18935 855 1 2 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.480 -0.271 18935 856 1 2 . 1 1 11 11 VAL H H 11 8.128 8.128 7.830 0.298 18935 857 1 2 . 1 1 12 12 ASN N N 12 115.822 115.822 117.534 -1.712 18935 858 1 2 . 1 1 12 12 ASN C C 12 177.375 177.375 176.775 0.600 18935 859 1 2 . 1 1 12 12 ASN CA C 12 55.970 55.970 55.792 0.178 18935 860 1 2 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.829 -1.266 18935 861 1 2 . 1 1 12 12 ASN H H 12 8.203 8.203 8.011 0.192 18935 862 1 2 . 1 1 13 13 HIS N N 13 117.659 117.659 117.072 0.587 18935 863 1 2 . 1 1 13 13 HIS C C 13 177.287 177.287 176.349 0.938 18935 864 1 2 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.749 0.938 18935 865 1 2 . 1 1 13 13 HIS CB C 13 30.021 30.021 29.912 0.109 18935 866 1 2 . 1 1 13 13 HIS H H 13 7.861 7.861 8.002 -0.141 18935 867 1 2 . 1 1 14 14 LEU N N 14 115.595 115.595 119.490 -3.895 18935 868 1 2 . 1 1 14 14 LEU C C 14 179.092 179.092 177.862 1.230 18935 869 1 2 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.178 0.463 18935 870 1 2 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.529 -1.509 18935 871 1 2 . 1 1 14 14 LEU H H 14 8.376 8.376 8.344 0.032 18935 872 1 2 . 1 1 15 15 ARG N N 15 115.006 115.006 118.814 -3.808 18935 873 1 2 . 1 1 15 15 ARG C C 15 176.265 176.265 176.505 -0.240 18935 874 1 2 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.700 1.184 18935 875 1 2 . 1 1 15 15 ARG CB C 15 29.072 29.072 30.294 -1.222 18935 876 1 2 . 1 1 15 15 ARG H H 15 8.074 8.074 8.117 -0.043 18935 877 1 2 . 1 1 16 16 SER N N 16 107.778 107.778 109.263 -1.485 18935 878 1 2 . 1 1 16 16 SER C C 16 176.009 176.009 174.889 1.120 18935 879 1 2 . 1 1 16 16 SER CA C 16 57.244 57.244 58.865 -1.621 18935 880 1 2 . 1 1 16 16 SER CB C 16 63.525 63.525 63.417 0.108 18935 881 1 2 . 1 1 16 16 SER H H 16 7.136 7.136 8.018 -0.882 18935 882 1 2 . 1 1 17 17 ARG N N 17 121.532 121.532 120.820 0.712 18935 883 1 2 . 1 1 17 17 ARG C C 17 174.482 174.482 175.456 -0.974 18935 884 1 2 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.419 0.903 18935 885 1 2 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.705 0.125 18935 886 1 2 . 1 1 17 17 ARG H H 17 7.913 7.913 7.579 0.334 18935 887 1 2 . 1 1 18 18 LEU N N 18 121.305 121.305 120.328 0.977 18935 888 1 2 . 1 1 18 18 LEU C C 18 176.283 176.283 175.827 0.456 18935 889 1 2 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.523 -0.824 18935 890 1 2 . 1 1 18 18 LEU CB C 18 43.055 43.055 42.753 0.302 18935 891 1 2 . 1 1 18 18 LEU H H 18 8.812 8.812 7.824 0.988 18935 892 1 2 . 1 1 19 19 ALA N N 19 125.293 125.293 122.005 3.288 18935 893 1 2 . 1 1 19 19 ALA C C 19 173.780 173.780 175.201 -1.421 18935 894 1 2 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.861 -1.059 18935 895 1 2 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.940 0.913 18935 896 1 2 . 1 1 19 19 ALA H H 19 8.790 8.790 7.933 0.857 18935 897 1 2 . 1 1 20 20 PHE N N 20 113.117 113.117 114.013 -0.896 18935 898 1 2 . 1 1 20 20 PHE C C 20 172.708 172.708 173.001 -0.293 18935 899 1 2 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.789 -1.191 18935 900 1 2 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.026 -0.301 18935 901 1 2 . 1 1 20 20 PHE H H 20 8.925 8.925 8.325 0.600 18935 902 1 2 . 1 1 21 21 GLU N N 21 121.532 121.532 120.847 0.685 18935 903 1 2 . 1 1 21 21 GLU C C 21 174.830 174.830 174.621 0.209 18935 904 1 2 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.259 -0.296 18935 905 1 2 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.797 -2.454 18935 906 1 2 . 1 1 21 21 GLU H H 21 7.972 7.972 9.019 -1.047 18935 907 1 2 . 1 1 22 22 TYR N N 22 125.339 125.339 127.135 -1.796 18935 908 1 2 . 1 1 22 22 TYR C C 22 174.864 174.864 174.973 -0.109 18935 909 1 2 . 1 1 22 22 TYR CA C 22 55.288 55.288 56.839 -1.551 18935 910 1 2 . 1 1 22 22 TYR CB C 22 39.859 39.859 41.050 -1.191 18935 911 1 2 . 1 1 22 22 TYR H H 22 9.016 9.016 9.274 -0.258 18935 912 1 2 . 1 1 23 23 ASN N N 23 127.024 127.024 126.540 0.484 18935 913 1 2 . 1 1 23 23 ASN C C 23 175.410 175.410 175.173 0.237 18935 914 1 2 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.801 -0.747 18935 915 1 2 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.120 -0.859 18935 916 1 2 . 1 1 23 23 ASN H H 23 9.181 9.181 9.109 0.072 18935 917 1 2 . 1 1 24 24 GLY N N 24 102.755 102.755 102.511 0.244 18935 918 1 2 . 1 1 24 24 GLY C C 24 173.626 173.626 174.185 -0.559 18935 919 1 2 . 1 1 24 24 GLY CA C 24 44.935 44.935 44.991 -0.056 18935 920 1 2 . 1 1 24 24 GLY H H 24 8.666 8.666 8.154 0.512 18935 921 1 2 . 1 1 25 25 GLN N N 25 118.722 118.722 120.616 -1.894 18935 922 1 2 . 1 1 25 25 GLN C C 25 173.657 173.657 175.220 -1.563 18935 923 1 2 . 1 1 25 25 GLN CA C 25 53.233 53.233 55.680 -2.447 18935 924 1 2 . 1 1 25 25 GLN CB C 25 30.805 30.805 29.660 1.145 18935 925 1 2 . 1 1 25 25 GLN H H 25 7.708 7.708 8.036 -0.328 18935 926 1 2 . 1 1 26 26 LEU N N 26 123.526 123.526 124.132 -0.606 18935 927 1 2 . 1 1 26 26 LEU C C 26 175.842 175.842 176.675 -0.833 18935 928 1 2 . 1 1 26 26 LEU CA C 26 53.986 53.986 54.114 -0.128 18935 929 1 2 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.303 -2.497 18935 930 1 2 . 1 1 26 26 LEU H H 26 8.543 8.543 8.476 0.067 18935 931 1 2 . 1 1 27 27 ILE N N 27 129.462 129.462 124.274 5.188 18935 932 1 2 . 1 1 27 27 ILE C C 27 175.085 175.085 174.119 0.966 18935 933 1 2 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.977 -0.004 18935 934 1 2 . 1 1 27 27 ILE CB C 27 35.552 35.552 37.817 -2.265 18935 935 1 2 . 1 1 27 27 ILE H H 27 8.989 8.989 8.939 0.050 18935 936 1 2 . 1 1 28 28 LYS N N 28 125.157 125.157 126.275 -1.118 18935 937 1 2 . 1 1 28 28 LYS C C 28 176.725 176.725 175.545 1.180 18935 938 1 2 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.920 0.890 18935 939 1 2 . 1 1 28 28 LYS CB C 28 31.817 31.817 32.954 -1.137 18935 940 1 2 . 1 1 28 28 LYS H H 28 8.311 8.311 8.327 -0.016 18935 941 1 2 . 1 1 29 29 ILE N N 29 125.565 125.565 121.365 4.200 18935 942 1 2 . 1 1 29 29 ILE C C 29 175.685 175.685 174.913 0.772 18935 943 1 2 . 1 1 29 29 ILE CA C 29 60.405 60.405 60.056 0.348 18935 944 1 2 . 1 1 29 29 ILE CB C 29 37.031 37.031 39.447 -2.416 18935 945 1 2 . 1 1 29 29 ILE H H 29 8.209 8.209 7.923 0.286 18935 946 1 2 . 1 1 30 30 LEU N N 30 127.831 127.831 120.440 7.391 18935 947 1 2 . 1 1 30 30 LEU C C 30 178.794 178.794 177.851 0.943 18935 948 1 2 . 1 1 30 30 LEU CA C 30 54.443 54.443 52.992 1.451 18935 949 1 2 . 1 1 30 30 LEU CB C 30 40.836 40.836 46.197 -5.361 18935 950 1 2 . 1 1 30 30 LEU H H 30 9.027 9.027 8.307 0.720 18935 951 1 2 . 1 1 31 31 SER N N 31 116.864 116.864 118.922 -2.058 18935 952 1 2 . 1 1 31 31 SER C C 31 177.464 177.464 176.790 0.674 18935 953 1 2 . 1 1 31 31 SER CA C 31 61.180 61.180 62.533 -1.353 18935 954 1 2 . 1 1 31 31 SER CB C 31 62.105 62.105 62.992 -0.887 18935 955 1 2 . 1 1 31 31 SER H H 31 8.887 8.887 9.043 -0.156 18935 956 1 2 . 1 1 32 32 LYS N N 32 114.825 114.825 120.405 -5.580 18935 957 1 2 . 1 1 32 32 LYS C C 32 176.243 176.243 177.155 -0.912 18935 958 1 2 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.365 -1.073 18935 959 1 2 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.170 -1.904 18935 960 1 2 . 1 1 32 32 LYS H H 32 8.290 8.290 8.429 -0.139 18935 961 1 2 . 1 1 33 33 ASN N N 33 117.564 117.564 114.674 2.890 18935 962 1 2 . 1 1 33 33 ASN C C 33 172.253 172.253 173.889 -1.636 18935 963 1 2 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.060 -0.969 18935 964 1 2 . 1 1 33 33 ASN CB C 33 38.339 38.339 40.147 -1.808 18935 965 1 2 . 1 1 33 33 ASN H H 33 8.051 8.051 7.910 0.141 18935 966 1 2 . 1 1 34 34 ILE N N 34 118.949 118.949 120.583 -1.634 18935 967 1 2 . 1 1 34 34 ILE C C 34 175.343 175.343 174.845 0.498 18935 968 1 2 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.305 0.248 18935 969 1 2 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.463 -2.596 18935 970 1 2 . 1 1 34 34 ILE H H 34 7.670 7.670 7.878 -0.208 18935 971 1 2 . 1 1 35 35 VAL N N 35 128.355 128.355 126.402 1.953 18935 972 1 2 . 1 1 35 35 VAL C C 35 175.543 175.543 174.533 1.010 18935 973 1 2 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.128 -0.114 18935 974 1 2 . 1 1 35 35 VAL CB C 35 34.231 34.231 36.219 -1.988 18935 975 1 2 . 1 1 35 35 VAL H H 35 9.698 9.698 9.200 0.498 18935 976 1 2 . 1 1 36 36 ALA N N 36 129.553 129.553 131.259 -1.706 18935 977 1 2 . 1 1 36 36 ALA C C 36 177.015 177.015 177.026 -0.011 18935 978 1 2 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.522 0.874 18935 979 1 2 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.227 -0.605 18935 980 1 2 . 1 1 36 36 ALA H H 36 8.917 8.917 8.474 0.443 18935 981 1 2 . 1 1 37 37 VAL N N 37 115.006 115.006 121.478 -6.472 18935 982 1 2 . 1 1 37 37 VAL C C 37 174.649 174.649 176.080 -1.431 18935 983 1 2 . 1 1 37 37 VAL CA C 37 59.321 59.321 60.263 -0.942 18935 984 1 2 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.585 -1.199 18935 985 1 2 . 1 1 37 37 VAL H H 37 8.214 8.214 7.448 0.766 18935 986 1 2 . 1 1 38 38 GLY N N 38 109.387 109.387 108.809 0.578 18935 987 1 2 . 1 1 38 38 GLY C C 38 174.152 174.152 176.537 -2.385 18935 988 1 2 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.515 -0.018 18935 989 1 2 . 1 1 38 38 GLY H H 38 8.677 8.677 8.333 0.344 18935 990 1 2 . 1 1 39 39 SER N N 39 116.776 116.776 119.695 -2.919 18935 991 1 2 . 1 1 39 39 SER C C 39 175.129 175.129 176.708 -1.579 18935 992 1 2 . 1 1 39 39 SER CA C 39 60.036 60.036 61.967 -1.931 18935 993 1 2 . 1 1 39 39 SER CB C 39 61.522 61.522 63.040 -1.518 18935 994 1 2 . 1 1 39 39 SER H H 39 9.705 9.705 8.635 1.070 18935 995 1 2 . 1 1 40 40 LEU N N 40 113.696 113.696 119.802 -6.106 18935 996 1 2 . 1 1 40 40 LEU C C 40 180.558 180.558 178.686 1.872 18935 997 1 2 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.387 0.986 18935 998 1 2 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.121 0.756 18935 999 1 2 . 1 1 40 40 LEU H H 40 7.311 7.311 7.918 -0.607 18935 1000 1 2 . 1 1 41 41 ARG N N 41 121.162 121.162 117.622 3.540 18935 1001 1 2 . 1 1 41 41 ARG C C 41 176.964 176.964 177.624 -0.660 18935 1002 1 2 . 1 1 41 41 ARG CA C 41 58.451 58.451 57.503 0.948 18935 1003 1 2 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.684 -2.479 18935 1004 1 2 . 1 1 41 41 ARG H H 41 6.999 6.999 7.876 -0.877 18935 1005 1 2 . 1 1 42 42 ARG N N 42 111.109 111.109 117.513 -6.404 18935 1006 1 2 . 1 1 42 42 ARG C C 42 172.564 172.564 175.890 -3.326 18935 1007 1 2 . 1 1 42 42 ARG CA C 42 56.380 56.380 56.796 -0.416 18935 1008 1 2 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.713 -2.364 18935 1009 1 2 . 1 1 42 42 ARG H H 42 7.041 7.041 7.500 -0.459 18935 1010 1 2 . 1 1 43 43 GLU N N 43 111.924 111.924 115.294 -3.370 18935 1011 1 2 . 1 1 43 43 GLU C C 43 176.202 176.202 174.922 1.280 18935 1012 1 2 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.314 -0.860 18935 1013 1 2 . 1 1 43 43 GLU CB C 43 25.301 25.301 26.944 -1.643 18935 1014 1 2 . 1 1 43 43 GLU H H 43 7.757 7.757 7.984 -0.227 18935 1015 1 2 . 1 1 44 44 GLU N N 44 117.861 117.861 119.288 -1.427 18935 1016 1 2 . 1 1 44 44 GLU C C 44 175.197 175.197 176.142 -0.945 18935 1017 1 2 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.225 -0.097 18935 1018 1 2 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.336 -1.777 18935 1019 1 2 . 1 1 44 44 GLU H H 44 7.461 7.461 7.786 -0.325 18935 1020 1 2 . 1 1 45 45 LYS N N 45 115.051 115.051 123.370 -8.319 18935 1021 1 2 . 1 1 45 45 LYS C C 45 177.733 177.733 176.069 1.664 18935 1022 1 2 . 1 1 45 45 LYS CA C 45 59.055 59.055 58.319 0.736 18935 1023 1 2 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.226 -1.199 18935 1024 1 2 . 1 1 45 45 LYS H H 45 8.123 8.123 8.717 -0.594 18935 1025 1 2 . 1 1 46 46 MET N N 46 114.009 114.009 117.363 -3.354 18935 1026 1 2 . 1 1 46 46 MET C C 46 174.067 174.067 174.727 -0.660 18935 1027 1 2 . 1 1 46 46 MET CA C 46 52.477 52.477 54.530 -2.053 18935 1028 1 2 . 1 1 46 46 MET CB C 46 33.974 33.974 34.151 -0.177 18935 1029 1 2 . 1 1 46 46 MET H H 46 7.767 7.767 7.397 0.370 18935 1030 1 2 . 1 1 47 47 LEU N N 47 120.263 120.263 120.876 -0.613 18935 1031 1 2 . 1 1 47 47 LEU C C 47 177.669 177.669 175.495 2.174 18935 1032 1 2 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.447 -1.246 18935 1033 1 2 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.053 -0.145 18935 1034 1 2 . 1 1 47 47 LEU H H 47 9.481 9.481 8.588 0.893 18935 1035 1 2 . 1 1 48 48 ASN N N 48 118.632 118.632 117.593 1.039 18935 1036 1 2 . 1 1 48 48 ASN C C 48 174.715 174.715 174.089 0.626 18935 1037 1 2 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.680 1.821 18935 1038 1 2 . 1 1 48 48 ASN CB C 48 38.828 38.828 41.285 -2.457 18935 1039 1 2 . 1 1 48 48 ASN H H 48 9.388 9.388 8.977 0.411 18935 1040 1 2 . 1 1 49 49 ASP N N 49 115.867 115.867 117.137 -1.270 18935 1041 1 2 . 1 1 49 49 ASP C C 49 174.111 174.111 174.846 -0.735 18935 1042 1 2 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.446 -1.245 18935 1043 1 2 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.867 -3.790 18935 1044 1 2 . 1 1 49 49 ASP H H 49 7.670 7.670 7.924 -0.254 18935 1045 1 2 . 1 1 50 50 VAL N N 50 119.185 119.185 119.316 -0.131 18935 1046 1 2 . 1 1 50 50 VAL C C 50 172.333 172.333 174.736 -2.403 18935 1047 1 2 . 1 1 50 50 VAL CA C 50 61.915 61.915 60.849 1.065 18935 1048 1 2 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.039 -0.074 18935 1049 1 2 . 1 1 50 50 VAL H H 50 8.339 8.339 7.876 0.463 18935 1050 1 2 . 1 1 51 51 ASP N N 51 124.704 124.704 127.056 -2.352 18935 1051 1 2 . 1 1 51 51 ASP C C 51 173.725 173.725 175.441 -1.716 18935 1052 1 2 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.456 -0.428 18935 1053 1 2 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.030 0.799 18935 1054 1 2 . 1 1 51 51 ASP H H 51 8.984 8.984 8.360 0.624 18935 1055 1 2 . 1 1 52 52 LEU N N 52 120.943 120.943 120.533 0.410 18935 1056 1 2 . 1 1 52 52 LEU C C 52 173.045 173.045 174.329 -1.284 18935 1057 1 2 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.169 -1.298 18935 1058 1 2 . 1 1 52 52 LEU CB C 52 44.253 44.253 45.474 -1.220 18935 1059 1 2 . 1 1 52 52 LEU H H 52 9.081 9.081 7.778 1.303 18935 1060 1 2 . 1 1 53 53 LEU N N 53 123.027 123.027 125.248 -2.221 18935 1061 1 2 . 1 1 53 53 LEU C C 53 173.750 173.750 175.173 -1.423 18935 1062 1 2 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.567 -1.234 18935 1063 1 2 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.511 -0.503 18935 1064 1 2 . 1 1 53 53 LEU H H 53 9.146 9.146 9.137 0.009 18935 1065 1 2 . 1 1 54 54 ILE N N 54 126.562 126.562 124.547 2.015 18935 1066 1 2 . 1 1 54 54 ILE C C 54 175.132 175.132 175.408 -0.276 18935 1067 1 2 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.783 -1.185 18935 1068 1 2 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.767 -1.206 18935 1069 1 2 . 1 1 54 54 ILE H H 54 9.440 9.440 9.249 0.191 18935 1070 1 2 . 1 1 55 55 ILE N N 55 126.879 126.879 128.317 -1.438 18935 1071 1 2 . 1 1 55 55 ILE C C 55 175.655 175.655 175.516 0.139 18935 1072 1 2 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.391 -2.830 18935 1073 1 2 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.332 -5.026 18935 1074 1 2 . 1 1 55 55 ILE H H 55 9.381 9.381 8.334 1.047 18935 1075 1 2 . 1 1 56 56 VAL N N 56 128.936 128.936 124.554 4.382 18935 1076 1 2 . 1 1 56 56 VAL C C 56 176.389 176.389 174.339 2.050 18935 1077 1 2 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.411 0.219 18935 1078 1 2 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.976 -1.192 18935 1079 1 2 . 1 1 56 56 VAL H H 56 9.227 9.227 8.789 0.438 18935 1080 1 2 . 1 1 58 58 GLU N N 58 112.423 112.423 118.849 -6.426 18935 1081 1 2 . 1 1 58 58 GLU C C 58 175.946 175.946 176.729 -0.783 18935 1082 1 2 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.863 -1.563 18935 1083 1 2 . 1 1 58 58 GLU CB C 58 32.097 32.097 30.952 1.145 18935 1084 1 2 . 1 1 58 58 GLU H H 58 6.685 6.685 8.386 -1.701 18935 1085 1 2 . 1 1 59 59 LYS N N 59 125.293 125.293 121.900 3.393 18935 1086 1 2 . 1 1 59 59 LYS C C 59 179.248 179.248 175.756 3.492 18935 1087 1 2 . 1 1 59 59 LYS CA C 59 59.774 59.774 56.487 3.287 18935 1088 1 2 . 1 1 59 59 LYS CB C 59 31.077 31.077 31.178 -0.102 18935 1089 1 2 . 1 1 59 59 LYS H H 59 9.108 9.108 8.565 0.543 18935 1090 1 2 . 1 1 60 60 LYS N N 60 117.408 117.408 117.528 -0.120 18935 1091 1 2 . 1 1 60 60 LYS C C 60 177.198 177.198 176.298 0.900 18935 1092 1 2 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.568 1.645 18935 1093 1 2 . 1 1 60 60 LYS CB C 60 30.583 30.583 33.109 -2.526 18935 1094 1 2 . 1 1 60 60 LYS H H 60 9.102 9.102 7.029 2.073 18935 1095 1 2 . 1 1 61 61 LEU N N 61 114.779 114.779 120.042 -5.263 18935 1096 1 2 . 1 1 61 61 LEU C C 61 178.790 178.790 178.820 -0.030 18935 1097 1 2 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.759 -2.735 18935 1098 1 2 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.135 -0.271 18935 1099 1 2 . 1 1 61 61 LEU H H 61 7.455 7.455 7.726 -0.271 18935 1100 1 2 . 1 1 62 62 LEU N N 62 119.629 119.629 118.571 1.058 18935 1101 1 2 . 1 1 62 62 LEU C C 62 177.762 177.762 178.602 -0.840 18935 1102 1 2 . 1 1 62 62 LEU CA C 62 58.198 58.198 58.093 0.105 18935 1103 1 2 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.824 -1.093 18935 1104 1 2 . 1 1 62 62 LEU H H 62 7.714 7.714 7.404 0.310 18935 1105 1 2 . 1 1 63 63 LYS N N 63 112.921 112.921 115.943 -3.022 18935 1106 1 2 . 1 1 63 63 LYS C C 63 175.386 175.386 177.705 -2.319 18935 1107 1 2 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.839 -0.483 18935 1108 1 2 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.278 -1.315 18935 1109 1 2 . 1 1 63 63 LYS H H 63 7.751 7.751 8.023 -0.272 18935 1110 1 2 . 1 1 64 64 HIS N N 64 112.468 112.468 117.323 -4.855 18935 1111 1 2 . 1 1 64 64 HIS C C 64 176.081 176.081 176.642 -0.561 18935 1112 1 2 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.667 -1.898 18935 1113 1 2 . 1 1 64 64 HIS CB C 64 32.370 32.370 30.785 1.585 18935 1114 1 2 . 1 1 64 64 HIS H H 64 7.697 7.697 7.776 -0.079 18935 1115 1 2 . 1 1 65 65 VAL N N 65 117.499 117.499 115.752 1.747 18935 1116 1 2 . 1 1 65 65 VAL C C 65 174.301 174.301 176.293 -1.992 18935 1117 1 2 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.575 2.755 18935 1118 1 2 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.444 -2.084 18935 1119 1 2 . 1 1 65 65 VAL H H 65 6.917 6.917 7.012 -0.095 18935 1120 1 2 . 1 1 66 66 LEU N N 66 113.873 113.873 119.731 -5.858 18935 1121 1 2 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.636 0.213 18935 1122 1 2 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.706 -3.647 18935 1123 1 2 . 1 1 66 66 LEU H H 66 9.102 9.102 7.827 1.275 18935 1124 1 2 . 1 1 68 68 ASN N N 68 110.792 110.792 116.683 -5.891 18935 1125 1 2 . 1 1 68 68 ASN C C 68 174.877 174.877 173.148 1.729 18935 1126 1 2 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.721 -1.907 18935 1127 1 2 . 1 1 68 68 ASN CB C 68 40.311 40.311 40.899 -0.588 18935 1128 1 2 . 1 1 68 68 ASN H H 68 7.234 7.234 8.249 -1.015 18935 1129 1 2 . 1 1 69 69 ILE N N 69 122.348 122.348 124.872 -2.524 18935 1130 1 2 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.397 -0.485 18935 1131 1 2 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.557 -2.519 18935 1132 1 2 . 1 1 69 69 ILE H H 69 7.428 7.428 8.566 -1.138 18935 1133 1 2 . 1 1 70 70 ARG N N 70 125.701 125.701 126.938 -1.237 18935 1134 1 2 . 1 1 70 70 ARG C C 70 174.596 174.596 173.387 1.209 18935 1135 1 2 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.944 -1.782 18935 1136 1 2 . 1 1 70 70 ARG CB C 70 32.453 32.453 32.635 -0.182 18935 1137 1 2 . 1 1 70 70 ARG H H 70 9.083 9.083 8.966 0.117 18935 1138 1 2 . 1 1 71 71 ILE N N 71 118.496 118.496 121.214 -2.718 18935 1139 1 2 . 1 1 71 71 ILE C C 71 175.625 175.625 174.873 0.752 18935 1140 1 2 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.593 0.183 18935 1141 1 2 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.879 -2.912 18935 1142 1 2 . 1 1 71 71 ILE H H 71 7.864 7.864 8.416 -0.552 18935 1143 1 2 . 1 1 72 72 LYS N N 72 127.423 127.423 130.182 -2.759 18935 1144 1 2 . 1 1 72 72 LYS C C 72 177.659 177.659 177.203 0.456 18935 1145 1 2 . 1 1 72 72 LYS CA C 72 57.428 57.428 57.774 -0.346 18935 1146 1 2 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.240 -0.866 18935 1147 1 2 . 1 1 72 72 LYS H H 72 8.720 8.720 9.031 -0.311 18935 1148 1 2 . 1 1 73 73 GLY N N 73 112.604 112.604 111.406 1.198 18935 1149 1 2 . 1 1 73 73 GLY C C 73 173.729 173.729 173.680 0.049 18935 1150 1 2 . 1 1 73 73 GLY CA C 73 45.831 45.831 44.828 1.002 18935 1151 1 2 . 1 1 73 73 GLY H H 73 8.930 8.930 8.834 0.096 18935 1152 1 2 . 1 1 74 74 LEU N N 74 119.538 119.538 121.095 -1.557 18935 1153 1 2 . 1 1 74 74 LEU C C 74 175.802 175.802 175.207 0.595 18935 1154 1 2 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.639 0.021 18935 1155 1 2 . 1 1 74 74 LEU CB C 74 44.053 44.053 45.173 -1.120 18935 1156 1 2 . 1 1 74 74 LEU H H 74 7.547 7.547 7.460 0.087 18935 1157 1 2 . 1 1 75 75 SER N N 75 118.994 118.994 119.070 -0.076 18935 1158 1 2 . 1 1 75 75 SER C C 75 173.111 173.111 173.080 0.031 18935 1159 1 2 . 1 1 75 75 SER CA C 75 57.696 57.696 58.087 -0.391 18935 1160 1 2 . 1 1 75 75 SER CB C 75 63.073 63.073 62.820 0.253 18935 1161 1 2 . 1 1 75 75 SER H H 75 9.076 9.076 8.899 0.177 18935 1162 1 2 . 1 1 76 76 PHE N N 76 117.802 117.802 121.264 -3.462 18935 1163 1 2 . 1 1 76 76 PHE C C 76 173.564 173.564 174.696 -1.132 18935 1164 1 2 . 1 1 76 76 PHE CA C 76 55.409 55.409 55.851 -0.442 18935 1165 1 2 . 1 1 76 76 PHE CB C 76 41.843 41.843 41.851 -0.008 18935 1166 1 2 . 1 1 76 76 PHE H H 76 8.119 8.119 7.685 0.434 18935 1167 1 2 . 1 1 77 77 SER N N 77 113.918 113.918 117.712 -3.794 18935 1168 1 2 . 1 1 77 77 SER C C 77 173.194 173.194 173.086 0.108 18935 1169 1 2 . 1 1 77 77 SER CA C 77 55.999 55.999 57.663 -1.664 18935 1170 1 2 . 1 1 77 77 SER CB C 77 65.218 65.218 65.586 -0.368 18935 1171 1 2 . 1 1 77 77 SER H H 77 8.989 8.989 8.751 0.238 18935 1172 1 2 . 1 1 78 78 VAL N N 78 123.662 123.662 126.098 -2.436 18935 1173 1 2 . 1 1 78 78 VAL C C 78 176.057 176.057 175.749 0.308 18935 1174 1 2 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.412 -0.321 18935 1175 1 2 . 1 1 78 78 VAL CB C 78 32.294 32.294 32.418 -0.124 18935 1176 1 2 . 1 1 78 78 VAL H H 78 8.995 8.995 8.842 0.153 18935 1177 1 2 . 1 1 79 79 LYS N N 79 129.417 129.417 129.088 0.329 18935 1178 1 2 . 1 1 79 79 LYS C C 79 176.436 176.436 174.567 1.869 18935 1179 1 2 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.617 3.035 18935 1180 1 2 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.435 -3.962 18935 1181 1 2 . 1 1 79 79 LYS H H 79 9.425 9.425 8.696 0.729 18935 1182 1 2 . 1 1 80 80 VAL N N 80 108.616 108.616 121.658 -13.042 18935 1183 1 2 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.642 -2.545 18935 1184 1 2 . 1 1 80 80 VAL CB C 80 34.082 34.082 34.113 -0.031 18935 1185 1 2 . 1 1 80 80 VAL H H 80 7.380 7.380 8.447 -1.067 18935 1186 1 2 . 1 1 81 81 CYS N N 81 123.254 123.254 129.581 -6.327 18935 1187 1 2 . 1 1 81 81 CYS C C 81 172.053 172.053 173.701 -1.648 18935 1188 1 2 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.669 2.070 18935 1189 1 2 . 1 1 81 81 CYS CB C 81 27.332 27.332 27.742 -0.410 18935 1190 1 2 . 1 1 81 81 CYS H H 81 9.759 9.759 8.603 1.156 18935 1191 1 2 . 1 1 82 82 GLY N N 82 118.450 118.450 113.459 4.991 18935 1192 1 2 . 1 1 82 82 GLY C C 82 171.814 171.814 174.655 -2.841 18935 1193 1 2 . 1 1 82 82 GLY CA C 82 44.353 44.353 45.082 -0.729 18935 1194 1 2 . 1 1 82 82 GLY H H 82 8.537 8.537 7.773 0.764 18935 1195 1 2 . 1 1 83 83 GLU N N 83 113.964 113.964 120.324 -6.360 18935 1196 1 2 . 1 1 83 83 GLU C C 83 179.320 179.320 176.681 2.639 18935 1197 1 2 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.314 0.361 18935 1198 1 2 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.403 0.504 18935 1199 1 2 . 1 1 83 83 GLU H H 83 8.473 8.473 8.710 -0.237 18935 1200 1 2 . 1 1 84 84 ARG N N 84 117.544 117.544 116.368 1.176 18935 1201 1 2 . 1 1 84 84 ARG C C 84 177.252 177.252 175.900 1.352 18935 1202 1 2 . 1 1 84 84 ARG CA C 84 54.504 54.504 54.865 -0.361 18935 1203 1 2 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.378 0.168 18935 1204 1 2 . 1 1 84 84 ARG H H 84 9.760 9.760 8.334 1.426 18935 1205 1 2 . 1 1 85 85 LYS N N 85 124.160 124.160 118.243 5.917 18935 1206 1 2 . 1 1 85 85 LYS C C 85 173.379 173.379 174.897 -1.518 18935 1207 1 2 . 1 1 85 85 LYS CA C 85 55.232 55.232 55.702 -0.470 18935 1208 1 2 . 1 1 85 85 LYS CB C 85 34.212 34.212 37.298 -3.086 18935 1209 1 2 . 1 1 85 85 LYS H H 85 8.494 8.494 7.571 0.923 18935 1210 1 2 . 1 1 86 86 CYS N N 86 126.472 126.472 119.048 7.424 18935 1211 1 2 . 1 1 86 86 CYS C C 86 171.935 171.935 172.842 -0.907 18935 1212 1 2 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.201 -1.323 18935 1213 1 2 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.586 -0.282 18935 1214 1 2 . 1 1 86 86 CYS H H 86 9.221 9.221 9.048 0.173 18935 1215 1 2 . 1 1 87 87 VAL N N 87 126.426 126.426 123.304 3.122 18935 1216 1 2 . 1 1 87 87 VAL C C 87 173.760 173.760 174.090 -0.330 18935 1217 1 2 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.680 -0.347 18935 1218 1 2 . 1 1 87 87 VAL CB C 87 33.338 33.338 33.062 0.276 18935 1219 1 2 . 1 1 87 87 VAL H H 87 8.623 8.623 8.763 -0.140 18935 1220 1 2 . 1 1 88 88 LEU N N 88 125.701 125.701 126.735 -1.034 18935 1221 1 2 . 1 1 88 88 LEU C C 88 175.424 175.424 175.083 0.341 18935 1222 1 2 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.378 -1.293 18935 1223 1 2 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.673 -2.129 18935 1224 1 2 . 1 1 88 88 LEU H H 88 9.592 9.592 8.953 0.639 18935 1225 1 2 . 1 1 89 89 PHE N N 89 118.314 118.314 122.500 -4.186 18935 1226 1 2 . 1 1 89 89 PHE C C 89 177.068 177.068 175.855 1.213 18935 1227 1 2 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.377 -0.502 18935 1228 1 2 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.059 -0.222 18935 1229 1 2 . 1 1 89 89 PHE H H 89 8.979 8.979 8.435 0.544 18935 1230 1 2 . 1 1 90 90 ILE N N 90 119.039 119.039 118.629 0.410 18935 1231 1 2 . 1 1 90 90 ILE C C 90 173.692 173.692 174.693 -1.001 18935 1232 1 2 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.933 -1.261 18935 1233 1 2 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.994 0.189 18935 1234 1 2 . 1 1 90 90 ILE H H 90 9.447 9.447 8.424 1.023 18935 1235 1 2 . 1 1 91 91 GLU N N 91 122.801 122.801 125.042 -2.241 18935 1236 1 2 . 1 1 91 91 GLU C C 91 175.565 175.565 174.581 0.984 18935 1237 1 2 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.047 -0.582 18935 1238 1 2 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.370 -3.708 18935 1239 1 2 . 1 1 91 91 GLU H H 91 8.360 8.360 8.760 -0.400 18935 1240 1 2 . 1 1 92 92 TRP N N 92 126.018 126.018 123.556 2.462 18935 1241 1 2 . 1 1 92 92 TRP C C 92 175.070 175.070 174.921 0.149 18935 1242 1 2 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.804 -0.614 18935 1243 1 2 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.379 -0.797 18935 1244 1 2 . 1 1 92 92 TRP H H 92 9.425 9.425 8.516 0.909 18935 1245 1 2 . 1 1 93 93 GLU N N 93 126.381 126.381 119.538 6.843 18935 1246 1 2 . 1 1 93 93 GLU C C 93 175.637 175.637 175.593 0.044 18935 1247 1 2 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.546 -0.777 18935 1248 1 2 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.445 -2.501 18935 1249 1 2 . 1 1 93 93 GLU H H 93 8.914 8.914 8.958 -0.044 18935 1250 1 2 . 1 1 94 94 LYS N N 94 107.891 107.891 111.283 -3.392 18935 1251 1 2 . 1 1 94 94 LYS C C 94 175.359 175.359 175.885 -0.526 18935 1252 1 2 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.053 0.376 18935 1253 1 2 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.416 -1.774 18935 1254 1 2 . 1 1 94 94 LYS H H 94 8.634 8.634 8.545 0.089 18935 1255 1 2 . 1 1 95 95 LYS N N 95 120.490 120.490 117.856 2.634 18935 1256 1 2 . 1 1 95 95 LYS C C 95 174.369 174.369 173.828 0.541 18935 1257 1 2 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.417 -0.064 18935 1258 1 2 . 1 1 95 95 LYS CB C 95 34.463 34.463 36.063 -1.600 18935 1259 1 2 . 1 1 95 95 LYS H H 95 7.924 7.924 7.676 0.248 18935 1260 1 2 . 1 1 96 96 THR N N 96 115.278 115.278 112.036 3.242 18935 1261 1 2 . 1 1 96 96 THR C C 96 174.317 174.317 173.269 1.048 18935 1262 1 2 . 1 1 96 96 THR CA C 96 61.203 61.203 60.459 0.744 18935 1263 1 2 . 1 1 96 96 THR CB C 96 69.348 69.348 69.978 -0.630 18935 1264 1 2 . 1 1 96 96 THR H H 96 7.967 7.967 7.708 0.259 18935 1265 1 2 . 1 1 97 97 TYR N N 97 123.254 123.254 124.934 -1.680 18935 1266 1 2 . 1 1 97 97 TYR C C 97 173.320 173.320 174.726 -1.406 18935 1267 1 2 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.067 -0.183 18935 1268 1 2 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.748 -0.612 18935 1269 1 2 . 1 1 97 97 TYR H H 97 9.232 9.232 9.028 0.204 18935 1270 1 2 . 1 1 98 98 GLN N N 98 122.574 122.574 119.062 3.512 18935 1271 1 2 . 1 1 98 98 GLN C C 98 172.781 172.781 174.802 -2.021 18935 1272 1 2 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.427 -0.256 18935 1273 1 2 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.187 -1.788 18935 1274 1 2 . 1 1 98 98 GLN H H 98 9.000 9.000 8.943 0.057 18935 1275 1 2 . 1 1 99 99 LEU N N 99 130.218 130.218 126.281 3.937 18935 1276 1 2 . 1 1 99 99 LEU C C 99 172.806 172.806 174.486 -1.680 18935 1277 1 2 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.499 -1.450 18935 1278 1 2 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.056 -0.304 18935 1279 1 2 . 1 1 99 99 LEU H H 99 9.246 9.246 9.056 0.190 18935 1280 1 2 . 1 1 100 100 ASP N N 100 124.931 124.931 127.507 -2.576 18935 1281 1 2 . 1 1 100 100 ASP C C 100 172.626 172.626 174.339 -1.713 18935 1282 1 2 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.537 -3.107 18935 1283 1 2 . 1 1 100 100 ASP CB C 100 37.328 37.328 42.963 -5.635 18935 1284 1 2 . 1 1 100 100 ASP H H 100 9.253 9.253 8.285 0.968 18935 1285 1 2 . 1 1 101 101 LEU N N 101 119.402 119.402 120.256 -0.854 18935 1286 1 2 . 1 1 101 101 LEU C C 101 173.869 173.869 174.649 -0.780 18935 1287 1 2 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.843 -1.188 18935 1288 1 2 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.414 0.752 18935 1289 1 2 . 1 1 101 101 LEU H H 101 8.726 8.726 7.852 0.874 18935 1290 1 2 . 1 1 102 102 PHE N N 102 117.952 117.952 120.816 -2.864 18935 1291 1 2 . 1 1 102 102 PHE C C 102 175.853 175.853 175.584 0.269 18935 1292 1 2 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.108 -1.826 18935 1293 1 2 . 1 1 102 102 PHE CB C 102 41.824 41.824 41.073 0.751 18935 1294 1 2 . 1 1 102 102 PHE H H 102 8.236 8.236 8.741 -0.505 18935 1295 1 2 . 1 1 103 103 THR N N 103 106.853 106.853 118.539 -11.686 18935 1296 1 2 . 1 1 103 103 THR C C 103 175.154 175.154 173.625 1.529 18935 1297 1 2 . 1 1 103 103 THR CA C 103 57.685 57.685 60.626 -2.941 18935 1298 1 2 . 1 1 103 103 THR CB C 103 71.037 71.037 69.042 1.995 18935 1299 1 2 . 1 1 103 103 THR H H 103 7.917 7.917 8.271 -0.354 18935 1300 1 2 . 1 1 104 104 ALA N N 104 122.348 122.348 128.608 -6.260 18935 1301 1 2 . 1 1 104 104 ALA C C 104 175.947 175.947 174.769 1.178 18935 1302 1 2 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.035 -0.228 18935 1303 1 2 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.647 -0.219 18935 1304 1 2 . 1 1 104 104 ALA H H 104 8.930 8.930 9.031 -0.101 18935 1305 1 2 . 1 1 105 105 LEU N N 105 119.855 119.855 119.506 0.349 18935 1306 1 2 . 1 1 105 105 LEU C C 105 179.628 179.628 178.196 1.432 18935 1307 1 2 . 1 1 105 105 LEU CA C 105 53.123 53.123 52.986 0.137 18935 1308 1 2 . 1 1 105 105 LEU CB C 105 41.334 41.334 44.112 -2.778 18935 1309 1 2 . 1 1 105 105 LEU H H 105 8.316 8.316 9.250 -0.934 18935 1310 1 2 . 1 1 106 106 ALA N N 106 123.662 123.662 122.726 0.936 18935 1311 1 2 . 1 1 106 106 ALA C C 106 181.056 181.056 177.907 3.149 18935 1312 1 2 . 1 1 106 106 ALA CA C 106 56.349 56.349 54.934 1.415 18935 1313 1 2 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.578 -1.263 18935 1314 1 2 . 1 1 106 106 ALA H H 106 8.306 8.306 8.175 0.131 18935 1315 1 2 . 1 1 107 107 GLU N N 107 114.825 114.825 114.526 0.299 18935 1316 1 2 . 1 1 107 107 GLU C C 107 177.854 177.854 177.021 0.833 18935 1317 1 2 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.825 0.561 18935 1318 1 2 . 1 1 107 107 GLU CB C 107 27.844 27.844 29.306 -1.462 18935 1319 1 2 . 1 1 107 107 GLU H H 107 9.754 9.754 8.644 1.110 18935 1320 1 2 . 1 1 108 108 GLU N N 108 115.097 115.097 117.867 -2.770 18935 1321 1 2 . 1 1 108 108 GLU C C 108 178.001 178.001 177.604 0.397 18935 1322 1 2 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.727 -1.801 18935 1323 1 2 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.878 0.123 18935 1324 1 2 . 1 1 108 108 GLU H H 108 7.859 7.859 7.687 0.172 18935 1325 1 2 . 1 1 109 109 LYS N N 109 118.360 118.360 122.072 -3.712 18935 1326 1 2 . 1 1 109 109 LYS C C 109 172.691 172.691 175.878 -3.187 18935 1327 1 2 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.295 1.607 18935 1328 1 2 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.650 -0.109 18935 1329 1 2 . 1 1 109 109 LYS H H 109 7.660 7.660 7.795 -0.135 18935 1330 1 2 . 1 1 111 111 TYR N N 111 114.054 114.054 117.790 -3.736 18935 1331 1 2 . 1 1 111 111 TYR C C 111 179.764 179.764 178.145 1.619 18935 1332 1 2 . 1 1 111 111 TYR CA C 111 58.998 58.998 59.997 -0.999 18935 1333 1 2 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.033 -1.077 18935 1334 1 2 . 1 1 111 111 TYR H H 111 6.583 6.583 7.903 -1.320 18935 1335 1 2 . 1 1 112 112 ALA N N 112 124.749 124.749 122.073 2.676 18935 1336 1 2 . 1 1 112 112 ALA C C 112 179.430 179.430 179.499 -0.069 18935 1337 1 2 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.848 0.121 18935 1338 1 2 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.816 -0.004 18935 1339 1 2 . 1 1 112 112 ALA H H 112 8.753 8.753 8.270 0.483 18935 1340 1 2 . 1 1 113 113 ILE N N 113 119.130 119.130 120.152 -1.022 18935 1341 1 2 . 1 1 113 113 ILE C C 113 178.646 178.646 178.464 0.182 18935 1342 1 2 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.943 2.458 18935 1343 1 2 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.503 0.734 18935 1344 1 2 . 1 1 113 113 ILE H H 113 8.946 8.946 8.802 0.144 18935 1345 1 2 . 1 1 114 114 PHE N N 114 121.758 121.758 121.270 0.488 18935 1346 1 2 . 1 1 114 114 PHE C C 114 177.954 177.954 176.904 1.050 18935 1347 1 2 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.881 -2.104 18935 1348 1 2 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.570 0.494 18935 1349 1 2 . 1 1 114 114 PHE H H 114 7.940 7.940 8.330 -0.390 18935 1350 1 2 . 1 1 115 115 HIS N N 115 116.547 116.547 118.809 -2.262 18935 1351 1 2 . 1 1 115 115 HIS C C 115 176.161 176.161 176.411 -0.250 18935 1352 1 2 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.588 -0.469 18935 1353 1 2 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.623 1.444 18935 1354 1 2 . 1 1 115 115 HIS H H 115 7.767 7.767 7.947 -0.180 18935 1355 1 2 . 1 1 116 116 PHE N N 116 109.387 109.387 114.122 -4.735 18935 1356 1 2 . 1 1 116 116 PHE C C 116 177.282 177.282 177.123 0.159 18935 1357 1 2 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.077 1.357 18935 1358 1 2 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.526 -2.271 18935 1359 1 2 . 1 1 116 116 PHE H H 116 8.989 8.989 8.132 0.857 18935 1360 1 2 . 1 1 117 117 THR N N 117 116.864 116.864 114.545 2.319 18935 1361 1 2 . 1 1 117 117 THR C C 117 172.889 172.889 175.224 -2.335 18935 1362 1 2 . 1 1 117 117 THR CA C 117 66.997 66.997 64.941 2.056 18935 1363 1 2 . 1 1 117 117 THR CB C 117 67.948 67.948 69.381 -1.433 18935 1364 1 2 . 1 1 117 117 THR H H 117 7.988 7.988 8.205 -0.217 18935 1365 1 2 . 1 1 118 118 GLY N N 118 103.320 103.320 109.328 -6.008 18935 1366 1 2 . 1 1 118 118 GLY C C 118 176.912 176.912 171.647 5.265 18935 1367 1 2 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.757 1.425 18935 1368 1 2 . 1 1 118 118 GLY H H 118 6.550 6.550 7.383 -0.833 18935 1369 1 2 . 1 1 120 120 VAL N N 120 120.671 120.671 124.050 -3.379 18935 1370 1 2 . 1 1 120 120 VAL C C 120 176.283 176.283 177.234 -0.951 18935 1371 1 2 . 1 1 120 120 VAL CA C 120 66.940 66.940 64.820 2.120 18935 1372 1 2 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.912 -2.060 18935 1373 1 2 . 1 1 120 120 VAL H H 120 8.408 8.408 8.542 -0.134 18935 1374 1 2 . 1 1 121 121 SER N N 121 111.789 111.789 115.187 -3.398 18935 1375 1 2 . 1 1 121 121 SER C C 121 175.658 175.658 175.986 -0.328 18935 1376 1 2 . 1 1 121 121 SER CA C 121 60.814 60.814 60.751 0.063 18935 1377 1 2 . 1 1 121 121 SER CB C 121 60.253 60.253 62.710 -2.457 18935 1378 1 2 . 1 1 121 121 SER H H 121 8.290 8.290 8.042 0.248 18935 1379 1 2 . 1 1 122 122 TYR N N 122 123.254 123.254 123.511 -0.257 18935 1380 1 2 . 1 1 122 122 TYR C C 122 174.611 174.611 176.052 -1.441 18935 1381 1 2 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.211 -1.665 18935 1382 1 2 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.332 -0.193 18935 1383 1 2 . 1 1 122 122 TYR H H 122 6.303 6.303 7.646 -1.343 18935 1384 1 2 . 1 1 123 123 LEU N N 123 114.825 114.825 118.559 -3.734 18935 1385 1 2 . 1 1 123 123 LEU C C 123 178.891 178.891 178.219 0.672 18935 1386 1 2 . 1 1 123 123 LEU CA C 123 56.779 56.779 56.779 0.000 18935 1387 1 2 . 1 1 123 123 LEU CB C 123 40.638 40.638 41.931 -1.293 18935 1388 1 2 . 1 1 123 123 LEU H H 123 6.965 6.965 7.607 -0.642 18935 1389 1 2 . 1 1 124 124 ILE N N 124 114.915 114.915 119.320 -4.405 18935 1390 1 2 . 1 1 124 124 ILE C C 124 177.187 177.187 177.623 -0.436 18935 1391 1 2 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.138 -0.706 18935 1392 1 2 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.469 -0.914 18935 1393 1 2 . 1 1 124 124 ILE H H 124 7.531 7.531 7.257 0.274 18935 1394 1 2 . 1 1 125 125 ARG N N 125 115.278 115.278 117.558 -2.280 18935 1395 1 2 . 1 1 125 125 ARG C C 125 178.473 178.473 176.373 2.100 18935 1396 1 2 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.403 0.056 18935 1397 1 2 . 1 1 125 125 ARG CB C 125 27.079 27.079 28.866 -1.787 18935 1398 1 2 . 1 1 125 125 ARG H H 125 6.809 6.809 7.709 -0.900 18935 1399 1 2 . 1 1 126 126 ILE N N 126 124.160 124.160 117.028 7.132 18935 1400 1 2 . 1 1 126 126 ILE C C 126 178.172 178.172 176.077 2.095 18935 1401 1 2 . 1 1 126 126 ILE CA C 126 60.927 60.927 61.773 -0.846 18935 1402 1 2 . 1 1 126 126 ILE CB C 126 34.466 34.466 38.972 -4.506 18935 1403 1 2 . 1 1 126 126 ILE H H 126 7.408 7.408 7.162 0.246 18935 1404 1 2 . 1 1 127 127 ARG N N 127 117.136 117.136 121.911 -4.775 18935 1405 1 2 . 1 1 127 127 ARG C C 127 179.227 179.227 178.013 1.214 18935 1406 1 2 . 1 1 127 127 ARG CA C 127 60.216 60.216 58.334 1.882 18935 1407 1 2 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.570 -1.781 18935 1408 1 2 . 1 1 127 127 ARG H H 127 8.230 8.230 7.832 0.398 18935 1409 1 2 . 1 1 128 128 ALA N N 128 121.305 121.305 121.693 -0.388 18935 1410 1 2 . 1 1 128 128 ALA C C 128 179.933 179.933 178.883 1.050 18935 1411 1 2 . 1 1 128 128 ALA CA C 128 54.706 54.706 54.605 0.101 18935 1412 1 2 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.148 0.190 18935 1413 1 2 . 1 1 128 128 ALA H H 128 8.666 8.666 8.508 0.158 18935 1414 1 2 . 1 1 129 129 ALA N N 129 120.943 120.943 121.505 -0.562 18935 1415 1 2 . 1 1 129 129 ALA C C 129 181.336 181.336 180.125 1.211 18935 1416 1 2 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.521 0.187 18935 1417 1 2 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.402 -1.542 18935 1418 1 2 . 1 1 129 129 ALA H H 129 7.837 7.837 7.527 0.310 18935 1419 1 2 . 1 1 130 130 LEU N N 130 117.726 117.726 118.394 -0.668 18935 1420 1 2 . 1 1 130 130 LEU C C 130 179.432 179.432 179.365 0.067 18935 1421 1 2 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.471 -0.295 18935 1422 1 2 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.687 -1.121 18935 1423 1 2 . 1 1 130 130 LEU H H 130 8.114 8.114 7.891 0.223 18935 1424 1 2 . 1 1 131 131 LYS N N 131 124.115 124.115 119.288 4.827 18935 1425 1 2 . 1 1 131 131 LYS C C 131 181.452 181.452 178.883 2.569 18935 1426 1 2 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.530 0.356 18935 1427 1 2 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.698 0.500 18935 1428 1 2 . 1 1 131 131 LYS H H 131 8.849 8.849 7.807 1.042 18935 1429 1 2 . 1 1 132 132 LYS N N 132 119.447 119.447 118.435 1.012 18935 1430 1 2 . 1 1 132 132 LYS C C 132 177.607 177.607 177.483 0.124 18935 1431 1 2 . 1 1 132 132 LYS CA C 132 57.952 57.952 57.718 0.235 18935 1432 1 2 . 1 1 132 132 LYS CB C 132 31.425 31.425 32.164 -0.739 18935 1433 1 2 . 1 1 132 132 LYS H H 132 7.778 7.778 7.509 0.269 18935 1434 1 2 . 1 1 133 133 LYS N N 133 116.638 116.638 116.479 0.159 18935 1435 1 2 . 1 1 133 133 LYS C C 133 174.681 174.681 176.249 -1.568 18935 1436 1 2 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.438 -0.360 18935 1437 1 2 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.315 -0.675 18935 1438 1 2 . 1 1 133 133 LYS H H 133 7.617 7.617 7.705 -0.088 18935 1439 1 2 . 1 1 134 134 ASN N N 134 110.792 110.792 117.001 -6.209 18935 1440 1 2 . 1 1 134 134 ASN C C 134 174.034 174.034 173.349 0.685 18935 1441 1 2 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.093 0.523 18935 1442 1 2 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.189 -1.137 18935 1443 1 2 . 1 1 134 134 ASN H H 134 8.123 8.123 7.806 0.317 18935 1444 1 2 . 1 1 135 135 TYR N N 135 115.867 115.867 119.727 -3.860 18935 1445 1 2 . 1 1 135 135 TYR C C 135 175.122 175.122 173.585 1.537 18935 1446 1 2 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.154 0.598 18935 1447 1 2 . 1 1 135 135 TYR CB C 135 41.916 41.916 41.758 0.158 18935 1448 1 2 . 1 1 135 135 TYR H H 135 8.133 8.133 7.858 0.275 18935 1449 1 2 . 1 1 136 136 LYS N N 136 119.870 119.870 128.995 -9.125 18935 1450 1 2 . 1 1 136 136 LYS C C 136 174.324 174.324 173.963 0.361 18935 1451 1 2 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.316 0.865 18935 1452 1 2 . 1 1 136 136 LYS CB C 136 34.073 34.073 35.365 -1.292 18935 1453 1 2 . 1 1 136 136 LYS H H 136 9.234 9.234 8.696 0.538 18935 1454 1 2 . 1 1 137 137 LEU N N 137 129.708 129.708 128.531 1.177 18935 1455 1 2 . 1 1 137 137 LEU C C 137 173.798 173.798 175.310 -1.512 18935 1456 1 2 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.127 -1.294 18935 1457 1 2 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.055 1.928 18935 1458 1 2 . 1 1 137 137 LEU H H 137 8.959 8.959 8.515 0.444 18935 1459 1 2 . 1 1 140 140 TYR N N 140 120.580 120.580 113.966 6.614 18935 1460 1 2 . 1 1 140 140 TYR C C 140 174.705 174.705 176.328 -1.623 18935 1461 1 2 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.062 -1.611 18935 1462 1 2 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.803 -0.502 18935 1463 1 2 . 1 1 140 140 TYR H H 140 8.962 8.962 7.370 1.592 18935 1464 1 2 . 1 1 141 141 GLY N N 141 104.986 104.986 106.283 -1.297 18935 1465 1 2 . 1 1 141 141 GLY C C 141 181.854 181.854 172.263 9.591 18935 1466 1 2 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.564 -0.442 18935 1467 1 2 . 1 1 141 141 GLY H H 141 7.555 7.555 7.507 0.048 18935 1468 1 2 . 1 1 142 142 LEU N N 142 118.269 118.269 121.030 -2.761 18935 1469 1 2 . 1 1 142 142 LEU C C 142 174.067 174.067 175.585 -1.518 18935 1470 1 2 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.436 -0.934 18935 1471 1 2 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.260 1.282 18935 1472 1 2 . 1 1 142 142 LEU H H 142 7.794 7.794 8.402 -0.608 18935 1473 1 2 . 1 1 143 143 PHE N N 143 122.076 122.076 125.168 -3.092 18935 1474 1 2 . 1 1 143 143 PHE C C 143 175.199 175.199 175.081 0.118 18935 1475 1 2 . 1 1 143 143 PHE CA C 143 56.032 56.032 56.896 -0.864 18935 1476 1 2 . 1 1 143 143 PHE CB C 143 42.070 42.070 40.106 1.964 18935 1477 1 2 . 1 1 143 143 PHE H H 143 9.522 9.522 9.330 0.192 18935 1478 1 2 . 1 1 144 144 LYS N N 144 121.305 121.305 125.864 -4.559 18935 1479 1 2 . 1 1 144 144 LYS C C 144 176.917 176.917 175.919 0.998 18935 1480 1 2 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.332 1.024 18935 1481 1 2 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.709 -0.030 18935 1482 1 2 . 1 1 144 144 LYS H H 144 9.076 9.076 9.220 -0.144 18935 1483 1 2 . 1 1 145 145 ASN N N 145 126.834 126.834 124.627 2.207 18935 1484 1 2 . 1 1 145 145 ASN C C 145 175.070 175.070 175.184 -0.114 18935 1485 1 2 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.355 0.409 18935 1486 1 2 . 1 1 145 145 ASN CB C 145 36.430 36.430 38.245 -1.815 18935 1487 1 2 . 1 1 145 145 ASN H H 145 9.618 9.618 8.999 0.619 18935 1488 1 2 . 1 1 146 146 GLN N N 146 110.112 110.112 111.306 -1.194 18935 1489 1 2 . 1 1 146 146 GLN C C 146 175.198 175.198 174.326 0.872 18935 1490 1 2 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.224 -0.328 18935 1491 1 2 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.054 -0.686 18935 1492 1 2 . 1 1 146 146 GLN H H 146 9.140 9.140 8.835 0.305 18935 1493 1 2 . 1 1 147 147 THR N N 147 116.003 116.003 114.819 1.184 18935 1494 1 2 . 1 1 147 147 THR C C 147 173.224 173.224 173.054 0.170 18935 1495 1 2 . 1 1 147 147 THR CA C 147 61.450 61.450 61.151 0.299 18935 1496 1 2 . 1 1 147 147 THR CB C 147 70.285 70.285 70.468 -0.183 18935 1497 1 2 . 1 1 147 147 THR H H 147 8.069 8.069 7.663 0.406 18935 1498 1 2 . 1 1 148 148 LEU N N 148 129.281 129.281 130.196 -0.915 18935 1499 1 2 . 1 1 148 148 LEU C C 148 176.703 176.703 175.407 1.296 18935 1500 1 2 . 1 1 148 148 LEU CA C 148 55.466 55.466 54.567 0.899 18935 1501 1 2 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.708 -0.983 18935 1502 1 2 . 1 1 148 148 LEU H H 148 8.831 8.831 8.777 0.054 18935 1503 1 2 . 1 1 149 149 VAL N N 149 130.189 130.189 127.400 2.789 18935 1504 1 2 . 1 1 149 149 VAL C C 149 175.012 175.012 173.822 1.190 18935 1505 1 2 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.566 0.702 18935 1506 1 2 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.197 -3.741 18935 1507 1 2 . 1 1 149 149 VAL H H 149 9.243 9.243 8.862 0.381 18935 1508 1 2 . 1 1 151 151 LEU N N 151 123.481 123.481 116.167 7.314 18935 1509 1 2 . 1 1 151 151 LEU C C 151 177.679 177.679 176.679 1.000 18935 1510 1 2 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.621 0.376 18935 1511 1 2 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.957 0.662 18935 1512 1 2 . 1 1 151 151 LEU H H 151 8.080 8.080 8.220 -0.140 18935 1513 1 2 . 1 1 152 152 LYS N N 152 126.381 126.381 120.112 6.269 18935 1514 1 2 . 1 1 152 152 LYS C C 152 175.115 175.115 175.268 -0.153 18935 1515 1 2 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.229 -1.633 18935 1516 1 2 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.493 -3.428 18935 1517 1 2 . 1 1 152 152 LYS H H 152 9.112 9.112 9.274 -0.162 18935 1518 1 2 . 1 1 153 153 ILE N N 153 113.737 113.737 117.318 -3.581 18935 1519 1 2 . 1 1 153 153 ILE C C 153 175.748 175.748 174.762 0.986 18935 1520 1 2 . 1 1 153 153 ILE CA C 153 58.389 58.389 58.965 -0.576 18935 1521 1 2 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.383 1.419 18935 1522 1 2 . 1 1 153 153 ILE H H 153 7.304 7.304 7.465 -0.161 18935 1523 1 2 . 1 1 154 154 THR N N 154 110.656 110.656 112.467 -1.811 18935 1524 1 2 . 1 1 154 154 THR C C 154 174.864 174.864 173.110 1.754 18935 1525 1 2 . 1 1 154 154 THR CA C 154 62.141 62.141 62.310 -0.169 18935 1526 1 2 . 1 1 154 154 THR CB C 154 70.413 70.413 69.894 0.519 18935 1527 1 2 . 1 1 154 154 THR H H 154 9.382 9.382 8.272 1.110 18935 1528 1 2 . 1 1 155 155 THR N N 155 110.746 110.746 114.764 -4.018 18935 1529 1 2 . 1 1 155 155 THR C C 155 174.718 174.718 174.804 -0.086 18935 1530 1 2 . 1 1 155 155 THR CA C 155 58.785 58.785 60.020 -1.235 18935 1531 1 2 . 1 1 155 155 THR CB C 155 72.277 72.277 71.906 0.371 18935 1532 1 2 . 1 1 155 155 THR H H 155 7.746 7.746 7.567 0.179 18935 1533 1 2 . 1 1 156 156 GLU N N 156 122.302 122.302 124.697 -2.395 18935 1534 1 2 . 1 1 156 156 GLU C C 156 177.289 177.289 178.279 -0.990 18935 1535 1 2 . 1 1 156 156 GLU CA C 156 58.824 58.824 61.051 -2.227 18935 1536 1 2 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.260 -0.879 18935 1537 1 2 . 1 1 156 156 GLU H H 156 9.490 9.490 8.976 0.514 18935 1538 1 2 . 1 1 157 157 LYS N N 157 118.905 118.905 116.738 2.167 18935 1539 1 2 . 1 1 157 157 LYS C C 157 178.241 178.241 179.316 -1.075 18935 1540 1 2 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.680 1.085 18935 1541 1 2 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.655 -0.377 18935 1542 1 2 . 1 1 157 157 LYS H H 157 8.329 8.329 8.556 -0.227 18935 1543 1 2 . 1 1 158 158 GLU N N 158 116.230 116.230 120.391 -4.161 18935 1544 1 2 . 1 1 158 158 GLU C C 158 178.988 178.988 178.515 0.473 18935 1545 1 2 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.127 0.129 18935 1546 1 2 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.369 -0.311 18935 1547 1 2 . 1 1 158 158 GLU H H 158 7.611 7.611 7.556 0.055 18935 1548 1 2 . 1 1 159 159 LEU N N 159 118.978 118.978 122.065 -3.087 18935 1549 1 2 . 1 1 159 159 LEU C C 159 176.347 176.347 178.503 -2.156 18935 1550 1 2 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.442 -5.203 18935 1551 1 2 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.891 -2.348 18935 1552 1 2 . 1 1 159 159 LEU H H 159 7.704 7.704 8.198 -0.494 18935 1553 1 2 . 1 1 160 160 ILE N N 160 117.227 117.227 114.986 2.241 18935 1554 1 2 . 1 1 160 160 ILE C C 160 177.219 177.219 177.381 -0.162 18935 1555 1 2 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.403 0.212 18935 1556 1 2 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.066 0.492 18935 1557 1 2 . 1 1 160 160 ILE H H 160 7.886 7.886 8.048 -0.162 18935 1558 1 2 . 1 1 161 161 LYS N N 161 115.912 115.912 120.631 -4.719 18935 1559 1 2 . 1 1 161 161 LYS C C 161 180.990 180.990 178.937 2.053 18935 1560 1 2 . 1 1 161 161 LYS CA C 161 58.631 58.631 59.456 -0.825 18935 1561 1 2 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.325 -1.577 18935 1562 1 2 . 1 1 161 161 LYS H H 161 7.536 7.536 7.561 -0.025 18935 1563 1 2 . 1 1 162 162 GLU N N 162 120.852 120.852 120.071 0.781 18935 1564 1 2 . 1 1 162 162 GLU C C 162 178.793 178.793 178.512 0.281 18935 1565 1 2 . 1 1 162 162 GLU CA C 162 57.982 57.982 59.010 -1.028 18935 1566 1 2 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.753 -1.961 18935 1567 1 2 . 1 1 162 162 GLU H H 162 8.392 8.392 7.933 0.459 18935 1568 1 2 . 1 1 163 163 LEU N N 163 115.912 115.912 117.255 -1.343 18935 1569 1 2 . 1 1 163 163 LEU C C 163 176.370 176.370 177.574 -1.204 18935 1570 1 2 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.891 -0.797 18935 1571 1 2 . 1 1 163 163 LEU CB C 163 41.174 41.174 43.053 -1.879 18935 1572 1 2 . 1 1 163 163 LEU H H 163 8.031 8.031 8.155 -0.124 18935 1573 1 2 . 1 1 164 164 GLY N N 164 103.160 103.160 104.184 -1.024 18935 1574 1 2 . 1 1 164 164 GLY C C 164 174.240 174.240 173.515 0.725 18935 1575 1 2 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.481 -0.179 18935 1576 1 2 . 1 1 164 164 GLY H H 164 7.625 7.625 7.685 -0.060 18935 1577 1 2 . 1 1 165 165 PHE N N 165 117.952 117.952 118.077 -0.125 18935 1578 1 2 . 1 1 165 165 PHE C C 165 174.556 174.556 174.691 -0.135 18935 1579 1 2 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.400 -0.935 18935 1580 1 2 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.962 -1.200 18935 1581 1 2 . 1 1 165 165 PHE H H 165 7.283 7.283 8.285 -1.002 18935 1582 1 2 . 1 1 166 166 THR N N 166 118.178 118.178 113.837 4.341 18935 1583 1 2 . 1 1 166 166 THR C C 166 175.306 175.306 173.426 1.880 18935 1584 1 2 . 1 1 166 166 THR CA C 166 63.466 63.466 59.719 3.747 18935 1585 1 2 . 1 1 166 166 THR CB C 166 68.721 68.721 70.958 -2.237 18935 1586 1 2 . 1 1 166 166 THR H H 166 9.678 9.678 8.828 0.850 18935 1587 1 2 . 1 1 167 167 TYR N N 167 128.239 128.239 123.020 5.219 18935 1588 1 2 . 1 1 167 167 TYR C C 167 173.297 173.297 175.017 -1.720 18935 1589 1 2 . 1 1 167 167 TYR CA C 167 60.412 60.412 58.716 1.696 18935 1590 1 2 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.424 -2.702 18935 1591 1 2 . 1 1 167 167 TYR H H 167 9.264 9.264 8.714 0.550 18935 1592 1 2 . 1 1 168 168 ARG N N 168 126.789 126.789 126.464 0.325 18935 1593 1 2 . 1 1 168 168 ARG C C 168 175.297 175.297 174.298 0.999 18935 1594 1 2 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.020 -1.255 18935 1595 1 2 . 1 1 168 168 ARG CB C 168 31.326 31.326 33.286 -1.960 18935 1596 1 2 . 1 1 168 168 ARG H H 168 7.030 7.030 8.187 -1.157 18935 1597 1 2 . 1 1 169 169 ILE N N 169 119.221 119.221 115.554 3.667 18935 1598 1 2 . 1 1 169 169 ILE C C 169 174.522 174.522 174.532 -0.010 18935 1599 1 2 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.173 3.106 18935 1600 1 2 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.821 -5.174 18935 1601 1 2 . 1 1 169 169 ILE H H 169 8.349 8.349 8.150 0.199 18935 1602 1 2 . 1 1 171 171 LYS N N 171 111.335 111.335 116.935 -5.600 18935 1603 1 2 . 1 1 171 171 LYS C C 171 176.638 176.638 177.951 -1.313 18935 1604 1 2 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.871 -1.333 18935 1605 1 2 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.733 0.234 18935 1606 1 2 . 1 1 171 171 LYS H H 171 8.198 8.198 8.493 -0.295 18935 1607 1 2 . 1 1 172 172 LYS N N 172 116.411 116.411 116.863 -0.452 18935 1608 1 2 . 1 1 172 172 LYS C C 172 175.331 175.331 175.200 0.131 18935 1609 1 2 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.407 -1.407 18935 1610 1 2 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.197 -1.379 18935 1611 1 2 . 1 1 172 172 LYS H H 172 7.843 7.843 7.515 0.328 18935 1612 1 2 . 1 1 173 173 ARG N N 173 120.490 120.490 117.777 2.713 18935 1613 1 2 . 1 1 173 173 ARG C C 173 172.830 172.830 175.358 -2.528 18935 1614 1 2 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.446 0.729 18935 1615 1 2 . 1 1 173 173 ARG CB C 173 28.829 28.829 27.771 1.058 18935 1616 1 2 . 1 1 173 173 ARG H H 173 6.917 6.917 7.316 -0.399 18935 1617 1 3 . 1 1 2 2 LEU N N 2 119.937 119.937 119.047 0.890 18935 1618 1 3 . 1 1 2 2 LEU C C 2 175.307 175.307 175.520 -0.213 18935 1619 1 3 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.837 0.456 18935 1620 1 3 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.012 -1.328 18935 1621 1 3 . 1 1 2 2 LEU H H 2 9.251 9.251 7.938 1.313 18935 1622 1 3 . 1 1 3 3 THR N N 3 111.335 111.335 111.633 -0.298 18935 1623 1 3 . 1 1 3 3 THR C C 3 175.854 175.854 175.784 0.070 18935 1624 1 3 . 1 1 3 3 THR CA C 3 60.540 60.540 60.640 -0.100 18935 1625 1 3 . 1 1 3 3 THR CB C 3 70.782 70.782 70.130 0.651 18935 1626 1 3 . 1 1 3 3 THR H H 3 8.677 8.677 8.129 0.548 18935 1627 1 3 . 1 1 4 4 LEU N N 4 120.988 120.988 123.015 -2.027 18935 1628 1 3 . 1 1 4 4 LEU C C 4 178.391 178.391 178.215 0.176 18935 1629 1 3 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.912 0.152 18935 1630 1 3 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.632 -2.370 18935 1631 1 3 . 1 1 4 4 LEU H H 4 7.746 7.746 7.923 -0.177 18935 1632 1 3 . 1 1 5 5 ILE N N 5 114.236 114.236 114.834 -0.598 18935 1633 1 3 . 1 1 5 5 ILE C C 5 178.339 178.339 177.669 0.670 18935 1634 1 3 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.548 -0.966 18935 1635 1 3 . 1 1 5 5 ILE CB C 5 36.799 36.799 36.949 -0.150 18935 1636 1 3 . 1 1 5 5 ILE H H 5 7.821 7.821 7.734 0.087 18935 1637 1 3 . 1 1 6 6 GLN N N 6 120.399 120.399 120.561 -0.162 18935 1638 1 3 . 1 1 6 6 GLN C C 6 178.783 178.783 178.362 0.421 18935 1639 1 3 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.971 -0.751 18935 1640 1 3 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.047 0.069 18935 1641 1 3 . 1 1 6 6 GLN H H 6 7.810 7.810 7.653 0.157 18935 1642 1 3 . 1 1 7 7 GLY N N 7 106.277 106.277 106.193 0.084 18935 1643 1 3 . 1 1 7 7 GLY C C 7 174.554 174.554 176.415 -1.861 18935 1644 1 3 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.002 -0.068 18935 1645 1 3 . 1 1 7 7 GLY H H 7 8.733 8.733 8.088 0.645 18935 1646 1 3 . 1 1 8 8 LYS N N 8 119.991 119.991 121.591 -1.600 18935 1647 1 3 . 1 1 8 8 LYS C C 8 179.433 179.433 178.307 1.126 18935 1648 1 3 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.174 1.718 18935 1649 1 3 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.233 -0.901 18935 1650 1 3 . 1 1 8 8 LYS H H 8 8.688 8.688 7.484 1.204 18935 1651 1 3 . 1 1 9 9 LYS N N 9 119.175 119.175 120.438 -1.263 18935 1652 1 3 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.952 -0.570 18935 1653 1 3 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.498 -1.063 18935 1654 1 3 . 1 1 9 9 LYS H H 9 8.015 8.015 7.823 0.192 18935 1655 1 3 . 1 1 10 10 ILE N N 10 120.308 120.308 116.732 3.576 18935 1656 1 3 . 1 1 10 10 ILE C C 10 177.766 177.766 177.483 0.283 18935 1657 1 3 . 1 1 10 10 ILE CA C 10 64.676 64.676 65.105 -0.429 18935 1658 1 3 . 1 1 10 10 ILE CB C 10 36.313 36.313 36.955 -0.642 18935 1659 1 3 . 1 1 10 10 ILE H H 10 7.967 7.967 8.215 -0.248 18935 1660 1 3 . 1 1 11 11 VAL N N 11 119.130 119.130 121.306 -2.176 18935 1661 1 3 . 1 1 11 11 VAL C C 11 176.606 176.606 178.032 -1.426 18935 1662 1 3 . 1 1 11 11 VAL CA C 11 67.640 67.640 67.049 0.591 18935 1663 1 3 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.068 -0.859 18935 1664 1 3 . 1 1 11 11 VAL H H 11 8.128 8.128 7.613 0.515 18935 1665 1 3 . 1 1 12 12 ASN N N 12 115.822 115.822 117.015 -1.193 18935 1666 1 3 . 1 1 12 12 ASN C C 12 177.375 177.375 176.673 0.702 18935 1667 1 3 . 1 1 12 12 ASN CA C 12 55.970 55.970 55.937 0.033 18935 1668 1 3 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.420 -0.857 18935 1669 1 3 . 1 1 12 12 ASN H H 12 8.203 8.203 7.900 0.303 18935 1670 1 3 . 1 1 13 13 HIS N N 13 117.659 117.659 117.052 0.607 18935 1671 1 3 . 1 1 13 13 HIS C C 13 177.287 177.287 177.855 -0.568 18935 1672 1 3 . 1 1 13 13 HIS CA C 13 58.687 58.687 59.352 -0.665 18935 1673 1 3 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.748 -0.728 18935 1674 1 3 . 1 1 13 13 HIS H H 13 7.861 7.861 7.768 0.093 18935 1675 1 3 . 1 1 14 14 LEU N N 14 115.595 115.595 120.221 -4.626 18935 1676 1 3 . 1 1 14 14 LEU C C 14 179.092 179.092 178.317 0.775 18935 1677 1 3 . 1 1 14 14 LEU CA C 14 56.641 56.641 57.810 -1.169 18935 1678 1 3 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.783 -0.763 18935 1679 1 3 . 1 1 14 14 LEU H H 14 8.376 8.376 8.987 -0.611 18935 1680 1 3 . 1 1 15 15 ARG N N 15 115.006 115.006 115.616 -0.610 18935 1681 1 3 . 1 1 15 15 ARG C C 15 176.265 176.265 177.166 -0.901 18935 1682 1 3 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.123 1.761 18935 1683 1 3 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.631 -0.559 18935 1684 1 3 . 1 1 15 15 ARG H H 15 8.074 8.074 8.358 -0.284 18935 1685 1 3 . 1 1 16 16 SER N N 16 107.778 107.778 114.044 -6.266 18935 1686 1 3 . 1 1 16 16 SER C C 16 176.009 176.009 174.830 1.179 18935 1687 1 3 . 1 1 16 16 SER CA C 16 57.244 57.244 58.972 -1.728 18935 1688 1 3 . 1 1 16 16 SER CB C 16 63.525 63.525 64.295 -0.770 18935 1689 1 3 . 1 1 16 16 SER H H 16 7.136 7.136 8.042 -0.906 18935 1690 1 3 . 1 1 17 17 ARG N N 17 121.532 121.532 121.911 -0.379 18935 1691 1 3 . 1 1 17 17 ARG C C 17 174.482 174.482 175.449 -0.967 18935 1692 1 3 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.321 1.001 18935 1693 1 3 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.292 0.538 18935 1694 1 3 . 1 1 17 17 ARG H H 17 7.913 7.913 7.455 0.458 18935 1695 1 3 . 1 1 18 18 LEU N N 18 121.305 121.305 120.031 1.274 18935 1696 1 3 . 1 1 18 18 LEU C C 18 176.283 176.283 175.401 0.882 18935 1697 1 3 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.212 -0.513 18935 1698 1 3 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.170 -0.115 18935 1699 1 3 . 1 1 18 18 LEU H H 18 8.812 8.812 7.615 1.197 18935 1700 1 3 . 1 1 19 19 ALA N N 19 125.293 125.293 122.385 2.908 18935 1701 1 3 . 1 1 19 19 ALA C C 19 173.780 173.780 175.010 -1.230 18935 1702 1 3 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.850 -1.048 18935 1703 1 3 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.831 1.022 18935 1704 1 3 . 1 1 19 19 ALA H H 19 8.790 8.790 7.839 0.951 18935 1705 1 3 . 1 1 20 20 PHE N N 20 113.117 113.117 113.916 -0.799 18935 1706 1 3 . 1 1 20 20 PHE C C 20 172.708 172.708 173.497 -0.789 18935 1707 1 3 . 1 1 20 20 PHE CA C 20 55.598 55.598 55.867 -0.269 18935 1708 1 3 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.642 -0.917 18935 1709 1 3 . 1 1 20 20 PHE H H 20 8.925 8.925 8.873 0.052 18935 1710 1 3 . 1 1 21 21 GLU N N 21 121.532 121.532 121.990 -0.458 18935 1711 1 3 . 1 1 21 21 GLU C C 21 174.830 174.830 175.107 -0.277 18935 1712 1 3 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.528 -0.565 18935 1713 1 3 . 1 1 21 21 GLU CB C 21 30.343 30.343 31.686 -1.343 18935 1714 1 3 . 1 1 21 21 GLU H H 21 7.972 7.972 8.806 -0.834 18935 1715 1 3 . 1 1 22 22 TYR N N 22 125.339 125.339 128.559 -3.220 18935 1716 1 3 . 1 1 22 22 TYR C C 22 174.864 174.864 175.738 -0.874 18935 1717 1 3 . 1 1 22 22 TYR CA C 22 55.288 55.288 57.084 -1.796 18935 1718 1 3 . 1 1 22 22 TYR CB C 22 39.859 39.859 39.489 0.370 18935 1719 1 3 . 1 1 22 22 TYR H H 22 9.016 9.016 8.682 0.334 18935 1720 1 3 . 1 1 23 23 ASN N N 23 127.024 127.024 127.147 -0.123 18935 1721 1 3 . 1 1 23 23 ASN C C 23 175.410 175.410 174.716 0.694 18935 1722 1 3 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.050 -0.996 18935 1723 1 3 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.384 -1.123 18935 1724 1 3 . 1 1 23 23 ASN H H 23 9.181 9.181 9.327 -0.146 18935 1725 1 3 . 1 1 24 24 GLY N N 24 102.755 102.755 103.784 -1.029 18935 1726 1 3 . 1 1 24 24 GLY C C 24 173.626 173.626 174.288 -0.662 18935 1727 1 3 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.043 -0.108 18935 1728 1 3 . 1 1 24 24 GLY H H 24 8.666 8.666 8.265 0.401 18935 1729 1 3 . 1 1 25 25 GLN N N 25 118.722 118.722 121.450 -2.728 18935 1730 1 3 . 1 1 25 25 GLN C C 25 173.657 173.657 175.538 -1.881 18935 1731 1 3 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.084 -0.851 18935 1732 1 3 . 1 1 25 25 GLN CB C 25 30.805 30.805 28.543 2.262 18935 1733 1 3 . 1 1 25 25 GLN H H 25 7.708 7.708 8.003 -0.295 18935 1734 1 3 . 1 1 26 26 LEU N N 26 123.526 123.526 126.424 -2.898 18935 1735 1 3 . 1 1 26 26 LEU C C 26 175.842 175.842 176.603 -0.761 18935 1736 1 3 . 1 1 26 26 LEU CA C 26 53.986 53.986 55.638 -1.652 18935 1737 1 3 . 1 1 26 26 LEU CB C 26 40.807 40.807 42.219 -1.412 18935 1738 1 3 . 1 1 26 26 LEU H H 26 8.543 8.543 8.542 0.001 18935 1739 1 3 . 1 1 27 27 ILE N N 27 129.462 129.462 125.035 4.427 18935 1740 1 3 . 1 1 27 27 ILE C C 27 175.085 175.085 174.123 0.962 18935 1741 1 3 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.779 0.194 18935 1742 1 3 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.699 -3.147 18935 1743 1 3 . 1 1 27 27 ILE H H 27 8.989 8.989 8.914 0.075 18935 1744 1 3 . 1 1 28 28 LYS N N 28 125.157 125.157 126.461 -1.304 18935 1745 1 3 . 1 1 28 28 LYS C C 28 176.725 176.725 175.410 1.315 18935 1746 1 3 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.703 1.107 18935 1747 1 3 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.264 -1.448 18935 1748 1 3 . 1 1 28 28 LYS H H 28 8.311 8.311 8.264 0.047 18935 1749 1 3 . 1 1 29 29 ILE N N 29 125.565 125.565 117.832 7.733 18935 1750 1 3 . 1 1 29 29 ILE C C 29 175.685 175.685 174.545 1.140 18935 1751 1 3 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.870 0.535 18935 1752 1 3 . 1 1 29 29 ILE CB C 29 37.031 37.031 39.769 -2.738 18935 1753 1 3 . 1 1 29 29 ILE H H 29 8.209 8.209 7.865 0.344 18935 1754 1 3 . 1 1 30 30 LEU N N 30 127.831 127.831 122.168 5.663 18935 1755 1 3 . 1 1 30 30 LEU C C 30 178.794 178.794 178.267 0.527 18935 1756 1 3 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.944 0.499 18935 1757 1 3 . 1 1 30 30 LEU CB C 30 40.836 40.836 44.663 -3.827 18935 1758 1 3 . 1 1 30 30 LEU H H 30 9.027 9.027 8.395 0.632 18935 1759 1 3 . 1 1 31 31 SER N N 31 116.864 116.864 120.067 -3.203 18935 1760 1 3 . 1 1 31 31 SER C C 31 177.464 177.464 176.544 0.920 18935 1761 1 3 . 1 1 31 31 SER CA C 31 61.180 61.180 61.348 -0.168 18935 1762 1 3 . 1 1 31 31 SER CB C 31 62.105 62.105 62.883 -0.778 18935 1763 1 3 . 1 1 31 31 SER H H 31 8.887 8.887 8.707 0.180 18935 1764 1 3 . 1 1 32 32 LYS N N 32 114.825 114.825 121.332 -6.507 18935 1765 1 3 . 1 1 32 32 LYS C C 32 176.243 176.243 177.113 -0.870 18935 1766 1 3 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.153 -0.861 18935 1767 1 3 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.287 -2.021 18935 1768 1 3 . 1 1 32 32 LYS H H 32 8.290 8.290 8.284 0.006 18935 1769 1 3 . 1 1 33 33 ASN N N 33 117.564 117.564 116.435 1.129 18935 1770 1 3 . 1 1 33 33 ASN C C 33 172.253 172.253 173.655 -1.402 18935 1771 1 3 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.278 -1.187 18935 1772 1 3 . 1 1 33 33 ASN CB C 33 38.339 38.339 39.545 -1.206 18935 1773 1 3 . 1 1 33 33 ASN H H 33 8.051 8.051 7.709 0.342 18935 1774 1 3 . 1 1 34 34 ILE N N 34 118.949 118.949 120.301 -1.352 18935 1775 1 3 . 1 1 34 34 ILE C C 34 175.343 175.343 174.966 0.377 18935 1776 1 3 . 1 1 34 34 ILE CA C 34 60.553 60.553 59.365 1.188 18935 1777 1 3 . 1 1 34 34 ILE CB C 34 38.867 38.867 38.348 0.519 18935 1778 1 3 . 1 1 34 34 ILE H H 34 7.670 7.670 7.616 0.054 18935 1779 1 3 . 1 1 35 35 VAL N N 35 128.355 128.355 125.984 2.371 18935 1780 1 3 . 1 1 35 35 VAL C C 35 175.543 175.543 174.813 0.730 18935 1781 1 3 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.164 -0.150 18935 1782 1 3 . 1 1 35 35 VAL CB C 35 34.231 34.231 34.678 -0.448 18935 1783 1 3 . 1 1 35 35 VAL H H 35 9.698 9.698 9.284 0.414 18935 1784 1 3 . 1 1 36 36 ALA N N 36 129.553 129.553 130.907 -1.354 18935 1785 1 3 . 1 1 36 36 ALA C C 36 177.015 177.015 176.924 0.091 18935 1786 1 3 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.240 1.156 18935 1787 1 3 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.148 -0.527 18935 1788 1 3 . 1 1 36 36 ALA H H 36 8.917 8.917 8.650 0.267 18935 1789 1 3 . 1 1 37 37 VAL N N 37 115.006 115.006 119.290 -4.284 18935 1790 1 3 . 1 1 37 37 VAL C C 37 174.649 174.649 176.490 -1.841 18935 1791 1 3 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.370 -0.049 18935 1792 1 3 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.278 -0.892 18935 1793 1 3 . 1 1 37 37 VAL H H 37 8.214 8.214 7.757 0.457 18935 1794 1 3 . 1 1 38 38 GLY N N 38 109.387 109.387 106.871 2.516 18935 1795 1 3 . 1 1 38 38 GLY C C 38 174.152 174.152 175.877 -1.725 18935 1796 1 3 . 1 1 38 38 GLY CA C 38 45.497 45.497 46.575 -1.078 18935 1797 1 3 . 1 1 38 38 GLY H H 38 8.677 8.677 7.848 0.829 18935 1798 1 3 . 1 1 39 39 SER N N 39 116.776 116.776 119.682 -2.906 18935 1799 1 3 . 1 1 39 39 SER C C 39 175.129 175.129 176.674 -1.545 18935 1800 1 3 . 1 1 39 39 SER CA C 39 60.036 60.036 62.132 -2.096 18935 1801 1 3 . 1 1 39 39 SER CB C 39 61.522 61.522 63.092 -1.570 18935 1802 1 3 . 1 1 39 39 SER H H 39 9.705 9.705 8.440 1.265 18935 1803 1 3 . 1 1 40 40 LEU N N 40 113.696 113.696 118.746 -5.050 18935 1804 1 3 . 1 1 40 40 LEU C C 40 180.558 180.558 178.181 2.377 18935 1805 1 3 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.578 1.795 18935 1806 1 3 . 1 1 40 40 LEU CB C 40 41.877 41.877 40.761 1.116 18935 1807 1 3 . 1 1 40 40 LEU H H 40 7.311 7.311 7.525 -0.214 18935 1808 1 3 . 1 1 41 41 ARG N N 41 121.162 121.162 116.755 4.407 18935 1809 1 3 . 1 1 41 41 ARG C C 41 176.964 176.964 177.255 -0.291 18935 1810 1 3 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.347 2.104 18935 1811 1 3 . 1 1 41 41 ARG CB C 41 28.205 28.205 31.067 -2.862 18935 1812 1 3 . 1 1 41 41 ARG H H 41 6.999 6.999 7.822 -0.823 18935 1813 1 3 . 1 1 42 42 ARG N N 42 111.109 111.109 118.853 -7.744 18935 1814 1 3 . 1 1 42 42 ARG C C 42 172.564 172.564 176.149 -3.585 18935 1815 1 3 . 1 1 42 42 ARG CA C 42 56.380 56.380 57.475 -1.095 18935 1816 1 3 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.743 -2.394 18935 1817 1 3 . 1 1 42 42 ARG H H 42 7.041 7.041 7.674 -0.633 18935 1818 1 3 . 1 1 43 43 GLU N N 43 111.924 111.924 115.603 -3.679 18935 1819 1 3 . 1 1 43 43 GLU C C 43 176.202 176.202 175.372 0.830 18935 1820 1 3 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.141 -0.687 18935 1821 1 3 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.267 -1.966 18935 1822 1 3 . 1 1 43 43 GLU H H 43 7.757 7.757 8.038 -0.281 18935 1823 1 3 . 1 1 44 44 GLU N N 44 117.861 117.861 118.557 -0.696 18935 1824 1 3 . 1 1 44 44 GLU C C 44 175.197 175.197 176.900 -1.703 18935 1825 1 3 . 1 1 44 44 GLU CA C 44 56.128 56.128 55.381 0.747 18935 1826 1 3 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.258 -1.698 18935 1827 1 3 . 1 1 44 44 GLU H H 44 7.461 7.461 7.667 -0.206 18935 1828 1 3 . 1 1 45 45 LYS N N 45 115.051 115.051 118.121 -3.070 18935 1829 1 3 . 1 1 45 45 LYS C C 45 177.733 177.733 175.493 2.240 18935 1830 1 3 . 1 1 45 45 LYS CA C 45 59.055 59.055 56.885 2.170 18935 1831 1 3 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.544 -1.517 18935 1832 1 3 . 1 1 45 45 LYS H H 45 8.123 8.123 8.320 -0.197 18935 1833 1 3 . 1 1 46 46 MET N N 46 114.009 114.009 119.638 -5.629 18935 1834 1 3 . 1 1 46 46 MET C C 46 174.067 174.067 174.448 -0.381 18935 1835 1 3 . 1 1 46 46 MET CA C 46 52.477 52.477 54.282 -1.804 18935 1836 1 3 . 1 1 46 46 MET CB C 46 33.974 33.974 34.257 -0.283 18935 1837 1 3 . 1 1 46 46 MET H H 46 7.767 7.767 7.530 0.237 18935 1838 1 3 . 1 1 47 47 LEU N N 47 120.263 120.263 122.951 -2.688 18935 1839 1 3 . 1 1 47 47 LEU C C 47 177.669 177.669 175.662 2.007 18935 1840 1 3 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.206 -1.005 18935 1841 1 3 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.969 -1.061 18935 1842 1 3 . 1 1 47 47 LEU H H 47 9.481 9.481 8.284 1.197 18935 1843 1 3 . 1 1 48 48 ASN N N 48 118.632 118.632 117.626 1.006 18935 1844 1 3 . 1 1 48 48 ASN C C 48 174.715 174.715 175.341 -0.626 18935 1845 1 3 . 1 1 48 48 ASN CA C 48 55.501 55.501 54.176 1.325 18935 1846 1 3 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.224 -1.397 18935 1847 1 3 . 1 1 48 48 ASN H H 48 9.388 9.388 8.938 0.450 18935 1848 1 3 . 1 1 49 49 ASP N N 49 115.867 115.867 119.508 -3.641 18935 1849 1 3 . 1 1 49 49 ASP C C 49 174.111 174.111 174.225 -0.114 18935 1850 1 3 . 1 1 49 49 ASP CA C 49 51.201 51.201 53.541 -2.340 18935 1851 1 3 . 1 1 49 49 ASP CB C 49 40.077 40.077 45.130 -5.053 18935 1852 1 3 . 1 1 49 49 ASP H H 49 7.670 7.670 8.164 -0.494 18935 1853 1 3 . 1 1 50 50 VAL N N 50 119.185 119.185 120.552 -1.367 18935 1854 1 3 . 1 1 50 50 VAL C C 50 172.333 172.333 174.354 -2.021 18935 1855 1 3 . 1 1 50 50 VAL CA C 50 61.915 61.915 62.623 -0.708 18935 1856 1 3 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.138 -0.173 18935 1857 1 3 . 1 1 50 50 VAL H H 50 8.339 8.339 7.972 0.367 18935 1858 1 3 . 1 1 51 51 ASP N N 51 124.704 124.704 127.617 -2.913 18935 1859 1 3 . 1 1 51 51 ASP C C 51 173.725 173.725 175.434 -1.709 18935 1860 1 3 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.473 -0.445 18935 1861 1 3 . 1 1 51 51 ASP CB C 51 43.829 43.829 42.761 1.069 18935 1862 1 3 . 1 1 51 51 ASP H H 51 8.984 8.984 8.732 0.252 18935 1863 1 3 . 1 1 52 52 LEU N N 52 120.943 120.943 122.580 -1.637 18935 1864 1 3 . 1 1 52 52 LEU C C 52 173.045 173.045 174.402 -1.357 18935 1865 1 3 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.756 -0.885 18935 1866 1 3 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.237 -1.984 18935 1867 1 3 . 1 1 52 52 LEU H H 52 9.081 9.081 8.184 0.897 18935 1868 1 3 . 1 1 53 53 LEU N N 53 123.027 123.027 124.466 -1.439 18935 1869 1 3 . 1 1 53 53 LEU C C 53 173.750 173.750 175.014 -1.264 18935 1870 1 3 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.449 -1.116 18935 1871 1 3 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.291 -0.283 18935 1872 1 3 . 1 1 53 53 LEU H H 53 9.146 9.146 9.182 -0.036 18935 1873 1 3 . 1 1 54 54 ILE N N 54 126.562 126.562 127.092 -0.530 18935 1874 1 3 . 1 1 54 54 ILE C C 54 175.132 175.132 175.216 -0.084 18935 1875 1 3 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.840 -1.242 18935 1876 1 3 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.896 -1.335 18935 1877 1 3 . 1 1 54 54 ILE H H 54 9.440 9.440 8.888 0.552 18935 1878 1 3 . 1 1 55 55 ILE N N 55 126.879 126.879 128.175 -1.296 18935 1879 1 3 . 1 1 55 55 ILE C C 55 175.655 175.655 175.477 0.178 18935 1880 1 3 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.182 -2.621 18935 1881 1 3 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.903 -5.597 18935 1882 1 3 . 1 1 55 55 ILE H H 55 9.381 9.381 8.465 0.916 18935 1883 1 3 . 1 1 56 56 VAL N N 56 128.936 128.936 124.155 4.781 18935 1884 1 3 . 1 1 56 56 VAL C C 56 176.389 176.389 174.305 2.084 18935 1885 1 3 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.397 0.234 18935 1886 1 3 . 1 1 56 56 VAL CB C 56 32.784 32.784 32.886 -0.102 18935 1887 1 3 . 1 1 56 56 VAL H H 56 9.227 9.227 8.825 0.402 18935 1888 1 3 . 1 1 58 58 GLU N N 58 112.423 112.423 119.082 -6.659 18935 1889 1 3 . 1 1 58 58 GLU C C 58 175.946 175.946 176.419 -0.473 18935 1890 1 3 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.005 -0.705 18935 1891 1 3 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.740 0.357 18935 1892 1 3 . 1 1 58 58 GLU H H 58 6.685 6.685 7.899 -1.214 18935 1893 1 3 . 1 1 59 59 LYS N N 59 125.293 125.293 120.151 5.142 18935 1894 1 3 . 1 1 59 59 LYS C C 59 179.248 179.248 175.926 3.322 18935 1895 1 3 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.101 2.673 18935 1896 1 3 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.328 -1.251 18935 1897 1 3 . 1 1 59 59 LYS H H 59 9.108 9.108 8.478 0.630 18935 1898 1 3 . 1 1 60 60 LYS N N 60 117.408 117.408 117.006 0.402 18935 1899 1 3 . 1 1 60 60 LYS C C 60 177.198 177.198 177.224 -0.026 18935 1900 1 3 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.688 1.525 18935 1901 1 3 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.518 -1.935 18935 1902 1 3 . 1 1 60 60 LYS H H 60 9.102 9.102 7.374 1.728 18935 1903 1 3 . 1 1 61 61 LEU N N 61 114.779 114.779 120.023 -5.244 18935 1904 1 3 . 1 1 61 61 LEU C C 61 178.790 178.790 178.623 0.167 18935 1905 1 3 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.628 -2.604 18935 1906 1 3 . 1 1 61 61 LEU CB C 61 40.864 40.864 40.827 0.037 18935 1907 1 3 . 1 1 61 61 LEU H H 61 7.455 7.455 8.075 -0.620 18935 1908 1 3 . 1 1 62 62 LEU N N 62 119.629 119.629 118.054 1.575 18935 1909 1 3 . 1 1 62 62 LEU C C 62 177.762 177.762 177.655 0.107 18935 1910 1 3 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.666 0.532 18935 1911 1 3 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.905 -1.174 18935 1912 1 3 . 1 1 62 62 LEU H H 62 7.714 7.714 7.459 0.255 18935 1913 1 3 . 1 1 63 63 LYS N N 63 112.921 112.921 114.570 -1.649 18935 1914 1 3 . 1 1 63 63 LYS C C 63 175.386 175.386 177.216 -1.830 18935 1915 1 3 . 1 1 63 63 LYS CA C 63 57.356 57.356 56.223 1.133 18935 1916 1 3 . 1 1 63 63 LYS CB C 63 30.963 30.963 33.451 -2.488 18935 1917 1 3 . 1 1 63 63 LYS H H 63 7.751 7.751 8.288 -0.537 18935 1918 1 3 . 1 1 64 64 HIS N N 64 112.468 112.468 117.450 -4.982 18935 1919 1 3 . 1 1 64 64 HIS C C 64 176.081 176.081 176.175 -0.094 18935 1920 1 3 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.564 -1.795 18935 1921 1 3 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.221 1.149 18935 1922 1 3 . 1 1 64 64 HIS H H 64 7.697 7.697 7.793 -0.096 18935 1923 1 3 . 1 1 65 65 VAL N N 65 117.499 117.499 114.384 3.115 18935 1924 1 3 . 1 1 65 65 VAL C C 65 174.301 174.301 176.668 -2.367 18935 1925 1 3 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.938 2.392 18935 1926 1 3 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.829 -2.469 18935 1927 1 3 . 1 1 65 65 VAL H H 65 6.917 6.917 7.088 -0.171 18935 1928 1 3 . 1 1 66 66 LEU N N 66 113.873 113.873 120.119 -6.246 18935 1929 1 3 . 1 1 66 66 LEU CA C 66 57.850 57.850 58.812 -0.962 18935 1930 1 3 . 1 1 66 66 LEU CB C 66 36.058 36.058 38.783 -2.725 18935 1931 1 3 . 1 1 66 66 LEU H H 66 9.102 9.102 8.267 0.835 18935 1932 1 3 . 1 1 68 68 ASN N N 68 110.792 110.792 117.028 -6.236 18935 1933 1 3 . 1 1 68 68 ASN C C 68 174.877 174.877 173.895 0.982 18935 1934 1 3 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.697 -1.882 18935 1935 1 3 . 1 1 68 68 ASN CB C 68 40.311 40.311 39.201 1.110 18935 1936 1 3 . 1 1 68 68 ASN H H 68 7.234 7.234 8.556 -1.322 18935 1937 1 3 . 1 1 69 69 ILE N N 69 122.348 122.348 122.593 -0.245 18935 1938 1 3 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.661 -0.749 18935 1939 1 3 . 1 1 69 69 ILE CB C 69 38.038 38.038 38.431 -0.393 18935 1940 1 3 . 1 1 69 69 ILE H H 69 7.428 7.428 7.951 -0.523 18935 1941 1 3 . 1 1 70 70 ARG N N 70 125.701 125.701 126.202 -0.501 18935 1942 1 3 . 1 1 70 70 ARG C C 70 174.596 174.596 173.858 0.738 18935 1943 1 3 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.777 -1.616 18935 1944 1 3 . 1 1 70 70 ARG CB C 70 32.453 32.453 30.232 2.221 18935 1945 1 3 . 1 1 70 70 ARG H H 70 9.083 9.083 8.803 0.280 18935 1946 1 3 . 1 1 71 71 ILE N N 71 118.496 118.496 119.006 -0.510 18935 1947 1 3 . 1 1 71 71 ILE C C 71 175.625 175.625 176.324 -0.699 18935 1948 1 3 . 1 1 71 71 ILE CA C 71 59.776 59.776 60.790 -1.014 18935 1949 1 3 . 1 1 71 71 ILE CB C 71 37.967 37.967 38.842 -0.875 18935 1950 1 3 . 1 1 71 71 ILE H H 71 7.864 7.864 7.887 -0.023 18935 1951 1 3 . 1 1 72 72 LYS N N 72 127.423 127.423 125.423 2.000 18935 1952 1 3 . 1 1 72 72 LYS C C 72 177.659 177.659 176.719 0.940 18935 1953 1 3 . 1 1 72 72 LYS CA C 72 57.428 57.428 56.048 1.380 18935 1954 1 3 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.601 -1.227 18935 1955 1 3 . 1 1 72 72 LYS H H 72 8.720 8.720 8.829 -0.109 18935 1956 1 3 . 1 1 73 73 GLY N N 73 112.604 112.604 113.274 -0.670 18935 1957 1 3 . 1 1 73 73 GLY C C 73 173.729 173.729 173.492 0.237 18935 1958 1 3 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.187 0.644 18935 1959 1 3 . 1 1 73 73 GLY H H 73 8.930 8.930 9.005 -0.075 18935 1960 1 3 . 1 1 74 74 LEU N N 74 119.538 119.538 119.027 0.511 18935 1961 1 3 . 1 1 74 74 LEU C C 74 175.802 175.802 175.979 -0.177 18935 1962 1 3 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.761 -0.100 18935 1963 1 3 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.829 -0.776 18935 1964 1 3 . 1 1 74 74 LEU H H 74 7.547 7.547 7.892 -0.345 18935 1965 1 3 . 1 1 75 75 SER N N 75 118.994 118.994 117.327 1.667 18935 1966 1 3 . 1 1 75 75 SER C C 75 173.111 173.111 172.904 0.207 18935 1967 1 3 . 1 1 75 75 SER CA C 75 57.696 57.696 57.602 0.094 18935 1968 1 3 . 1 1 75 75 SER CB C 75 63.073 63.073 63.024 0.049 18935 1969 1 3 . 1 1 75 75 SER H H 75 9.076 9.076 8.793 0.283 18935 1970 1 3 . 1 1 76 76 PHE N N 76 117.802 117.802 121.197 -3.395 18935 1971 1 3 . 1 1 76 76 PHE C C 76 173.564 173.564 175.102 -1.538 18935 1972 1 3 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.314 -0.905 18935 1973 1 3 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.734 -0.891 18935 1974 1 3 . 1 1 76 76 PHE H H 76 8.119 8.119 7.699 0.420 18935 1975 1 3 . 1 1 77 77 SER N N 77 113.918 113.918 118.127 -4.209 18935 1976 1 3 . 1 1 77 77 SER C C 77 173.194 173.194 174.503 -1.309 18935 1977 1 3 . 1 1 77 77 SER CA C 77 55.999 55.999 57.248 -1.249 18935 1978 1 3 . 1 1 77 77 SER CB C 77 65.218 65.218 63.820 1.398 18935 1979 1 3 . 1 1 77 77 SER H H 77 8.989 8.989 8.598 0.391 18935 1980 1 3 . 1 1 78 78 VAL N N 78 123.662 123.662 123.931 -0.269 18935 1981 1 3 . 1 1 78 78 VAL C C 78 176.057 176.057 176.084 -0.027 18935 1982 1 3 . 1 1 78 78 VAL CA C 78 62.091 62.091 63.806 -1.715 18935 1983 1 3 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.265 1.030 18935 1984 1 3 . 1 1 78 78 VAL H H 78 8.995 8.995 8.426 0.569 18935 1985 1 3 . 1 1 79 79 LYS N N 79 129.417 129.417 128.900 0.517 18935 1986 1 3 . 1 1 79 79 LYS C C 79 176.436 176.436 174.658 1.778 18935 1987 1 3 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.165 3.487 18935 1988 1 3 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.482 -4.009 18935 1989 1 3 . 1 1 79 79 LYS H H 79 9.425 9.425 8.960 0.465 18935 1990 1 3 . 1 1 80 80 VAL N N 80 108.616 108.616 122.687 -14.071 18935 1991 1 3 . 1 1 80 80 VAL CA C 80 59.097 59.097 62.456 -3.359 18935 1992 1 3 . 1 1 80 80 VAL CB C 80 34.082 34.082 32.844 1.238 18935 1993 1 3 . 1 1 80 80 VAL H H 80 7.380 7.380 8.495 -1.115 18935 1994 1 3 . 1 1 81 81 CYS N N 81 123.254 123.254 128.838 -5.584 18935 1995 1 3 . 1 1 81 81 CYS C C 81 172.053 172.053 173.867 -1.814 18935 1996 1 3 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.588 2.151 18935 1997 1 3 . 1 1 81 81 CYS CB C 81 27.332 27.332 27.787 -0.455 18935 1998 1 3 . 1 1 81 81 CYS H H 81 9.759 9.759 8.405 1.354 18935 1999 1 3 . 1 1 82 82 GLY N N 82 118.450 118.450 115.234 3.216 18935 2000 1 3 . 1 1 82 82 GLY C C 82 171.814 171.814 174.635 -2.821 18935 2001 1 3 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.028 -1.675 18935 2002 1 3 . 1 1 82 82 GLY H H 82 8.537 8.537 8.491 0.046 18935 2003 1 3 . 1 1 83 83 GLU N N 83 113.964 113.964 121.553 -7.589 18935 2004 1 3 . 1 1 83 83 GLU C C 83 179.320 179.320 177.402 1.918 18935 2005 1 3 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.209 0.466 18935 2006 1 3 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.227 -0.320 18935 2007 1 3 . 1 1 83 83 GLU H H 83 8.473 8.473 8.826 -0.353 18935 2008 1 3 . 1 1 84 84 ARG N N 84 117.544 117.544 117.212 0.332 18935 2009 1 3 . 1 1 84 84 ARG C C 84 177.252 177.252 175.545 1.707 18935 2010 1 3 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.503 -0.999 18935 2011 1 3 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.655 -0.109 18935 2012 1 3 . 1 1 84 84 ARG H H 84 9.760 9.760 8.382 1.378 18935 2013 1 3 . 1 1 85 85 LYS N N 85 124.160 124.160 119.586 4.574 18935 2014 1 3 . 1 1 85 85 LYS C C 85 173.379 173.379 175.410 -2.031 18935 2015 1 3 . 1 1 85 85 LYS CA C 85 55.232 55.232 55.359 -0.127 18935 2016 1 3 . 1 1 85 85 LYS CB C 85 34.212 34.212 35.881 -1.669 18935 2017 1 3 . 1 1 85 85 LYS H H 85 8.494 8.494 7.714 0.780 18935 2018 1 3 . 1 1 86 86 CYS N N 86 126.472 126.472 118.415 8.057 18935 2019 1 3 . 1 1 86 86 CYS C C 86 171.935 171.935 172.962 -1.027 18935 2020 1 3 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.549 -1.671 18935 2021 1 3 . 1 1 86 86 CYS CB C 86 30.304 30.304 29.984 0.320 18935 2022 1 3 . 1 1 86 86 CYS H H 86 9.221 9.221 8.438 0.783 18935 2023 1 3 . 1 1 87 87 VAL N N 87 126.426 126.426 123.360 3.066 18935 2024 1 3 . 1 1 87 87 VAL C C 87 173.760 173.760 174.160 -0.400 18935 2025 1 3 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.179 0.154 18935 2026 1 3 . 1 1 87 87 VAL CB C 87 33.338 33.338 33.967 -0.629 18935 2027 1 3 . 1 1 87 87 VAL H H 87 8.623 8.623 9.232 -0.609 18935 2028 1 3 . 1 1 88 88 LEU N N 88 125.701 125.701 126.183 -0.482 18935 2029 1 3 . 1 1 88 88 LEU C C 88 175.424 175.424 175.066 0.358 18935 2030 1 3 . 1 1 88 88 LEU CA C 88 52.085 52.085 54.046 -1.961 18935 2031 1 3 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.797 -2.253 18935 2032 1 3 . 1 1 88 88 LEU H H 88 9.592 9.592 8.713 0.879 18935 2033 1 3 . 1 1 89 89 PHE N N 89 118.314 118.314 122.860 -4.546 18935 2034 1 3 . 1 1 89 89 PHE C C 89 177.068 177.068 175.724 1.344 18935 2035 1 3 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.175 -0.300 18935 2036 1 3 . 1 1 89 89 PHE CB C 89 38.837 38.837 38.170 0.667 18935 2037 1 3 . 1 1 89 89 PHE H H 89 8.979 8.979 8.795 0.184 18935 2038 1 3 . 1 1 90 90 ILE N N 90 119.039 119.039 122.327 -3.288 18935 2039 1 3 . 1 1 90 90 ILE C C 90 173.692 173.692 175.346 -1.654 18935 2040 1 3 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.588 -0.916 18935 2041 1 3 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.520 0.663 18935 2042 1 3 . 1 1 90 90 ILE H H 90 9.447 9.447 7.987 1.460 18935 2043 1 3 . 1 1 91 91 GLU N N 91 122.801 122.801 121.551 1.250 18935 2044 1 3 . 1 1 91 91 GLU C C 91 175.565 175.565 175.266 0.299 18935 2045 1 3 . 1 1 91 91 GLU CA C 91 54.465 54.465 54.826 -0.361 18935 2046 1 3 . 1 1 91 91 GLU CB C 91 29.662 29.662 32.026 -2.364 18935 2047 1 3 . 1 1 91 91 GLU H H 91 8.360 8.360 7.838 0.522 18935 2048 1 3 . 1 1 92 92 TRP N N 92 126.018 126.018 123.834 2.184 18935 2049 1 3 . 1 1 92 92 TRP C C 92 175.070 175.070 176.418 -1.348 18935 2050 1 3 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.123 0.067 18935 2051 1 3 . 1 1 92 92 TRP CB C 92 30.582 30.582 32.000 -1.418 18935 2052 1 3 . 1 1 92 92 TRP H H 92 9.425 9.425 9.032 0.393 18935 2053 1 3 . 1 1 93 93 GLU N N 93 126.381 126.381 124.799 1.582 18935 2054 1 3 . 1 1 93 93 GLU C C 93 175.637 175.637 175.927 -0.290 18935 2055 1 3 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.727 -0.958 18935 2056 1 3 . 1 1 93 93 GLU CB C 93 25.944 25.944 27.745 -1.801 18935 2057 1 3 . 1 1 93 93 GLU H H 93 8.914 8.914 9.087 -0.173 18935 2058 1 3 . 1 1 94 94 LYS N N 94 107.891 107.891 110.503 -2.612 18935 2059 1 3 . 1 1 94 94 LYS C C 94 175.359 175.359 176.239 -0.880 18935 2060 1 3 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.274 0.155 18935 2061 1 3 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.786 -2.144 18935 2062 1 3 . 1 1 94 94 LYS H H 94 8.634 8.634 8.506 0.128 18935 2063 1 3 . 1 1 95 95 LYS N N 95 120.490 120.490 119.745 0.745 18935 2064 1 3 . 1 1 95 95 LYS C C 95 174.369 174.369 174.628 -0.259 18935 2065 1 3 . 1 1 95 95 LYS CA C 95 54.353 54.353 55.211 -0.858 18935 2066 1 3 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.033 -0.570 18935 2067 1 3 . 1 1 95 95 LYS H H 95 7.924 7.924 7.893 0.031 18935 2068 1 3 . 1 1 96 96 THR N N 96 115.278 115.278 113.403 1.875 18935 2069 1 3 . 1 1 96 96 THR C C 96 174.317 174.317 173.415 0.902 18935 2070 1 3 . 1 1 96 96 THR CA C 96 61.203 61.203 60.401 0.802 18935 2071 1 3 . 1 1 96 96 THR CB C 96 69.348 69.348 70.070 -0.722 18935 2072 1 3 . 1 1 96 96 THR H H 96 7.967 7.967 7.872 0.096 18935 2073 1 3 . 1 1 97 97 TYR N N 97 123.254 123.254 124.984 -1.730 18935 2074 1 3 . 1 1 97 97 TYR C C 97 173.320 173.320 174.825 -1.505 18935 2075 1 3 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.380 -0.496 18935 2076 1 3 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.505 -0.369 18935 2077 1 3 . 1 1 97 97 TYR H H 97 9.232 9.232 8.827 0.405 18935 2078 1 3 . 1 1 98 98 GLN N N 98 122.574 122.574 117.956 4.618 18935 2079 1 3 . 1 1 98 98 GLN C C 98 172.781 172.781 174.617 -1.836 18935 2080 1 3 . 1 1 98 98 GLN CA C 98 55.171 55.171 54.669 0.502 18935 2081 1 3 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.954 -3.555 18935 2082 1 3 . 1 1 98 98 GLN H H 98 9.000 9.000 8.703 0.297 18935 2083 1 3 . 1 1 99 99 LEU N N 99 130.218 130.218 124.332 5.886 18935 2084 1 3 . 1 1 99 99 LEU C C 99 172.806 172.806 174.647 -1.841 18935 2085 1 3 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.540 -1.490 18935 2086 1 3 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.149 -0.397 18935 2087 1 3 . 1 1 99 99 LEU H H 99 9.246 9.246 9.201 0.045 18935 2088 1 3 . 1 1 100 100 ASP N N 100 124.931 124.931 127.096 -2.165 18935 2089 1 3 . 1 1 100 100 ASP C C 100 172.626 172.626 174.590 -1.964 18935 2090 1 3 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.243 -2.813 18935 2091 1 3 . 1 1 100 100 ASP CB C 100 37.328 37.328 42.483 -5.155 18935 2092 1 3 . 1 1 100 100 ASP H H 100 9.253 9.253 8.657 0.596 18935 2093 1 3 . 1 1 101 101 LEU N N 101 119.402 119.402 119.429 -0.027 18935 2094 1 3 . 1 1 101 101 LEU C C 101 173.869 173.869 174.504 -0.635 18935 2095 1 3 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.928 -1.273 18935 2096 1 3 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.252 0.914 18935 2097 1 3 . 1 1 101 101 LEU H H 101 8.726 8.726 7.562 1.164 18935 2098 1 3 . 1 1 102 102 PHE N N 102 117.952 117.952 118.699 -0.747 18935 2099 1 3 . 1 1 102 102 PHE C C 102 175.853 175.853 175.497 0.356 18935 2100 1 3 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.610 -2.328 18935 2101 1 3 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.293 1.531 18935 2102 1 3 . 1 1 102 102 PHE H H 102 8.236 8.236 8.676 -0.440 18935 2103 1 3 . 1 1 103 103 THR N N 103 106.853 106.853 118.913 -12.060 18935 2104 1 3 . 1 1 103 103 THR C C 103 175.154 175.154 173.981 1.173 18935 2105 1 3 . 1 1 103 103 THR CA C 103 57.685 57.685 61.040 -3.355 18935 2106 1 3 . 1 1 103 103 THR CB C 103 71.037 71.037 69.286 1.751 18935 2107 1 3 . 1 1 103 103 THR H H 103 7.917 7.917 8.612 -0.695 18935 2108 1 3 . 1 1 104 104 ALA N N 104 122.348 122.348 127.933 -5.585 18935 2109 1 3 . 1 1 104 104 ALA C C 104 175.947 175.947 174.782 1.165 18935 2110 1 3 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.314 -0.507 18935 2111 1 3 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.372 0.056 18935 2112 1 3 . 1 1 104 104 ALA H H 104 8.930 8.930 8.582 0.348 18935 2113 1 3 . 1 1 105 105 LEU N N 105 119.855 119.855 119.430 0.425 18935 2114 1 3 . 1 1 105 105 LEU C C 105 179.628 179.628 179.038 0.590 18935 2115 1 3 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.644 -1.521 18935 2116 1 3 . 1 1 105 105 LEU CB C 105 41.334 41.334 42.993 -1.659 18935 2117 1 3 . 1 1 105 105 LEU H H 105 8.316 8.316 9.073 -0.757 18935 2118 1 3 . 1 1 106 106 ALA N N 106 123.662 123.662 124.885 -1.223 18935 2119 1 3 . 1 1 106 106 ALA C C 106 181.056 181.056 179.337 1.719 18935 2120 1 3 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.392 0.957 18935 2121 1 3 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.457 -1.143 18935 2122 1 3 . 1 1 106 106 ALA H H 106 8.306 8.306 8.389 -0.083 18935 2123 1 3 . 1 1 107 107 GLU N N 107 114.825 114.825 115.644 -0.819 18935 2124 1 3 . 1 1 107 107 GLU C C 107 177.854 177.854 177.076 0.778 18935 2125 1 3 . 1 1 107 107 GLU CA C 107 58.386 58.386 58.121 0.265 18935 2126 1 3 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.387 -0.543 18935 2127 1 3 . 1 1 107 107 GLU H H 107 9.754 9.754 8.798 0.956 18935 2128 1 3 . 1 1 108 108 GLU N N 108 115.097 115.097 118.555 -3.458 18935 2129 1 3 . 1 1 108 108 GLU C C 108 178.001 178.001 177.421 0.580 18935 2130 1 3 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.462 -1.536 18935 2131 1 3 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.511 0.490 18935 2132 1 3 . 1 1 108 108 GLU H H 108 7.859 7.859 7.780 0.079 18935 2133 1 3 . 1 1 109 109 LYS N N 109 118.360 118.360 121.405 -3.045 18935 2134 1 3 . 1 1 109 109 LYS C C 109 172.691 172.691 175.911 -3.220 18935 2135 1 3 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.865 1.037 18935 2136 1 3 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.902 -0.361 18935 2137 1 3 . 1 1 109 109 LYS H H 109 7.660 7.660 7.509 0.151 18935 2138 1 3 . 1 1 111 111 TYR N N 111 114.054 114.054 118.947 -4.893 18935 2139 1 3 . 1 1 111 111 TYR C C 111 179.764 179.764 178.004 1.760 18935 2140 1 3 . 1 1 111 111 TYR CA C 111 58.998 58.998 61.152 -2.154 18935 2141 1 3 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.458 -1.502 18935 2142 1 3 . 1 1 111 111 TYR H H 111 6.583 6.583 8.346 -1.763 18935 2143 1 3 . 1 1 112 112 ALA N N 112 124.749 124.749 122.013 2.736 18935 2144 1 3 . 1 1 112 112 ALA C C 112 179.430 179.430 179.481 -0.051 18935 2145 1 3 . 1 1 112 112 ALA CA C 112 54.969 54.969 55.067 -0.098 18935 2146 1 3 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.776 0.035 18935 2147 1 3 . 1 1 112 112 ALA H H 112 8.753 8.753 9.026 -0.273 18935 2148 1 3 . 1 1 113 113 ILE N N 113 119.130 119.130 119.992 -0.862 18935 2149 1 3 . 1 1 113 113 ILE C C 113 178.646 178.646 178.264 0.382 18935 2150 1 3 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.775 1.627 18935 2151 1 3 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.793 0.444 18935 2152 1 3 . 1 1 113 113 ILE H H 113 8.946 8.946 8.524 0.422 18935 2153 1 3 . 1 1 114 114 PHE N N 114 121.758 121.758 120.811 0.947 18935 2154 1 3 . 1 1 114 114 PHE C C 114 177.954 177.954 176.754 1.200 18935 2155 1 3 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.951 -2.174 18935 2156 1 3 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.591 0.473 18935 2157 1 3 . 1 1 114 114 PHE H H 114 7.940 7.940 8.280 -0.340 18935 2158 1 3 . 1 1 115 115 HIS N N 115 116.547 116.547 119.307 -2.760 18935 2159 1 3 . 1 1 115 115 HIS C C 115 176.161 176.161 176.368 -0.207 18935 2160 1 3 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.492 -0.373 18935 2161 1 3 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.600 1.467 18935 2162 1 3 . 1 1 115 115 HIS H H 115 7.767 7.767 7.933 -0.166 18935 2163 1 3 . 1 1 116 116 PHE N N 116 109.387 109.387 113.540 -4.153 18935 2164 1 3 . 1 1 116 116 PHE C C 116 177.282 177.282 176.886 0.396 18935 2165 1 3 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.035 1.399 18935 2166 1 3 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.279 -2.024 18935 2167 1 3 . 1 1 116 116 PHE H H 116 8.989 8.989 8.349 0.640 18935 2168 1 3 . 1 1 117 117 THR N N 117 116.864 116.864 114.798 2.066 18935 2169 1 3 . 1 1 117 117 THR C C 117 172.889 172.889 175.225 -2.336 18935 2170 1 3 . 1 1 117 117 THR CA C 117 66.997 66.997 65.033 1.964 18935 2171 1 3 . 1 1 117 117 THR CB C 117 67.948 67.948 69.304 -1.356 18935 2172 1 3 . 1 1 117 117 THR H H 117 7.988 7.988 7.740 0.248 18935 2173 1 3 . 1 1 118 118 GLY N N 118 103.320 103.320 109.069 -5.749 18935 2174 1 3 . 1 1 118 118 GLY C C 118 176.912 176.912 171.387 5.525 18935 2175 1 3 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.774 1.408 18935 2176 1 3 . 1 1 118 118 GLY H H 118 6.550 6.550 7.200 -0.650 18935 2177 1 3 . 1 1 120 120 VAL N N 120 120.671 120.671 124.635 -3.964 18935 2178 1 3 . 1 1 120 120 VAL C C 120 176.283 176.283 177.859 -1.576 18935 2179 1 3 . 1 1 120 120 VAL CA C 120 66.940 66.940 66.557 0.383 18935 2180 1 3 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.722 -1.870 18935 2181 1 3 . 1 1 120 120 VAL H H 120 8.408 8.408 8.372 0.036 18935 2182 1 3 . 1 1 121 121 SER N N 121 111.789 111.789 114.481 -2.692 18935 2183 1 3 . 1 1 121 121 SER C C 121 175.658 175.658 176.560 -0.902 18935 2184 1 3 . 1 1 121 121 SER CA C 121 60.814 60.814 61.647 -0.833 18935 2185 1 3 . 1 1 121 121 SER CB C 121 60.253 60.253 62.668 -2.415 18935 2186 1 3 . 1 1 121 121 SER H H 121 8.290 8.290 8.161 0.129 18935 2187 1 3 . 1 1 122 122 TYR N N 122 123.254 123.254 121.903 1.351 18935 2188 1 3 . 1 1 122 122 TYR C C 122 174.611 174.611 177.484 -2.873 18935 2189 1 3 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.779 -2.233 18935 2190 1 3 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.186 -0.047 18935 2191 1 3 . 1 1 122 122 TYR H H 122 6.303 6.303 7.775 -1.472 18935 2192 1 3 . 1 1 123 123 LEU N N 123 114.825 114.825 118.391 -3.566 18935 2193 1 3 . 1 1 123 123 LEU C C 123 178.891 178.891 179.021 -0.130 18935 2194 1 3 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.501 -0.722 18935 2195 1 3 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.697 -0.059 18935 2196 1 3 . 1 1 123 123 LEU H H 123 6.965 6.965 7.207 -0.242 18935 2197 1 3 . 1 1 124 124 ILE N N 124 114.915 114.915 117.814 -2.899 18935 2198 1 3 . 1 1 124 124 ILE C C 124 177.187 177.187 177.989 -0.802 18935 2199 1 3 . 1 1 124 124 ILE CA C 124 64.431 64.431 63.832 0.599 18935 2200 1 3 . 1 1 124 124 ILE CB C 124 36.555 36.555 36.018 0.537 18935 2201 1 3 . 1 1 124 124 ILE H H 124 7.531 7.531 7.680 -0.149 18935 2202 1 3 . 1 1 125 125 ARG N N 125 115.278 115.278 117.839 -2.561 18935 2203 1 3 . 1 1 125 125 ARG C C 125 178.473 178.473 177.897 0.576 18935 2204 1 3 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.411 0.048 18935 2205 1 3 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.466 -2.387 18935 2206 1 3 . 1 1 125 125 ARG H H 125 6.809 6.809 7.570 -0.761 18935 2207 1 3 . 1 1 126 126 ILE N N 126 124.160 124.160 118.054 6.106 18935 2208 1 3 . 1 1 126 126 ILE C C 126 178.172 178.172 176.767 1.405 18935 2209 1 3 . 1 1 126 126 ILE CA C 126 60.927 60.927 61.265 -0.338 18935 2210 1 3 . 1 1 126 126 ILE CB C 126 34.466 34.466 38.503 -4.037 18935 2211 1 3 . 1 1 126 126 ILE H H 126 7.408 7.408 7.449 -0.041 18935 2212 1 3 . 1 1 127 127 ARG N N 127 117.136 117.136 122.136 -5.000 18935 2213 1 3 . 1 1 127 127 ARG C C 127 179.227 179.227 178.260 0.967 18935 2214 1 3 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.883 0.333 18935 2215 1 3 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.815 -2.026 18935 2216 1 3 . 1 1 127 127 ARG H H 127 8.230 8.230 8.280 -0.050 18935 2217 1 3 . 1 1 128 128 ALA N N 128 121.305 121.305 121.110 0.195 18935 2218 1 3 . 1 1 128 128 ALA C C 128 179.933 179.933 178.990 0.943 18935 2219 1 3 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.208 -0.502 18935 2220 1 3 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.158 0.180 18935 2221 1 3 . 1 1 128 128 ALA H H 128 8.666 8.666 7.749 0.917 18935 2222 1 3 . 1 1 129 129 ALA N N 129 120.943 120.943 121.452 -0.509 18935 2223 1 3 . 1 1 129 129 ALA C C 129 181.336 181.336 179.842 1.494 18935 2224 1 3 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.933 -0.225 18935 2225 1 3 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.303 -1.443 18935 2226 1 3 . 1 1 129 129 ALA H H 129 7.837 7.837 7.997 -0.160 18935 2227 1 3 . 1 1 130 130 LEU N N 130 117.726 117.726 117.961 -0.235 18935 2228 1 3 . 1 1 130 130 LEU C C 130 179.432 179.432 179.673 -0.241 18935 2229 1 3 . 1 1 130 130 LEU CA C 130 57.176 57.176 58.041 -0.865 18935 2230 1 3 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.703 -1.137 18935 2231 1 3 . 1 1 130 130 LEU H H 130 8.114 8.114 8.181 -0.067 18935 2232 1 3 . 1 1 131 131 LYS N N 131 124.115 124.115 121.711 2.404 18935 2233 1 3 . 1 1 131 131 LYS C C 131 181.452 181.452 179.336 2.116 18935 2234 1 3 . 1 1 131 131 LYS CA C 131 58.886 58.886 59.010 -0.124 18935 2235 1 3 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.903 0.295 18935 2236 1 3 . 1 1 131 131 LYS H H 131 8.849 8.849 7.861 0.988 18935 2237 1 3 . 1 1 132 132 LYS N N 132 119.447 119.447 118.265 1.182 18935 2238 1 3 . 1 1 132 132 LYS C C 132 177.607 177.607 177.915 -0.308 18935 2239 1 3 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.663 -0.711 18935 2240 1 3 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.852 -0.427 18935 2241 1 3 . 1 1 132 132 LYS H H 132 7.778 7.778 8.128 -0.350 18935 2242 1 3 . 1 1 133 133 LYS N N 133 116.638 116.638 115.172 1.466 18935 2243 1 3 . 1 1 133 133 LYS C C 133 174.681 174.681 175.948 -1.267 18935 2244 1 3 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.281 -0.203 18935 2245 1 3 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.355 -0.715 18935 2246 1 3 . 1 1 133 133 LYS H H 133 7.617 7.617 7.711 -0.094 18935 2247 1 3 . 1 1 134 134 ASN N N 134 110.792 110.792 117.590 -6.798 18935 2248 1 3 . 1 1 134 134 ASN C C 134 174.034 174.034 173.179 0.855 18935 2249 1 3 . 1 1 134 134 ASN CA C 134 54.615 54.615 53.995 0.620 18935 2250 1 3 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.032 -0.980 18935 2251 1 3 . 1 1 134 134 ASN H H 134 8.123 8.123 8.673 -0.550 18935 2252 1 3 . 1 1 135 135 TYR N N 135 115.867 115.867 117.205 -1.338 18935 2253 1 3 . 1 1 135 135 TYR C C 135 175.122 175.122 173.955 1.167 18935 2254 1 3 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.141 -0.389 18935 2255 1 3 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.666 -1.750 18935 2256 1 3 . 1 1 135 135 TYR H H 135 8.133 8.133 7.816 0.317 18935 2257 1 3 . 1 1 136 136 LYS N N 136 119.870 119.870 119.783 0.087 18935 2258 1 3 . 1 1 136 136 LYS C C 136 174.324 174.324 174.337 -0.013 18935 2259 1 3 . 1 1 136 136 LYS CA C 136 55.181 55.181 55.240 -0.060 18935 2260 1 3 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.463 -2.390 18935 2261 1 3 . 1 1 136 136 LYS H H 136 9.234 9.234 8.990 0.244 18935 2262 1 3 . 1 1 137 137 LEU N N 137 129.708 129.708 127.267 2.441 18935 2263 1 3 . 1 1 137 137 LEU C C 137 173.798 173.798 174.997 -1.199 18935 2264 1 3 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.179 -1.345 18935 2265 1 3 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.294 1.689 18935 2266 1 3 . 1 1 137 137 LEU H H 137 8.959 8.959 8.670 0.289 18935 2267 1 3 . 1 1 140 140 TYR N N 140 120.580 120.580 114.174 6.406 18935 2268 1 3 . 1 1 140 140 TYR C C 140 174.705 174.705 175.773 -1.068 18935 2269 1 3 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.704 -1.252 18935 2270 1 3 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.332 -0.031 18935 2271 1 3 . 1 1 140 140 TYR H H 140 8.962 8.962 7.209 1.753 18935 2272 1 3 . 1 1 141 141 GLY N N 141 104.986 104.986 106.062 -1.076 18935 2273 1 3 . 1 1 141 141 GLY C C 141 181.854 181.854 172.274 9.580 18935 2274 1 3 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.590 -0.468 18935 2275 1 3 . 1 1 141 141 GLY H H 141 7.555 7.555 7.488 0.067 18935 2276 1 3 . 1 1 142 142 LEU N N 142 118.269 118.269 120.969 -2.700 18935 2277 1 3 . 1 1 142 142 LEU C C 142 174.067 174.067 176.294 -2.227 18935 2278 1 3 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.697 -1.195 18935 2279 1 3 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.448 1.094 18935 2280 1 3 . 1 1 142 142 LEU H H 142 7.794 7.794 8.469 -0.675 18935 2281 1 3 . 1 1 143 143 PHE N N 143 122.076 122.076 124.922 -2.846 18935 2282 1 3 . 1 1 143 143 PHE C C 143 175.199 175.199 175.169 0.030 18935 2283 1 3 . 1 1 143 143 PHE CA C 143 56.032 56.032 58.117 -2.085 18935 2284 1 3 . 1 1 143 143 PHE CB C 143 42.070 42.070 41.002 1.069 18935 2285 1 3 . 1 1 143 143 PHE H H 143 9.522 9.522 9.554 -0.032 18935 2286 1 3 . 1 1 144 144 LYS N N 144 121.305 121.305 123.462 -2.157 18935 2287 1 3 . 1 1 144 144 LYS C C 144 176.917 176.917 175.852 1.065 18935 2288 1 3 . 1 1 144 144 LYS CA C 144 55.356 55.356 55.179 0.177 18935 2289 1 3 . 1 1 144 144 LYS CB C 144 33.679 33.679 34.178 -0.499 18935 2290 1 3 . 1 1 144 144 LYS H H 144 9.076 9.076 9.078 -0.002 18935 2291 1 3 . 1 1 145 145 ASN N N 145 126.834 126.834 124.904 1.930 18935 2292 1 3 . 1 1 145 145 ASN C C 145 175.070 175.070 175.173 -0.103 18935 2293 1 3 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.243 0.521 18935 2294 1 3 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.958 -1.528 18935 2295 1 3 . 1 1 145 145 ASN H H 145 9.618 9.618 9.228 0.390 18935 2296 1 3 . 1 1 146 146 GLN N N 146 110.112 110.112 112.071 -1.959 18935 2297 1 3 . 1 1 146 146 GLN C C 146 175.198 175.198 174.564 0.634 18935 2298 1 3 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.479 -0.583 18935 2299 1 3 . 1 1 146 146 GLN CB C 146 26.368 26.368 28.293 -1.925 18935 2300 1 3 . 1 1 146 146 GLN H H 146 9.140 9.140 8.844 0.296 18935 2301 1 3 . 1 1 147 147 THR N N 147 116.003 116.003 115.768 0.235 18935 2302 1 3 . 1 1 147 147 THR C C 147 173.224 173.224 173.476 -0.252 18935 2303 1 3 . 1 1 147 147 THR CA C 147 61.450 61.450 61.301 0.149 18935 2304 1 3 . 1 1 147 147 THR CB C 147 70.285 70.285 69.999 0.286 18935 2305 1 3 . 1 1 147 147 THR H H 147 8.069 8.069 7.599 0.470 18935 2306 1 3 . 1 1 148 148 LEU N N 148 129.281 129.281 129.028 0.253 18935 2307 1 3 . 1 1 148 148 LEU C C 148 176.703 176.703 175.207 1.496 18935 2308 1 3 . 1 1 148 148 LEU CA C 148 55.466 55.466 54.943 0.523 18935 2309 1 3 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.698 -0.973 18935 2310 1 3 . 1 1 148 148 LEU H H 148 8.831 8.831 8.770 0.061 18935 2311 1 3 . 1 1 149 149 VAL N N 149 130.189 130.189 127.390 2.799 18935 2312 1 3 . 1 1 149 149 VAL C C 149 175.012 175.012 173.848 1.164 18935 2313 1 3 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.452 0.817 18935 2314 1 3 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.091 -3.635 18935 2315 1 3 . 1 1 149 149 VAL H H 149 9.243 9.243 8.377 0.866 18935 2316 1 3 . 1 1 151 151 LEU N N 151 123.481 123.481 117.763 5.718 18935 2317 1 3 . 1 1 151 151 LEU C C 151 177.679 177.679 176.722 0.957 18935 2318 1 3 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.892 -0.895 18935 2319 1 3 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.992 0.627 18935 2320 1 3 . 1 1 151 151 LEU H H 151 8.080 8.080 8.057 0.023 18935 2321 1 3 . 1 1 152 152 LYS N N 152 126.381 126.381 121.877 4.504 18935 2322 1 3 . 1 1 152 152 LYS C C 152 175.115 175.115 175.294 -0.179 18935 2323 1 3 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.252 -1.656 18935 2324 1 3 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.243 -3.178 18935 2325 1 3 . 1 1 152 152 LYS H H 152 9.112 9.112 8.821 0.291 18935 2326 1 3 . 1 1 153 153 ILE N N 153 113.737 113.737 116.654 -2.917 18935 2327 1 3 . 1 1 153 153 ILE C C 153 175.748 175.748 174.698 1.050 18935 2328 1 3 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.106 -0.717 18935 2329 1 3 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.370 1.433 18935 2330 1 3 . 1 1 153 153 ILE H H 153 7.304 7.304 7.526 -0.222 18935 2331 1 3 . 1 1 154 154 THR N N 154 110.656 110.656 112.699 -2.043 18935 2332 1 3 . 1 1 154 154 THR C C 154 174.864 174.864 173.478 1.386 18935 2333 1 3 . 1 1 154 154 THR CA C 154 62.141 62.141 62.529 -0.388 18935 2334 1 3 . 1 1 154 154 THR CB C 154 70.413 70.413 69.987 0.426 18935 2335 1 3 . 1 1 154 154 THR H H 154 9.382 9.382 8.411 0.971 18935 2336 1 3 . 1 1 155 155 THR N N 155 110.746 110.746 115.895 -5.149 18935 2337 1 3 . 1 1 155 155 THR C C 155 174.718 174.718 174.858 -0.140 18935 2338 1 3 . 1 1 155 155 THR CA C 155 58.785 58.785 60.950 -2.164 18935 2339 1 3 . 1 1 155 155 THR CB C 155 72.277 72.277 71.218 1.059 18935 2340 1 3 . 1 1 155 155 THR H H 155 7.746 7.746 7.711 0.035 18935 2341 1 3 . 1 1 156 156 GLU N N 156 122.302 122.302 123.495 -1.193 18935 2342 1 3 . 1 1 156 156 GLU C C 156 177.289 177.289 178.080 -0.791 18935 2343 1 3 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.831 -2.007 18935 2344 1 3 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.487 -1.106 18935 2345 1 3 . 1 1 156 156 GLU H H 156 9.490 9.490 8.976 0.514 18935 2346 1 3 . 1 1 157 157 LYS N N 157 118.905 118.905 116.906 1.999 18935 2347 1 3 . 1 1 157 157 LYS C C 157 178.241 178.241 179.134 -0.893 18935 2348 1 3 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.233 1.532 18935 2349 1 3 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.725 -0.447 18935 2350 1 3 . 1 1 157 157 LYS H H 157 8.329 8.329 8.421 -0.092 18935 2351 1 3 . 1 1 158 158 GLU N N 158 116.230 116.230 120.816 -4.586 18935 2352 1 3 . 1 1 158 158 GLU C C 158 178.988 178.988 178.513 0.475 18935 2353 1 3 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.272 -0.016 18935 2354 1 3 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.096 -0.038 18935 2355 1 3 . 1 1 158 158 GLU H H 158 7.611 7.611 7.357 0.254 18935 2356 1 3 . 1 1 159 159 LEU N N 159 118.978 118.978 121.380 -2.402 18935 2357 1 3 . 1 1 159 159 LEU C C 159 176.347 176.347 178.446 -2.099 18935 2358 1 3 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.289 -5.050 18935 2359 1 3 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.863 -2.320 18935 2360 1 3 . 1 1 159 159 LEU H H 159 7.704 7.704 8.047 -0.343 18935 2361 1 3 . 1 1 160 160 ILE N N 160 117.227 117.227 114.814 2.413 18935 2362 1 3 . 1 1 160 160 ILE C C 160 177.219 177.219 177.481 -0.262 18935 2363 1 3 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.950 0.665 18935 2364 1 3 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.171 0.386 18935 2365 1 3 . 1 1 160 160 ILE H H 160 7.886 7.886 7.458 0.428 18935 2366 1 3 . 1 1 161 161 LYS N N 161 115.912 115.912 119.791 -3.879 18935 2367 1 3 . 1 1 161 161 LYS C C 161 180.990 180.990 178.936 2.054 18935 2368 1 3 . 1 1 161 161 LYS CA C 161 58.631 58.631 59.478 -0.848 18935 2369 1 3 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.207 -1.459 18935 2370 1 3 . 1 1 161 161 LYS H H 161 7.536 7.536 7.489 0.047 18935 2371 1 3 . 1 1 162 162 GLU N N 162 120.852 120.852 119.628 1.224 18935 2372 1 3 . 1 1 162 162 GLU C C 162 178.793 178.793 177.964 0.829 18935 2373 1 3 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.551 -0.569 18935 2374 1 3 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.424 -1.632 18935 2375 1 3 . 1 1 162 162 GLU H H 162 8.392 8.392 7.864 0.528 18935 2376 1 3 . 1 1 163 163 LEU N N 163 115.912 115.912 116.542 -0.630 18935 2377 1 3 . 1 1 163 163 LEU C C 163 176.370 176.370 177.257 -0.887 18935 2378 1 3 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.447 -0.353 18935 2379 1 3 . 1 1 163 163 LEU CB C 163 41.174 41.174 43.028 -1.853 18935 2380 1 3 . 1 1 163 163 LEU H H 163 8.031 8.031 7.676 0.355 18935 2381 1 3 . 1 1 164 164 GLY N N 164 103.160 103.160 104.339 -1.179 18935 2382 1 3 . 1 1 164 164 GLY C C 164 174.240 174.240 174.255 -0.015 18935 2383 1 3 . 1 1 164 164 GLY CA C 164 44.302 44.302 45.052 -0.750 18935 2384 1 3 . 1 1 164 164 GLY H H 164 7.625 7.625 7.847 -0.222 18935 2385 1 3 . 1 1 165 165 PHE N N 165 117.952 117.952 118.288 -0.336 18935 2386 1 3 . 1 1 165 165 PHE C C 165 174.556 174.556 174.612 -0.056 18935 2387 1 3 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.043 -0.578 18935 2388 1 3 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.890 -1.128 18935 2389 1 3 . 1 1 165 165 PHE H H 165 7.283 7.283 7.967 -0.684 18935 2390 1 3 . 1 1 166 166 THR N N 166 118.178 118.178 114.149 4.029 18935 2391 1 3 . 1 1 166 166 THR C C 166 175.306 175.306 174.110 1.196 18935 2392 1 3 . 1 1 166 166 THR CA C 166 63.466 63.466 60.340 3.127 18935 2393 1 3 . 1 1 166 166 THR CB C 166 68.721 68.721 70.688 -1.967 18935 2394 1 3 . 1 1 166 166 THR H H 166 9.678 9.678 8.534 1.144 18935 2395 1 3 . 1 1 167 167 TYR N N 167 128.239 128.239 122.727 5.512 18935 2396 1 3 . 1 1 167 167 TYR C C 167 173.297 173.297 175.556 -2.259 18935 2397 1 3 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.624 0.788 18935 2398 1 3 . 1 1 167 167 TYR CB C 167 36.722 36.722 38.872 -2.150 18935 2399 1 3 . 1 1 167 167 TYR H H 167 9.264 9.264 8.655 0.609 18935 2400 1 3 . 1 1 168 168 ARG N N 168 126.789 126.789 126.496 0.293 18935 2401 1 3 . 1 1 168 168 ARG C C 168 175.297 175.297 175.037 0.260 18935 2402 1 3 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.443 -1.678 18935 2403 1 3 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.994 -1.668 18935 2404 1 3 . 1 1 168 168 ARG H H 168 7.030 7.030 8.410 -1.380 18935 2405 1 3 . 1 1 169 169 ILE N N 169 119.221 119.221 118.285 0.936 18935 2406 1 3 . 1 1 169 169 ILE C C 169 174.522 174.522 175.509 -0.987 18935 2407 1 3 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.645 2.634 18935 2408 1 3 . 1 1 169 169 ILE CB C 169 34.647 34.647 38.851 -4.204 18935 2409 1 3 . 1 1 169 169 ILE H H 169 8.349 8.349 8.337 0.012 18935 2410 1 3 . 1 1 171 171 LYS N N 171 111.335 111.335 118.578 -7.243 18935 2411 1 3 . 1 1 171 171 LYS C C 171 176.638 176.638 177.347 -0.709 18935 2412 1 3 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.804 -1.266 18935 2413 1 3 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.681 0.286 18935 2414 1 3 . 1 1 171 171 LYS H H 171 8.198 8.198 8.407 -0.209 18935 2415 1 3 . 1 1 172 172 LYS N N 172 116.411 116.411 117.271 -0.860 18935 2416 1 3 . 1 1 172 172 LYS C C 172 175.331 175.331 175.834 -0.503 18935 2417 1 3 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.060 -1.059 18935 2418 1 3 . 1 1 172 172 LYS CB C 172 31.818 31.818 32.580 -0.762 18935 2419 1 3 . 1 1 172 172 LYS H H 172 7.843 7.843 7.669 0.174 18935 2420 1 3 . 1 1 173 173 ARG N N 173 120.490 120.490 118.181 2.309 18935 2421 1 3 . 1 1 173 173 ARG C C 173 172.830 172.830 175.159 -2.329 18935 2422 1 3 . 1 1 173 173 ARG CA C 173 57.175 57.175 52.762 4.413 18935 2423 1 3 . 1 1 173 173 ARG CB C 173 28.829 28.829 31.631 -2.802 18935 2424 1 3 . 1 1 173 173 ARG H H 173 6.917 6.917 7.562 -0.645 18935 2425 1 4 . 1 1 2 2 LEU N N 2 119.937 119.937 115.366 4.571 18935 2426 1 4 . 1 1 2 2 LEU C C 2 175.307 175.307 175.141 0.166 18935 2427 1 4 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.772 0.520 18935 2428 1 4 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.416 -1.732 18935 2429 1 4 . 1 1 2 2 LEU H H 2 9.251 9.251 8.027 1.224 18935 2430 1 4 . 1 1 3 3 THR N N 3 111.335 111.335 110.254 1.081 18935 2431 1 4 . 1 1 3 3 THR C C 3 175.854 175.854 175.777 0.077 18935 2432 1 4 . 1 1 3 3 THR CA C 3 60.540 60.540 60.564 -0.024 18935 2433 1 4 . 1 1 3 3 THR CB C 3 70.782 70.782 70.426 0.356 18935 2434 1 4 . 1 1 3 3 THR H H 3 8.677 8.677 8.171 0.506 18935 2435 1 4 . 1 1 4 4 LEU N N 4 120.988 120.988 122.600 -1.612 18935 2436 1 4 . 1 1 4 4 LEU C C 4 178.391 178.391 178.469 -0.078 18935 2437 1 4 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.802 0.262 18935 2438 1 4 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.607 -2.346 18935 2439 1 4 . 1 1 4 4 LEU H H 4 7.746 7.746 7.919 -0.173 18935 2440 1 4 . 1 1 5 5 ILE N N 5 114.236 114.236 114.485 -0.249 18935 2441 1 4 . 1 1 5 5 ILE C C 5 178.339 178.339 177.692 0.647 18935 2442 1 4 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.620 -1.038 18935 2443 1 4 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.023 -0.224 18935 2444 1 4 . 1 1 5 5 ILE H H 5 7.821 7.821 7.839 -0.018 18935 2445 1 4 . 1 1 6 6 GLN N N 6 120.399 120.399 120.985 -0.586 18935 2446 1 4 . 1 1 6 6 GLN C C 6 178.783 178.783 178.370 0.413 18935 2447 1 4 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.988 -0.768 18935 2448 1 4 . 1 1 6 6 GLN CB C 6 28.115 28.115 27.985 0.130 18935 2449 1 4 . 1 1 6 6 GLN H H 6 7.810 7.810 8.035 -0.225 18935 2450 1 4 . 1 1 7 7 GLY N N 7 106.277 106.277 106.195 0.082 18935 2451 1 4 . 1 1 7 7 GLY C C 7 174.554 174.554 176.312 -1.758 18935 2452 1 4 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.148 -0.214 18935 2453 1 4 . 1 1 7 7 GLY H H 7 8.733 8.733 8.094 0.639 18935 2454 1 4 . 1 1 8 8 LYS N N 8 119.991 119.991 121.510 -1.519 18935 2455 1 4 . 1 1 8 8 LYS C C 8 179.433 179.433 178.227 1.206 18935 2456 1 4 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.102 1.790 18935 2457 1 4 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.366 -1.034 18935 2458 1 4 . 1 1 8 8 LYS H H 8 8.688 8.688 7.417 1.271 18935 2459 1 4 . 1 1 9 9 LYS N N 9 119.175 119.175 120.680 -1.505 18935 2460 1 4 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.762 -0.380 18935 2461 1 4 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.525 -1.090 18935 2462 1 4 . 1 1 9 9 LYS H H 9 8.015 8.015 7.908 0.107 18935 2463 1 4 . 1 1 10 10 ILE N N 10 120.308 120.308 116.618 3.690 18935 2464 1 4 . 1 1 10 10 ILE C C 10 177.766 177.766 177.523 0.243 18935 2465 1 4 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.900 -0.224 18935 2466 1 4 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.467 -1.154 18935 2467 1 4 . 1 1 10 10 ILE H H 10 7.967 7.967 8.247 -0.280 18935 2468 1 4 . 1 1 11 11 VAL N N 11 119.130 119.130 119.739 -0.609 18935 2469 1 4 . 1 1 11 11 VAL C C 11 176.606 176.606 178.233 -1.627 18935 2470 1 4 . 1 1 11 11 VAL CA C 11 67.640 67.640 65.837 1.803 18935 2471 1 4 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.474 -0.265 18935 2472 1 4 . 1 1 11 11 VAL H H 11 8.128 8.128 7.624 0.504 18935 2473 1 4 . 1 1 12 12 ASN N N 12 115.822 115.822 117.219 -1.397 18935 2474 1 4 . 1 1 12 12 ASN C C 12 177.375 177.375 176.467 0.908 18935 2475 1 4 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.233 -0.263 18935 2476 1 4 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.749 -1.186 18935 2477 1 4 . 1 1 12 12 ASN H H 12 8.203 8.203 7.826 0.377 18935 2478 1 4 . 1 1 13 13 HIS N N 13 117.659 117.659 116.611 1.048 18935 2479 1 4 . 1 1 13 13 HIS C C 13 177.287 177.287 176.246 1.041 18935 2480 1 4 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.406 1.281 18935 2481 1 4 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.616 -0.595 18935 2482 1 4 . 1 1 13 13 HIS H H 13 7.861 7.861 8.041 -0.180 18935 2483 1 4 . 1 1 14 14 LEU N N 14 115.595 115.595 119.013 -3.418 18935 2484 1 4 . 1 1 14 14 LEU C C 14 179.092 179.092 177.748 1.344 18935 2485 1 4 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.029 0.612 18935 2486 1 4 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.969 -1.949 18935 2487 1 4 . 1 1 14 14 LEU H H 14 8.376 8.376 8.273 0.103 18935 2488 1 4 . 1 1 15 15 ARG N N 15 115.006 115.006 118.076 -3.070 18935 2489 1 4 . 1 1 15 15 ARG C C 15 176.265 176.265 176.574 -0.309 18935 2490 1 4 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.351 1.533 18935 2491 1 4 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.948 -0.876 18935 2492 1 4 . 1 1 15 15 ARG H H 15 8.074 8.074 8.140 -0.066 18935 2493 1 4 . 1 1 16 16 SER N N 16 107.778 107.778 112.159 -4.381 18935 2494 1 4 . 1 1 16 16 SER C C 16 176.009 176.009 174.559 1.450 18935 2495 1 4 . 1 1 16 16 SER CA C 16 57.244 57.244 58.813 -1.569 18935 2496 1 4 . 1 1 16 16 SER CB C 16 63.525 63.525 63.646 -0.121 18935 2497 1 4 . 1 1 16 16 SER H H 16 7.136 7.136 8.157 -1.021 18935 2498 1 4 . 1 1 17 17 ARG N N 17 121.532 121.532 120.134 1.398 18935 2499 1 4 . 1 1 17 17 ARG C C 17 174.482 174.482 175.492 -1.010 18935 2500 1 4 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.169 1.153 18935 2501 1 4 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.487 0.343 18935 2502 1 4 . 1 1 17 17 ARG H H 17 7.913 7.913 7.346 0.567 18935 2503 1 4 . 1 1 18 18 LEU N N 18 121.305 121.305 120.435 0.870 18935 2504 1 4 . 1 1 18 18 LEU C C 18 176.283 176.283 175.175 1.108 18935 2505 1 4 . 1 1 18 18 LEU CA C 18 54.698 54.698 54.885 -0.187 18935 2506 1 4 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.023 0.032 18935 2507 1 4 . 1 1 18 18 LEU H H 18 8.812 8.812 7.545 1.267 18935 2508 1 4 . 1 1 19 19 ALA N N 19 125.293 125.293 121.364 3.929 18935 2509 1 4 . 1 1 19 19 ALA C C 19 173.780 173.780 175.187 -1.407 18935 2510 1 4 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.660 -0.858 18935 2511 1 4 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.996 0.857 18935 2512 1 4 . 1 1 19 19 ALA H H 19 8.790 8.790 7.702 1.088 18935 2513 1 4 . 1 1 20 20 PHE N N 20 113.117 113.117 115.255 -2.138 18935 2514 1 4 . 1 1 20 20 PHE C C 20 172.708 172.708 172.917 -0.209 18935 2515 1 4 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.593 -0.995 18935 2516 1 4 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.357 0.368 18935 2517 1 4 . 1 1 20 20 PHE H H 20 8.925 8.925 8.792 0.133 18935 2518 1 4 . 1 1 21 21 GLU N N 21 121.532 121.532 120.105 1.427 18935 2519 1 4 . 1 1 21 21 GLU C C 21 174.830 174.830 175.195 -0.365 18935 2520 1 4 . 1 1 21 21 GLU CA C 21 54.963 54.963 56.266 -1.303 18935 2521 1 4 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.512 -2.169 18935 2522 1 4 . 1 1 21 21 GLU H H 21 7.972 7.972 9.288 -1.316 18935 2523 1 4 . 1 1 22 22 TYR N N 22 125.339 125.339 120.383 4.956 18935 2524 1 4 . 1 1 22 22 TYR C C 22 174.864 174.864 174.486 0.378 18935 2525 1 4 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.413 -3.124 18935 2526 1 4 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.101 -0.242 18935 2527 1 4 . 1 1 22 22 TYR H H 22 9.016 9.016 8.380 0.636 18935 2528 1 4 . 1 1 23 23 ASN N N 23 127.024 127.024 126.089 0.935 18935 2529 1 4 . 1 1 23 23 ASN C C 23 175.410 175.410 175.148 0.262 18935 2530 1 4 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.082 -1.028 18935 2531 1 4 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.704 -1.443 18935 2532 1 4 . 1 1 23 23 ASN H H 23 9.181 9.181 9.163 0.018 18935 2533 1 4 . 1 1 24 24 GLY N N 24 102.755 102.755 102.479 0.276 18935 2534 1 4 . 1 1 24 24 GLY C C 24 173.626 173.626 174.803 -1.177 18935 2535 1 4 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.078 -0.142 18935 2536 1 4 . 1 1 24 24 GLY H H 24 8.666 8.666 8.169 0.497 18935 2537 1 4 . 1 1 25 25 GLN N N 25 118.722 118.722 120.917 -2.195 18935 2538 1 4 . 1 1 25 25 GLN C C 25 173.657 173.657 175.032 -1.375 18935 2539 1 4 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.504 -1.271 18935 2540 1 4 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.459 0.346 18935 2541 1 4 . 1 1 25 25 GLN H H 25 7.708 7.708 8.065 -0.357 18935 2542 1 4 . 1 1 26 26 LEU N N 26 123.526 123.526 120.308 3.218 18935 2543 1 4 . 1 1 26 26 LEU C C 26 175.842 175.842 176.203 -0.361 18935 2544 1 4 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.859 0.127 18935 2545 1 4 . 1 1 26 26 LEU CB C 26 40.807 40.807 44.238 -3.431 18935 2546 1 4 . 1 1 26 26 LEU H H 26 8.543 8.543 8.297 0.246 18935 2547 1 4 . 1 1 27 27 ILE N N 27 129.462 129.462 124.046 5.416 18935 2548 1 4 . 1 1 27 27 ILE C C 27 175.085 175.085 174.227 0.858 18935 2549 1 4 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.383 0.590 18935 2550 1 4 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.387 -2.835 18935 2551 1 4 . 1 1 27 27 ILE H H 27 8.989 8.989 9.099 -0.110 18935 2552 1 4 . 1 1 28 28 LYS N N 28 125.157 125.157 126.669 -1.512 18935 2553 1 4 . 1 1 28 28 LYS C C 28 176.725 176.725 175.470 1.255 18935 2554 1 4 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.633 1.177 18935 2555 1 4 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.170 -1.353 18935 2556 1 4 . 1 1 28 28 LYS H H 28 8.311 8.311 8.258 0.053 18935 2557 1 4 . 1 1 29 29 ILE N N 29 125.565 125.565 115.566 9.999 18935 2558 1 4 . 1 1 29 29 ILE C C 29 175.685 175.685 173.686 1.999 18935 2559 1 4 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.576 0.829 18935 2560 1 4 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.383 -3.352 18935 2561 1 4 . 1 1 29 29 ILE H H 29 8.209 8.209 7.651 0.558 18935 2562 1 4 . 1 1 30 30 LEU N N 30 127.831 127.831 120.550 7.281 18935 2563 1 4 . 1 1 30 30 LEU C C 30 178.794 178.794 176.526 2.268 18935 2564 1 4 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.219 1.224 18935 2565 1 4 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.898 -5.062 18935 2566 1 4 . 1 1 30 30 LEU H H 30 9.027 9.027 8.111 0.916 18935 2567 1 4 . 1 1 31 31 SER N N 31 116.864 116.864 114.596 2.268 18935 2568 1 4 . 1 1 31 31 SER C C 31 177.464 177.464 175.889 1.575 18935 2569 1 4 . 1 1 31 31 SER CA C 31 61.180 61.180 60.825 0.355 18935 2570 1 4 . 1 1 31 31 SER CB C 31 62.105 62.105 63.092 -0.987 18935 2571 1 4 . 1 1 31 31 SER H H 31 8.887 8.887 8.338 0.549 18935 2572 1 4 . 1 1 32 32 LYS N N 32 114.825 114.825 119.786 -4.961 18935 2573 1 4 . 1 1 32 32 LYS C C 32 176.243 176.243 175.726 0.517 18935 2574 1 4 . 1 1 32 32 LYS CA C 32 57.292 57.292 56.645 0.647 18935 2575 1 4 . 1 1 32 32 LYS CB C 32 30.266 30.266 30.874 -0.608 18935 2576 1 4 . 1 1 32 32 LYS H H 32 8.290 8.290 8.405 -0.115 18935 2577 1 4 . 1 1 33 33 ASN N N 33 117.564 117.564 114.016 3.548 18935 2578 1 4 . 1 1 33 33 ASN C C 33 172.253 172.253 173.816 -1.563 18935 2579 1 4 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.208 -1.117 18935 2580 1 4 . 1 1 33 33 ASN CB C 33 38.339 38.339 41.492 -3.152 18935 2581 1 4 . 1 1 33 33 ASN H H 33 8.051 8.051 8.125 -0.074 18935 2582 1 4 . 1 1 34 34 ILE N N 34 118.949 118.949 121.360 -2.411 18935 2583 1 4 . 1 1 34 34 ILE C C 34 175.343 175.343 174.899 0.444 18935 2584 1 4 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.301 0.252 18935 2585 1 4 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.801 -2.934 18935 2586 1 4 . 1 1 34 34 ILE H H 34 7.670 7.670 7.843 -0.173 18935 2587 1 4 . 1 1 35 35 VAL N N 35 128.355 128.355 126.099 2.256 18935 2588 1 4 . 1 1 35 35 VAL C C 35 175.543 175.543 174.445 1.098 18935 2589 1 4 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.401 -0.387 18935 2590 1 4 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.431 -1.200 18935 2591 1 4 . 1 1 35 35 VAL H H 35 9.698 9.698 9.235 0.463 18935 2592 1 4 . 1 1 36 36 ALA N N 36 129.553 129.553 132.005 -2.452 18935 2593 1 4 . 1 1 36 36 ALA C C 36 177.015 177.015 176.621 0.394 18935 2594 1 4 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.407 0.989 18935 2595 1 4 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.524 -0.902 18935 2596 1 4 . 1 1 36 36 ALA H H 36 8.917 8.917 8.665 0.252 18935 2597 1 4 . 1 1 37 37 VAL N N 37 115.006 115.006 118.915 -3.909 18935 2598 1 4 . 1 1 37 37 VAL C C 37 174.649 174.649 175.262 -0.613 18935 2599 1 4 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.432 -0.111 18935 2600 1 4 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.986 -1.600 18935 2601 1 4 . 1 1 37 37 VAL H H 37 8.214 8.214 7.692 0.522 18935 2602 1 4 . 1 1 38 38 GLY N N 38 109.387 109.387 108.160 1.227 18935 2603 1 4 . 1 1 38 38 GLY C C 38 174.152 174.152 175.946 -1.794 18935 2604 1 4 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.049 0.448 18935 2605 1 4 . 1 1 38 38 GLY H H 38 8.677 8.677 7.963 0.714 18935 2606 1 4 . 1 1 39 39 SER N N 39 116.776 116.776 118.602 -1.826 18935 2607 1 4 . 1 1 39 39 SER C C 39 175.129 175.129 176.593 -1.464 18935 2608 1 4 . 1 1 39 39 SER CA C 39 60.036 60.036 62.123 -2.087 18935 2609 1 4 . 1 1 39 39 SER CB C 39 61.522 61.522 62.990 -1.468 18935 2610 1 4 . 1 1 39 39 SER H H 39 9.705 9.705 8.721 0.984 18935 2611 1 4 . 1 1 40 40 LEU N N 40 113.696 113.696 122.011 -8.315 18935 2612 1 4 . 1 1 40 40 LEU C C 40 180.558 180.558 177.353 3.205 18935 2613 1 4 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.986 1.387 18935 2614 1 4 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.774 0.103 18935 2615 1 4 . 1 1 40 40 LEU H H 40 7.311 7.311 8.193 -0.882 18935 2616 1 4 . 1 1 41 41 ARG N N 41 121.162 121.162 116.823 4.339 18935 2617 1 4 . 1 1 41 41 ARG C C 41 176.964 176.964 177.132 -0.168 18935 2618 1 4 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.863 1.588 18935 2619 1 4 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.340 -2.135 18935 2620 1 4 . 1 1 41 41 ARG H H 41 6.999 6.999 7.579 -0.580 18935 2621 1 4 . 1 1 42 42 ARG N N 42 111.109 111.109 118.475 -7.366 18935 2622 1 4 . 1 1 42 42 ARG C C 42 172.564 172.564 175.117 -2.553 18935 2623 1 4 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.460 0.920 18935 2624 1 4 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.785 -2.436 18935 2625 1 4 . 1 1 42 42 ARG H H 42 7.041 7.041 7.593 -0.552 18935 2626 1 4 . 1 1 43 43 GLU N N 43 111.924 111.924 116.261 -4.337 18935 2627 1 4 . 1 1 43 43 GLU C C 43 176.202 176.202 174.742 1.460 18935 2628 1 4 . 1 1 43 43 GLU CA C 43 56.454 56.454 56.949 -0.495 18935 2629 1 4 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.310 -2.009 18935 2630 1 4 . 1 1 43 43 GLU H H 43 7.757 7.757 7.929 -0.172 18935 2631 1 4 . 1 1 44 44 GLU N N 44 117.861 117.861 119.856 -1.995 18935 2632 1 4 . 1 1 44 44 GLU C C 44 175.197 175.197 176.231 -1.034 18935 2633 1 4 . 1 1 44 44 GLU CA C 44 56.128 56.128 55.494 0.634 18935 2634 1 4 . 1 1 44 44 GLU CB C 44 28.559 28.559 31.008 -2.449 18935 2635 1 4 . 1 1 44 44 GLU H H 44 7.461 7.461 7.702 -0.241 18935 2636 1 4 . 1 1 45 45 LYS N N 45 115.051 115.051 122.324 -7.273 18935 2637 1 4 . 1 1 45 45 LYS C C 45 177.733 177.733 176.071 1.662 18935 2638 1 4 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.423 1.631 18935 2639 1 4 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.304 -1.278 18935 2640 1 4 . 1 1 45 45 LYS H H 45 8.123 8.123 8.617 -0.494 18935 2641 1 4 . 1 1 46 46 MET N N 46 114.009 114.009 119.103 -5.094 18935 2642 1 4 . 1 1 46 46 MET C C 46 174.067 174.067 174.430 -0.363 18935 2643 1 4 . 1 1 46 46 MET CA C 46 52.477 52.477 54.706 -2.229 18935 2644 1 4 . 1 1 46 46 MET CB C 46 33.974 33.974 34.593 -0.619 18935 2645 1 4 . 1 1 46 46 MET H H 46 7.767 7.767 7.906 -0.139 18935 2646 1 4 . 1 1 47 47 LEU N N 47 120.263 120.263 125.723 -5.460 18935 2647 1 4 . 1 1 47 47 LEU C C 47 177.669 177.669 176.251 1.418 18935 2648 1 4 . 1 1 47 47 LEU CA C 47 52.201 52.201 54.375 -2.174 18935 2649 1 4 . 1 1 47 47 LEU CB C 47 42.908 42.908 42.898 0.010 18935 2650 1 4 . 1 1 47 47 LEU H H 47 9.481 9.481 8.734 0.747 18935 2651 1 4 . 1 1 48 48 ASN N N 48 118.632 118.632 116.379 2.253 18935 2652 1 4 . 1 1 48 48 ASN C C 48 174.715 174.715 174.002 0.713 18935 2653 1 4 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.648 1.853 18935 2654 1 4 . 1 1 48 48 ASN CB C 48 38.828 38.828 41.697 -2.869 18935 2655 1 4 . 1 1 48 48 ASN H H 48 9.388 9.388 9.118 0.270 18935 2656 1 4 . 1 1 49 49 ASP N N 49 115.867 115.867 115.424 0.443 18935 2657 1 4 . 1 1 49 49 ASP C C 49 174.111 174.111 174.279 -0.168 18935 2658 1 4 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.893 -1.692 18935 2659 1 4 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.180 -3.103 18935 2660 1 4 . 1 1 49 49 ASP H H 49 7.670 7.670 7.920 -0.250 18935 2661 1 4 . 1 1 50 50 VAL N N 50 119.185 119.185 119.078 0.107 18935 2662 1 4 . 1 1 50 50 VAL C C 50 172.333 172.333 174.389 -2.056 18935 2663 1 4 . 1 1 50 50 VAL CA C 50 61.915 61.915 60.748 1.167 18935 2664 1 4 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.576 -0.611 18935 2665 1 4 . 1 1 50 50 VAL H H 50 8.339 8.339 7.943 0.396 18935 2666 1 4 . 1 1 51 51 ASP N N 51 124.704 124.704 126.141 -1.437 18935 2667 1 4 . 1 1 51 51 ASP C C 51 173.725 173.725 175.104 -1.379 18935 2668 1 4 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.433 -0.405 18935 2669 1 4 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.975 -0.146 18935 2670 1 4 . 1 1 51 51 ASP H H 51 8.984 8.984 8.234 0.750 18935 2671 1 4 . 1 1 52 52 LEU N N 52 120.943 120.943 121.547 -0.604 18935 2672 1 4 . 1 1 52 52 LEU C C 52 173.045 173.045 174.121 -1.076 18935 2673 1 4 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.847 -0.976 18935 2674 1 4 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.190 -1.937 18935 2675 1 4 . 1 1 52 52 LEU H H 52 9.081 9.081 7.965 1.116 18935 2676 1 4 . 1 1 53 53 LEU N N 53 123.027 123.027 124.718 -1.691 18935 2677 1 4 . 1 1 53 53 LEU C C 53 173.750 173.750 174.928 -1.178 18935 2678 1 4 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.451 -1.118 18935 2679 1 4 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.544 -0.536 18935 2680 1 4 . 1 1 53 53 LEU H H 53 9.146 9.146 9.131 0.015 18935 2681 1 4 . 1 1 54 54 ILE N N 54 126.562 126.562 126.925 -0.363 18935 2682 1 4 . 1 1 54 54 ILE C C 54 175.132 175.132 175.092 0.040 18935 2683 1 4 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.871 -1.273 18935 2684 1 4 . 1 1 54 54 ILE CB C 54 38.561 38.561 40.076 -1.515 18935 2685 1 4 . 1 1 54 54 ILE H H 54 9.440 9.440 9.130 0.310 18935 2686 1 4 . 1 1 55 55 ILE N N 55 126.879 126.879 126.602 0.277 18935 2687 1 4 . 1 1 55 55 ILE C C 55 175.655 175.655 175.361 0.294 18935 2688 1 4 . 1 1 55 55 ILE CA C 55 57.561 57.561 59.829 -2.268 18935 2689 1 4 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.356 -5.050 18935 2690 1 4 . 1 1 55 55 ILE H H 55 9.381 9.381 8.514 0.867 18935 2691 1 4 . 1 1 56 56 VAL N N 56 128.936 128.936 123.266 5.670 18935 2692 1 4 . 1 1 56 56 VAL C C 56 176.389 176.389 174.743 1.646 18935 2693 1 4 . 1 1 56 56 VAL CA C 56 58.630 58.630 59.004 -0.374 18935 2694 1 4 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.973 -1.189 18935 2695 1 4 . 1 1 56 56 VAL H H 56 9.227 9.227 8.927 0.300 18935 2696 1 4 . 1 1 58 58 GLU N N 58 112.423 112.423 119.177 -6.754 18935 2697 1 4 . 1 1 58 58 GLU C C 58 175.946 175.946 176.465 -0.519 18935 2698 1 4 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.286 -0.987 18935 2699 1 4 . 1 1 58 58 GLU CB C 58 32.097 32.097 30.931 1.166 18935 2700 1 4 . 1 1 58 58 GLU H H 58 6.685 6.685 8.002 -1.317 18935 2701 1 4 . 1 1 59 59 LYS N N 59 125.293 125.293 119.898 5.395 18935 2702 1 4 . 1 1 59 59 LYS C C 59 179.248 179.248 175.978 3.270 18935 2703 1 4 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.290 2.484 18935 2704 1 4 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.488 -1.411 18935 2705 1 4 . 1 1 59 59 LYS H H 59 9.108 9.108 8.583 0.525 18935 2706 1 4 . 1 1 60 60 LYS N N 60 117.408 117.408 117.821 -0.413 18935 2707 1 4 . 1 1 60 60 LYS C C 60 177.198 177.198 178.337 -1.139 18935 2708 1 4 . 1 1 60 60 LYS CA C 60 58.213 58.213 57.225 0.988 18935 2709 1 4 . 1 1 60 60 LYS CB C 60 30.583 30.583 33.181 -2.598 18935 2710 1 4 . 1 1 60 60 LYS H H 60 9.102 9.102 7.650 1.452 18935 2711 1 4 . 1 1 61 61 LEU N N 61 114.779 114.779 121.521 -6.742 18935 2712 1 4 . 1 1 61 61 LEU C C 61 178.790 178.790 178.736 0.054 18935 2713 1 4 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.720 -2.696 18935 2714 1 4 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.442 -0.578 18935 2715 1 4 . 1 1 61 61 LEU H H 61 7.455 7.455 8.062 -0.607 18935 2716 1 4 . 1 1 62 62 LEU N N 62 119.629 119.629 118.118 1.511 18935 2717 1 4 . 1 1 62 62 LEU C C 62 177.762 177.762 177.773 -0.011 18935 2718 1 4 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.746 0.452 18935 2719 1 4 . 1 1 62 62 LEU CB C 62 40.731 40.731 42.001 -1.270 18935 2720 1 4 . 1 1 62 62 LEU H H 62 7.714 7.714 7.598 0.116 18935 2721 1 4 . 1 1 63 63 LYS N N 63 112.921 112.921 114.983 -2.062 18935 2722 1 4 . 1 1 63 63 LYS C C 63 175.386 175.386 177.338 -1.952 18935 2723 1 4 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.003 0.353 18935 2724 1 4 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.980 -2.017 18935 2725 1 4 . 1 1 63 63 LYS H H 63 7.751 7.751 8.162 -0.411 18935 2726 1 4 . 1 1 64 64 HIS N N 64 112.468 112.468 117.581 -5.113 18935 2727 1 4 . 1 1 64 64 HIS C C 64 176.081 176.081 176.340 -0.259 18935 2728 1 4 . 1 1 64 64 HIS CA C 64 55.769 55.769 58.548 -2.779 18935 2729 1 4 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.318 1.052 18935 2730 1 4 . 1 1 64 64 HIS H H 64 7.697 7.697 7.776 -0.079 18935 2731 1 4 . 1 1 65 65 VAL N N 65 117.499 117.499 119.517 -2.018 18935 2732 1 4 . 1 1 65 65 VAL C C 65 174.301 174.301 176.875 -2.574 18935 2733 1 4 . 1 1 65 65 VAL CA C 65 66.330 66.330 64.199 2.131 18935 2734 1 4 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.355 -1.995 18935 2735 1 4 . 1 1 65 65 VAL H H 65 6.917 6.917 7.233 -0.316 18935 2736 1 4 . 1 1 66 66 LEU N N 66 113.873 113.873 119.328 -5.455 18935 2737 1 4 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.742 0.108 18935 2738 1 4 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.187 -3.129 18935 2739 1 4 . 1 1 66 66 LEU H H 66 9.102 9.102 7.931 1.171 18935 2740 1 4 . 1 1 68 68 ASN N N 68 110.792 110.792 115.955 -5.163 18935 2741 1 4 . 1 1 68 68 ASN C C 68 174.877 174.877 173.306 1.571 18935 2742 1 4 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.623 -1.808 18935 2743 1 4 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.695 -1.384 18935 2744 1 4 . 1 1 68 68 ASN H H 68 7.234 7.234 8.344 -1.110 18935 2745 1 4 . 1 1 69 69 ILE N N 69 122.348 122.348 125.242 -2.894 18935 2746 1 4 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.262 -0.350 18935 2747 1 4 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.069 -2.031 18935 2748 1 4 . 1 1 69 69 ILE H H 69 7.428 7.428 8.615 -1.187 18935 2749 1 4 . 1 1 70 70 ARG N N 70 125.701 125.701 125.332 0.369 18935 2750 1 4 . 1 1 70 70 ARG C C 70 174.596 174.596 173.353 1.243 18935 2751 1 4 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.695 -1.534 18935 2752 1 4 . 1 1 70 70 ARG CB C 70 32.453 32.453 30.855 1.598 18935 2753 1 4 . 1 1 70 70 ARG H H 70 9.083 9.083 8.697 0.386 18935 2754 1 4 . 1 1 71 71 ILE N N 71 118.496 118.496 118.816 -0.320 18935 2755 1 4 . 1 1 71 71 ILE C C 71 175.625 175.625 176.411 -0.786 18935 2756 1 4 . 1 1 71 71 ILE CA C 71 59.776 59.776 60.890 -1.114 18935 2757 1 4 . 1 1 71 71 ILE CB C 71 37.967 37.967 39.017 -1.050 18935 2758 1 4 . 1 1 71 71 ILE H H 71 7.864 7.864 7.973 -0.109 18935 2759 1 4 . 1 1 72 72 LYS N N 72 127.423 127.423 125.624 1.799 18935 2760 1 4 . 1 1 72 72 LYS C C 72 177.659 177.659 176.699 0.960 18935 2761 1 4 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.808 1.620 18935 2762 1 4 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.352 -0.978 18935 2763 1 4 . 1 1 72 72 LYS H H 72 8.720 8.720 8.855 -0.135 18935 2764 1 4 . 1 1 73 73 GLY N N 73 112.604 112.604 112.580 0.024 18935 2765 1 4 . 1 1 73 73 GLY C C 73 173.729 173.729 173.495 0.234 18935 2766 1 4 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.065 0.766 18935 2767 1 4 . 1 1 73 73 GLY H H 73 8.930 8.930 8.864 0.066 18935 2768 1 4 . 1 1 74 74 LEU N N 74 119.538 119.538 119.811 -0.273 18935 2769 1 4 . 1 1 74 74 LEU C C 74 175.802 175.802 175.136 0.666 18935 2770 1 4 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.542 0.119 18935 2771 1 4 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.841 -0.788 18935 2772 1 4 . 1 1 74 74 LEU H H 74 7.547 7.547 7.544 0.003 18935 2773 1 4 . 1 1 75 75 SER N N 75 118.994 118.994 117.155 1.839 18935 2774 1 4 . 1 1 75 75 SER C C 75 173.111 173.111 172.778 0.333 18935 2775 1 4 . 1 1 75 75 SER CA C 75 57.696 57.696 57.832 -0.136 18935 2776 1 4 . 1 1 75 75 SER CB C 75 63.073 63.073 63.476 -0.403 18935 2777 1 4 . 1 1 75 75 SER H H 75 9.076 9.076 8.597 0.479 18935 2778 1 4 . 1 1 76 76 PHE N N 76 117.802 117.802 121.047 -3.245 18935 2779 1 4 . 1 1 76 76 PHE C C 76 173.564 173.564 174.598 -1.034 18935 2780 1 4 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.087 -0.678 18935 2781 1 4 . 1 1 76 76 PHE CB C 76 41.843 41.843 41.650 0.193 18935 2782 1 4 . 1 1 76 76 PHE H H 76 8.119 8.119 7.896 0.223 18935 2783 1 4 . 1 1 77 77 SER N N 77 113.918 113.918 118.258 -4.340 18935 2784 1 4 . 1 1 77 77 SER C C 77 173.194 173.194 173.367 -0.173 18935 2785 1 4 . 1 1 77 77 SER CA C 77 55.999 55.999 57.569 -1.570 18935 2786 1 4 . 1 1 77 77 SER CB C 77 65.218 65.218 65.310 -0.092 18935 2787 1 4 . 1 1 77 77 SER H H 77 8.989 8.989 8.409 0.580 18935 2788 1 4 . 1 1 78 78 VAL N N 78 123.662 123.662 126.930 -3.268 18935 2789 1 4 . 1 1 78 78 VAL C C 78 176.057 176.057 176.055 0.002 18935 2790 1 4 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.171 -0.080 18935 2791 1 4 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.150 1.144 18935 2792 1 4 . 1 1 78 78 VAL H H 78 8.995 8.995 8.891 0.104 18935 2793 1 4 . 1 1 79 79 LYS N N 79 129.417 129.417 129.376 0.041 18935 2794 1 4 . 1 1 79 79 LYS C C 79 176.436 176.436 174.787 1.649 18935 2795 1 4 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.127 3.525 18935 2796 1 4 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.315 -3.841 18935 2797 1 4 . 1 1 79 79 LYS H H 79 9.425 9.425 9.106 0.319 18935 2798 1 4 . 1 1 80 80 VAL N N 80 108.616 108.616 122.915 -14.299 18935 2799 1 4 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.216 -2.119 18935 2800 1 4 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.243 0.839 18935 2801 1 4 . 1 1 80 80 VAL H H 80 7.380 7.380 8.502 -1.122 18935 2802 1 4 . 1 1 81 81 CYS N N 81 123.254 123.254 128.278 -5.024 18935 2803 1 4 . 1 1 81 81 CYS C C 81 172.053 172.053 173.766 -1.713 18935 2804 1 4 . 1 1 81 81 CYS CA C 81 59.739 59.739 58.031 1.708 18935 2805 1 4 . 1 1 81 81 CYS CB C 81 27.332 27.332 27.904 -0.572 18935 2806 1 4 . 1 1 81 81 CYS H H 81 9.759 9.759 8.531 1.228 18935 2807 1 4 . 1 1 82 82 GLY N N 82 118.450 118.450 111.686 6.764 18935 2808 1 4 . 1 1 82 82 GLY C C 82 171.814 171.814 173.936 -2.122 18935 2809 1 4 . 1 1 82 82 GLY CA C 82 44.353 44.353 44.765 -0.412 18935 2810 1 4 . 1 1 82 82 GLY H H 82 8.537 8.537 7.926 0.611 18935 2811 1 4 . 1 1 83 83 GLU N N 83 113.964 113.964 120.223 -6.259 18935 2812 1 4 . 1 1 83 83 GLU C C 83 179.320 179.320 176.412 2.908 18935 2813 1 4 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.329 0.346 18935 2814 1 4 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.122 0.785 18935 2815 1 4 . 1 1 83 83 GLU H H 83 8.473 8.473 8.766 -0.293 18935 2816 1 4 . 1 1 84 84 ARG N N 84 117.544 117.544 115.382 2.162 18935 2817 1 4 . 1 1 84 84 ARG C C 84 177.252 177.252 175.846 1.406 18935 2818 1 4 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.355 -0.850 18935 2819 1 4 . 1 1 84 84 ARG CB C 84 31.546 31.546 32.062 -0.516 18935 2820 1 4 . 1 1 84 84 ARG H H 84 9.760 9.760 8.167 1.593 18935 2821 1 4 . 1 1 85 85 LYS N N 85 124.160 124.160 118.420 5.740 18935 2822 1 4 . 1 1 85 85 LYS C C 85 173.379 173.379 174.805 -1.426 18935 2823 1 4 . 1 1 85 85 LYS CA C 85 55.232 55.232 55.584 -0.352 18935 2824 1 4 . 1 1 85 85 LYS CB C 85 34.212 34.212 37.191 -2.979 18935 2825 1 4 . 1 1 85 85 LYS H H 85 8.494 8.494 7.680 0.814 18935 2826 1 4 . 1 1 86 86 CYS N N 86 126.472 126.472 118.815 7.657 18935 2827 1 4 . 1 1 86 86 CYS C C 86 171.935 171.935 172.880 -0.945 18935 2828 1 4 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.486 -1.608 18935 2829 1 4 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.736 -0.432 18935 2830 1 4 . 1 1 86 86 CYS H H 86 9.221 9.221 8.888 0.333 18935 2831 1 4 . 1 1 87 87 VAL N N 87 126.426 126.426 123.783 2.643 18935 2832 1 4 . 1 1 87 87 VAL C C 87 173.760 173.760 174.218 -0.458 18935 2833 1 4 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.703 -0.369 18935 2834 1 4 . 1 1 87 87 VAL CB C 87 33.338 33.338 33.287 0.051 18935 2835 1 4 . 1 1 87 87 VAL H H 87 8.623 8.623 9.068 -0.445 18935 2836 1 4 . 1 1 88 88 LEU N N 88 125.701 125.701 126.643 -0.942 18935 2837 1 4 . 1 1 88 88 LEU C C 88 175.424 175.424 175.124 0.300 18935 2838 1 4 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.432 -1.347 18935 2839 1 4 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.847 -2.303 18935 2840 1 4 . 1 1 88 88 LEU H H 88 9.592 9.592 9.103 0.489 18935 2841 1 4 . 1 1 89 89 PHE N N 89 118.314 118.314 122.537 -4.223 18935 2842 1 4 . 1 1 89 89 PHE C C 89 177.068 177.068 176.063 1.005 18935 2843 1 4 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.418 -0.543 18935 2844 1 4 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.349 -0.512 18935 2845 1 4 . 1 1 89 89 PHE H H 89 8.979 8.979 8.595 0.384 18935 2846 1 4 . 1 1 90 90 ILE N N 90 119.039 119.039 119.775 -0.736 18935 2847 1 4 . 1 1 90 90 ILE C C 90 173.692 173.692 174.957 -1.265 18935 2848 1 4 . 1 1 90 90 ILE CA C 90 58.672 58.672 60.374 -1.702 18935 2849 1 4 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.209 0.974 18935 2850 1 4 . 1 1 90 90 ILE H H 90 9.447 9.447 8.388 1.059 18935 2851 1 4 . 1 1 91 91 GLU N N 91 122.801 122.801 127.049 -4.248 18935 2852 1 4 . 1 1 91 91 GLU C C 91 175.565 175.565 174.755 0.810 18935 2853 1 4 . 1 1 91 91 GLU CA C 91 54.465 54.465 54.869 -0.404 18935 2854 1 4 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.179 -3.517 18935 2855 1 4 . 1 1 91 91 GLU H H 91 8.360 8.360 8.677 -0.317 18935 2856 1 4 . 1 1 92 92 TRP N N 92 126.018 126.018 122.614 3.404 18935 2857 1 4 . 1 1 92 92 TRP C C 92 175.070 175.070 175.154 -0.084 18935 2858 1 4 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.435 -0.246 18935 2859 1 4 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.124 -0.542 18935 2860 1 4 . 1 1 92 92 TRP H H 92 9.425 9.425 8.404 1.021 18935 2861 1 4 . 1 1 93 93 GLU N N 93 126.381 126.381 120.900 5.481 18935 2862 1 4 . 1 1 93 93 GLU C C 93 175.637 175.637 175.654 -0.017 18935 2863 1 4 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.968 -1.199 18935 2864 1 4 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.060 -2.116 18935 2865 1 4 . 1 1 93 93 GLU H H 93 8.914 8.914 9.209 -0.295 18935 2866 1 4 . 1 1 94 94 LYS N N 94 107.891 107.891 111.682 -3.791 18935 2867 1 4 . 1 1 94 94 LYS C C 94 175.359 175.359 175.685 -0.326 18935 2868 1 4 . 1 1 94 94 LYS CA C 94 57.429 57.429 56.981 0.448 18935 2869 1 4 . 1 1 94 94 LYS CB C 94 28.642 28.642 31.019 -2.377 18935 2870 1 4 . 1 1 94 94 LYS H H 94 8.634 8.634 8.479 0.155 18935 2871 1 4 . 1 1 95 95 LYS N N 95 120.490 120.490 118.566 1.924 18935 2872 1 4 . 1 1 95 95 LYS C C 95 174.369 174.369 173.995 0.374 18935 2873 1 4 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.260 0.093 18935 2874 1 4 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.647 -1.184 18935 2875 1 4 . 1 1 95 95 LYS H H 95 7.924 7.924 7.707 0.217 18935 2876 1 4 . 1 1 96 96 THR N N 96 115.278 115.278 112.393 2.885 18935 2877 1 4 . 1 1 96 96 THR C C 96 174.317 174.317 173.278 1.039 18935 2878 1 4 . 1 1 96 96 THR CA C 96 61.203 61.203 60.191 1.012 18935 2879 1 4 . 1 1 96 96 THR CB C 96 69.348 69.348 70.109 -0.761 18935 2880 1 4 . 1 1 96 96 THR H H 96 7.967 7.967 7.679 0.288 18935 2881 1 4 . 1 1 97 97 TYR N N 97 123.254 123.254 125.050 -1.796 18935 2882 1 4 . 1 1 97 97 TYR C C 97 173.320 173.320 174.600 -1.280 18935 2883 1 4 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.282 -0.398 18935 2884 1 4 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.879 -0.743 18935 2885 1 4 . 1 1 97 97 TYR H H 97 9.232 9.232 9.149 0.083 18935 2886 1 4 . 1 1 98 98 GLN N N 98 122.574 122.574 119.189 3.385 18935 2887 1 4 . 1 1 98 98 GLN C C 98 172.781 172.781 174.280 -1.499 18935 2888 1 4 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.031 0.140 18935 2889 1 4 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.832 -2.433 18935 2890 1 4 . 1 1 98 98 GLN H H 98 9.000 9.000 8.872 0.128 18935 2891 1 4 . 1 1 99 99 LEU N N 99 130.218 130.218 125.517 4.701 18935 2892 1 4 . 1 1 99 99 LEU C C 99 172.806 172.806 174.092 -1.286 18935 2893 1 4 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.490 -1.440 18935 2894 1 4 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.582 -0.830 18935 2895 1 4 . 1 1 99 99 LEU H H 99 9.246 9.246 9.093 0.153 18935 2896 1 4 . 1 1 100 100 ASP N N 100 124.931 124.931 127.104 -2.173 18935 2897 1 4 . 1 1 100 100 ASP C C 100 172.626 172.626 174.427 -1.801 18935 2898 1 4 . 1 1 100 100 ASP CA C 100 50.430 50.430 52.922 -2.493 18935 2899 1 4 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.455 -6.127 18935 2900 1 4 . 1 1 100 100 ASP H H 100 9.253 9.253 8.493 0.760 18935 2901 1 4 . 1 1 101 101 LEU N N 101 119.402 119.402 120.459 -1.057 18935 2902 1 4 . 1 1 101 101 LEU C C 101 173.869 173.869 174.628 -0.759 18935 2903 1 4 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.582 -0.927 18935 2904 1 4 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.659 0.507 18935 2905 1 4 . 1 1 101 101 LEU H H 101 8.726 8.726 8.071 0.655 18935 2906 1 4 . 1 1 102 102 PHE N N 102 117.952 117.952 119.263 -1.311 18935 2907 1 4 . 1 1 102 102 PHE C C 102 175.853 175.853 175.437 0.416 18935 2908 1 4 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.307 -2.025 18935 2909 1 4 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.715 1.109 18935 2910 1 4 . 1 1 102 102 PHE H H 102 8.236 8.236 8.630 -0.394 18935 2911 1 4 . 1 1 103 103 THR N N 103 106.853 106.853 119.201 -12.348 18935 2912 1 4 . 1 1 103 103 THR C C 103 175.154 175.154 173.719 1.435 18935 2913 1 4 . 1 1 103 103 THR CA C 103 57.685 57.685 60.934 -3.249 18935 2914 1 4 . 1 1 103 103 THR CB C 103 71.037 71.037 68.832 2.205 18935 2915 1 4 . 1 1 103 103 THR H H 103 7.917 7.917 8.803 -0.886 18935 2916 1 4 . 1 1 104 104 ALA N N 104 122.348 122.348 128.631 -6.283 18935 2917 1 4 . 1 1 104 104 ALA C C 104 175.947 175.947 174.957 0.990 18935 2918 1 4 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.046 -0.239 18935 2919 1 4 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.704 -0.276 18935 2920 1 4 . 1 1 104 104 ALA H H 104 8.930 8.930 9.079 -0.149 18935 2921 1 4 . 1 1 105 105 LEU N N 105 119.855 119.855 119.756 0.099 18935 2922 1 4 . 1 1 105 105 LEU C C 105 179.628 179.628 178.815 0.813 18935 2923 1 4 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.180 -1.057 18935 2924 1 4 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.365 -2.031 18935 2925 1 4 . 1 1 105 105 LEU H H 105 8.316 8.316 9.326 -1.010 18935 2926 1 4 . 1 1 106 106 ALA N N 106 123.662 123.662 124.482 -0.820 18935 2927 1 4 . 1 1 106 106 ALA C C 106 181.056 181.056 177.480 3.576 18935 2928 1 4 . 1 1 106 106 ALA CA C 106 56.349 56.349 54.924 1.425 18935 2929 1 4 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.545 -1.230 18935 2930 1 4 . 1 1 106 106 ALA H H 106 8.306 8.306 8.234 0.072 18935 2931 1 4 . 1 1 107 107 GLU N N 107 114.825 114.825 114.307 0.518 18935 2932 1 4 . 1 1 107 107 GLU C C 107 177.854 177.854 176.831 1.023 18935 2933 1 4 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.522 0.864 18935 2934 1 4 . 1 1 107 107 GLU CB C 107 27.844 27.844 29.376 -1.532 18935 2935 1 4 . 1 1 107 107 GLU H H 107 9.754 9.754 8.589 1.165 18935 2936 1 4 . 1 1 108 108 GLU N N 108 115.097 115.097 118.280 -3.183 18935 2937 1 4 . 1 1 108 108 GLU C C 108 178.001 178.001 177.540 0.461 18935 2938 1 4 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.689 -1.763 18935 2939 1 4 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.795 0.206 18935 2940 1 4 . 1 1 108 108 GLU H H 108 7.859 7.859 7.715 0.144 18935 2941 1 4 . 1 1 109 109 LYS N N 109 118.360 118.360 122.033 -3.673 18935 2942 1 4 . 1 1 109 109 LYS C C 109 172.691 172.691 176.255 -3.564 18935 2943 1 4 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.870 1.032 18935 2944 1 4 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.701 -0.160 18935 2945 1 4 . 1 1 109 109 LYS H H 109 7.660 7.660 7.587 0.073 18935 2946 1 4 . 1 1 111 111 TYR N N 111 114.054 114.054 118.509 -4.455 18935 2947 1 4 . 1 1 111 111 TYR C C 111 179.764 179.764 178.241 1.523 18935 2948 1 4 . 1 1 111 111 TYR CA C 111 58.998 58.998 59.384 -0.386 18935 2949 1 4 . 1 1 111 111 TYR CB C 111 35.956 35.956 36.829 -0.873 18935 2950 1 4 . 1 1 111 111 TYR H H 111 6.583 6.583 7.229 -0.646 18935 2951 1 4 . 1 1 112 112 ALA N N 112 124.749 124.749 122.243 2.506 18935 2952 1 4 . 1 1 112 112 ALA C C 112 179.430 179.430 179.539 -0.109 18935 2953 1 4 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.992 -0.023 18935 2954 1 4 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.761 0.051 18935 2955 1 4 . 1 1 112 112 ALA H H 112 8.753 8.753 8.319 0.434 18935 2956 1 4 . 1 1 113 113 ILE N N 113 119.130 119.130 119.775 -0.645 18935 2957 1 4 . 1 1 113 113 ILE C C 113 178.646 178.646 178.524 0.122 18935 2958 1 4 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.892 1.509 18935 2959 1 4 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.735 0.502 18935 2960 1 4 . 1 1 113 113 ILE H H 113 8.946 8.946 8.779 0.167 18935 2961 1 4 . 1 1 114 114 PHE N N 114 121.758 121.758 120.917 0.841 18935 2962 1 4 . 1 1 114 114 PHE C C 114 177.954 177.954 176.940 1.014 18935 2963 1 4 . 1 1 114 114 PHE CA C 114 59.777 59.777 62.233 -2.457 18935 2964 1 4 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.629 0.435 18935 2965 1 4 . 1 1 114 114 PHE H H 114 7.940 7.940 8.202 -0.262 18935 2966 1 4 . 1 1 115 115 HIS N N 115 116.547 116.547 119.109 -2.562 18935 2967 1 4 . 1 1 115 115 HIS C C 115 176.161 176.161 176.628 -0.467 18935 2968 1 4 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.637 -0.518 18935 2969 1 4 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.650 1.417 18935 2970 1 4 . 1 1 115 115 HIS H H 115 7.767 7.767 8.016 -0.249 18935 2971 1 4 . 1 1 116 116 PHE N N 116 109.387 109.387 114.435 -5.048 18935 2972 1 4 . 1 1 116 116 PHE C C 116 177.282 177.282 176.923 0.359 18935 2973 1 4 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.984 1.450 18935 2974 1 4 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.351 -2.096 18935 2975 1 4 . 1 1 116 116 PHE H H 116 8.989 8.989 8.292 0.697 18935 2976 1 4 . 1 1 117 117 THR N N 117 116.864 116.864 114.679 2.185 18935 2977 1 4 . 1 1 117 117 THR C C 117 172.889 172.889 175.619 -2.730 18935 2978 1 4 . 1 1 117 117 THR CA C 117 66.997 66.997 65.551 1.446 18935 2979 1 4 . 1 1 117 117 THR CB C 117 67.948 67.948 69.339 -1.391 18935 2980 1 4 . 1 1 117 117 THR H H 117 7.988 7.988 7.854 0.134 18935 2981 1 4 . 1 1 118 118 GLY N N 118 103.320 103.320 108.682 -5.362 18935 2982 1 4 . 1 1 118 118 GLY C C 118 176.912 176.912 171.659 5.253 18935 2983 1 4 . 1 1 118 118 GLY CA C 118 44.182 44.182 43.114 1.068 18935 2984 1 4 . 1 1 118 118 GLY H H 118 6.550 6.550 7.501 -0.951 18935 2985 1 4 . 1 1 120 120 VAL N N 120 120.671 120.671 126.309 -5.638 18935 2986 1 4 . 1 1 120 120 VAL C C 120 176.283 176.283 177.103 -0.820 18935 2987 1 4 . 1 1 120 120 VAL CA C 120 66.940 66.940 66.032 0.908 18935 2988 1 4 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.631 -1.779 18935 2989 1 4 . 1 1 120 120 VAL H H 120 8.408 8.408 8.536 -0.128 18935 2990 1 4 . 1 1 121 121 SER N N 121 111.789 111.789 114.451 -2.662 18935 2991 1 4 . 1 1 121 121 SER C C 121 175.658 175.658 176.756 -1.098 18935 2992 1 4 . 1 1 121 121 SER CA C 121 60.814 60.814 61.833 -1.019 18935 2993 1 4 . 1 1 121 121 SER CB C 121 60.253 60.253 62.259 -2.006 18935 2994 1 4 . 1 1 121 121 SER H H 121 8.290 8.290 8.358 -0.068 18935 2995 1 4 . 1 1 122 122 TYR N N 122 123.254 123.254 122.914 0.340 18935 2996 1 4 . 1 1 122 122 TYR C C 122 174.611 174.611 177.411 -2.800 18935 2997 1 4 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.735 -2.189 18935 2998 1 4 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.411 -0.272 18935 2999 1 4 . 1 1 122 122 TYR H H 122 6.303 6.303 7.581 -1.278 18935 3000 1 4 . 1 1 123 123 LEU N N 123 114.825 114.825 119.833 -5.008 18935 3001 1 4 . 1 1 123 123 LEU C C 123 178.891 178.891 179.140 -0.249 18935 3002 1 4 . 1 1 123 123 LEU CA C 123 56.779 56.779 58.020 -1.241 18935 3003 1 4 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.995 -0.357 18935 3004 1 4 . 1 1 123 123 LEU H H 123 6.965 6.965 7.482 -0.517 18935 3005 1 4 . 1 1 124 124 ILE N N 124 114.915 114.915 118.846 -3.931 18935 3006 1 4 . 1 1 124 124 ILE C C 124 177.187 177.187 178.199 -1.012 18935 3007 1 4 . 1 1 124 124 ILE CA C 124 64.431 64.431 64.155 0.276 18935 3008 1 4 . 1 1 124 124 ILE CB C 124 36.555 36.555 35.982 0.573 18935 3009 1 4 . 1 1 124 124 ILE H H 124 7.531 7.531 7.863 -0.332 18935 3010 1 4 . 1 1 125 125 ARG N N 125 115.278 115.278 117.390 -2.112 18935 3011 1 4 . 1 1 125 125 ARG C C 125 178.473 178.473 178.137 0.336 18935 3012 1 4 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.218 0.241 18935 3013 1 4 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.288 -2.209 18935 3014 1 4 . 1 1 125 125 ARG H H 125 6.809 6.809 7.619 -0.810 18935 3015 1 4 . 1 1 126 126 ILE N N 126 124.160 124.160 118.211 5.949 18935 3016 1 4 . 1 1 126 126 ILE C C 126 178.172 178.172 177.032 1.140 18935 3017 1 4 . 1 1 126 126 ILE CA C 126 60.927 60.927 61.200 -0.273 18935 3018 1 4 . 1 1 126 126 ILE CB C 126 34.466 34.466 38.416 -3.950 18935 3019 1 4 . 1 1 126 126 ILE H H 126 7.408 7.408 7.398 0.010 18935 3020 1 4 . 1 1 127 127 ARG N N 127 117.136 117.136 120.945 -3.809 18935 3021 1 4 . 1 1 127 127 ARG C C 127 179.227 179.227 178.451 0.776 18935 3022 1 4 . 1 1 127 127 ARG CA C 127 60.216 60.216 60.053 0.163 18935 3023 1 4 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.632 -1.843 18935 3024 1 4 . 1 1 127 127 ARG H H 127 8.230 8.230 8.216 0.014 18935 3025 1 4 . 1 1 128 128 ALA N N 128 121.305 121.305 121.270 0.035 18935 3026 1 4 . 1 1 128 128 ALA C C 128 179.933 179.933 178.753 1.180 18935 3027 1 4 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.145 -0.438 18935 3028 1 4 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.237 0.101 18935 3029 1 4 . 1 1 128 128 ALA H H 128 8.666 8.666 8.030 0.636 18935 3030 1 4 . 1 1 129 129 ALA N N 129 120.943 120.943 120.547 0.396 18935 3031 1 4 . 1 1 129 129 ALA C C 129 181.336 181.336 180.358 0.978 18935 3032 1 4 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.711 -0.003 18935 3033 1 4 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.174 -1.314 18935 3034 1 4 . 1 1 129 129 ALA H H 129 7.837 7.837 7.768 0.069 18935 3035 1 4 . 1 1 130 130 LEU N N 130 117.726 117.726 118.221 -0.495 18935 3036 1 4 . 1 1 130 130 LEU C C 130 179.432 179.432 179.457 -0.025 18935 3037 1 4 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.668 -0.492 18935 3038 1 4 . 1 1 130 130 LEU CB C 130 40.566 40.566 42.094 -1.528 18935 3039 1 4 . 1 1 130 130 LEU H H 130 8.114 8.114 8.091 0.023 18935 3040 1 4 . 1 1 131 131 LYS N N 131 124.115 124.115 118.748 5.367 18935 3041 1 4 . 1 1 131 131 LYS C C 131 181.452 181.452 178.509 2.943 18935 3042 1 4 . 1 1 131 131 LYS CA C 131 58.886 58.886 57.776 1.110 18935 3043 1 4 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.443 0.755 18935 3044 1 4 . 1 1 131 131 LYS H H 131 8.849 8.849 8.227 0.622 18935 3045 1 4 . 1 1 132 132 LYS N N 132 119.447 119.447 118.219 1.228 18935 3046 1 4 . 1 1 132 132 LYS C C 132 177.607 177.607 177.489 0.118 18935 3047 1 4 . 1 1 132 132 LYS CA C 132 57.952 57.952 56.972 0.980 18935 3048 1 4 . 1 1 132 132 LYS CB C 132 31.425 31.425 32.122 -0.697 18935 3049 1 4 . 1 1 132 132 LYS H H 132 7.778 7.778 7.720 0.058 18935 3050 1 4 . 1 1 133 133 LYS N N 133 116.638 116.638 117.896 -1.258 18935 3051 1 4 . 1 1 133 133 LYS C C 133 174.681 174.681 175.444 -0.763 18935 3052 1 4 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.305 -0.227 18935 3053 1 4 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.847 -1.207 18935 3054 1 4 . 1 1 133 133 LYS H H 133 7.617 7.617 7.911 -0.294 18935 3055 1 4 . 1 1 134 134 ASN N N 134 110.792 110.792 114.930 -4.138 18935 3056 1 4 . 1 1 134 134 ASN C C 134 174.034 174.034 173.368 0.666 18935 3057 1 4 . 1 1 134 134 ASN CA C 134 54.615 54.615 53.838 0.777 18935 3058 1 4 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.030 -0.978 18935 3059 1 4 . 1 1 134 134 ASN H H 134 8.123 8.123 8.293 -0.170 18935 3060 1 4 . 1 1 135 135 TYR N N 135 115.867 115.867 117.222 -1.355 18935 3061 1 4 . 1 1 135 135 TYR C C 135 175.122 175.122 174.798 0.324 18935 3062 1 4 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.182 -0.430 18935 3063 1 4 . 1 1 135 135 TYR CB C 135 41.916 41.916 42.623 -0.707 18935 3064 1 4 . 1 1 135 135 TYR H H 135 8.133 8.133 7.536 0.597 18935 3065 1 4 . 1 1 136 136 LYS N N 136 119.870 119.870 125.633 -5.763 18935 3066 1 4 . 1 1 136 136 LYS C C 136 174.324 174.324 174.541 -0.217 18935 3067 1 4 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.640 0.541 18935 3068 1 4 . 1 1 136 136 LYS CB C 136 34.073 34.073 35.455 -1.382 18935 3069 1 4 . 1 1 136 136 LYS H H 136 9.234 9.234 8.826 0.408 18935 3070 1 4 . 1 1 137 137 LEU N N 137 129.708 129.708 128.696 1.012 18935 3071 1 4 . 1 1 137 137 LEU C C 137 173.798 173.798 174.665 -0.867 18935 3072 1 4 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.467 -1.633 18935 3073 1 4 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.315 1.668 18935 3074 1 4 . 1 1 137 137 LEU H H 137 8.959 8.959 8.733 0.226 18935 3075 1 4 . 1 1 140 140 TYR N N 140 120.580 120.580 111.519 9.061 18935 3076 1 4 . 1 1 140 140 TYR C C 140 174.705 174.705 175.609 -0.904 18935 3077 1 4 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.178 -0.726 18935 3078 1 4 . 1 1 140 140 TYR CB C 140 38.301 38.301 39.939 -1.638 18935 3079 1 4 . 1 1 140 140 TYR H H 140 8.962 8.962 7.417 1.545 18935 3080 1 4 . 1 1 141 141 GLY N N 141 104.986 104.986 107.023 -2.037 18935 3081 1 4 . 1 1 141 141 GLY C C 141 181.854 181.854 172.050 9.804 18935 3082 1 4 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.840 -0.718 18935 3083 1 4 . 1 1 141 141 GLY H H 141 7.555 7.555 7.649 -0.094 18935 3084 1 4 . 1 1 142 142 LEU N N 142 118.269 118.269 121.460 -3.191 18935 3085 1 4 . 1 1 142 142 LEU C C 142 174.067 174.067 175.511 -1.444 18935 3086 1 4 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.080 -0.578 18935 3087 1 4 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.391 1.151 18935 3088 1 4 . 1 1 142 142 LEU H H 142 7.794 7.794 8.234 -0.440 18935 3089 1 4 . 1 1 143 143 PHE N N 143 122.076 122.076 125.458 -3.382 18935 3090 1 4 . 1 1 143 143 PHE C C 143 175.199 175.199 175.162 0.037 18935 3091 1 4 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.203 -1.171 18935 3092 1 4 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.694 2.376 18935 3093 1 4 . 1 1 143 143 PHE H H 143 9.522 9.522 9.517 0.005 18935 3094 1 4 . 1 1 144 144 LYS N N 144 121.305 121.305 125.292 -3.987 18935 3095 1 4 . 1 1 144 144 LYS C C 144 176.917 176.917 176.733 0.184 18935 3096 1 4 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.514 0.842 18935 3097 1 4 . 1 1 144 144 LYS CB C 144 33.679 33.679 32.916 0.763 18935 3098 1 4 . 1 1 144 144 LYS H H 144 9.076 9.076 8.999 0.077 18935 3099 1 4 . 1 1 145 145 ASN N N 145 126.834 126.834 125.544 1.290 18935 3100 1 4 . 1 1 145 145 ASN C C 145 175.070 175.070 174.782 0.288 18935 3101 1 4 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.245 0.519 18935 3102 1 4 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.160 -0.730 18935 3103 1 4 . 1 1 145 145 ASN H H 145 9.618 9.618 9.252 0.366 18935 3104 1 4 . 1 1 146 146 GLN N N 146 110.112 110.112 110.281 -0.169 18935 3105 1 4 . 1 1 146 146 GLN C C 146 175.198 175.198 174.959 0.239 18935 3106 1 4 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.833 -0.937 18935 3107 1 4 . 1 1 146 146 GLN CB C 146 26.368 26.368 28.158 -1.790 18935 3108 1 4 . 1 1 146 146 GLN H H 146 9.140 9.140 8.572 0.568 18935 3109 1 4 . 1 1 147 147 THR N N 147 116.003 116.003 117.271 -1.268 18935 3110 1 4 . 1 1 147 147 THR C C 147 173.224 173.224 173.552 -0.328 18935 3111 1 4 . 1 1 147 147 THR CA C 147 61.450 61.450 62.486 -1.036 18935 3112 1 4 . 1 1 147 147 THR CB C 147 70.285 70.285 69.365 0.920 18935 3113 1 4 . 1 1 147 147 THR H H 147 8.069 8.069 7.572 0.497 18935 3114 1 4 . 1 1 148 148 LEU N N 148 129.281 129.281 130.764 -1.483 18935 3115 1 4 . 1 1 148 148 LEU C C 148 176.703 176.703 175.640 1.063 18935 3116 1 4 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.204 0.262 18935 3117 1 4 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.900 -1.175 18935 3118 1 4 . 1 1 148 148 LEU H H 148 8.831 8.831 8.818 0.013 18935 3119 1 4 . 1 1 149 149 VAL N N 149 130.189 130.189 127.214 2.975 18935 3120 1 4 . 1 1 149 149 VAL C C 149 175.012 175.012 174.020 0.992 18935 3121 1 4 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.568 0.701 18935 3122 1 4 . 1 1 149 149 VAL CB C 149 31.456 31.456 34.760 -3.304 18935 3123 1 4 . 1 1 149 149 VAL H H 149 9.243 9.243 8.936 0.307 18935 3124 1 4 . 1 1 151 151 LEU N N 151 123.481 123.481 115.211 8.270 18935 3125 1 4 . 1 1 151 151 LEU C C 151 177.679 177.679 176.926 0.753 18935 3126 1 4 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.010 0.987 18935 3127 1 4 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.654 0.966 18935 3128 1 4 . 1 1 151 151 LEU H H 151 8.080 8.080 8.117 -0.037 18935 3129 1 4 . 1 1 152 152 LYS N N 152 126.381 126.381 120.501 5.880 18935 3130 1 4 . 1 1 152 152 LYS C C 152 175.115 175.115 175.282 -0.167 18935 3131 1 4 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.425 -1.829 18935 3132 1 4 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.128 -3.063 18935 3133 1 4 . 1 1 152 152 LYS H H 152 9.112 9.112 8.494 0.618 18935 3134 1 4 . 1 1 153 153 ILE N N 153 113.737 113.737 116.456 -2.719 18935 3135 1 4 . 1 1 153 153 ILE C C 153 175.748 175.748 173.557 2.191 18935 3136 1 4 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.518 -1.129 18935 3137 1 4 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.992 0.811 18935 3138 1 4 . 1 1 153 153 ILE H H 153 7.304 7.304 7.574 -0.270 18935 3139 1 4 . 1 1 154 154 THR N N 154 110.656 110.656 113.967 -3.311 18935 3140 1 4 . 1 1 154 154 THR C C 154 174.864 174.864 173.289 1.575 18935 3141 1 4 . 1 1 154 154 THR CA C 154 62.141 62.141 62.105 0.036 18935 3142 1 4 . 1 1 154 154 THR CB C 154 70.413 70.413 70.003 0.410 18935 3143 1 4 . 1 1 154 154 THR H H 154 9.382 9.382 8.357 1.025 18935 3144 1 4 . 1 1 155 155 THR N N 155 110.746 110.746 116.618 -5.872 18935 3145 1 4 . 1 1 155 155 THR C C 155 174.718 174.718 174.737 -0.019 18935 3146 1 4 . 1 1 155 155 THR CA C 155 58.785 58.785 61.106 -2.321 18935 3147 1 4 . 1 1 155 155 THR CB C 155 72.277 72.277 71.165 1.112 18935 3148 1 4 . 1 1 155 155 THR H H 155 7.746 7.746 7.649 0.097 18935 3149 1 4 . 1 1 156 156 GLU N N 156 122.302 122.302 124.314 -2.012 18935 3150 1 4 . 1 1 156 156 GLU C C 156 177.289 177.289 178.105 -0.816 18935 3151 1 4 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.805 -1.981 18935 3152 1 4 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.306 -0.925 18935 3153 1 4 . 1 1 156 156 GLU H H 156 9.490 9.490 9.052 0.438 18935 3154 1 4 . 1 1 157 157 LYS N N 157 118.905 118.905 116.854 2.051 18935 3155 1 4 . 1 1 157 157 LYS C C 157 178.241 178.241 179.187 -0.946 18935 3156 1 4 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.544 1.221 18935 3157 1 4 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.881 -0.603 18935 3158 1 4 . 1 1 157 157 LYS H H 157 8.329 8.329 8.414 -0.085 18935 3159 1 4 . 1 1 158 158 GLU N N 158 116.230 116.230 120.815 -4.585 18935 3160 1 4 . 1 1 158 158 GLU C C 158 178.988 178.988 178.563 0.425 18935 3161 1 4 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.521 -0.265 18935 3162 1 4 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.083 -0.025 18935 3163 1 4 . 1 1 158 158 GLU H H 158 7.611 7.611 7.370 0.241 18935 3164 1 4 . 1 1 159 159 LEU N N 159 118.978 118.978 121.550 -2.572 18935 3165 1 4 . 1 1 159 159 LEU C C 159 176.347 176.347 178.525 -2.178 18935 3166 1 4 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.447 -5.208 18935 3167 1 4 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.901 -2.358 18935 3168 1 4 . 1 1 159 159 LEU H H 159 7.704 7.704 8.362 -0.658 18935 3169 1 4 . 1 1 160 160 ILE N N 160 117.227 117.227 114.681 2.546 18935 3170 1 4 . 1 1 160 160 ILE C C 160 177.219 177.219 177.428 -0.209 18935 3171 1 4 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.091 0.524 18935 3172 1 4 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.165 0.392 18935 3173 1 4 . 1 1 160 160 ILE H H 160 7.886 7.886 7.485 0.401 18935 3174 1 4 . 1 1 161 161 LYS N N 161 115.912 115.912 119.949 -4.037 18935 3175 1 4 . 1 1 161 161 LYS C C 161 180.990 180.990 179.028 1.962 18935 3176 1 4 . 1 1 161 161 LYS CA C 161 58.631 58.631 59.454 -0.823 18935 3177 1 4 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.253 -1.505 18935 3178 1 4 . 1 1 161 161 LYS H H 161 7.536 7.536 7.475 0.061 18935 3179 1 4 . 1 1 162 162 GLU N N 162 120.852 120.852 119.820 1.032 18935 3180 1 4 . 1 1 162 162 GLU C C 162 178.793 178.793 178.021 0.772 18935 3181 1 4 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.516 -0.534 18935 3182 1 4 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.419 -1.627 18935 3183 1 4 . 1 1 162 162 GLU H H 162 8.392 8.392 7.983 0.409 18935 3184 1 4 . 1 1 163 163 LEU N N 163 115.912 115.912 116.773 -0.861 18935 3185 1 4 . 1 1 163 163 LEU C C 163 176.370 176.370 177.065 -0.695 18935 3186 1 4 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.462 -0.368 18935 3187 1 4 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.921 -1.747 18935 3188 1 4 . 1 1 163 163 LEU H H 163 8.031 8.031 7.703 0.328 18935 3189 1 4 . 1 1 164 164 GLY N N 164 103.160 103.160 105.235 -2.075 18935 3190 1 4 . 1 1 164 164 GLY C C 164 174.240 174.240 173.938 0.302 18935 3191 1 4 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.752 -0.450 18935 3192 1 4 . 1 1 164 164 GLY H H 164 7.625 7.625 7.820 -0.195 18935 3193 1 4 . 1 1 165 165 PHE N N 165 117.952 117.952 117.904 0.048 18935 3194 1 4 . 1 1 165 165 PHE C C 165 174.556 174.556 174.341 0.215 18935 3195 1 4 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.362 -0.897 18935 3196 1 4 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.136 -0.374 18935 3197 1 4 . 1 1 165 165 PHE H H 165 7.283 7.283 8.063 -0.780 18935 3198 1 4 . 1 1 166 166 THR N N 166 118.178 118.178 114.168 4.010 18935 3199 1 4 . 1 1 166 166 THR C C 166 175.306 175.306 174.105 1.201 18935 3200 1 4 . 1 1 166 166 THR CA C 166 63.466 63.466 60.305 3.161 18935 3201 1 4 . 1 1 166 166 THR CB C 166 68.721 68.721 71.014 -2.293 18935 3202 1 4 . 1 1 166 166 THR H H 166 9.678 9.678 8.590 1.088 18935 3203 1 4 . 1 1 167 167 TYR N N 167 128.239 128.239 123.194 5.045 18935 3204 1 4 . 1 1 167 167 TYR C C 167 173.297 173.297 175.334 -2.037 18935 3205 1 4 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.355 1.057 18935 3206 1 4 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.182 -2.460 18935 3207 1 4 . 1 1 167 167 TYR H H 167 9.264 9.264 8.694 0.570 18935 3208 1 4 . 1 1 168 168 ARG N N 168 126.789 126.789 126.270 0.519 18935 3209 1 4 . 1 1 168 168 ARG C C 168 175.297 175.297 174.891 0.406 18935 3210 1 4 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.303 -1.538 18935 3211 1 4 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.916 -1.589 18935 3212 1 4 . 1 1 168 168 ARG H H 168 7.030 7.030 8.597 -1.567 18935 3213 1 4 . 1 1 169 169 ILE N N 169 119.221 119.221 118.198 1.023 18935 3214 1 4 . 1 1 169 169 ILE C C 169 174.522 174.522 175.238 -0.716 18935 3215 1 4 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.190 3.090 18935 3216 1 4 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.683 -5.036 18935 3217 1 4 . 1 1 169 169 ILE H H 169 8.349 8.349 8.293 0.056 18935 3218 1 4 . 1 1 171 171 LYS N N 171 111.335 111.335 116.504 -5.169 18935 3219 1 4 . 1 1 171 171 LYS C C 171 176.638 176.638 177.889 -1.251 18935 3220 1 4 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.760 -1.222 18935 3221 1 4 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.719 0.248 18935 3222 1 4 . 1 1 171 171 LYS H H 171 8.198 8.198 8.443 -0.245 18935 3223 1 4 . 1 1 172 172 LYS N N 172 116.411 116.411 116.564 -0.153 18935 3224 1 4 . 1 1 172 172 LYS C C 172 175.331 175.331 175.585 -0.254 18935 3225 1 4 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.540 -1.539 18935 3226 1 4 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.599 -1.781 18935 3227 1 4 . 1 1 172 172 LYS H H 172 7.843 7.843 7.476 0.367 18935 3228 1 4 . 1 1 173 173 ARG N N 173 120.490 120.490 117.276 3.214 18935 3229 1 4 . 1 1 173 173 ARG C C 173 172.830 172.830 175.022 -2.192 18935 3230 1 4 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.336 0.839 18935 3231 1 4 . 1 1 173 173 ARG CB C 173 28.829 28.829 28.537 0.292 18935 3232 1 4 . 1 1 173 173 ARG H H 173 6.917 6.917 7.522 -0.605 18935 3233 1 5 . 1 1 2 2 LEU N N 2 119.937 119.937 115.832 4.105 18935 3234 1 5 . 1 1 2 2 LEU C C 2 175.307 175.307 174.879 0.428 18935 3235 1 5 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.936 0.356 18935 3236 1 5 . 1 1 2 2 LEU CB C 2 42.684 42.684 45.104 -2.420 18935 3237 1 5 . 1 1 2 2 LEU H H 2 9.251 9.251 7.999 1.252 18935 3238 1 5 . 1 1 3 3 THR N N 3 111.335 111.335 109.504 1.831 18935 3239 1 5 . 1 1 3 3 THR C C 3 175.854 175.854 175.626 0.228 18935 3240 1 5 . 1 1 3 3 THR CA C 3 60.540 60.540 59.572 0.968 18935 3241 1 5 . 1 1 3 3 THR CB C 3 70.782 70.782 71.001 -0.219 18935 3242 1 5 . 1 1 3 3 THR H H 3 8.677 8.677 8.101 0.576 18935 3243 1 5 . 1 1 4 4 LEU N N 4 120.988 120.988 122.386 -1.398 18935 3244 1 5 . 1 1 4 4 LEU C C 4 178.391 178.391 178.191 0.200 18935 3245 1 5 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.932 0.132 18935 3246 1 5 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.184 -2.923 18935 3247 1 5 . 1 1 4 4 LEU H H 4 7.746 7.746 8.752 -1.006 18935 3248 1 5 . 1 1 5 5 ILE N N 5 114.236 114.236 113.663 0.573 18935 3249 1 5 . 1 1 5 5 ILE C C 5 178.339 178.339 177.631 0.708 18935 3250 1 5 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.208 -0.626 18935 3251 1 5 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.271 -0.472 18935 3252 1 5 . 1 1 5 5 ILE H H 5 7.821 7.821 7.628 0.193 18935 3253 1 5 . 1 1 6 6 GLN N N 6 120.399 120.399 120.852 -0.453 18935 3254 1 5 . 1 1 6 6 GLN C C 6 178.783 178.783 178.364 0.419 18935 3255 1 5 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.718 -0.498 18935 3256 1 5 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.074 0.041 18935 3257 1 5 . 1 1 6 6 GLN H H 6 7.810 7.810 7.781 0.029 18935 3258 1 5 . 1 1 7 7 GLY N N 7 106.277 106.277 105.937 0.340 18935 3259 1 5 . 1 1 7 7 GLY C C 7 174.554 174.554 176.058 -1.504 18935 3260 1 5 . 1 1 7 7 GLY CA C 7 46.934 46.934 46.977 -0.043 18935 3261 1 5 . 1 1 7 7 GLY H H 7 8.733 8.733 7.999 0.734 18935 3262 1 5 . 1 1 8 8 LYS N N 8 119.991 119.991 120.802 -0.811 18935 3263 1 5 . 1 1 8 8 LYS C C 8 179.433 179.433 177.909 1.524 18935 3264 1 5 . 1 1 8 8 LYS CA C 8 59.892 59.892 57.912 1.980 18935 3265 1 5 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.239 -0.907 18935 3266 1 5 . 1 1 8 8 LYS H H 8 8.688 8.688 7.067 1.621 18935 3267 1 5 . 1 1 9 9 LYS N N 9 119.175 119.175 120.680 -1.505 18935 3268 1 5 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.678 -0.297 18935 3269 1 5 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.556 -1.121 18935 3270 1 5 . 1 1 9 9 LYS H H 9 8.015 8.015 7.741 0.274 18935 3271 1 5 . 1 1 10 10 ILE N N 10 120.308 120.308 115.922 4.386 18935 3272 1 5 . 1 1 10 10 ILE C C 10 177.766 177.766 177.581 0.185 18935 3273 1 5 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.653 0.023 18935 3274 1 5 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.255 -0.942 18935 3275 1 5 . 1 1 10 10 ILE H H 10 7.967 7.967 8.149 -0.182 18935 3276 1 5 . 1 1 11 11 VAL N N 11 119.130 119.130 120.677 -1.547 18935 3277 1 5 . 1 1 11 11 VAL C C 11 176.606 176.606 178.189 -1.583 18935 3278 1 5 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.524 1.116 18935 3279 1 5 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.131 -0.922 18935 3280 1 5 . 1 1 11 11 VAL H H 11 8.128 8.128 7.561 0.567 18935 3281 1 5 . 1 1 12 12 ASN N N 12 115.822 115.822 117.581 -1.759 18935 3282 1 5 . 1 1 12 12 ASN C C 12 177.375 177.375 177.267 0.108 18935 3283 1 5 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.200 -0.230 18935 3284 1 5 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.492 -0.929 18935 3285 1 5 . 1 1 12 12 ASN H H 12 8.203 8.203 7.811 0.392 18935 3286 1 5 . 1 1 13 13 HIS N N 13 117.659 117.659 117.620 0.039 18935 3287 1 5 . 1 1 13 13 HIS C C 13 177.287 177.287 176.555 0.732 18935 3288 1 5 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.528 1.159 18935 3289 1 5 . 1 1 13 13 HIS CB C 13 30.021 30.021 29.874 0.147 18935 3290 1 5 . 1 1 13 13 HIS H H 13 7.861 7.861 7.707 0.154 18935 3291 1 5 . 1 1 14 14 LEU N N 14 115.595 115.595 119.204 -3.609 18935 3292 1 5 . 1 1 14 14 LEU C C 14 179.092 179.092 177.852 1.240 18935 3293 1 5 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.387 0.254 18935 3294 1 5 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.504 -1.484 18935 3295 1 5 . 1 1 14 14 LEU H H 14 8.376 8.376 8.228 0.148 18935 3296 1 5 . 1 1 15 15 ARG N N 15 115.006 115.006 118.146 -3.140 18935 3297 1 5 . 1 1 15 15 ARG C C 15 176.265 176.265 176.679 -0.414 18935 3298 1 5 . 1 1 15 15 ARG CA C 15 59.884 59.884 57.506 2.378 18935 3299 1 5 . 1 1 15 15 ARG CB C 15 29.072 29.072 30.393 -1.321 18935 3300 1 5 . 1 1 15 15 ARG H H 15 8.074 8.074 7.939 0.135 18935 3301 1 5 . 1 1 16 16 SER N N 16 107.778 107.778 110.515 -2.737 18935 3302 1 5 . 1 1 16 16 SER C C 16 176.009 176.009 175.151 0.858 18935 3303 1 5 . 1 1 16 16 SER CA C 16 57.244 57.244 59.737 -2.493 18935 3304 1 5 . 1 1 16 16 SER CB C 16 63.525 63.525 63.871 -0.346 18935 3305 1 5 . 1 1 16 16 SER H H 16 7.136 7.136 8.365 -1.229 18935 3306 1 5 . 1 1 17 17 ARG N N 17 121.532 121.532 121.504 0.028 18935 3307 1 5 . 1 1 17 17 ARG C C 17 174.482 174.482 175.923 -1.441 18935 3308 1 5 . 1 1 17 17 ARG CA C 17 56.322 56.322 56.380 -0.058 18935 3309 1 5 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.649 1.181 18935 3310 1 5 . 1 1 17 17 ARG H H 17 7.913 7.913 8.030 -0.117 18935 3311 1 5 . 1 1 18 18 LEU N N 18 121.305 121.305 118.966 2.339 18935 3312 1 5 . 1 1 18 18 LEU C C 18 176.283 176.283 175.798 0.485 18935 3313 1 5 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.407 -0.709 18935 3314 1 5 . 1 1 18 18 LEU CB C 18 43.055 43.055 42.949 0.106 18935 3315 1 5 . 1 1 18 18 LEU H H 18 8.812 8.812 7.524 1.288 18935 3316 1 5 . 1 1 19 19 ALA N N 19 125.293 125.293 122.316 2.977 18935 3317 1 5 . 1 1 19 19 ALA C C 19 173.780 173.780 175.053 -1.273 18935 3318 1 5 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.889 -1.087 18935 3319 1 5 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.709 1.144 18935 3320 1 5 . 1 1 19 19 ALA H H 19 8.790 8.790 7.860 0.930 18935 3321 1 5 . 1 1 20 20 PHE N N 20 113.117 113.117 114.737 -1.620 18935 3322 1 5 . 1 1 20 20 PHE C C 20 172.708 172.708 172.846 -0.138 18935 3323 1 5 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.557 -0.959 18935 3324 1 5 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.247 -0.522 18935 3325 1 5 . 1 1 20 20 PHE H H 20 8.925 8.925 8.725 0.200 18935 3326 1 5 . 1 1 21 21 GLU N N 21 121.532 121.532 123.388 -1.856 18935 3327 1 5 . 1 1 21 21 GLU C C 21 174.830 174.830 174.633 0.197 18935 3328 1 5 . 1 1 21 21 GLU CA C 21 54.963 54.963 54.402 0.561 18935 3329 1 5 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.961 -2.618 18935 3330 1 5 . 1 1 21 21 GLU H H 21 7.972 7.972 8.864 -0.892 18935 3331 1 5 . 1 1 22 22 TYR N N 22 125.339 125.339 128.645 -3.306 18935 3332 1 5 . 1 1 22 22 TYR C C 22 174.864 174.864 175.245 -0.381 18935 3333 1 5 . 1 1 22 22 TYR CA C 22 55.288 55.288 56.572 -1.284 18935 3334 1 5 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.535 -0.676 18935 3335 1 5 . 1 1 22 22 TYR H H 22 9.016 9.016 8.723 0.293 18935 3336 1 5 . 1 1 23 23 ASN N N 23 127.024 127.024 126.164 0.860 18935 3337 1 5 . 1 1 23 23 ASN C C 23 175.410 175.410 174.735 0.675 18935 3338 1 5 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.025 -0.971 18935 3339 1 5 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.737 -1.476 18935 3340 1 5 . 1 1 23 23 ASN H H 23 9.181 9.181 9.299 -0.118 18935 3341 1 5 . 1 1 24 24 GLY N N 24 102.755 102.755 102.699 0.056 18935 3342 1 5 . 1 1 24 24 GLY C C 24 173.626 173.626 174.531 -0.905 18935 3343 1 5 . 1 1 24 24 GLY CA C 24 44.935 44.935 44.869 0.066 18935 3344 1 5 . 1 1 24 24 GLY H H 24 8.666 8.666 8.439 0.227 18935 3345 1 5 . 1 1 25 25 GLN N N 25 118.722 118.722 120.696 -1.974 18935 3346 1 5 . 1 1 25 25 GLN C C 25 173.657 173.657 174.932 -1.275 18935 3347 1 5 . 1 1 25 25 GLN CA C 25 53.233 53.233 55.208 -1.975 18935 3348 1 5 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.345 0.460 18935 3349 1 5 . 1 1 25 25 GLN H H 25 7.708 7.708 7.929 -0.221 18935 3350 1 5 . 1 1 26 26 LEU N N 26 123.526 123.526 122.299 1.227 18935 3351 1 5 . 1 1 26 26 LEU C C 26 175.842 175.842 176.448 -0.606 18935 3352 1 5 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.804 0.182 18935 3353 1 5 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.469 -2.662 18935 3354 1 5 . 1 1 26 26 LEU H H 26 8.543 8.543 8.386 0.157 18935 3355 1 5 . 1 1 27 27 ILE N N 27 129.462 129.462 123.945 5.517 18935 3356 1 5 . 1 1 27 27 ILE C C 27 175.085 175.085 174.406 0.679 18935 3357 1 5 . 1 1 27 27 ILE CA C 27 58.973 58.973 59.252 -0.279 18935 3358 1 5 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.378 -2.826 18935 3359 1 5 . 1 1 27 27 ILE H H 27 8.989 8.989 8.989 -0.000 18935 3360 1 5 . 1 1 28 28 LYS N N 28 125.157 125.157 126.529 -1.372 18935 3361 1 5 . 1 1 28 28 LYS C C 28 176.725 176.725 175.566 1.159 18935 3362 1 5 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.880 0.930 18935 3363 1 5 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.216 -1.399 18935 3364 1 5 . 1 1 28 28 LYS H H 28 8.311 8.311 8.339 -0.028 18935 3365 1 5 . 1 1 29 29 ILE N N 29 125.565 125.565 116.951 8.614 18935 3366 1 5 . 1 1 29 29 ILE C C 29 175.685 175.685 174.411 1.274 18935 3367 1 5 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.531 0.874 18935 3368 1 5 . 1 1 29 29 ILE CB C 29 37.031 37.031 39.788 -2.757 18935 3369 1 5 . 1 1 29 29 ILE H H 29 8.209 8.209 7.894 0.315 18935 3370 1 5 . 1 1 30 30 LEU N N 30 127.831 127.831 121.440 6.391 18935 3371 1 5 . 1 1 30 30 LEU C C 30 178.794 178.794 177.915 0.879 18935 3372 1 5 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.418 1.025 18935 3373 1 5 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.002 -4.167 18935 3374 1 5 . 1 1 30 30 LEU H H 30 9.027 9.027 8.275 0.752 18935 3375 1 5 . 1 1 31 31 SER N N 31 116.864 116.864 120.858 -3.994 18935 3376 1 5 . 1 1 31 31 SER C C 31 177.464 177.464 176.440 1.024 18935 3377 1 5 . 1 1 31 31 SER CA C 31 61.180 61.180 61.595 -0.415 18935 3378 1 5 . 1 1 31 31 SER CB C 31 62.105 62.105 62.887 -0.782 18935 3379 1 5 . 1 1 31 31 SER H H 31 8.887 8.887 8.902 -0.015 18935 3380 1 5 . 1 1 32 32 LYS N N 32 114.825 114.825 121.042 -6.217 18935 3381 1 5 . 1 1 32 32 LYS C C 32 176.243 176.243 177.473 -1.230 18935 3382 1 5 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.416 -1.123 18935 3383 1 5 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.271 -2.005 18935 3384 1 5 . 1 1 32 32 LYS H H 32 8.290 8.290 8.154 0.136 18935 3385 1 5 . 1 1 33 33 ASN N N 33 117.564 117.564 116.578 0.986 18935 3386 1 5 . 1 1 33 33 ASN C C 33 172.253 172.253 173.866 -1.613 18935 3387 1 5 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.654 -1.563 18935 3388 1 5 . 1 1 33 33 ASN CB C 33 38.339 38.339 39.158 -0.819 18935 3389 1 5 . 1 1 33 33 ASN H H 33 8.051 8.051 7.918 0.133 18935 3390 1 5 . 1 1 34 34 ILE N N 34 118.949 118.949 120.341 -1.392 18935 3391 1 5 . 1 1 34 34 ILE C C 34 175.343 175.343 175.134 0.209 18935 3392 1 5 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.158 0.395 18935 3393 1 5 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.946 -3.079 18935 3394 1 5 . 1 1 34 34 ILE H H 34 7.670 7.670 7.630 0.040 18935 3395 1 5 . 1 1 35 35 VAL N N 35 128.355 128.355 126.474 1.881 18935 3396 1 5 . 1 1 35 35 VAL C C 35 175.543 175.543 174.456 1.087 18935 3397 1 5 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.385 -0.371 18935 3398 1 5 . 1 1 35 35 VAL CB C 35 34.231 34.231 36.021 -1.790 18935 3399 1 5 . 1 1 35 35 VAL H H 35 9.698 9.698 9.220 0.478 18935 3400 1 5 . 1 1 36 36 ALA N N 36 129.553 129.553 131.677 -2.124 18935 3401 1 5 . 1 1 36 36 ALA C C 36 177.015 177.015 176.850 0.165 18935 3402 1 5 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.536 0.860 18935 3403 1 5 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.827 -1.205 18935 3404 1 5 . 1 1 36 36 ALA H H 36 8.917 8.917 8.639 0.278 18935 3405 1 5 . 1 1 37 37 VAL N N 37 115.006 115.006 121.267 -6.261 18935 3406 1 5 . 1 1 37 37 VAL C C 37 174.649 174.649 174.655 -0.006 18935 3407 1 5 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.883 -0.562 18935 3408 1 5 . 1 1 37 37 VAL CB C 37 32.386 32.386 34.554 -2.168 18935 3409 1 5 . 1 1 37 37 VAL H H 37 8.214 8.214 8.205 0.009 18935 3410 1 5 . 1 1 38 38 GLY N N 38 109.387 109.387 109.693 -0.306 18935 3411 1 5 . 1 1 38 38 GLY C C 38 174.152 174.152 175.452 -1.300 18935 3412 1 5 . 1 1 38 38 GLY CA C 38 45.497 45.497 44.965 0.532 18935 3413 1 5 . 1 1 38 38 GLY H H 38 8.677 8.677 8.232 0.445 18935 3414 1 5 . 1 1 39 39 SER N N 39 116.776 116.776 118.111 -1.335 18935 3415 1 5 . 1 1 39 39 SER C C 39 175.129 175.129 176.700 -1.571 18935 3416 1 5 . 1 1 39 39 SER CA C 39 60.036 60.036 62.484 -2.448 18935 3417 1 5 . 1 1 39 39 SER CB C 39 61.522 61.522 63.107 -1.585 18935 3418 1 5 . 1 1 39 39 SER H H 39 9.705 9.705 8.839 0.866 18935 3419 1 5 . 1 1 40 40 LEU N N 40 113.696 113.696 117.086 -3.390 18935 3420 1 5 . 1 1 40 40 LEU C C 40 180.558 180.558 177.574 2.984 18935 3421 1 5 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.769 1.604 18935 3422 1 5 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.462 0.415 18935 3423 1 5 . 1 1 40 40 LEU H H 40 7.311 7.311 8.046 -0.735 18935 3424 1 5 . 1 1 41 41 ARG N N 41 121.162 121.162 117.918 3.244 18935 3425 1 5 . 1 1 41 41 ARG C C 41 176.964 176.964 177.153 -0.189 18935 3426 1 5 . 1 1 41 41 ARG CA C 41 58.451 58.451 57.047 1.405 18935 3427 1 5 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.503 -2.298 18935 3428 1 5 . 1 1 41 41 ARG H H 41 6.999 6.999 7.769 -0.770 18935 3429 1 5 . 1 1 42 42 ARG N N 42 111.109 111.109 118.828 -7.719 18935 3430 1 5 . 1 1 42 42 ARG C C 42 172.564 172.564 175.173 -2.609 18935 3431 1 5 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.419 0.961 18935 3432 1 5 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.596 -2.247 18935 3433 1 5 . 1 1 42 42 ARG H H 42 7.041 7.041 7.562 -0.521 18935 3434 1 5 . 1 1 43 43 GLU N N 43 111.924 111.924 114.845 -2.921 18935 3435 1 5 . 1 1 43 43 GLU C C 43 176.202 176.202 175.065 1.137 18935 3436 1 5 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.022 -0.568 18935 3437 1 5 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.010 -1.709 18935 3438 1 5 . 1 1 43 43 GLU H H 43 7.757 7.757 7.958 -0.201 18935 3439 1 5 . 1 1 44 44 GLU N N 44 117.861 117.861 119.231 -1.370 18935 3440 1 5 . 1 1 44 44 GLU C C 44 175.197 175.197 176.658 -1.461 18935 3441 1 5 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.043 0.085 18935 3442 1 5 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.788 -2.229 18935 3443 1 5 . 1 1 44 44 GLU H H 44 7.461 7.461 7.653 -0.192 18935 3444 1 5 . 1 1 45 45 LYS N N 45 115.051 115.051 124.383 -9.332 18935 3445 1 5 . 1 1 45 45 LYS C C 45 177.733 177.733 176.315 1.418 18935 3446 1 5 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.926 1.129 18935 3447 1 5 . 1 1 45 45 LYS CB C 45 32.027 32.027 32.863 -0.836 18935 3448 1 5 . 1 1 45 45 LYS H H 45 8.123 8.123 8.603 -0.480 18935 3449 1 5 . 1 1 46 46 MET N N 46 114.009 114.009 117.921 -3.912 18935 3450 1 5 . 1 1 46 46 MET C C 46 174.067 174.067 174.255 -0.188 18935 3451 1 5 . 1 1 46 46 MET CA C 46 52.477 52.477 54.701 -2.224 18935 3452 1 5 . 1 1 46 46 MET CB C 46 33.974 33.974 35.068 -1.094 18935 3453 1 5 . 1 1 46 46 MET H H 46 7.767 7.767 7.438 0.329 18935 3454 1 5 . 1 1 47 47 LEU N N 47 120.263 120.263 121.481 -1.218 18935 3455 1 5 . 1 1 47 47 LEU C C 47 177.669 177.669 175.537 2.132 18935 3456 1 5 . 1 1 47 47 LEU CA C 47 52.201 52.201 52.959 -0.758 18935 3457 1 5 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.461 -0.553 18935 3458 1 5 . 1 1 47 47 LEU H H 47 9.481 9.481 8.610 0.871 18935 3459 1 5 . 1 1 48 48 ASN N N 48 118.632 118.632 118.096 0.536 18935 3460 1 5 . 1 1 48 48 ASN C C 48 174.715 174.715 174.275 0.440 18935 3461 1 5 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.833 1.668 18935 3462 1 5 . 1 1 48 48 ASN CB C 48 38.828 38.828 41.039 -2.211 18935 3463 1 5 . 1 1 48 48 ASN H H 48 9.388 9.388 9.068 0.320 18935 3464 1 5 . 1 1 49 49 ASP N N 49 115.867 115.867 116.757 -0.890 18935 3465 1 5 . 1 1 49 49 ASP C C 49 174.111 174.111 174.281 -0.170 18935 3466 1 5 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.863 -1.662 18935 3467 1 5 . 1 1 49 49 ASP CB C 49 40.077 40.077 44.050 -3.973 18935 3468 1 5 . 1 1 49 49 ASP H H 49 7.670 7.670 7.837 -0.167 18935 3469 1 5 . 1 1 50 50 VAL N N 50 119.185 119.185 117.638 1.547 18935 3470 1 5 . 1 1 50 50 VAL C C 50 172.333 172.333 174.487 -2.154 18935 3471 1 5 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.831 0.084 18935 3472 1 5 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.504 -1.539 18935 3473 1 5 . 1 1 50 50 VAL H H 50 8.339 8.339 7.826 0.513 18935 3474 1 5 . 1 1 51 51 ASP N N 51 124.704 124.704 126.359 -1.655 18935 3475 1 5 . 1 1 51 51 ASP C C 51 173.725 173.725 175.348 -1.623 18935 3476 1 5 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.229 -0.201 18935 3477 1 5 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.716 0.113 18935 3478 1 5 . 1 1 51 51 ASP H H 51 8.984 8.984 8.287 0.697 18935 3479 1 5 . 1 1 52 52 LEU N N 52 120.943 120.943 121.833 -0.890 18935 3480 1 5 . 1 1 52 52 LEU C C 52 173.045 173.045 174.693 -1.648 18935 3481 1 5 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.325 -1.454 18935 3482 1 5 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.787 -2.534 18935 3483 1 5 . 1 1 52 52 LEU H H 52 9.081 9.081 8.808 0.273 18935 3484 1 5 . 1 1 53 53 LEU N N 53 123.027 123.027 122.096 0.931 18935 3485 1 5 . 1 1 53 53 LEU C C 53 173.750 173.750 175.067 -1.317 18935 3486 1 5 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.526 -1.193 18935 3487 1 5 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.977 -0.969 18935 3488 1 5 . 1 1 53 53 LEU H H 53 9.146 9.146 9.074 0.072 18935 3489 1 5 . 1 1 54 54 ILE N N 54 126.562 126.562 124.669 1.893 18935 3490 1 5 . 1 1 54 54 ILE C C 54 175.132 175.132 175.322 -0.190 18935 3491 1 5 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.825 -1.227 18935 3492 1 5 . 1 1 54 54 ILE CB C 54 38.561 38.561 40.176 -1.615 18935 3493 1 5 . 1 1 54 54 ILE H H 54 9.440 9.440 9.123 0.317 18935 3494 1 5 . 1 1 55 55 ILE N N 55 126.879 126.879 127.798 -0.919 18935 3495 1 5 . 1 1 55 55 ILE C C 55 175.655 175.655 175.487 0.168 18935 3496 1 5 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.300 -2.739 18935 3497 1 5 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.647 -5.341 18935 3498 1 5 . 1 1 55 55 ILE H H 55 9.381 9.381 8.099 1.282 18935 3499 1 5 . 1 1 56 56 VAL N N 56 128.936 128.936 124.372 4.564 18935 3500 1 5 . 1 1 56 56 VAL C C 56 176.389 176.389 174.683 1.706 18935 3501 1 5 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.132 0.498 18935 3502 1 5 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.503 -0.719 18935 3503 1 5 . 1 1 56 56 VAL H H 56 9.227 9.227 8.943 0.284 18935 3504 1 5 . 1 1 58 58 GLU N N 58 112.423 112.423 119.173 -6.750 18935 3505 1 5 . 1 1 58 58 GLU C C 58 175.946 175.946 176.836 -0.890 18935 3506 1 5 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.430 -1.130 18935 3507 1 5 . 1 1 58 58 GLU CB C 58 32.097 32.097 30.886 1.212 18935 3508 1 5 . 1 1 58 58 GLU H H 58 6.685 6.685 8.035 -1.350 18935 3509 1 5 . 1 1 59 59 LYS N N 59 125.293 125.293 121.521 3.772 18935 3510 1 5 . 1 1 59 59 LYS C C 59 179.248 179.248 175.976 3.272 18935 3511 1 5 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.105 2.669 18935 3512 1 5 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.110 -1.033 18935 3513 1 5 . 1 1 59 59 LYS H H 59 9.108 9.108 8.635 0.473 18935 3514 1 5 . 1 1 60 60 LYS N N 60 117.408 117.408 118.721 -1.313 18935 3515 1 5 . 1 1 60 60 LYS C C 60 177.198 177.198 177.629 -0.431 18935 3516 1 5 . 1 1 60 60 LYS CA C 60 58.213 58.213 57.614 0.599 18935 3517 1 5 . 1 1 60 60 LYS CB C 60 30.583 30.583 33.056 -2.473 18935 3518 1 5 . 1 1 60 60 LYS H H 60 9.102 9.102 7.576 1.526 18935 3519 1 5 . 1 1 61 61 LEU N N 61 114.779 114.779 121.444 -6.665 18935 3520 1 5 . 1 1 61 61 LEU C C 61 178.790 178.790 178.649 0.141 18935 3521 1 5 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.542 -2.518 18935 3522 1 5 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.424 -0.560 18935 3523 1 5 . 1 1 61 61 LEU H H 61 7.455 7.455 8.376 -0.921 18935 3524 1 5 . 1 1 62 62 LEU N N 62 119.629 119.629 118.178 1.451 18935 3525 1 5 . 1 1 62 62 LEU C C 62 177.762 177.762 177.239 0.523 18935 3526 1 5 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.622 0.576 18935 3527 1 5 . 1 1 62 62 LEU CB C 62 40.731 40.731 42.028 -1.297 18935 3528 1 5 . 1 1 62 62 LEU H H 62 7.714 7.714 7.559 0.155 18935 3529 1 5 . 1 1 63 63 LYS N N 63 112.921 112.921 114.450 -1.529 18935 3530 1 5 . 1 1 63 63 LYS C C 63 175.386 175.386 177.862 -2.476 18935 3531 1 5 . 1 1 63 63 LYS CA C 63 57.356 57.356 56.298 1.058 18935 3532 1 5 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.923 -1.960 18935 3533 1 5 . 1 1 63 63 LYS H H 63 7.751 7.751 8.141 -0.390 18935 3534 1 5 . 1 1 64 64 HIS N N 64 112.468 112.468 117.642 -5.174 18935 3535 1 5 . 1 1 64 64 HIS C C 64 176.081 176.081 176.842 -0.761 18935 3536 1 5 . 1 1 64 64 HIS CA C 64 55.769 55.769 59.119 -3.350 18935 3537 1 5 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.089 1.281 18935 3538 1 5 . 1 1 64 64 HIS H H 64 7.697 7.697 7.778 -0.081 18935 3539 1 5 . 1 1 65 65 VAL N N 65 117.499 117.499 116.322 1.177 18935 3540 1 5 . 1 1 65 65 VAL C C 65 174.301 174.301 176.650 -2.349 18935 3541 1 5 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.252 3.078 18935 3542 1 5 . 1 1 65 65 VAL CB C 65 29.360 29.360 30.989 -1.629 18935 3543 1 5 . 1 1 65 65 VAL H H 65 6.917 6.917 7.097 -0.180 18935 3544 1 5 . 1 1 66 66 LEU N N 66 113.873 113.873 119.893 -6.020 18935 3545 1 5 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.420 0.430 18935 3546 1 5 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.296 -3.238 18935 3547 1 5 . 1 1 66 66 LEU H H 66 9.102 9.102 8.036 1.066 18935 3548 1 5 . 1 1 68 68 ASN N N 68 110.792 110.792 116.434 -5.642 18935 3549 1 5 . 1 1 68 68 ASN C C 68 174.877 174.877 173.322 1.555 18935 3550 1 5 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.512 -1.697 18935 3551 1 5 . 1 1 68 68 ASN CB C 68 40.311 40.311 40.698 -0.387 18935 3552 1 5 . 1 1 68 68 ASN H H 68 7.234 7.234 8.332 -1.098 18935 3553 1 5 . 1 1 69 69 ILE N N 69 122.348 122.348 126.608 -4.260 18935 3554 1 5 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.525 -0.613 18935 3555 1 5 . 1 1 69 69 ILE CB C 69 38.038 38.038 39.431 -1.393 18935 3556 1 5 . 1 1 69 69 ILE H H 69 7.428 7.428 8.638 -1.210 18935 3557 1 5 . 1 1 70 70 ARG N N 70 125.701 125.701 125.265 0.436 18935 3558 1 5 . 1 1 70 70 ARG C C 70 174.596 174.596 173.424 1.172 18935 3559 1 5 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.891 -1.730 18935 3560 1 5 . 1 1 70 70 ARG CB C 70 32.453 32.453 30.969 1.484 18935 3561 1 5 . 1 1 70 70 ARG H H 70 9.083 9.083 8.663 0.420 18935 3562 1 5 . 1 1 71 71 ILE N N 71 118.496 118.496 118.760 -0.264 18935 3563 1 5 . 1 1 71 71 ILE C C 71 175.625 175.625 176.377 -0.752 18935 3564 1 5 . 1 1 71 71 ILE CA C 71 59.776 59.776 60.088 -0.312 18935 3565 1 5 . 1 1 71 71 ILE CB C 71 37.967 37.967 39.514 -1.547 18935 3566 1 5 . 1 1 71 71 ILE H H 71 7.864 7.864 8.041 -0.177 18935 3567 1 5 . 1 1 72 72 LYS N N 72 127.423 127.423 123.206 4.217 18935 3568 1 5 . 1 1 72 72 LYS C C 72 177.659 177.659 176.896 0.763 18935 3569 1 5 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.647 1.781 18935 3570 1 5 . 1 1 72 72 LYS CB C 72 31.374 31.374 33.513 -2.139 18935 3571 1 5 . 1 1 72 72 LYS H H 72 8.720 8.720 8.822 -0.102 18935 3572 1 5 . 1 1 73 73 GLY N N 73 112.604 112.604 113.042 -0.438 18935 3573 1 5 . 1 1 73 73 GLY C C 73 173.729 173.729 173.636 0.093 18935 3574 1 5 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.387 0.444 18935 3575 1 5 . 1 1 73 73 GLY H H 73 8.930 8.930 8.747 0.183 18935 3576 1 5 . 1 1 74 74 LEU N N 74 119.538 119.538 119.027 0.511 18935 3577 1 5 . 1 1 74 74 LEU C C 74 175.802 175.802 175.312 0.490 18935 3578 1 5 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.087 0.574 18935 3579 1 5 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.623 -0.570 18935 3580 1 5 . 1 1 74 74 LEU H H 74 7.547 7.547 7.429 0.118 18935 3581 1 5 . 1 1 75 75 SER N N 75 118.994 118.994 117.178 1.816 18935 3582 1 5 . 1 1 75 75 SER C C 75 173.111 173.111 172.466 0.645 18935 3583 1 5 . 1 1 75 75 SER CA C 75 57.696 57.696 57.578 0.118 18935 3584 1 5 . 1 1 75 75 SER CB C 75 63.073 63.073 63.041 0.032 18935 3585 1 5 . 1 1 75 75 SER H H 75 9.076 9.076 8.362 0.714 18935 3586 1 5 . 1 1 76 76 PHE N N 76 117.802 117.802 119.900 -2.098 18935 3587 1 5 . 1 1 76 76 PHE C C 76 173.564 173.564 174.171 -0.607 18935 3588 1 5 . 1 1 76 76 PHE CA C 76 55.409 55.409 55.279 0.130 18935 3589 1 5 . 1 1 76 76 PHE CB C 76 41.843 41.843 41.195 0.648 18935 3590 1 5 . 1 1 76 76 PHE H H 76 8.119 8.119 7.759 0.360 18935 3591 1 5 . 1 1 77 77 SER N N 77 113.918 113.918 116.356 -2.438 18935 3592 1 5 . 1 1 77 77 SER C C 77 173.194 173.194 173.168 0.026 18935 3593 1 5 . 1 1 77 77 SER CA C 77 55.999 55.999 56.824 -0.825 18935 3594 1 5 . 1 1 77 77 SER CB C 77 65.218 65.218 65.607 -0.389 18935 3595 1 5 . 1 1 77 77 SER H H 77 8.989 8.989 8.326 0.663 18935 3596 1 5 . 1 1 78 78 VAL N N 78 123.662 123.662 126.282 -2.620 18935 3597 1 5 . 1 1 78 78 VAL C C 78 176.057 176.057 175.879 0.178 18935 3598 1 5 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.179 -0.088 18935 3599 1 5 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.653 0.641 18935 3600 1 5 . 1 1 78 78 VAL H H 78 8.995 8.995 8.735 0.260 18935 3601 1 5 . 1 1 79 79 LYS N N 79 129.417 129.417 128.887 0.530 18935 3602 1 5 . 1 1 79 79 LYS C C 79 176.436 176.436 174.453 1.983 18935 3603 1 5 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.567 3.085 18935 3604 1 5 . 1 1 79 79 LYS CB C 79 32.473 32.473 35.784 -3.311 18935 3605 1 5 . 1 1 79 79 LYS H H 79 9.425 9.425 8.966 0.459 18935 3606 1 5 . 1 1 80 80 VAL N N 80 108.616 108.616 121.637 -13.021 18935 3607 1 5 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.647 -2.550 18935 3608 1 5 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.931 0.151 18935 3609 1 5 . 1 1 80 80 VAL H H 80 7.380 7.380 8.461 -1.081 18935 3610 1 5 . 1 1 81 81 CYS N N 81 123.254 123.254 129.714 -6.460 18935 3611 1 5 . 1 1 81 81 CYS C C 81 172.053 172.053 173.786 -1.733 18935 3612 1 5 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.973 1.766 18935 3613 1 5 . 1 1 81 81 CYS CB C 81 27.332 27.332 26.975 0.357 18935 3614 1 5 . 1 1 81 81 CYS H H 81 9.759 9.759 8.534 1.225 18935 3615 1 5 . 1 1 82 82 GLY N N 82 118.450 118.450 110.661 7.789 18935 3616 1 5 . 1 1 82 82 GLY C C 82 171.814 171.814 173.787 -1.973 18935 3617 1 5 . 1 1 82 82 GLY CA C 82 44.353 44.353 44.924 -0.571 18935 3618 1 5 . 1 1 82 82 GLY H H 82 8.537 8.537 7.720 0.817 18935 3619 1 5 . 1 1 83 83 GLU N N 83 113.964 113.964 120.496 -6.532 18935 3620 1 5 . 1 1 83 83 GLU C C 83 179.320 179.320 176.980 2.340 18935 3621 1 5 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.195 0.480 18935 3622 1 5 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.772 0.135 18935 3623 1 5 . 1 1 83 83 GLU H H 83 8.473 8.473 8.667 -0.194 18935 3624 1 5 . 1 1 84 84 ARG N N 84 117.544 117.544 115.616 1.928 18935 3625 1 5 . 1 1 84 84 ARG C C 84 177.252 177.252 175.921 1.331 18935 3626 1 5 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.125 -0.621 18935 3627 1 5 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.683 -0.137 18935 3628 1 5 . 1 1 84 84 ARG H H 84 9.760 9.760 8.195 1.565 18935 3629 1 5 . 1 1 85 85 LYS N N 85 124.160 124.160 118.770 5.390 18935 3630 1 5 . 1 1 85 85 LYS C C 85 173.379 173.379 174.704 -1.325 18935 3631 1 5 . 1 1 85 85 LYS CA C 85 55.232 55.232 55.653 -0.421 18935 3632 1 5 . 1 1 85 85 LYS CB C 85 34.212 34.212 36.860 -2.648 18935 3633 1 5 . 1 1 85 85 LYS H H 85 8.494 8.494 7.628 0.866 18935 3634 1 5 . 1 1 86 86 CYS N N 86 126.472 126.472 120.512 5.960 18935 3635 1 5 . 1 1 86 86 CYS C C 86 171.935 171.935 172.559 -0.624 18935 3636 1 5 . 1 1 86 86 CYS CA C 86 55.878 55.878 58.046 -2.168 18935 3637 1 5 . 1 1 86 86 CYS CB C 86 30.304 30.304 31.215 -0.911 18935 3638 1 5 . 1 1 86 86 CYS H H 86 9.221 9.221 8.741 0.480 18935 3639 1 5 . 1 1 87 87 VAL N N 87 126.426 126.426 124.024 2.402 18935 3640 1 5 . 1 1 87 87 VAL C C 87 173.760 173.760 174.216 -0.456 18935 3641 1 5 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.652 -0.319 18935 3642 1 5 . 1 1 87 87 VAL CB C 87 33.338 33.338 34.204 -0.866 18935 3643 1 5 . 1 1 87 87 VAL H H 87 8.623 8.623 8.637 -0.014 18935 3644 1 5 . 1 1 88 88 LEU N N 88 125.701 125.701 127.586 -1.885 18935 3645 1 5 . 1 1 88 88 LEU C C 88 175.424 175.424 175.027 0.397 18935 3646 1 5 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.642 -1.556 18935 3647 1 5 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.474 -1.930 18935 3648 1 5 . 1 1 88 88 LEU H H 88 9.592 9.592 9.183 0.409 18935 3649 1 5 . 1 1 89 89 PHE N N 89 118.314 118.314 125.690 -7.376 18935 3650 1 5 . 1 1 89 89 PHE C C 89 177.068 177.068 173.548 3.520 18935 3651 1 5 . 1 1 89 89 PHE CA C 89 55.875 55.875 55.613 0.262 18935 3652 1 5 . 1 1 89 89 PHE CB C 89 38.837 38.837 40.028 -1.191 18935 3653 1 5 . 1 1 89 89 PHE H H 89 8.979 8.979 8.508 0.471 18935 3654 1 5 . 1 1 90 90 ILE N N 90 119.039 119.039 125.374 -6.335 18935 3655 1 5 . 1 1 90 90 ILE C C 90 173.692 173.692 174.562 -0.870 18935 3656 1 5 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.029 -0.357 18935 3657 1 5 . 1 1 90 90 ILE CB C 90 40.183 40.183 40.069 0.114 18935 3658 1 5 . 1 1 90 90 ILE H H 90 9.447 9.447 7.889 1.558 18935 3659 1 5 . 1 1 91 91 GLU N N 91 122.801 122.801 120.658 2.143 18935 3660 1 5 . 1 1 91 91 GLU C C 91 175.565 175.565 175.012 0.553 18935 3661 1 5 . 1 1 91 91 GLU CA C 91 54.465 54.465 54.695 -0.230 18935 3662 1 5 . 1 1 91 91 GLU CB C 91 29.662 29.662 32.380 -2.718 18935 3663 1 5 . 1 1 91 91 GLU H H 91 8.360 8.360 7.689 0.671 18935 3664 1 5 . 1 1 92 92 TRP N N 92 126.018 126.018 123.320 2.698 18935 3665 1 5 . 1 1 92 92 TRP C C 92 175.070 175.070 176.158 -1.088 18935 3666 1 5 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.477 -0.287 18935 3667 1 5 . 1 1 92 92 TRP CB C 92 30.582 30.582 32.500 -1.918 18935 3668 1 5 . 1 1 92 92 TRP H H 92 9.425 9.425 8.499 0.926 18935 3669 1 5 . 1 1 93 93 GLU N N 93 126.381 126.381 122.572 3.809 18935 3670 1 5 . 1 1 93 93 GLU C C 93 175.637 175.637 176.234 -0.597 18935 3671 1 5 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.633 -0.864 18935 3672 1 5 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.794 -2.850 18935 3673 1 5 . 1 1 93 93 GLU H H 93 8.914 8.914 9.205 -0.291 18935 3674 1 5 . 1 1 94 94 LYS N N 94 107.891 107.891 110.139 -2.248 18935 3675 1 5 . 1 1 94 94 LYS C C 94 175.359 175.359 176.327 -0.968 18935 3676 1 5 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.597 -0.168 18935 3677 1 5 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.797 -2.155 18935 3678 1 5 . 1 1 94 94 LYS H H 94 8.634 8.634 8.664 -0.030 18935 3679 1 5 . 1 1 95 95 LYS N N 95 120.490 120.490 119.536 0.954 18935 3680 1 5 . 1 1 95 95 LYS C C 95 174.369 174.369 174.792 -0.423 18935 3681 1 5 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.797 -0.444 18935 3682 1 5 . 1 1 95 95 LYS CB C 95 34.463 34.463 34.687 -0.224 18935 3683 1 5 . 1 1 95 95 LYS H H 95 7.924 7.924 7.846 0.078 18935 3684 1 5 . 1 1 96 96 THR N N 96 115.278 115.278 113.547 1.731 18935 3685 1 5 . 1 1 96 96 THR C C 96 174.317 174.317 173.118 1.199 18935 3686 1 5 . 1 1 96 96 THR CA C 96 61.203 61.203 60.732 0.471 18935 3687 1 5 . 1 1 96 96 THR CB C 96 69.348 69.348 69.398 -0.050 18935 3688 1 5 . 1 1 96 96 THR H H 96 7.967 7.967 7.944 0.023 18935 3689 1 5 . 1 1 97 97 TYR N N 97 123.254 123.254 125.696 -2.442 18935 3690 1 5 . 1 1 97 97 TYR C C 97 173.320 173.320 174.542 -1.222 18935 3691 1 5 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.396 -0.512 18935 3692 1 5 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.601 -0.465 18935 3693 1 5 . 1 1 97 97 TYR H H 97 9.232 9.232 8.837 0.395 18935 3694 1 5 . 1 1 98 98 GLN N N 98 122.574 122.574 118.016 4.558 18935 3695 1 5 . 1 1 98 98 GLN C C 98 172.781 172.781 174.587 -1.806 18935 3696 1 5 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.413 -0.242 18935 3697 1 5 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.576 -3.177 18935 3698 1 5 . 1 1 98 98 GLN H H 98 9.000 9.000 8.914 0.086 18935 3699 1 5 . 1 1 99 99 LEU N N 99 130.218 130.218 124.502 5.716 18935 3700 1 5 . 1 1 99 99 LEU C C 99 172.806 172.806 174.761 -1.955 18935 3701 1 5 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.544 -1.494 18935 3702 1 5 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.665 -0.913 18935 3703 1 5 . 1 1 99 99 LEU H H 99 9.246 9.246 9.200 0.046 18935 3704 1 5 . 1 1 100 100 ASP N N 100 124.931 124.931 126.444 -1.513 18935 3705 1 5 . 1 1 100 100 ASP C C 100 172.626 172.626 174.670 -2.044 18935 3706 1 5 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.449 -3.018 18935 3707 1 5 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.003 -5.675 18935 3708 1 5 . 1 1 100 100 ASP H H 100 9.253 9.253 8.527 0.726 18935 3709 1 5 . 1 1 101 101 LEU N N 101 119.402 119.402 120.337 -0.935 18935 3710 1 5 . 1 1 101 101 LEU C C 101 173.869 173.869 174.532 -0.663 18935 3711 1 5 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.728 -1.073 18935 3712 1 5 . 1 1 101 101 LEU CB C 101 44.166 44.166 44.176 -0.010 18935 3713 1 5 . 1 1 101 101 LEU H H 101 8.726 8.726 7.917 0.809 18935 3714 1 5 . 1 1 102 102 PHE N N 102 117.952 117.952 119.073 -1.121 18935 3715 1 5 . 1 1 102 102 PHE C C 102 175.853 175.853 175.352 0.501 18935 3716 1 5 . 1 1 102 102 PHE CA C 102 53.282 53.282 56.091 -2.809 18935 3717 1 5 . 1 1 102 102 PHE CB C 102 41.824 41.824 41.328 0.496 18935 3718 1 5 . 1 1 102 102 PHE H H 102 8.236 8.236 8.714 -0.478 18935 3719 1 5 . 1 1 103 103 THR N N 103 106.853 106.853 118.343 -11.490 18935 3720 1 5 . 1 1 103 103 THR C C 103 175.154 175.154 174.247 0.907 18935 3721 1 5 . 1 1 103 103 THR CA C 103 57.685 57.685 60.655 -2.970 18935 3722 1 5 . 1 1 103 103 THR CB C 103 71.037 71.037 69.579 1.458 18935 3723 1 5 . 1 1 103 103 THR H H 103 7.917 7.917 8.784 -0.867 18935 3724 1 5 . 1 1 104 104 ALA N N 104 122.348 122.348 128.686 -6.338 18935 3725 1 5 . 1 1 104 104 ALA C C 104 175.947 175.947 174.859 1.088 18935 3726 1 5 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.196 -0.389 18935 3727 1 5 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.649 -0.221 18935 3728 1 5 . 1 1 104 104 ALA H H 104 8.930 8.930 8.790 0.140 18935 3729 1 5 . 1 1 105 105 LEU N N 105 119.855 119.855 118.942 0.913 18935 3730 1 5 . 1 1 105 105 LEU C C 105 179.628 179.628 179.021 0.607 18935 3731 1 5 . 1 1 105 105 LEU CA C 105 53.123 53.123 53.636 -0.513 18935 3732 1 5 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.386 -2.052 18935 3733 1 5 . 1 1 105 105 LEU H H 105 8.316 8.316 9.193 -0.877 18935 3734 1 5 . 1 1 106 106 ALA N N 106 123.662 123.662 125.526 -1.864 18935 3735 1 5 . 1 1 106 106 ALA C C 106 181.056 181.056 177.795 3.261 18935 3736 1 5 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.195 1.154 18935 3737 1 5 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.748 -1.433 18935 3738 1 5 . 1 1 106 106 ALA H H 106 8.306 8.306 8.332 -0.026 18935 3739 1 5 . 1 1 107 107 GLU N N 107 114.825 114.825 114.096 0.729 18935 3740 1 5 . 1 1 107 107 GLU C C 107 177.854 177.854 177.224 0.630 18935 3741 1 5 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.726 0.660 18935 3742 1 5 . 1 1 107 107 GLU CB C 107 27.844 27.844 29.087 -1.243 18935 3743 1 5 . 1 1 107 107 GLU H H 107 9.754 9.754 8.621 1.133 18935 3744 1 5 . 1 1 108 108 GLU N N 108 115.097 115.097 119.256 -4.159 18935 3745 1 5 . 1 1 108 108 GLU C C 108 178.001 178.001 177.719 0.282 18935 3746 1 5 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.629 -1.703 18935 3747 1 5 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.705 0.296 18935 3748 1 5 . 1 1 108 108 GLU H H 108 7.859 7.859 7.798 0.061 18935 3749 1 5 . 1 1 109 109 LYS N N 109 118.360 118.360 121.483 -3.123 18935 3750 1 5 . 1 1 109 109 LYS C C 109 172.691 172.691 175.978 -3.287 18935 3751 1 5 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.750 1.152 18935 3752 1 5 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.898 -0.357 18935 3753 1 5 . 1 1 109 109 LYS H H 109 7.660 7.660 7.571 0.089 18935 3754 1 5 . 1 1 111 111 TYR N N 111 114.054 114.054 118.678 -4.624 18935 3755 1 5 . 1 1 111 111 TYR C C 111 179.764 179.764 177.961 1.803 18935 3756 1 5 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.856 -1.858 18935 3757 1 5 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.328 -1.373 18935 3758 1 5 . 1 1 111 111 TYR H H 111 6.583 6.583 8.379 -1.796 18935 3759 1 5 . 1 1 112 112 ALA N N 112 124.749 124.749 122.726 2.023 18935 3760 1 5 . 1 1 112 112 ALA C C 112 179.430 179.430 179.744 -0.314 18935 3761 1 5 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.883 0.086 18935 3762 1 5 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.893 -0.081 18935 3763 1 5 . 1 1 112 112 ALA H H 112 8.753 8.753 8.787 -0.034 18935 3764 1 5 . 1 1 113 113 ILE N N 113 119.130 119.130 119.810 -0.680 18935 3765 1 5 . 1 1 113 113 ILE C C 113 178.646 178.646 178.445 0.201 18935 3766 1 5 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.867 2.534 18935 3767 1 5 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.697 0.541 18935 3768 1 5 . 1 1 113 113 ILE H H 113 8.946 8.946 8.737 0.209 18935 3769 1 5 . 1 1 114 114 PHE N N 114 121.758 121.758 121.429 0.329 18935 3770 1 5 . 1 1 114 114 PHE C C 114 177.954 177.954 177.369 0.585 18935 3771 1 5 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.618 -1.841 18935 3772 1 5 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.620 0.444 18935 3773 1 5 . 1 1 114 114 PHE H H 114 7.940 7.940 8.414 -0.474 18935 3774 1 5 . 1 1 115 115 HIS N N 115 116.547 116.547 119.196 -2.649 18935 3775 1 5 . 1 1 115 115 HIS C C 115 176.161 176.161 176.617 -0.456 18935 3776 1 5 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.455 -0.335 18935 3777 1 5 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.856 1.211 18935 3778 1 5 . 1 1 115 115 HIS H H 115 7.767 7.767 8.045 -0.278 18935 3779 1 5 . 1 1 116 116 PHE N N 116 109.387 109.387 113.835 -4.448 18935 3780 1 5 . 1 1 116 116 PHE C C 116 177.282 177.282 176.856 0.426 18935 3781 1 5 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.489 1.945 18935 3782 1 5 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.354 -2.099 18935 3783 1 5 . 1 1 116 116 PHE H H 116 8.989 8.989 8.287 0.702 18935 3784 1 5 . 1 1 117 117 THR N N 117 116.864 116.864 114.855 2.009 18935 3785 1 5 . 1 1 117 117 THR C C 117 172.889 172.889 175.470 -2.581 18935 3786 1 5 . 1 1 117 117 THR CA C 117 66.997 66.997 65.926 1.071 18935 3787 1 5 . 1 1 117 117 THR CB C 117 67.948 67.948 69.206 -1.258 18935 3788 1 5 . 1 1 117 117 THR H H 117 7.988 7.988 8.037 -0.049 18935 3789 1 5 . 1 1 118 118 GLY N N 118 103.320 103.320 107.695 -4.375 18935 3790 1 5 . 1 1 118 118 GLY C C 118 176.912 176.912 171.556 5.356 18935 3791 1 5 . 1 1 118 118 GLY CA C 118 44.182 44.182 44.766 -0.584 18935 3792 1 5 . 1 1 118 118 GLY H H 118 6.550 6.550 7.368 -0.818 18935 3793 1 5 . 1 1 120 120 VAL N N 120 120.671 120.671 120.162 0.509 18935 3794 1 5 . 1 1 120 120 VAL C C 120 176.283 176.283 177.289 -1.006 18935 3795 1 5 . 1 1 120 120 VAL CA C 120 66.940 66.940 63.577 3.363 18935 3796 1 5 . 1 1 120 120 VAL CB C 120 29.852 29.852 32.504 -2.652 18935 3797 1 5 . 1 1 120 120 VAL H H 120 8.408 8.408 8.152 0.256 18935 3798 1 5 . 1 1 121 121 SER N N 121 111.789 111.789 116.458 -4.669 18935 3799 1 5 . 1 1 121 121 SER C C 121 175.658 175.658 176.279 -0.621 18935 3800 1 5 . 1 1 121 121 SER CA C 121 60.814 60.814 61.302 -0.488 18935 3801 1 5 . 1 1 121 121 SER CB C 121 60.253 60.253 62.396 -2.143 18935 3802 1 5 . 1 1 121 121 SER H H 121 8.290 8.290 8.300 -0.010 18935 3803 1 5 . 1 1 122 122 TYR N N 122 123.254 123.254 121.722 1.532 18935 3804 1 5 . 1 1 122 122 TYR C C 122 174.611 174.611 177.432 -2.821 18935 3805 1 5 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.862 -2.316 18935 3806 1 5 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.038 0.101 18935 3807 1 5 . 1 1 122 122 TYR H H 122 6.303 6.303 8.204 -1.901 18935 3808 1 5 . 1 1 123 123 LEU N N 123 114.825 114.825 118.705 -3.880 18935 3809 1 5 . 1 1 123 123 LEU C C 123 178.891 178.891 179.140 -0.249 18935 3810 1 5 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.773 -0.994 18935 3811 1 5 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.936 -0.298 18935 3812 1 5 . 1 1 123 123 LEU H H 123 6.965 6.965 7.557 -0.592 18935 3813 1 5 . 1 1 124 124 ILE N N 124 114.915 114.915 119.099 -4.184 18935 3814 1 5 . 1 1 124 124 ILE C C 124 177.187 177.187 177.823 -0.636 18935 3815 1 5 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.859 -1.428 18935 3816 1 5 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.419 -0.864 18935 3817 1 5 . 1 1 124 124 ILE H H 124 7.531 7.531 8.049 -0.518 18935 3818 1 5 . 1 1 125 125 ARG N N 125 115.278 115.278 120.025 -4.747 18935 3819 1 5 . 1 1 125 125 ARG C C 125 178.473 178.473 178.765 -0.292 18935 3820 1 5 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.878 -0.419 18935 3821 1 5 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.435 -2.356 18935 3822 1 5 . 1 1 125 125 ARG H H 125 6.809 6.809 7.840 -1.031 18935 3823 1 5 . 1 1 126 126 ILE N N 126 124.160 124.160 119.107 5.053 18935 3824 1 5 . 1 1 126 126 ILE C C 126 178.172 178.172 177.846 0.326 18935 3825 1 5 . 1 1 126 126 ILE CA C 126 60.927 60.927 64.044 -3.117 18935 3826 1 5 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.345 -2.879 18935 3827 1 5 . 1 1 126 126 ILE H H 126 7.408 7.408 7.913 -0.505 18935 3828 1 5 . 1 1 127 127 ARG N N 127 117.136 117.136 120.537 -3.401 18935 3829 1 5 . 1 1 127 127 ARG C C 127 179.227 179.227 178.609 0.618 18935 3830 1 5 . 1 1 127 127 ARG CA C 127 60.216 60.216 58.910 1.306 18935 3831 1 5 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.705 -1.916 18935 3832 1 5 . 1 1 127 127 ARG H H 127 8.230 8.230 8.087 0.143 18935 3833 1 5 . 1 1 128 128 ALA N N 128 121.305 121.305 119.147 2.158 18935 3834 1 5 . 1 1 128 128 ALA C C 128 179.933 179.933 179.081 0.852 18935 3835 1 5 . 1 1 128 128 ALA CA C 128 54.706 54.706 54.747 -0.041 18935 3836 1 5 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.323 0.015 18935 3837 1 5 . 1 1 128 128 ALA H H 128 8.666 8.666 8.637 0.029 18935 3838 1 5 . 1 1 129 129 ALA N N 129 120.943 120.943 120.785 0.158 18935 3839 1 5 . 1 1 129 129 ALA C C 129 181.336 181.336 179.608 1.728 18935 3840 1 5 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.022 0.687 18935 3841 1 5 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.643 -1.783 18935 3842 1 5 . 1 1 129 129 ALA H H 129 7.837 7.837 7.361 0.476 18935 3843 1 5 . 1 1 130 130 LEU N N 130 117.726 117.726 119.893 -2.167 18935 3844 1 5 . 1 1 130 130 LEU C C 130 179.432 179.432 179.231 0.201 18935 3845 1 5 . 1 1 130 130 LEU CA C 130 57.176 57.176 58.177 -1.001 18935 3846 1 5 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.700 -1.134 18935 3847 1 5 . 1 1 130 130 LEU H H 130 8.114 8.114 7.921 0.193 18935 3848 1 5 . 1 1 131 131 LYS N N 131 124.115 124.115 120.254 3.861 18935 3849 1 5 . 1 1 131 131 LYS C C 131 181.452 181.452 179.570 1.882 18935 3850 1 5 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.856 0.030 18935 3851 1 5 . 1 1 131 131 LYS CB C 131 32.198 32.198 32.028 0.170 18935 3852 1 5 . 1 1 131 131 LYS H H 131 8.849 8.849 7.817 1.032 18935 3853 1 5 . 1 1 132 132 LYS N N 132 119.447 119.447 118.331 1.116 18935 3854 1 5 . 1 1 132 132 LYS C C 132 177.607 177.607 178.183 -0.576 18935 3855 1 5 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.273 -0.321 18935 3856 1 5 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.430 -0.005 18935 3857 1 5 . 1 1 132 132 LYS H H 132 7.778 7.778 7.728 0.050 18935 3858 1 5 . 1 1 133 133 LYS N N 133 116.638 116.638 116.003 0.635 18935 3859 1 5 . 1 1 133 133 LYS C C 133 174.681 174.681 176.063 -1.382 18935 3860 1 5 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.881 -0.803 18935 3861 1 5 . 1 1 133 133 LYS CB C 133 31.640 31.640 31.907 -0.267 18935 3862 1 5 . 1 1 133 133 LYS H H 133 7.617 7.617 7.598 0.019 18935 3863 1 5 . 1 1 134 134 ASN N N 134 110.792 110.792 115.800 -5.008 18935 3864 1 5 . 1 1 134 134 ASN C C 134 174.034 174.034 173.306 0.728 18935 3865 1 5 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.200 0.416 18935 3866 1 5 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.083 -1.031 18935 3867 1 5 . 1 1 134 134 ASN H H 134 8.123 8.123 8.465 -0.342 18935 3868 1 5 . 1 1 135 135 TYR N N 135 115.867 115.867 115.933 -0.066 18935 3869 1 5 . 1 1 135 135 TYR C C 135 175.122 175.122 173.735 1.387 18935 3870 1 5 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.193 -0.441 18935 3871 1 5 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.705 -1.789 18935 3872 1 5 . 1 1 135 135 TYR H H 135 8.133 8.133 8.100 0.033 18935 3873 1 5 . 1 1 136 136 LYS N N 136 119.870 119.870 122.073 -2.203 18935 3874 1 5 . 1 1 136 136 LYS C C 136 174.324 174.324 174.142 0.182 18935 3875 1 5 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.733 0.447 18935 3876 1 5 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.617 -2.544 18935 3877 1 5 . 1 1 136 136 LYS H H 136 9.234 9.234 8.919 0.315 18935 3878 1 5 . 1 1 137 137 LEU N N 137 129.708 129.708 128.462 1.246 18935 3879 1 5 . 1 1 137 137 LEU C C 137 173.798 173.798 174.949 -1.151 18935 3880 1 5 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.497 -1.663 18935 3881 1 5 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.119 1.864 18935 3882 1 5 . 1 1 137 137 LEU H H 137 8.959 8.959 8.730 0.229 18935 3883 1 5 . 1 1 140 140 TYR N N 140 120.580 120.580 111.801 8.779 18935 3884 1 5 . 1 1 140 140 TYR C C 140 174.705 174.705 176.164 -1.459 18935 3885 1 5 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.753 -1.301 18935 3886 1 5 . 1 1 140 140 TYR CB C 140 38.301 38.301 39.009 -0.708 18935 3887 1 5 . 1 1 140 140 TYR H H 140 8.962 8.962 7.432 1.530 18935 3888 1 5 . 1 1 141 141 GLY N N 141 104.986 104.986 106.137 -1.151 18935 3889 1 5 . 1 1 141 141 GLY C C 141 181.854 181.854 172.332 9.522 18935 3890 1 5 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.607 -0.485 18935 3891 1 5 . 1 1 141 141 GLY H H 141 7.555 7.555 7.526 0.029 18935 3892 1 5 . 1 1 142 142 LEU N N 142 118.269 118.269 121.220 -2.951 18935 3893 1 5 . 1 1 142 142 LEU C C 142 174.067 174.067 176.117 -2.050 18935 3894 1 5 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.759 -1.257 18935 3895 1 5 . 1 1 142 142 LEU CB C 142 44.542 44.542 42.904 1.638 18935 3896 1 5 . 1 1 142 142 LEU H H 142 7.794 7.794 8.344 -0.550 18935 3897 1 5 . 1 1 143 143 PHE N N 143 122.076 122.076 125.176 -3.100 18935 3898 1 5 . 1 1 143 143 PHE C C 143 175.199 175.199 175.349 -0.150 18935 3899 1 5 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.576 -1.544 18935 3900 1 5 . 1 1 143 143 PHE CB C 143 42.070 42.070 40.139 1.931 18935 3901 1 5 . 1 1 143 143 PHE H H 143 9.522 9.522 9.703 -0.181 18935 3902 1 5 . 1 1 144 144 LYS N N 144 121.305 121.305 125.644 -4.339 18935 3903 1 5 . 1 1 144 144 LYS C C 144 176.917 176.917 175.819 1.098 18935 3904 1 5 . 1 1 144 144 LYS CA C 144 55.356 55.356 53.918 1.438 18935 3905 1 5 . 1 1 144 144 LYS CB C 144 33.679 33.679 31.652 2.027 18935 3906 1 5 . 1 1 144 144 LYS H H 144 9.076 9.076 9.139 -0.063 18935 3907 1 5 . 1 1 145 145 ASN N N 145 126.834 126.834 123.478 3.356 18935 3908 1 5 . 1 1 145 145 ASN C C 145 175.070 175.070 175.216 -0.146 18935 3909 1 5 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.344 0.420 18935 3910 1 5 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.695 -1.265 18935 3911 1 5 . 1 1 145 145 ASN H H 145 9.618 9.618 8.705 0.913 18935 3912 1 5 . 1 1 146 146 GLN N N 146 110.112 110.112 110.000 0.112 18935 3913 1 5 . 1 1 146 146 GLN C C 146 175.198 175.198 175.265 -0.067 18935 3914 1 5 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.866 -0.970 18935 3915 1 5 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.573 -1.205 18935 3916 1 5 . 1 1 146 146 GLN H H 146 9.140 9.140 8.823 0.317 18935 3917 1 5 . 1 1 147 147 THR N N 147 116.003 116.003 117.427 -1.424 18935 3918 1 5 . 1 1 147 147 THR C C 147 173.224 173.224 173.613 -0.389 18935 3919 1 5 . 1 1 147 147 THR CA C 147 61.450 61.450 61.612 -0.162 18935 3920 1 5 . 1 1 147 147 THR CB C 147 70.285 70.285 69.061 1.224 18935 3921 1 5 . 1 1 147 147 THR H H 147 8.069 8.069 7.560 0.509 18935 3922 1 5 . 1 1 148 148 LEU N N 148 129.281 129.281 130.385 -1.104 18935 3923 1 5 . 1 1 148 148 LEU C C 148 176.703 176.703 175.287 1.416 18935 3924 1 5 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.137 0.329 18935 3925 1 5 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.810 -1.085 18935 3926 1 5 . 1 1 148 148 LEU H H 148 8.831 8.831 8.831 0.000 18935 3927 1 5 . 1 1 149 149 VAL N N 149 130.189 130.189 127.152 3.037 18935 3928 1 5 . 1 1 149 149 VAL C C 149 175.012 175.012 173.687 1.325 18935 3929 1 5 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.690 0.580 18935 3930 1 5 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.066 -3.610 18935 3931 1 5 . 1 1 149 149 VAL H H 149 9.243 9.243 8.506 0.737 18935 3932 1 5 . 1 1 151 151 LEU N N 151 123.481 123.481 116.431 7.050 18935 3933 1 5 . 1 1 151 151 LEU C C 151 177.679 177.679 177.190 0.489 18935 3934 1 5 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.916 -0.919 18935 3935 1 5 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.521 1.098 18935 3936 1 5 . 1 1 151 151 LEU H H 151 8.080 8.080 8.091 -0.011 18935 3937 1 5 . 1 1 152 152 LYS N N 152 126.381 126.381 122.978 3.403 18935 3938 1 5 . 1 1 152 152 LYS C C 152 175.115 175.115 175.059 0.056 18935 3939 1 5 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.210 -1.614 18935 3940 1 5 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.263 -2.198 18935 3941 1 5 . 1 1 152 152 LYS H H 152 9.112 9.112 8.765 0.347 18935 3942 1 5 . 1 1 153 153 ILE N N 153 113.737 113.737 115.627 -1.890 18935 3943 1 5 . 1 1 153 153 ILE C C 153 175.748 175.748 173.816 1.932 18935 3944 1 5 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.309 -0.920 18935 3945 1 5 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.741 1.062 18935 3946 1 5 . 1 1 153 153 ILE H H 153 7.304 7.304 7.471 -0.167 18935 3947 1 5 . 1 1 154 154 THR N N 154 110.656 110.656 112.927 -2.271 18935 3948 1 5 . 1 1 154 154 THR C C 154 174.864 174.864 173.286 1.578 18935 3949 1 5 . 1 1 154 154 THR CA C 154 62.141 62.141 62.358 -0.217 18935 3950 1 5 . 1 1 154 154 THR CB C 154 70.413 70.413 70.178 0.235 18935 3951 1 5 . 1 1 154 154 THR H H 154 9.382 9.382 8.390 0.992 18935 3952 1 5 . 1 1 155 155 THR N N 155 110.746 110.746 116.158 -5.412 18935 3953 1 5 . 1 1 155 155 THR C C 155 174.718 174.718 174.942 -0.224 18935 3954 1 5 . 1 1 155 155 THR CA C 155 58.785 58.785 60.350 -1.565 18935 3955 1 5 . 1 1 155 155 THR CB C 155 72.277 72.277 71.678 0.599 18935 3956 1 5 . 1 1 155 155 THR H H 155 7.746 7.746 7.752 -0.006 18935 3957 1 5 . 1 1 156 156 GLU N N 156 122.302 122.302 125.126 -2.824 18935 3958 1 5 . 1 1 156 156 GLU C C 156 177.289 177.289 178.405 -1.116 18935 3959 1 5 . 1 1 156 156 GLU CA C 156 58.824 58.824 61.247 -2.423 18935 3960 1 5 . 1 1 156 156 GLU CB C 156 28.381 28.381 28.992 -0.611 18935 3961 1 5 . 1 1 156 156 GLU H H 156 9.490 9.490 9.111 0.379 18935 3962 1 5 . 1 1 157 157 LYS N N 157 118.905 118.905 116.880 2.025 18935 3963 1 5 . 1 1 157 157 LYS C C 157 178.241 178.241 179.378 -1.137 18935 3964 1 5 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.729 1.036 18935 3965 1 5 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.737 -0.459 18935 3966 1 5 . 1 1 157 157 LYS H H 157 8.329 8.329 8.488 -0.159 18935 3967 1 5 . 1 1 158 158 GLU N N 158 116.230 116.230 120.553 -4.323 18935 3968 1 5 . 1 1 158 158 GLU C C 158 178.988 178.988 178.695 0.293 18935 3969 1 5 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.762 -0.506 18935 3970 1 5 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.245 -0.187 18935 3971 1 5 . 1 1 158 158 GLU H H 158 7.611 7.611 7.419 0.192 18935 3972 1 5 . 1 1 159 159 LEU N N 159 118.978 118.978 121.284 -2.306 18935 3973 1 5 . 1 1 159 159 LEU C C 159 176.347 176.347 178.496 -2.149 18935 3974 1 5 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.359 -5.120 18935 3975 1 5 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.906 -2.363 18935 3976 1 5 . 1 1 159 159 LEU H H 159 7.704 7.704 8.234 -0.530 18935 3977 1 5 . 1 1 160 160 ILE N N 160 117.227 117.227 114.542 2.685 18935 3978 1 5 . 1 1 160 160 ILE C C 160 177.219 177.219 177.110 0.109 18935 3979 1 5 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.031 0.584 18935 3980 1 5 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.146 0.411 18935 3981 1 5 . 1 1 160 160 ILE H H 160 7.886 7.886 7.581 0.305 18935 3982 1 5 . 1 1 161 161 LYS N N 161 115.912 115.912 118.866 -2.954 18935 3983 1 5 . 1 1 161 161 LYS C C 161 180.990 180.990 178.789 2.201 18935 3984 1 5 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.279 0.352 18935 3985 1 5 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.175 -1.427 18935 3986 1 5 . 1 1 161 161 LYS H H 161 7.536 7.536 7.525 0.011 18935 3987 1 5 . 1 1 162 162 GLU N N 162 120.852 120.852 120.880 -0.028 18935 3988 1 5 . 1 1 162 162 GLU C C 162 178.793 178.793 177.904 0.889 18935 3989 1 5 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.310 -0.328 18935 3990 1 5 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.292 -1.500 18935 3991 1 5 . 1 1 162 162 GLU H H 162 8.392 8.392 7.910 0.482 18935 3992 1 5 . 1 1 163 163 LEU N N 163 115.912 115.912 116.244 -0.332 18935 3993 1 5 . 1 1 163 163 LEU C C 163 176.370 176.370 176.915 -0.545 18935 3994 1 5 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.449 -0.355 18935 3995 1 5 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.865 -1.691 18935 3996 1 5 . 1 1 163 163 LEU H H 163 8.031 8.031 7.842 0.189 18935 3997 1 5 . 1 1 164 164 GLY N N 164 103.160 103.160 104.782 -1.622 18935 3998 1 5 . 1 1 164 164 GLY C C 164 174.240 174.240 174.015 0.225 18935 3999 1 5 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.893 -0.591 18935 4000 1 5 . 1 1 164 164 GLY H H 164 7.625 7.625 7.631 -0.006 18935 4001 1 5 . 1 1 165 165 PHE N N 165 117.952 117.952 118.052 -0.100 18935 4002 1 5 . 1 1 165 165 PHE C C 165 174.556 174.556 174.489 0.067 18935 4003 1 5 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.106 -0.641 18935 4004 1 5 . 1 1 165 165 PHE CB C 165 40.762 40.762 40.965 -0.203 18935 4005 1 5 . 1 1 165 165 PHE H H 165 7.283 7.283 8.167 -0.884 18935 4006 1 5 . 1 1 166 166 THR N N 166 118.178 118.178 113.078 5.100 18935 4007 1 5 . 1 1 166 166 THR C C 166 175.306 175.306 173.521 1.785 18935 4008 1 5 . 1 1 166 166 THR CA C 166 63.466 63.466 60.718 2.748 18935 4009 1 5 . 1 1 166 166 THR CB C 166 68.721 68.721 70.907 -2.186 18935 4010 1 5 . 1 1 166 166 THR H H 166 9.678 9.678 8.473 1.205 18935 4011 1 5 . 1 1 167 167 TYR N N 167 128.239 128.239 124.263 3.976 18935 4012 1 5 . 1 1 167 167 TYR C C 167 173.297 173.297 175.249 -1.952 18935 4013 1 5 . 1 1 167 167 TYR CA C 167 60.412 60.412 58.588 1.824 18935 4014 1 5 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.093 -2.371 18935 4015 1 5 . 1 1 167 167 TYR H H 167 9.264 9.264 8.724 0.540 18935 4016 1 5 . 1 1 168 168 ARG N N 168 126.789 126.789 126.783 0.006 18935 4017 1 5 . 1 1 168 168 ARG C C 168 175.297 175.297 174.533 0.764 18935 4018 1 5 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.242 -1.477 18935 4019 1 5 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.921 -1.595 18935 4020 1 5 . 1 1 168 168 ARG H H 168 7.030 7.030 8.595 -1.565 18935 4021 1 5 . 1 1 169 169 ILE N N 169 119.221 119.221 116.811 2.410 18935 4022 1 5 . 1 1 169 169 ILE C C 169 174.522 174.522 174.938 -0.416 18935 4023 1 5 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.536 2.743 18935 4024 1 5 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.377 -4.731 18935 4025 1 5 . 1 1 169 169 ILE H H 169 8.349 8.349 8.227 0.122 18935 4026 1 5 . 1 1 171 171 LYS N N 171 111.335 111.335 117.257 -5.922 18935 4027 1 5 . 1 1 171 171 LYS C C 171 176.638 176.638 177.782 -1.144 18935 4028 1 5 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.022 -1.484 18935 4029 1 5 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.603 0.364 18935 4030 1 5 . 1 1 171 171 LYS H H 171 8.198 8.198 8.559 -0.361 18935 4031 1 5 . 1 1 172 172 LYS N N 172 116.411 116.411 115.232 1.179 18935 4032 1 5 . 1 1 172 172 LYS C C 172 175.331 175.331 175.614 -0.283 18935 4033 1 5 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.172 -1.171 18935 4034 1 5 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.324 -1.506 18935 4035 1 5 . 1 1 172 172 LYS H H 172 7.843 7.843 7.563 0.280 18935 4036 1 5 . 1 1 173 173 ARG N N 173 120.490 120.490 117.140 3.350 18935 4037 1 5 . 1 1 173 173 ARG C C 173 172.830 172.830 175.283 -2.453 18935 4038 1 5 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.221 0.954 18935 4039 1 5 . 1 1 173 173 ARG CB C 173 28.829 28.829 28.319 0.510 18935 4040 1 5 . 1 1 173 173 ARG H H 173 6.917 6.917 7.745 -0.828 18935 4041 1 6 . 1 1 2 2 LEU N N 2 119.937 119.937 118.502 1.435 18935 4042 1 6 . 1 1 2 2 LEU C C 2 175.307 175.307 175.553 -0.246 18935 4043 1 6 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.583 0.709 18935 4044 1 6 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.589 -1.905 18935 4045 1 6 . 1 1 2 2 LEU H H 2 9.251 9.251 7.863 1.388 18935 4046 1 6 . 1 1 3 3 THR N N 3 111.335 111.335 110.860 0.475 18935 4047 1 6 . 1 1 3 3 THR C C 3 175.854 175.854 175.695 0.159 18935 4048 1 6 . 1 1 3 3 THR CA C 3 60.540 60.540 60.277 0.263 18935 4049 1 6 . 1 1 3 3 THR CB C 3 70.782 70.782 71.064 -0.283 18935 4050 1 6 . 1 1 3 3 THR H H 3 8.677 8.677 8.275 0.402 18935 4051 1 6 . 1 1 4 4 LEU N N 4 120.988 120.988 122.264 -1.276 18935 4052 1 6 . 1 1 4 4 LEU C C 4 178.391 178.391 178.470 -0.079 18935 4053 1 6 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.836 0.228 18935 4054 1 6 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.159 -2.898 18935 4055 1 6 . 1 1 4 4 LEU H H 4 7.746 7.746 7.929 -0.183 18935 4056 1 6 . 1 1 5 5 ILE N N 5 114.236 114.236 118.170 -3.934 18935 4057 1 6 . 1 1 5 5 ILE C C 5 178.339 178.339 177.986 0.353 18935 4058 1 6 . 1 1 5 5 ILE CA C 5 63.582 63.582 65.286 -1.704 18935 4059 1 6 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.437 -0.638 18935 4060 1 6 . 1 1 5 5 ILE H H 5 7.821 7.821 7.701 0.120 18935 4061 1 6 . 1 1 6 6 GLN N N 6 120.399 120.399 119.099 1.300 18935 4062 1 6 . 1 1 6 6 GLN C C 6 178.783 178.783 178.714 0.069 18935 4063 1 6 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.572 -1.352 18935 4064 1 6 . 1 1 6 6 GLN CB C 6 28.115 28.115 27.855 0.260 18935 4065 1 6 . 1 1 6 6 GLN H H 6 7.810 7.810 7.755 0.055 18935 4066 1 6 . 1 1 7 7 GLY N N 7 106.277 106.277 105.175 1.102 18935 4067 1 6 . 1 1 7 7 GLY C C 7 174.554 174.554 175.871 -1.317 18935 4068 1 6 . 1 1 7 7 GLY CA C 7 46.934 46.934 46.980 -0.046 18935 4069 1 6 . 1 1 7 7 GLY H H 7 8.733 8.733 8.080 0.653 18935 4070 1 6 . 1 1 8 8 LYS N N 8 119.991 119.991 121.643 -1.652 18935 4071 1 6 . 1 1 8 8 LYS C C 8 179.433 179.433 178.645 0.788 18935 4072 1 6 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.141 1.751 18935 4073 1 6 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.176 -0.844 18935 4074 1 6 . 1 1 8 8 LYS H H 8 8.688 8.688 7.565 1.123 18935 4075 1 6 . 1 1 9 9 LYS N N 9 119.175 119.175 120.071 -0.896 18935 4076 1 6 . 1 1 9 9 LYS CA C 9 59.382 59.382 60.111 -0.729 18935 4077 1 6 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.435 -1.000 18935 4078 1 6 . 1 1 9 9 LYS H H 9 8.015 8.015 8.023 -0.008 18935 4079 1 6 . 1 1 10 10 ILE N N 10 120.308 120.308 116.670 3.638 18935 4080 1 6 . 1 1 10 10 ILE C C 10 177.766 177.766 177.445 0.321 18935 4081 1 6 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.935 -0.259 18935 4082 1 6 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.425 -1.112 18935 4083 1 6 . 1 1 10 10 ILE H H 10 7.967 7.967 8.168 -0.201 18935 4084 1 6 . 1 1 11 11 VAL N N 11 119.130 119.130 120.261 -1.131 18935 4085 1 6 . 1 1 11 11 VAL C C 11 176.606 176.606 178.200 -1.594 18935 4086 1 6 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.513 1.127 18935 4087 1 6 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.581 -0.371 18935 4088 1 6 . 1 1 11 11 VAL H H 11 8.128 8.128 7.682 0.446 18935 4089 1 6 . 1 1 12 12 ASN N N 12 115.822 115.822 117.600 -1.778 18935 4090 1 6 . 1 1 12 12 ASN C C 12 177.375 177.375 177.108 0.267 18935 4091 1 6 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.464 -0.493 18935 4092 1 6 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.639 -1.076 18935 4093 1 6 . 1 1 12 12 ASN H H 12 8.203 8.203 7.834 0.369 18935 4094 1 6 . 1 1 13 13 HIS N N 13 117.659 117.659 116.430 1.229 18935 4095 1 6 . 1 1 13 13 HIS C C 13 177.287 177.287 177.042 0.245 18935 4096 1 6 . 1 1 13 13 HIS CA C 13 58.687 58.687 58.044 0.643 18935 4097 1 6 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.365 -0.344 18935 4098 1 6 . 1 1 13 13 HIS H H 13 7.861 7.861 7.957 -0.096 18935 4099 1 6 . 1 1 14 14 LEU N N 14 115.595 115.595 119.843 -4.248 18935 4100 1 6 . 1 1 14 14 LEU C C 14 179.092 179.092 177.732 1.360 18935 4101 1 6 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.736 -0.095 18935 4102 1 6 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.625 -1.605 18935 4103 1 6 . 1 1 14 14 LEU H H 14 8.376 8.376 8.329 0.047 18935 4104 1 6 . 1 1 15 15 ARG N N 15 115.006 115.006 118.733 -3.727 18935 4105 1 6 . 1 1 15 15 ARG C C 15 176.265 176.265 177.170 -0.905 18935 4106 1 6 . 1 1 15 15 ARG CA C 15 59.884 59.884 57.811 2.073 18935 4107 1 6 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.239 -0.167 18935 4108 1 6 . 1 1 15 15 ARG H H 15 8.074 8.074 8.188 -0.114 18935 4109 1 6 . 1 1 16 16 SER N N 16 107.778 107.778 112.277 -4.499 18935 4110 1 6 . 1 1 16 16 SER C C 16 176.009 176.009 174.620 1.389 18935 4111 1 6 . 1 1 16 16 SER CA C 16 57.244 57.244 59.675 -2.431 18935 4112 1 6 . 1 1 16 16 SER CB C 16 63.525 63.525 63.419 0.106 18935 4113 1 6 . 1 1 16 16 SER H H 16 7.136 7.136 8.201 -1.065 18935 4114 1 6 . 1 1 17 17 ARG N N 17 121.532 121.532 119.308 2.224 18935 4115 1 6 . 1 1 17 17 ARG C C 17 174.482 174.482 175.504 -1.022 18935 4116 1 6 . 1 1 17 17 ARG CA C 17 56.322 56.322 54.671 1.651 18935 4117 1 6 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.183 0.646 18935 4118 1 6 . 1 1 17 17 ARG H H 17 7.913 7.913 7.461 0.452 18935 4119 1 6 . 1 1 18 18 LEU N N 18 121.305 121.305 120.452 0.853 18935 4120 1 6 . 1 1 18 18 LEU C C 18 176.283 176.283 175.750 0.533 18935 4121 1 6 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.107 -0.409 18935 4122 1 6 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.032 0.023 18935 4123 1 6 . 1 1 18 18 LEU H H 18 8.812 8.812 7.564 1.248 18935 4124 1 6 . 1 1 19 19 ALA N N 19 125.293 125.293 121.216 4.077 18935 4125 1 6 . 1 1 19 19 ALA C C 19 173.780 173.780 175.170 -1.390 18935 4126 1 6 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.877 -1.075 18935 4127 1 6 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.773 1.080 18935 4128 1 6 . 1 1 19 19 ALA H H 19 8.790 8.790 7.861 0.929 18935 4129 1 6 . 1 1 20 20 PHE N N 20 113.117 113.117 114.957 -1.840 18935 4130 1 6 . 1 1 20 20 PHE C C 20 172.708 172.708 173.042 -0.334 18935 4131 1 6 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.751 -1.153 18935 4132 1 6 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.389 -0.664 18935 4133 1 6 . 1 1 20 20 PHE H H 20 8.925 8.925 8.740 0.185 18935 4134 1 6 . 1 1 21 21 GLU N N 21 121.532 121.532 122.782 -1.250 18935 4135 1 6 . 1 1 21 21 GLU C C 21 174.830 174.830 175.493 -0.663 18935 4136 1 6 . 1 1 21 21 GLU CA C 21 54.963 54.963 54.853 0.110 18935 4137 1 6 . 1 1 21 21 GLU CB C 21 30.343 30.343 30.699 -0.356 18935 4138 1 6 . 1 1 21 21 GLU H H 21 7.972 7.972 9.207 -1.235 18935 4139 1 6 . 1 1 22 22 TYR N N 22 125.339 125.339 127.743 -2.404 18935 4140 1 6 . 1 1 22 22 TYR C C 22 174.864 174.864 175.572 -0.708 18935 4141 1 6 . 1 1 22 22 TYR CA C 22 55.288 55.288 57.871 -2.583 18935 4142 1 6 . 1 1 22 22 TYR CB C 22 39.859 39.859 39.801 0.058 18935 4143 1 6 . 1 1 22 22 TYR H H 22 9.016 9.016 7.855 1.161 18935 4144 1 6 . 1 1 23 23 ASN N N 23 127.024 127.024 127.657 -0.633 18935 4145 1 6 . 1 1 23 23 ASN C C 23 175.410 175.410 174.882 0.528 18935 4146 1 6 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.642 -0.587 18935 4147 1 6 . 1 1 23 23 ASN CB C 23 36.261 36.261 36.974 -0.713 18935 4148 1 6 . 1 1 23 23 ASN H H 23 9.181 9.181 9.317 -0.136 18935 4149 1 6 . 1 1 24 24 GLY N N 24 102.755 102.755 102.096 0.659 18935 4150 1 6 . 1 1 24 24 GLY C C 24 173.626 173.626 174.532 -0.906 18935 4151 1 6 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.069 -0.134 18935 4152 1 6 . 1 1 24 24 GLY H H 24 8.666 8.666 8.296 0.370 18935 4153 1 6 . 1 1 25 25 GLN N N 25 118.722 118.722 120.261 -1.539 18935 4154 1 6 . 1 1 25 25 GLN C C 25 173.657 173.657 174.803 -1.146 18935 4155 1 6 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.918 -1.685 18935 4156 1 6 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.637 0.168 18935 4157 1 6 . 1 1 25 25 GLN H H 25 7.708 7.708 8.036 -0.328 18935 4158 1 6 . 1 1 26 26 LEU N N 26 123.526 123.526 121.350 2.176 18935 4159 1 6 . 1 1 26 26 LEU C C 26 175.842 175.842 176.219 -0.377 18935 4160 1 6 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.910 0.076 18935 4161 1 6 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.132 -2.325 18935 4162 1 6 . 1 1 26 26 LEU H H 26 8.543 8.543 8.395 0.148 18935 4163 1 6 . 1 1 27 27 ILE N N 27 129.462 129.462 124.990 4.472 18935 4164 1 6 . 1 1 27 27 ILE C C 27 175.085 175.085 174.546 0.539 18935 4165 1 6 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.902 0.071 18935 4166 1 6 . 1 1 27 27 ILE CB C 27 35.552 35.552 37.907 -2.355 18935 4167 1 6 . 1 1 27 27 ILE H H 27 8.989 8.989 9.009 -0.020 18935 4168 1 6 . 1 1 28 28 LYS N N 28 125.157 125.157 127.134 -1.977 18935 4169 1 6 . 1 1 28 28 LYS C C 28 176.725 176.725 175.612 1.113 18935 4170 1 6 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.859 0.951 18935 4171 1 6 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.272 -1.455 18935 4172 1 6 . 1 1 28 28 LYS H H 28 8.311 8.311 8.451 -0.140 18935 4173 1 6 . 1 1 29 29 ILE N N 29 125.565 125.565 114.489 11.076 18935 4174 1 6 . 1 1 29 29 ILE C C 29 175.685 175.685 174.079 1.606 18935 4175 1 6 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.560 0.845 18935 4176 1 6 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.542 -3.511 18935 4177 1 6 . 1 1 29 29 ILE H H 29 8.209 8.209 7.797 0.412 18935 4178 1 6 . 1 1 30 30 LEU N N 30 127.831 127.831 116.659 11.172 18935 4179 1 6 . 1 1 30 30 LEU C C 30 178.794 178.794 177.535 1.259 18935 4180 1 6 . 1 1 30 30 LEU CA C 30 54.443 54.443 52.781 1.662 18935 4181 1 6 . 1 1 30 30 LEU CB C 30 40.836 40.836 44.275 -3.438 18935 4182 1 6 . 1 1 30 30 LEU H H 30 9.027 9.027 7.996 1.031 18935 4183 1 6 . 1 1 31 31 SER N N 31 116.864 116.864 115.654 1.210 18935 4184 1 6 . 1 1 31 31 SER C C 31 177.464 177.464 176.350 1.114 18935 4185 1 6 . 1 1 31 31 SER CA C 31 61.180 61.180 61.160 0.020 18935 4186 1 6 . 1 1 31 31 SER CB C 31 62.105 62.105 62.605 -0.500 18935 4187 1 6 . 1 1 31 31 SER H H 31 8.887 8.887 8.668 0.219 18935 4188 1 6 . 1 1 32 32 LYS N N 32 114.825 114.825 121.475 -6.650 18935 4189 1 6 . 1 1 32 32 LYS C C 32 176.243 176.243 176.285 -0.042 18935 4190 1 6 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.598 -1.306 18935 4191 1 6 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.289 -2.023 18935 4192 1 6 . 1 1 32 32 LYS H H 32 8.290 8.290 8.438 -0.148 18935 4193 1 6 . 1 1 33 33 ASN N N 33 117.564 117.564 113.128 4.436 18935 4194 1 6 . 1 1 33 33 ASN C C 33 172.253 172.253 174.154 -1.901 18935 4195 1 6 . 1 1 33 33 ASN CA C 33 52.091 52.091 51.834 0.257 18935 4196 1 6 . 1 1 33 33 ASN CB C 33 38.339 38.339 39.245 -0.906 18935 4197 1 6 . 1 1 33 33 ASN H H 33 8.051 8.051 7.851 0.200 18935 4198 1 6 . 1 1 34 34 ILE N N 34 118.949 118.949 120.284 -1.335 18935 4199 1 6 . 1 1 34 34 ILE C C 34 175.343 175.343 174.952 0.391 18935 4200 1 6 . 1 1 34 34 ILE CA C 34 60.553 60.553 59.560 0.993 18935 4201 1 6 . 1 1 34 34 ILE CB C 34 38.867 38.867 38.519 0.348 18935 4202 1 6 . 1 1 34 34 ILE H H 34 7.670 7.670 8.028 -0.358 18935 4203 1 6 . 1 1 35 35 VAL N N 35 128.355 128.355 126.260 2.095 18935 4204 1 6 . 1 1 35 35 VAL C C 35 175.543 175.543 174.696 0.847 18935 4205 1 6 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.119 -0.105 18935 4206 1 6 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.064 -0.833 18935 4207 1 6 . 1 1 35 35 VAL H H 35 9.698 9.698 9.249 0.449 18935 4208 1 6 . 1 1 36 36 ALA N N 36 129.553 129.553 132.059 -2.506 18935 4209 1 6 . 1 1 36 36 ALA C C 36 177.015 177.015 176.668 0.347 18935 4210 1 6 . 1 1 36 36 ALA CA C 36 52.396 52.396 50.934 1.462 18935 4211 1 6 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.286 -0.664 18935 4212 1 6 . 1 1 36 36 ALA H H 36 8.917 8.917 8.690 0.227 18935 4213 1 6 . 1 1 37 37 VAL N N 37 115.006 115.006 120.119 -5.113 18935 4214 1 6 . 1 1 37 37 VAL C C 37 174.649 174.649 176.805 -2.156 18935 4215 1 6 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.716 -0.395 18935 4216 1 6 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.553 -1.167 18935 4217 1 6 . 1 1 37 37 VAL H H 37 8.214 8.214 7.569 0.645 18935 4218 1 6 . 1 1 38 38 GLY N N 38 109.387 109.387 108.142 1.245 18935 4219 1 6 . 1 1 38 38 GLY C C 38 174.152 174.152 176.488 -2.336 18935 4220 1 6 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.917 -0.420 18935 4221 1 6 . 1 1 38 38 GLY H H 38 8.677 8.677 7.863 0.814 18935 4222 1 6 . 1 1 39 39 SER N N 39 116.776 116.776 119.786 -3.010 18935 4223 1 6 . 1 1 39 39 SER C C 39 175.129 175.129 176.606 -1.477 18935 4224 1 6 . 1 1 39 39 SER CA C 39 60.036 60.036 62.424 -2.388 18935 4225 1 6 . 1 1 39 39 SER CB C 39 61.522 61.522 63.395 -1.873 18935 4226 1 6 . 1 1 39 39 SER H H 39 9.705 9.705 8.316 1.389 18935 4227 1 6 . 1 1 40 40 LEU N N 40 113.696 113.696 118.888 -5.192 18935 4228 1 6 . 1 1 40 40 LEU C C 40 180.558 180.558 177.744 2.814 18935 4229 1 6 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.648 1.725 18935 4230 1 6 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.353 0.524 18935 4231 1 6 . 1 1 40 40 LEU H H 40 7.311 7.311 7.607 -0.296 18935 4232 1 6 . 1 1 41 41 ARG N N 41 121.162 121.162 116.470 4.692 18935 4233 1 6 . 1 1 41 41 ARG C C 41 176.964 176.964 177.083 -0.119 18935 4234 1 6 . 1 1 41 41 ARG CA C 41 58.451 58.451 55.916 2.535 18935 4235 1 6 . 1 1 41 41 ARG CB C 41 28.205 28.205 31.148 -2.942 18935 4236 1 6 . 1 1 41 41 ARG H H 41 6.999 6.999 7.805 -0.806 18935 4237 1 6 . 1 1 42 42 ARG N N 42 111.109 111.109 119.331 -8.222 18935 4238 1 6 . 1 1 42 42 ARG C C 42 172.564 172.564 176.011 -3.447 18935 4239 1 6 . 1 1 42 42 ARG CA C 42 56.380 56.380 56.121 0.259 18935 4240 1 6 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.710 -2.361 18935 4241 1 6 . 1 1 42 42 ARG H H 42 7.041 7.041 7.626 -0.585 18935 4242 1 6 . 1 1 43 43 GLU N N 43 111.924 111.924 116.034 -4.110 18935 4243 1 6 . 1 1 43 43 GLU C C 43 176.202 176.202 174.978 1.224 18935 4244 1 6 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.460 -1.006 18935 4245 1 6 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.323 -2.022 18935 4246 1 6 . 1 1 43 43 GLU H H 43 7.757 7.757 8.026 -0.269 18935 4247 1 6 . 1 1 44 44 GLU N N 44 117.861 117.861 118.731 -0.870 18935 4248 1 6 . 1 1 44 44 GLU C C 44 175.197 175.197 176.334 -1.137 18935 4249 1 6 . 1 1 44 44 GLU CA C 44 56.128 56.128 57.024 -0.896 18935 4250 1 6 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.573 -2.014 18935 4251 1 6 . 1 1 44 44 GLU H H 44 7.461 7.461 7.673 -0.212 18935 4252 1 6 . 1 1 45 45 LYS N N 45 115.051 115.051 121.902 -6.851 18935 4253 1 6 . 1 1 45 45 LYS C C 45 177.733 177.733 176.606 1.127 18935 4254 1 6 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.702 1.353 18935 4255 1 6 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.388 -1.361 18935 4256 1 6 . 1 1 45 45 LYS H H 45 8.123 8.123 8.659 -0.536 18935 4257 1 6 . 1 1 46 46 MET N N 46 114.009 114.009 118.313 -4.304 18935 4258 1 6 . 1 1 46 46 MET C C 46 174.067 174.067 174.836 -0.769 18935 4259 1 6 . 1 1 46 46 MET CA C 46 52.477 52.477 54.367 -1.890 18935 4260 1 6 . 1 1 46 46 MET CB C 46 33.974 33.974 33.902 0.072 18935 4261 1 6 . 1 1 46 46 MET H H 46 7.767 7.767 7.463 0.304 18935 4262 1 6 . 1 1 47 47 LEU N N 47 120.263 120.263 121.499 -1.236 18935 4263 1 6 . 1 1 47 47 LEU C C 47 177.669 177.669 175.532 2.137 18935 4264 1 6 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.662 -1.461 18935 4265 1 6 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.093 -0.184 18935 4266 1 6 . 1 1 47 47 LEU H H 47 9.481 9.481 8.370 1.111 18935 4267 1 6 . 1 1 48 48 ASN N N 48 118.632 118.632 117.421 1.211 18935 4268 1 6 . 1 1 48 48 ASN C C 48 174.715 174.715 173.999 0.716 18935 4269 1 6 . 1 1 48 48 ASN CA C 48 55.501 55.501 54.236 1.266 18935 4270 1 6 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.565 -1.737 18935 4271 1 6 . 1 1 48 48 ASN H H 48 9.388 9.388 9.008 0.380 18935 4272 1 6 . 1 1 49 49 ASP N N 49 115.867 115.867 115.629 0.238 18935 4273 1 6 . 1 1 49 49 ASP C C 49 174.111 174.111 174.463 -0.352 18935 4274 1 6 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.244 -1.043 18935 4275 1 6 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.976 -3.899 18935 4276 1 6 . 1 1 49 49 ASP H H 49 7.670 7.670 7.870 -0.200 18935 4277 1 6 . 1 1 50 50 VAL N N 50 119.185 119.185 119.657 -0.472 18935 4278 1 6 . 1 1 50 50 VAL C C 50 172.333 172.333 174.516 -2.183 18935 4279 1 6 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.596 0.319 18935 4280 1 6 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.330 -0.365 18935 4281 1 6 . 1 1 50 50 VAL H H 50 8.339 8.339 7.736 0.603 18935 4282 1 6 . 1 1 51 51 ASP N N 51 124.704 124.704 127.121 -2.417 18935 4283 1 6 . 1 1 51 51 ASP C C 51 173.725 173.725 175.124 -1.399 18935 4284 1 6 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.603 -0.575 18935 4285 1 6 . 1 1 51 51 ASP CB C 51 43.829 43.829 42.868 0.961 18935 4286 1 6 . 1 1 51 51 ASP H H 51 8.984 8.984 8.588 0.396 18935 4287 1 6 . 1 1 52 52 LEU N N 52 120.943 120.943 122.768 -1.825 18935 4288 1 6 . 1 1 52 52 LEU C C 52 173.045 173.045 174.181 -1.136 18935 4289 1 6 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.144 -1.273 18935 4290 1 6 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.553 -2.300 18935 4291 1 6 . 1 1 52 52 LEU H H 52 9.081 9.081 8.169 0.912 18935 4292 1 6 . 1 1 53 53 LEU N N 53 123.027 123.027 126.091 -3.064 18935 4293 1 6 . 1 1 53 53 LEU C C 53 173.750 173.750 175.038 -1.288 18935 4294 1 6 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.725 -1.392 18935 4295 1 6 . 1 1 53 53 LEU CB C 53 45.008 45.008 44.983 0.025 18935 4296 1 6 . 1 1 53 53 LEU H H 53 9.146 9.146 9.275 -0.129 18935 4297 1 6 . 1 1 54 54 ILE N N 54 126.562 126.562 126.951 -0.389 18935 4298 1 6 . 1 1 54 54 ILE C C 54 175.132 175.132 175.137 -0.005 18935 4299 1 6 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.826 -1.228 18935 4300 1 6 . 1 1 54 54 ILE CB C 54 38.561 38.561 40.205 -1.644 18935 4301 1 6 . 1 1 54 54 ILE H H 54 9.440 9.440 9.250 0.190 18935 4302 1 6 . 1 1 55 55 ILE N N 55 126.879 126.879 128.074 -1.195 18935 4303 1 6 . 1 1 55 55 ILE C C 55 175.655 175.655 175.441 0.214 18935 4304 1 6 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.322 -2.761 18935 4305 1 6 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.997 -5.691 18935 4306 1 6 . 1 1 55 55 ILE H H 55 9.381 9.381 8.428 0.953 18935 4307 1 6 . 1 1 56 56 VAL N N 56 128.936 128.936 126.303 2.633 18935 4308 1 6 . 1 1 56 56 VAL C C 56 176.389 176.389 174.395 1.994 18935 4309 1 6 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.552 0.078 18935 4310 1 6 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.399 -0.615 18935 4311 1 6 . 1 1 56 56 VAL H H 56 9.227 9.227 8.974 0.253 18935 4312 1 6 . 1 1 58 58 GLU N N 58 112.423 112.423 119.696 -7.273 18935 4313 1 6 . 1 1 58 58 GLU C C 58 175.946 175.946 176.681 -0.735 18935 4314 1 6 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.250 -0.950 18935 4315 1 6 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.007 1.090 18935 4316 1 6 . 1 1 58 58 GLU H H 58 6.685 6.685 7.926 -1.241 18935 4317 1 6 . 1 1 59 59 LYS N N 59 125.293 125.293 119.994 5.299 18935 4318 1 6 . 1 1 59 59 LYS C C 59 179.248 179.248 176.146 3.102 18935 4319 1 6 . 1 1 59 59 LYS CA C 59 59.774 59.774 56.502 3.272 18935 4320 1 6 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.150 -1.073 18935 4321 1 6 . 1 1 59 59 LYS H H 59 9.108 9.108 8.542 0.566 18935 4322 1 6 . 1 1 60 60 LYS N N 60 117.408 117.408 117.024 0.384 18935 4323 1 6 . 1 1 60 60 LYS C C 60 177.198 177.198 177.852 -0.654 18935 4324 1 6 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.605 1.608 18935 4325 1 6 . 1 1 60 60 LYS CB C 60 30.583 30.583 33.108 -2.525 18935 4326 1 6 . 1 1 60 60 LYS H H 60 9.102 9.102 7.421 1.681 18935 4327 1 6 . 1 1 61 61 LEU N N 61 114.779 114.779 121.135 -6.356 18935 4328 1 6 . 1 1 61 61 LEU C C 61 178.790 178.790 178.693 0.097 18935 4329 1 6 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.536 -2.512 18935 4330 1 6 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.264 -0.401 18935 4331 1 6 . 1 1 61 61 LEU H H 61 7.455 7.455 7.699 -0.244 18935 4332 1 6 . 1 1 62 62 LEU N N 62 119.629 119.629 117.977 1.652 18935 4333 1 6 . 1 1 62 62 LEU C C 62 177.762 177.762 178.006 -0.244 18935 4334 1 6 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.863 0.335 18935 4335 1 6 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.761 -1.030 18935 4336 1 6 . 1 1 62 62 LEU H H 62 7.714 7.714 7.493 0.221 18935 4337 1 6 . 1 1 63 63 LYS N N 63 112.921 112.921 117.249 -4.328 18935 4338 1 6 . 1 1 63 63 LYS C C 63 175.386 175.386 177.844 -2.458 18935 4339 1 6 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.230 0.126 18935 4340 1 6 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.745 -1.782 18935 4341 1 6 . 1 1 63 63 LYS H H 63 7.751 7.751 8.541 -0.790 18935 4342 1 6 . 1 1 64 64 HIS N N 64 112.468 112.468 117.689 -5.221 18935 4343 1 6 . 1 1 64 64 HIS C C 64 176.081 176.081 175.731 0.350 18935 4344 1 6 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.502 -1.733 18935 4345 1 6 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.361 1.009 18935 4346 1 6 . 1 1 64 64 HIS H H 64 7.697 7.697 7.952 -0.255 18935 4347 1 6 . 1 1 65 65 VAL N N 65 117.499 117.499 119.081 -1.582 18935 4348 1 6 . 1 1 65 65 VAL C C 65 174.301 174.301 176.699 -2.398 18935 4349 1 6 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.493 2.837 18935 4350 1 6 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.406 -2.046 18935 4351 1 6 . 1 1 65 65 VAL H H 65 6.917 6.917 7.388 -0.471 18935 4352 1 6 . 1 1 66 66 LEU N N 66 113.873 113.873 118.980 -5.107 18935 4353 1 6 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.937 -0.087 18935 4354 1 6 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.149 -3.091 18935 4355 1 6 . 1 1 66 66 LEU H H 66 9.102 9.102 8.159 0.943 18935 4356 1 6 . 1 1 68 68 ASN N N 68 110.792 110.792 118.012 -7.220 18935 4357 1 6 . 1 1 68 68 ASN C C 68 174.877 174.877 173.331 1.546 18935 4358 1 6 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.447 -1.632 18935 4359 1 6 . 1 1 68 68 ASN CB C 68 40.311 40.311 40.335 -0.024 18935 4360 1 6 . 1 1 68 68 ASN H H 68 7.234 7.234 8.464 -1.230 18935 4361 1 6 . 1 1 69 69 ILE N N 69 122.348 122.348 125.048 -2.700 18935 4362 1 6 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.218 -0.306 18935 4363 1 6 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.547 -2.509 18935 4364 1 6 . 1 1 69 69 ILE H H 69 7.428 7.428 8.695 -1.267 18935 4365 1 6 . 1 1 70 70 ARG N N 70 125.701 125.701 126.156 -0.455 18935 4366 1 6 . 1 1 70 70 ARG C C 70 174.596 174.596 173.638 0.958 18935 4367 1 6 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.613 -1.452 18935 4368 1 6 . 1 1 70 70 ARG CB C 70 32.453 32.453 32.748 -0.295 18935 4369 1 6 . 1 1 70 70 ARG H H 70 9.083 9.083 8.679 0.404 18935 4370 1 6 . 1 1 71 71 ILE N N 71 118.496 118.496 118.312 0.184 18935 4371 1 6 . 1 1 71 71 ILE C C 71 175.625 175.625 175.857 -0.232 18935 4372 1 6 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.606 0.170 18935 4373 1 6 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.388 -2.421 18935 4374 1 6 . 1 1 71 71 ILE H H 71 7.864 7.864 7.932 -0.068 18935 4375 1 6 . 1 1 72 72 LYS N N 72 127.423 127.423 125.933 1.490 18935 4376 1 6 . 1 1 72 72 LYS C C 72 177.659 177.659 177.025 0.634 18935 4377 1 6 . 1 1 72 72 LYS CA C 72 57.428 57.428 56.486 0.943 18935 4378 1 6 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.462 -1.088 18935 4379 1 6 . 1 1 72 72 LYS H H 72 8.720 8.720 8.766 -0.046 18935 4380 1 6 . 1 1 73 73 GLY N N 73 112.604 112.604 114.185 -1.581 18935 4381 1 6 . 1 1 73 73 GLY C C 73 173.729 173.729 173.570 0.159 18935 4382 1 6 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.004 0.827 18935 4383 1 6 . 1 1 73 73 GLY H H 73 8.930 8.930 9.024 -0.094 18935 4384 1 6 . 1 1 74 74 LEU N N 74 119.538 119.538 120.036 -0.498 18935 4385 1 6 . 1 1 74 74 LEU C C 74 175.802 175.802 175.526 0.276 18935 4386 1 6 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.962 -0.301 18935 4387 1 6 . 1 1 74 74 LEU CB C 74 44.053 44.053 45.801 -1.748 18935 4388 1 6 . 1 1 74 74 LEU H H 74 7.547 7.547 8.129 -0.582 18935 4389 1 6 . 1 1 75 75 SER N N 75 118.994 118.994 117.632 1.362 18935 4390 1 6 . 1 1 75 75 SER C C 75 173.111 173.111 173.446 -0.335 18935 4391 1 6 . 1 1 75 75 SER CA C 75 57.696 57.696 58.344 -0.648 18935 4392 1 6 . 1 1 75 75 SER CB C 75 63.073 63.073 62.917 0.156 18935 4393 1 6 . 1 1 75 75 SER H H 75 9.076 9.076 8.989 0.087 18935 4394 1 6 . 1 1 76 76 PHE N N 76 117.802 117.802 121.357 -3.555 18935 4395 1 6 . 1 1 76 76 PHE C C 76 173.564 173.564 174.580 -1.016 18935 4396 1 6 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.597 -1.188 18935 4397 1 6 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.182 -0.339 18935 4398 1 6 . 1 1 76 76 PHE H H 76 8.119 8.119 7.769 0.350 18935 4399 1 6 . 1 1 77 77 SER N N 77 113.918 113.918 117.500 -3.582 18935 4400 1 6 . 1 1 77 77 SER C C 77 173.194 173.194 173.167 0.027 18935 4401 1 6 . 1 1 77 77 SER CA C 77 55.999 55.999 57.385 -1.385 18935 4402 1 6 . 1 1 77 77 SER CB C 77 65.218 65.218 65.684 -0.466 18935 4403 1 6 . 1 1 77 77 SER H H 77 8.989 8.989 8.443 0.546 18935 4404 1 6 . 1 1 78 78 VAL N N 78 123.662 123.662 125.918 -2.256 18935 4405 1 6 . 1 1 78 78 VAL C C 78 176.057 176.057 176.259 -0.202 18935 4406 1 6 . 1 1 78 78 VAL CA C 78 62.091 62.091 61.933 0.158 18935 4407 1 6 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.676 0.618 18935 4408 1 6 . 1 1 78 78 VAL H H 78 8.995 8.995 8.828 0.167 18935 4409 1 6 . 1 1 79 79 LYS N N 79 129.417 129.417 128.510 0.907 18935 4410 1 6 . 1 1 79 79 LYS C C 79 176.436 176.436 174.574 1.862 18935 4411 1 6 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.890 2.762 18935 4412 1 6 . 1 1 79 79 LYS CB C 79 32.473 32.473 37.011 -4.538 18935 4413 1 6 . 1 1 79 79 LYS H H 79 9.425 9.425 8.979 0.446 18935 4414 1 6 . 1 1 80 80 VAL N N 80 108.616 108.616 121.426 -12.810 18935 4415 1 6 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.195 -2.098 18935 4416 1 6 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.856 0.226 18935 4417 1 6 . 1 1 80 80 VAL H H 80 7.380 7.380 8.459 -1.079 18935 4418 1 6 . 1 1 81 81 CYS N N 81 123.254 123.254 127.897 -4.643 18935 4419 1 6 . 1 1 81 81 CYS C C 81 172.053 172.053 173.896 -1.843 18935 4420 1 6 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.504 2.235 18935 4421 1 6 . 1 1 81 81 CYS CB C 81 27.332 27.332 28.508 -1.176 18935 4422 1 6 . 1 1 81 81 CYS H H 81 9.759 9.759 8.677 1.082 18935 4423 1 6 . 1 1 82 82 GLY N N 82 118.450 118.450 115.610 2.840 18935 4424 1 6 . 1 1 82 82 GLY C C 82 171.814 171.814 174.854 -3.040 18935 4425 1 6 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.083 -1.730 18935 4426 1 6 . 1 1 82 82 GLY H H 82 8.537 8.537 8.594 -0.057 18935 4427 1 6 . 1 1 83 83 GLU N N 83 113.964 113.964 121.751 -7.787 18935 4428 1 6 . 1 1 83 83 GLU C C 83 179.320 179.320 177.669 1.651 18935 4429 1 6 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.157 0.518 18935 4430 1 6 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.469 -0.562 18935 4431 1 6 . 1 1 83 83 GLU H H 83 8.473 8.473 8.793 -0.320 18935 4432 1 6 . 1 1 84 84 ARG N N 84 117.544 117.544 117.933 -0.389 18935 4433 1 6 . 1 1 84 84 ARG C C 84 177.252 177.252 175.433 1.819 18935 4434 1 6 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.181 -0.676 18935 4435 1 6 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.589 -0.043 18935 4436 1 6 . 1 1 84 84 ARG H H 84 9.760 9.760 8.334 1.426 18935 4437 1 6 . 1 1 85 85 LYS N N 85 124.160 124.160 120.448 3.712 18935 4438 1 6 . 1 1 85 85 LYS C C 85 173.379 173.379 175.521 -2.142 18935 4439 1 6 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.292 -1.060 18935 4440 1 6 . 1 1 85 85 LYS CB C 85 34.212 34.212 35.046 -0.834 18935 4441 1 6 . 1 1 85 85 LYS H H 85 8.494 8.494 7.739 0.755 18935 4442 1 6 . 1 1 86 86 CYS N N 86 126.472 126.472 120.187 6.285 18935 4443 1 6 . 1 1 86 86 CYS C C 86 171.935 171.935 173.284 -1.349 18935 4444 1 6 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.302 -1.424 18935 4445 1 6 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.002 0.302 18935 4446 1 6 . 1 1 86 86 CYS H H 86 9.221 9.221 8.518 0.703 18935 4447 1 6 . 1 1 87 87 VAL N N 87 126.426 126.426 124.009 2.417 18935 4448 1 6 . 1 1 87 87 VAL C C 87 173.760 173.760 174.214 -0.454 18935 4449 1 6 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.093 0.240 18935 4450 1 6 . 1 1 87 87 VAL CB C 87 33.338 33.338 33.308 0.030 18935 4451 1 6 . 1 1 87 87 VAL H H 87 8.623 8.623 9.002 -0.379 18935 4452 1 6 . 1 1 88 88 LEU N N 88 125.701 125.701 127.399 -1.698 18935 4453 1 6 . 1 1 88 88 LEU C C 88 175.424 175.424 175.386 0.038 18935 4454 1 6 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.279 -1.194 18935 4455 1 6 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.551 -2.007 18935 4456 1 6 . 1 1 88 88 LEU H H 88 9.592 9.592 9.055 0.537 18935 4457 1 6 . 1 1 89 89 PHE N N 89 118.314 118.314 123.612 -5.298 18935 4458 1 6 . 1 1 89 89 PHE C C 89 177.068 177.068 176.017 1.051 18935 4459 1 6 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.731 -0.856 18935 4460 1 6 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.048 -0.211 18935 4461 1 6 . 1 1 89 89 PHE H H 89 8.979 8.979 8.733 0.246 18935 4462 1 6 . 1 1 90 90 ILE N N 90 119.039 119.039 119.191 -0.152 18935 4463 1 6 . 1 1 90 90 ILE C C 90 173.692 173.692 174.637 -0.945 18935 4464 1 6 . 1 1 90 90 ILE CA C 90 58.672 58.672 60.074 -1.402 18935 4465 1 6 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.571 0.612 18935 4466 1 6 . 1 1 90 90 ILE H H 90 9.447 9.447 8.504 0.943 18935 4467 1 6 . 1 1 91 91 GLU N N 91 122.801 122.801 126.854 -4.053 18935 4468 1 6 . 1 1 91 91 GLU C C 91 175.565 175.565 174.618 0.947 18935 4469 1 6 . 1 1 91 91 GLU CA C 91 54.465 54.465 54.805 -0.340 18935 4470 1 6 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.422 -3.760 18935 4471 1 6 . 1 1 91 91 GLU H H 91 8.360 8.360 8.902 -0.542 18935 4472 1 6 . 1 1 92 92 TRP N N 92 126.018 126.018 123.301 2.717 18935 4473 1 6 . 1 1 92 92 TRP C C 92 175.070 175.070 175.075 -0.005 18935 4474 1 6 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.753 -0.563 18935 4475 1 6 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.540 -0.958 18935 4476 1 6 . 1 1 92 92 TRP H H 92 9.425 9.425 8.549 0.876 18935 4477 1 6 . 1 1 93 93 GLU N N 93 126.381 126.381 119.756 6.625 18935 4478 1 6 . 1 1 93 93 GLU C C 93 175.637 175.637 176.091 -0.454 18935 4479 1 6 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.839 -1.070 18935 4480 1 6 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.841 -2.897 18935 4481 1 6 . 1 1 93 93 GLU H H 93 8.914 8.914 9.126 -0.212 18935 4482 1 6 . 1 1 94 94 LYS N N 94 107.891 107.891 110.193 -2.302 18935 4483 1 6 . 1 1 94 94 LYS C C 94 175.359 175.359 176.063 -0.704 18935 4484 1 6 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.380 0.049 18935 4485 1 6 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.582 -1.940 18935 4486 1 6 . 1 1 94 94 LYS H H 94 8.634 8.634 8.610 0.024 18935 4487 1 6 . 1 1 95 95 LYS N N 95 120.490 120.490 118.942 1.548 18935 4488 1 6 . 1 1 95 95 LYS C C 95 174.369 174.369 174.302 0.067 18935 4489 1 6 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.995 -0.641 18935 4490 1 6 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.277 -0.814 18935 4491 1 6 . 1 1 95 95 LYS H H 95 7.924 7.924 7.822 0.102 18935 4492 1 6 . 1 1 96 96 THR N N 96 115.278 115.278 112.971 2.307 18935 4493 1 6 . 1 1 96 96 THR C C 96 174.317 174.317 173.221 1.096 18935 4494 1 6 . 1 1 96 96 THR CA C 96 61.203 61.203 60.574 0.629 18935 4495 1 6 . 1 1 96 96 THR CB C 96 69.348 69.348 69.911 -0.563 18935 4496 1 6 . 1 1 96 96 THR H H 96 7.967 7.967 7.756 0.211 18935 4497 1 6 . 1 1 97 97 TYR N N 97 123.254 123.254 124.373 -1.119 18935 4498 1 6 . 1 1 97 97 TYR C C 97 173.320 173.320 174.888 -1.568 18935 4499 1 6 . 1 1 97 97 TYR CA C 97 55.884 55.884 55.916 -0.032 18935 4500 1 6 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.772 -0.635 18935 4501 1 6 . 1 1 97 97 TYR H H 97 9.232 9.232 9.043 0.189 18935 4502 1 6 . 1 1 98 98 GLN N N 98 122.574 122.574 118.590 3.984 18935 4503 1 6 . 1 1 98 98 GLN C C 98 172.781 172.781 174.395 -1.614 18935 4504 1 6 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.034 0.137 18935 4505 1 6 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.941 -2.542 18935 4506 1 6 . 1 1 98 98 GLN H H 98 9.000 9.000 8.852 0.148 18935 4507 1 6 . 1 1 99 99 LEU N N 99 130.218 130.218 124.932 5.286 18935 4508 1 6 . 1 1 99 99 LEU C C 99 172.806 172.806 174.127 -1.321 18935 4509 1 6 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.673 -1.623 18935 4510 1 6 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.416 -0.665 18935 4511 1 6 . 1 1 99 99 LEU H H 99 9.246 9.246 9.118 0.128 18935 4512 1 6 . 1 1 100 100 ASP N N 100 124.931 124.931 127.279 -2.348 18935 4513 1 6 . 1 1 100 100 ASP C C 100 172.626 172.626 174.511 -1.885 18935 4514 1 6 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.024 -2.594 18935 4515 1 6 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.173 -5.845 18935 4516 1 6 . 1 1 100 100 ASP H H 100 9.253 9.253 8.602 0.651 18935 4517 1 6 . 1 1 101 101 LEU N N 101 119.402 119.402 120.016 -0.614 18935 4518 1 6 . 1 1 101 101 LEU C C 101 173.869 173.869 174.432 -0.563 18935 4519 1 6 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.877 -1.222 18935 4520 1 6 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.451 0.715 18935 4521 1 6 . 1 1 101 101 LEU H H 101 8.726 8.726 7.689 1.037 18935 4522 1 6 . 1 1 102 102 PHE N N 102 117.952 117.952 118.421 -0.469 18935 4523 1 6 . 1 1 102 102 PHE C C 102 175.853 175.853 175.762 0.091 18935 4524 1 6 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.572 -2.290 18935 4525 1 6 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.649 1.175 18935 4526 1 6 . 1 1 102 102 PHE H H 102 8.236 8.236 8.722 -0.486 18935 4527 1 6 . 1 1 103 103 THR N N 103 106.853 106.853 117.996 -11.143 18935 4528 1 6 . 1 1 103 103 THR C C 103 175.154 175.154 173.800 1.354 18935 4529 1 6 . 1 1 103 103 THR CA C 103 57.685 57.685 60.452 -2.767 18935 4530 1 6 . 1 1 103 103 THR CB C 103 71.037 71.037 69.509 1.528 18935 4531 1 6 . 1 1 103 103 THR H H 103 7.917 7.917 8.342 -0.425 18935 4532 1 6 . 1 1 104 104 ALA N N 104 122.348 122.348 128.677 -6.329 18935 4533 1 6 . 1 1 104 104 ALA C C 104 175.947 175.947 174.837 1.110 18935 4534 1 6 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.298 -0.491 18935 4535 1 6 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.466 -0.038 18935 4536 1 6 . 1 1 104 104 ALA H H 104 8.930 8.930 8.902 0.028 18935 4537 1 6 . 1 1 105 105 LEU N N 105 119.855 119.855 119.188 0.667 18935 4538 1 6 . 1 1 105 105 LEU C C 105 179.628 179.628 179.121 0.507 18935 4539 1 6 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.547 -1.424 18935 4540 1 6 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.005 -1.671 18935 4541 1 6 . 1 1 105 105 LEU H H 105 8.316 8.316 9.456 -1.140 18935 4542 1 6 . 1 1 106 106 ALA N N 106 123.662 123.662 124.686 -1.024 18935 4543 1 6 . 1 1 106 106 ALA C C 106 181.056 181.056 178.616 2.440 18935 4544 1 6 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.046 1.303 18935 4545 1 6 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.489 -1.174 18935 4546 1 6 . 1 1 106 106 ALA H H 106 8.306 8.306 8.400 -0.094 18935 4547 1 6 . 1 1 107 107 GLU N N 107 114.825 114.825 115.044 -0.219 18935 4548 1 6 . 1 1 107 107 GLU C C 107 177.854 177.854 176.625 1.229 18935 4549 1 6 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.739 0.647 18935 4550 1 6 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.557 -0.713 18935 4551 1 6 . 1 1 107 107 GLU H H 107 9.754 9.754 8.705 1.049 18935 4552 1 6 . 1 1 108 108 GLU N N 108 115.097 115.097 118.906 -3.809 18935 4553 1 6 . 1 1 108 108 GLU C C 108 178.001 178.001 177.567 0.434 18935 4554 1 6 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.956 -2.030 18935 4555 1 6 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.834 0.167 18935 4556 1 6 . 1 1 108 108 GLU H H 108 7.859 7.859 7.624 0.235 18935 4557 1 6 . 1 1 109 109 LYS N N 109 118.360 118.360 120.942 -2.582 18935 4558 1 6 . 1 1 109 109 LYS C C 109 172.691 172.691 176.679 -3.988 18935 4559 1 6 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.563 0.339 18935 4560 1 6 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.525 0.016 18935 4561 1 6 . 1 1 109 109 LYS H H 109 7.660 7.660 7.260 0.400 18935 4562 1 6 . 1 1 111 111 TYR N N 111 114.054 114.054 119.051 -4.997 18935 4563 1 6 . 1 1 111 111 TYR C C 111 179.764 179.764 178.123 1.641 18935 4564 1 6 . 1 1 111 111 TYR CA C 111 58.998 58.998 61.118 -2.120 18935 4565 1 6 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.424 -1.468 18935 4566 1 6 . 1 1 111 111 TYR H H 111 6.583 6.583 8.402 -1.819 18935 4567 1 6 . 1 1 112 112 ALA N N 112 124.749 124.749 121.892 2.857 18935 4568 1 6 . 1 1 112 112 ALA C C 112 179.430 179.430 179.377 0.053 18935 4569 1 6 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.824 0.145 18935 4570 1 6 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.907 -0.095 18935 4571 1 6 . 1 1 112 112 ALA H H 112 8.753 8.753 8.928 -0.175 18935 4572 1 6 . 1 1 113 113 ILE N N 113 119.130 119.130 120.324 -1.194 18935 4573 1 6 . 1 1 113 113 ILE C C 113 178.646 178.646 178.541 0.105 18935 4574 1 6 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.413 1.988 18935 4575 1 6 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.602 0.635 18935 4576 1 6 . 1 1 113 113 ILE H H 113 8.946 8.946 8.567 0.379 18935 4577 1 6 . 1 1 114 114 PHE N N 114 121.758 121.758 120.862 0.896 18935 4578 1 6 . 1 1 114 114 PHE C C 114 177.954 177.954 176.888 1.066 18935 4579 1 6 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.504 -1.727 18935 4580 1 6 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.493 0.571 18935 4581 1 6 . 1 1 114 114 PHE H H 114 7.940 7.940 8.544 -0.604 18935 4582 1 6 . 1 1 115 115 HIS N N 115 116.547 116.547 118.757 -2.210 18935 4583 1 6 . 1 1 115 115 HIS C C 115 176.161 176.161 176.526 -0.365 18935 4584 1 6 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.354 -0.235 18935 4585 1 6 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.807 1.260 18935 4586 1 6 . 1 1 115 115 HIS H H 115 7.767 7.767 7.777 -0.010 18935 4587 1 6 . 1 1 116 116 PHE N N 116 109.387 109.387 113.136 -3.749 18935 4588 1 6 . 1 1 116 116 PHE C C 116 177.282 177.282 176.924 0.358 18935 4589 1 6 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.669 1.765 18935 4590 1 6 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.455 -2.200 18935 4591 1 6 . 1 1 116 116 PHE H H 116 8.989 8.989 8.483 0.506 18935 4592 1 6 . 1 1 117 117 THR N N 117 116.864 116.864 115.161 1.703 18935 4593 1 6 . 1 1 117 117 THR C C 117 172.889 172.889 174.909 -2.020 18935 4594 1 6 . 1 1 117 117 THR CA C 117 66.997 66.997 65.081 1.916 18935 4595 1 6 . 1 1 117 117 THR CB C 117 67.948 67.948 69.228 -1.280 18935 4596 1 6 . 1 1 117 117 THR H H 117 7.988 7.988 8.242 -0.254 18935 4597 1 6 . 1 1 118 118 GLY N N 118 103.320 103.320 108.547 -5.227 18935 4598 1 6 . 1 1 118 118 GLY C C 118 176.912 176.912 171.456 5.456 18935 4599 1 6 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.526 1.656 18935 4600 1 6 . 1 1 118 118 GLY H H 118 6.550 6.550 7.187 -0.637 18935 4601 1 6 . 1 1 120 120 VAL N N 120 120.671 120.671 125.965 -5.294 18935 4602 1 6 . 1 1 120 120 VAL C C 120 176.283 176.283 177.429 -1.146 18935 4603 1 6 . 1 1 120 120 VAL CA C 120 66.940 66.940 66.277 0.663 18935 4604 1 6 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.928 -2.076 18935 4605 1 6 . 1 1 120 120 VAL H H 120 8.408 8.408 8.470 -0.062 18935 4606 1 6 . 1 1 121 121 SER N N 121 111.789 111.789 114.818 -3.029 18935 4607 1 6 . 1 1 121 121 SER C C 121 175.658 175.658 176.235 -0.577 18935 4608 1 6 . 1 1 121 121 SER CA C 121 60.814 60.814 61.545 -0.731 18935 4609 1 6 . 1 1 121 121 SER CB C 121 60.253 60.253 62.520 -2.267 18935 4610 1 6 . 1 1 121 121 SER H H 121 8.290 8.290 8.172 0.118 18935 4611 1 6 . 1 1 122 122 TYR N N 122 123.254 123.254 122.573 0.681 18935 4612 1 6 . 1 1 122 122 TYR C C 122 174.611 174.611 177.037 -2.426 18935 4613 1 6 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.630 -2.084 18935 4614 1 6 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.211 -0.072 18935 4615 1 6 . 1 1 122 122 TYR H H 122 6.303 6.303 7.522 -1.219 18935 4616 1 6 . 1 1 123 123 LEU N N 123 114.825 114.825 118.855 -4.030 18935 4617 1 6 . 1 1 123 123 LEU C C 123 178.891 178.891 178.854 0.037 18935 4618 1 6 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.160 -0.381 18935 4619 1 6 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.435 0.203 18935 4620 1 6 . 1 1 123 123 LEU H H 123 6.965 6.965 7.400 -0.435 18935 4621 1 6 . 1 1 124 124 ILE N N 124 114.915 114.915 118.344 -3.429 18935 4622 1 6 . 1 1 124 124 ILE C C 124 177.187 177.187 178.018 -0.831 18935 4623 1 6 . 1 1 124 124 ILE CA C 124 64.431 64.431 63.663 0.768 18935 4624 1 6 . 1 1 124 124 ILE CB C 124 36.555 36.555 36.208 0.347 18935 4625 1 6 . 1 1 124 124 ILE H H 124 7.531 7.531 7.651 -0.120 18935 4626 1 6 . 1 1 125 125 ARG N N 125 115.278 115.278 119.160 -3.882 18935 4627 1 6 . 1 1 125 125 ARG C C 125 178.473 178.473 178.926 -0.453 18935 4628 1 6 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.719 -0.260 18935 4629 1 6 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.579 -2.501 18935 4630 1 6 . 1 1 125 125 ARG H H 125 6.809 6.809 7.605 -0.796 18935 4631 1 6 . 1 1 126 126 ILE N N 126 124.160 124.160 118.900 5.260 18935 4632 1 6 . 1 1 126 126 ILE C C 126 178.172 178.172 177.237 0.935 18935 4633 1 6 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.477 -1.550 18935 4634 1 6 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.710 -3.244 18935 4635 1 6 . 1 1 126 126 ILE H H 126 7.408 7.408 7.410 -0.002 18935 4636 1 6 . 1 1 127 127 ARG N N 127 117.136 117.136 120.633 -3.497 18935 4637 1 6 . 1 1 127 127 ARG C C 127 179.227 179.227 178.533 0.694 18935 4638 1 6 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.726 0.490 18935 4639 1 6 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.450 -1.661 18935 4640 1 6 . 1 1 127 127 ARG H H 127 8.230 8.230 8.056 0.174 18935 4641 1 6 . 1 1 128 128 ALA N N 128 121.305 121.305 120.815 0.490 18935 4642 1 6 . 1 1 128 128 ALA C C 128 179.933 179.933 179.009 0.924 18935 4643 1 6 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.087 -0.381 18935 4644 1 6 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.174 0.164 18935 4645 1 6 . 1 1 128 128 ALA H H 128 8.666 8.666 7.986 0.680 18935 4646 1 6 . 1 1 129 129 ALA N N 129 120.943 120.943 121.419 -0.476 18935 4647 1 6 . 1 1 129 129 ALA C C 129 181.336 181.336 179.838 1.498 18935 4648 1 6 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.866 -0.158 18935 4649 1 6 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.272 -1.412 18935 4650 1 6 . 1 1 129 129 ALA H H 129 7.837 7.837 7.606 0.231 18935 4651 1 6 . 1 1 130 130 LEU N N 130 117.726 117.726 117.371 0.355 18935 4652 1 6 . 1 1 130 130 LEU C C 130 179.432 179.432 179.747 -0.315 18935 4653 1 6 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.909 -0.733 18935 4654 1 6 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.869 -1.303 18935 4655 1 6 . 1 1 130 130 LEU H H 130 8.114 8.114 8.012 0.102 18935 4656 1 6 . 1 1 131 131 LYS N N 131 124.115 124.115 121.713 2.402 18935 4657 1 6 . 1 1 131 131 LYS C C 131 181.452 181.452 179.380 2.072 18935 4658 1 6 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.951 -0.065 18935 4659 1 6 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.900 0.298 18935 4660 1 6 . 1 1 131 131 LYS H H 131 8.849 8.849 7.848 1.001 18935 4661 1 6 . 1 1 132 132 LYS N N 132 119.447 119.447 117.737 1.710 18935 4662 1 6 . 1 1 132 132 LYS C C 132 177.607 177.607 177.756 -0.149 18935 4663 1 6 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.398 -0.446 18935 4664 1 6 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.774 -0.349 18935 4665 1 6 . 1 1 132 132 LYS H H 132 7.778 7.778 8.420 -0.642 18935 4666 1 6 . 1 1 133 133 LYS N N 133 116.638 116.638 115.166 1.472 18935 4667 1 6 . 1 1 133 133 LYS C C 133 174.681 174.681 175.833 -1.152 18935 4668 1 6 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.377 -0.299 18935 4669 1 6 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.618 -0.978 18935 4670 1 6 . 1 1 133 133 LYS H H 133 7.617 7.617 7.596 0.021 18935 4671 1 6 . 1 1 134 134 ASN N N 134 110.792 110.792 115.800 -5.008 18935 4672 1 6 . 1 1 134 134 ASN C C 134 174.034 174.034 173.307 0.727 18935 4673 1 6 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.347 0.268 18935 4674 1 6 . 1 1 134 134 ASN CB C 134 36.052 36.052 36.591 -0.539 18935 4675 1 6 . 1 1 134 134 ASN H H 134 8.123 8.123 8.746 -0.623 18935 4676 1 6 . 1 1 135 135 TYR N N 135 115.867 115.867 117.107 -1.240 18935 4677 1 6 . 1 1 135 135 TYR C C 135 175.122 175.122 173.952 1.170 18935 4678 1 6 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.305 -0.553 18935 4679 1 6 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.889 -1.973 18935 4680 1 6 . 1 1 135 135 TYR H H 135 8.133 8.133 8.030 0.103 18935 4681 1 6 . 1 1 136 136 LYS N N 136 119.870 119.870 122.701 -2.831 18935 4682 1 6 . 1 1 136 136 LYS C C 136 174.324 174.324 174.101 0.223 18935 4683 1 6 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.656 0.526 18935 4684 1 6 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.427 -2.354 18935 4685 1 6 . 1 1 136 136 LYS H H 136 9.234 9.234 8.840 0.394 18935 4686 1 6 . 1 1 137 137 LEU N N 137 129.708 129.708 128.161 1.547 18935 4687 1 6 . 1 1 137 137 LEU C C 137 173.798 173.798 174.785 -0.987 18935 4688 1 6 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.402 -1.568 18935 4689 1 6 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.797 1.186 18935 4690 1 6 . 1 1 137 137 LEU H H 137 8.959 8.959 8.745 0.214 18935 4691 1 6 . 1 1 140 140 TYR N N 140 120.580 120.580 114.393 6.187 18935 4692 1 6 . 1 1 140 140 TYR C C 140 174.705 174.705 176.202 -1.497 18935 4693 1 6 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.163 -1.712 18935 4694 1 6 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.493 -0.192 18935 4695 1 6 . 1 1 140 140 TYR H H 140 8.962 8.962 7.432 1.530 18935 4696 1 6 . 1 1 141 141 GLY N N 141 104.986 104.986 105.674 -0.688 18935 4697 1 6 . 1 1 141 141 GLY C C 141 181.854 181.854 172.360 9.494 18935 4698 1 6 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.582 -0.460 18935 4699 1 6 . 1 1 141 141 GLY H H 141 7.555 7.555 7.600 -0.045 18935 4700 1 6 . 1 1 142 142 LEU N N 142 118.269 118.269 121.129 -2.860 18935 4701 1 6 . 1 1 142 142 LEU C C 142 174.067 174.067 176.089 -2.022 18935 4702 1 6 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.707 -1.205 18935 4703 1 6 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.041 1.501 18935 4704 1 6 . 1 1 142 142 LEU H H 142 7.794 7.794 8.416 -0.622 18935 4705 1 6 . 1 1 143 143 PHE N N 143 122.076 122.076 124.725 -2.649 18935 4706 1 6 . 1 1 143 143 PHE C C 143 175.199 175.199 175.320 -0.121 18935 4707 1 6 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.671 -1.639 18935 4708 1 6 . 1 1 143 143 PHE CB C 143 42.070 42.070 40.398 1.671 18935 4709 1 6 . 1 1 143 143 PHE H H 143 9.522 9.522 9.601 -0.079 18935 4710 1 6 . 1 1 144 144 LYS N N 144 121.305 121.305 125.364 -4.059 18935 4711 1 6 . 1 1 144 144 LYS C C 144 176.917 176.917 176.061 0.856 18935 4712 1 6 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.215 1.141 18935 4713 1 6 . 1 1 144 144 LYS CB C 144 33.679 33.679 32.861 0.818 18935 4714 1 6 . 1 1 144 144 LYS H H 144 9.076 9.076 9.258 -0.182 18935 4715 1 6 . 1 1 145 145 ASN N N 145 126.834 126.834 124.868 1.966 18935 4716 1 6 . 1 1 145 145 ASN C C 145 175.070 175.070 175.374 -0.304 18935 4717 1 6 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.217 0.548 18935 4718 1 6 . 1 1 145 145 ASN CB C 145 36.430 36.430 38.163 -1.733 18935 4719 1 6 . 1 1 145 145 ASN H H 145 9.618 9.618 9.210 0.408 18935 4720 1 6 . 1 1 146 146 GLN N N 146 110.112 110.112 111.139 -1.027 18935 4721 1 6 . 1 1 146 146 GLN C C 146 175.198 175.198 175.092 0.106 18935 4722 1 6 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.704 -0.808 18935 4723 1 6 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.476 -1.108 18935 4724 1 6 . 1 1 146 146 GLN H H 146 9.140 9.140 8.908 0.232 18935 4725 1 6 . 1 1 147 147 THR N N 147 116.003 116.003 115.954 0.049 18935 4726 1 6 . 1 1 147 147 THR C C 147 173.224 173.224 173.181 0.043 18935 4727 1 6 . 1 1 147 147 THR CA C 147 61.450 61.450 61.374 0.076 18935 4728 1 6 . 1 1 147 147 THR CB C 147 70.285 70.285 70.025 0.260 18935 4729 1 6 . 1 1 147 147 THR H H 147 8.069 8.069 7.647 0.422 18935 4730 1 6 . 1 1 148 148 LEU N N 148 129.281 129.281 129.705 -0.424 18935 4731 1 6 . 1 1 148 148 LEU C C 148 176.703 176.703 175.310 1.393 18935 4732 1 6 . 1 1 148 148 LEU CA C 148 55.466 55.466 54.959 0.507 18935 4733 1 6 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.675 -0.950 18935 4734 1 6 . 1 1 148 148 LEU H H 148 8.831 8.831 8.771 0.060 18935 4735 1 6 . 1 1 149 149 VAL N N 149 130.189 130.189 126.842 3.347 18935 4736 1 6 . 1 1 149 149 VAL C C 149 175.012 175.012 173.800 1.212 18935 4737 1 6 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.502 0.768 18935 4738 1 6 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.153 -3.697 18935 4739 1 6 . 1 1 149 149 VAL H H 149 9.243 9.243 8.377 0.866 18935 4740 1 6 . 1 1 151 151 LEU N N 151 123.481 123.481 117.318 6.163 18935 4741 1 6 . 1 1 151 151 LEU C C 151 177.679 177.679 176.905 0.774 18935 4742 1 6 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.266 -0.269 18935 4743 1 6 . 1 1 151 151 LEU CB C 151 43.619 43.619 43.329 0.290 18935 4744 1 6 . 1 1 151 151 LEU H H 151 8.080 8.080 8.065 0.015 18935 4745 1 6 . 1 1 152 152 LYS N N 152 126.381 126.381 120.376 6.005 18935 4746 1 6 . 1 1 152 152 LYS C C 152 175.115 175.115 175.233 -0.118 18935 4747 1 6 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.309 -1.713 18935 4748 1 6 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.352 -3.287 18935 4749 1 6 . 1 1 152 152 LYS H H 152 9.112 9.112 8.790 0.322 18935 4750 1 6 . 1 1 153 153 ILE N N 153 113.737 113.737 116.331 -2.594 18935 4751 1 6 . 1 1 153 153 ILE C C 153 175.748 175.748 173.721 2.027 18935 4752 1 6 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.303 -0.915 18935 4753 1 6 . 1 1 153 153 ILE CB C 153 41.803 41.803 41.192 0.611 18935 4754 1 6 . 1 1 153 153 ILE H H 153 7.304 7.304 7.633 -0.329 18935 4755 1 6 . 1 1 154 154 THR N N 154 110.656 110.656 112.995 -2.339 18935 4756 1 6 . 1 1 154 154 THR C C 154 174.864 174.864 173.334 1.530 18935 4757 1 6 . 1 1 154 154 THR CA C 154 62.141 62.141 61.814 0.327 18935 4758 1 6 . 1 1 154 154 THR CB C 154 70.413 70.413 69.760 0.653 18935 4759 1 6 . 1 1 154 154 THR H H 154 9.382 9.382 8.388 0.994 18935 4760 1 6 . 1 1 155 155 THR N N 155 110.746 110.746 116.071 -5.325 18935 4761 1 6 . 1 1 155 155 THR C C 155 174.718 174.718 175.032 -0.314 18935 4762 1 6 . 1 1 155 155 THR CA C 155 58.785 58.785 60.986 -2.201 18935 4763 1 6 . 1 1 155 155 THR CB C 155 72.277 72.277 71.109 1.168 18935 4764 1 6 . 1 1 155 155 THR H H 155 7.746 7.746 7.615 0.131 18935 4765 1 6 . 1 1 156 156 GLU N N 156 122.302 122.302 123.588 -1.286 18935 4766 1 6 . 1 1 156 156 GLU C C 156 177.289 177.289 177.877 -0.588 18935 4767 1 6 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.684 -1.860 18935 4768 1 6 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.097 -0.716 18935 4769 1 6 . 1 1 156 156 GLU H H 156 9.490 9.490 9.063 0.427 18935 4770 1 6 . 1 1 157 157 LYS N N 157 118.905 118.905 118.472 0.433 18935 4771 1 6 . 1 1 157 157 LYS C C 157 178.241 178.241 179.063 -0.822 18935 4772 1 6 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.154 1.611 18935 4773 1 6 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.862 -0.584 18935 4774 1 6 . 1 1 157 157 LYS H H 157 8.329 8.329 8.272 0.057 18935 4775 1 6 . 1 1 158 158 GLU N N 158 116.230 116.230 120.638 -4.408 18935 4776 1 6 . 1 1 158 158 GLU C C 158 178.988 178.988 178.629 0.359 18935 4777 1 6 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.702 -0.446 18935 4778 1 6 . 1 1 158 158 GLU CB C 158 29.058 29.058 28.881 0.177 18935 4779 1 6 . 1 1 158 158 GLU H H 158 7.611 7.611 8.201 -0.590 18935 4780 1 6 . 1 1 159 159 LEU N N 159 118.978 118.978 120.726 -1.748 18935 4781 1 6 . 1 1 159 159 LEU C C 159 176.347 176.347 178.394 -2.047 18935 4782 1 6 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.256 -5.017 18935 4783 1 6 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.849 -2.305 18935 4784 1 6 . 1 1 159 159 LEU H H 159 7.704 7.704 8.267 -0.563 18935 4785 1 6 . 1 1 160 160 ILE N N 160 117.227 117.227 115.621 1.606 18935 4786 1 6 . 1 1 160 160 ILE C C 160 177.219 177.219 177.769 -0.550 18935 4787 1 6 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.724 0.891 18935 4788 1 6 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.244 0.313 18935 4789 1 6 . 1 1 160 160 ILE H H 160 7.886 7.886 7.293 0.593 18935 4790 1 6 . 1 1 161 161 LYS N N 161 115.912 115.912 118.798 -2.886 18935 4791 1 6 . 1 1 161 161 LYS C C 161 180.990 180.990 178.731 2.259 18935 4792 1 6 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.093 0.538 18935 4793 1 6 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.886 -1.138 18935 4794 1 6 . 1 1 161 161 LYS H H 161 7.536 7.536 7.720 -0.184 18935 4795 1 6 . 1 1 162 162 GLU N N 162 120.852 120.852 119.173 1.679 18935 4796 1 6 . 1 1 162 162 GLU C C 162 178.793 178.793 177.730 1.063 18935 4797 1 6 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.139 -0.157 18935 4798 1 6 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.751 -1.959 18935 4799 1 6 . 1 1 162 162 GLU H H 162 8.392 8.392 7.908 0.484 18935 4800 1 6 . 1 1 163 163 LEU N N 163 115.912 115.912 116.861 -0.949 18935 4801 1 6 . 1 1 163 163 LEU C C 163 176.370 176.370 177.081 -0.711 18935 4802 1 6 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.676 -0.582 18935 4803 1 6 . 1 1 163 163 LEU CB C 163 41.174 41.174 43.132 -1.958 18935 4804 1 6 . 1 1 163 163 LEU H H 163 8.031 8.031 7.825 0.206 18935 4805 1 6 . 1 1 164 164 GLY N N 164 103.160 103.160 105.319 -2.159 18935 4806 1 6 . 1 1 164 164 GLY C C 164 174.240 174.240 174.009 0.231 18935 4807 1 6 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.828 -0.526 18935 4808 1 6 . 1 1 164 164 GLY H H 164 7.625 7.625 8.141 -0.516 18935 4809 1 6 . 1 1 165 165 PHE N N 165 117.952 117.952 118.877 -0.925 18935 4810 1 6 . 1 1 165 165 PHE C C 165 174.556 174.556 174.902 -0.346 18935 4811 1 6 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.981 -0.516 18935 4812 1 6 . 1 1 165 165 PHE CB C 165 40.762 40.762 42.309 -1.547 18935 4813 1 6 . 1 1 165 165 PHE H H 165 7.283 7.283 7.999 -0.716 18935 4814 1 6 . 1 1 166 166 THR N N 166 118.178 118.178 113.324 4.854 18935 4815 1 6 . 1 1 166 166 THR C C 166 175.306 175.306 173.986 1.320 18935 4816 1 6 . 1 1 166 166 THR CA C 166 63.466 63.466 61.289 2.177 18935 4817 1 6 . 1 1 166 166 THR CB C 166 68.721 68.721 70.367 -1.646 18935 4818 1 6 . 1 1 166 166 THR H H 166 9.678 9.678 8.558 1.120 18935 4819 1 6 . 1 1 167 167 TYR N N 167 128.239 128.239 125.002 3.237 18935 4820 1 6 . 1 1 167 167 TYR C C 167 173.297 173.297 175.428 -2.131 18935 4821 1 6 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.039 1.373 18935 4822 1 6 . 1 1 167 167 TYR CB C 167 36.722 36.722 38.711 -1.989 18935 4823 1 6 . 1 1 167 167 TYR H H 167 9.264 9.264 8.679 0.585 18935 4824 1 6 . 1 1 168 168 ARG N N 168 126.789 126.789 126.742 0.047 18935 4825 1 6 . 1 1 168 168 ARG C C 168 175.297 175.297 174.943 0.354 18935 4826 1 6 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.096 -1.331 18935 4827 1 6 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.766 -1.440 18935 4828 1 6 . 1 1 168 168 ARG H H 168 7.030 7.030 8.519 -1.489 18935 4829 1 6 . 1 1 169 169 ILE N N 169 119.221 119.221 116.647 2.574 18935 4830 1 6 . 1 1 169 169 ILE C C 169 174.522 174.522 175.485 -0.963 18935 4831 1 6 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.557 2.722 18935 4832 1 6 . 1 1 169 169 ILE CB C 169 34.647 34.647 38.697 -4.050 18935 4833 1 6 . 1 1 169 169 ILE H H 169 8.349 8.349 8.283 0.066 18935 4834 1 6 . 1 1 171 171 LYS N N 171 111.335 111.335 117.386 -6.051 18935 4835 1 6 . 1 1 171 171 LYS C C 171 176.638 176.638 177.529 -0.891 18935 4836 1 6 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.757 -1.219 18935 4837 1 6 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.703 0.264 18935 4838 1 6 . 1 1 171 171 LYS H H 171 8.198 8.198 8.447 -0.249 18935 4839 1 6 . 1 1 172 172 LYS N N 172 116.411 116.411 116.731 -0.320 18935 4840 1 6 . 1 1 172 172 LYS C C 172 175.331 175.331 175.484 -0.153 18935 4841 1 6 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.486 -1.485 18935 4842 1 6 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.098 -1.280 18935 4843 1 6 . 1 1 172 172 LYS H H 172 7.843 7.843 7.450 0.393 18935 4844 1 6 . 1 1 173 173 ARG N N 173 120.490 120.490 118.499 1.991 18935 4845 1 6 . 1 1 173 173 ARG C C 173 172.830 172.830 173.730 -0.900 18935 4846 1 6 . 1 1 173 173 ARG CA C 173 57.175 57.175 53.492 3.683 18935 4847 1 6 . 1 1 173 173 ARG CB C 173 28.829 28.829 33.062 -4.233 18935 4848 1 6 . 1 1 173 173 ARG H H 173 6.917 6.917 7.713 -0.796 18935 4849 1 7 . 1 1 2 2 LEU N N 2 119.937 119.937 115.150 4.787 18935 4850 1 7 . 1 1 2 2 LEU C C 2 175.307 175.307 174.974 0.333 18935 4851 1 7 . 1 1 2 2 LEU CA C 2 54.292 54.292 54.253 0.039 18935 4852 1 7 . 1 1 2 2 LEU CB C 2 42.684 42.684 45.022 -2.338 18935 4853 1 7 . 1 1 2 2 LEU H H 2 9.251 9.251 8.647 0.604 18935 4854 1 7 . 1 1 3 3 THR N N 3 111.335 111.335 110.925 0.410 18935 4855 1 7 . 1 1 3 3 THR C C 3 175.854 175.854 175.452 0.402 18935 4856 1 7 . 1 1 3 3 THR CA C 3 60.540 60.540 60.300 0.240 18935 4857 1 7 . 1 1 3 3 THR CB C 3 70.782 70.782 70.419 0.363 18935 4858 1 7 . 1 1 3 3 THR H H 3 8.677 8.677 8.205 0.472 18935 4859 1 7 . 1 1 4 4 LEU N N 4 120.988 120.988 123.254 -2.266 18935 4860 1 7 . 1 1 4 4 LEU C C 4 178.391 178.391 178.027 0.364 18935 4861 1 7 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.105 -0.041 18935 4862 1 7 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.947 -2.686 18935 4863 1 7 . 1 1 4 4 LEU H H 4 7.746 7.746 8.199 -0.453 18935 4864 1 7 . 1 1 5 5 ILE N N 5 114.236 114.236 115.193 -0.957 18935 4865 1 7 . 1 1 5 5 ILE C C 5 178.339 178.339 177.793 0.546 18935 4866 1 7 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.794 -1.212 18935 4867 1 7 . 1 1 5 5 ILE CB C 5 36.799 36.799 36.877 -0.078 18935 4868 1 7 . 1 1 5 5 ILE H H 5 7.821 7.821 7.994 -0.173 18935 4869 1 7 . 1 1 6 6 GLN N N 6 120.399 120.399 120.181 0.218 18935 4870 1 7 . 1 1 6 6 GLN C C 6 178.783 178.783 178.621 0.162 18935 4871 1 7 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.680 -0.460 18935 4872 1 7 . 1 1 6 6 GLN CB C 6 28.115 28.115 27.963 0.152 18935 4873 1 7 . 1 1 6 6 GLN H H 6 7.810 7.810 8.099 -0.289 18935 4874 1 7 . 1 1 7 7 GLY N N 7 106.277 106.277 106.665 -0.388 18935 4875 1 7 . 1 1 7 7 GLY C C 7 174.554 174.554 176.328 -1.774 18935 4876 1 7 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.271 -0.337 18935 4877 1 7 . 1 1 7 7 GLY H H 7 8.733 8.733 8.165 0.568 18935 4878 1 7 . 1 1 8 8 LYS N N 8 119.991 119.991 121.602 -1.611 18935 4879 1 7 . 1 1 8 8 LYS C C 8 179.433 179.433 178.281 1.152 18935 4880 1 7 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.061 1.831 18935 4881 1 7 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.379 -1.047 18935 4882 1 7 . 1 1 8 8 LYS H H 8 8.688 8.688 7.524 1.164 18935 4883 1 7 . 1 1 9 9 LYS N N 9 119.175 119.175 120.736 -1.561 18935 4884 1 7 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.883 -0.501 18935 4885 1 7 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.385 -0.950 18935 4886 1 7 . 1 1 9 9 LYS H H 9 8.015 8.015 7.927 0.088 18935 4887 1 7 . 1 1 10 10 ILE N N 10 120.308 120.308 116.556 3.752 18935 4888 1 7 . 1 1 10 10 ILE C C 10 177.766 177.766 177.630 0.136 18935 4889 1 7 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.904 -0.228 18935 4890 1 7 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.496 -1.183 18935 4891 1 7 . 1 1 10 10 ILE H H 10 7.967 7.967 8.209 -0.242 18935 4892 1 7 . 1 1 11 11 VAL N N 11 119.130 119.130 120.805 -1.675 18935 4893 1 7 . 1 1 11 11 VAL C C 11 176.606 176.606 178.225 -1.619 18935 4894 1 7 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.543 1.097 18935 4895 1 7 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.203 -0.994 18935 4896 1 7 . 1 1 11 11 VAL H H 11 8.128 8.128 7.673 0.455 18935 4897 1 7 . 1 1 12 12 ASN N N 12 115.822 115.822 117.181 -1.359 18935 4898 1 7 . 1 1 12 12 ASN C C 12 177.375 177.375 177.170 0.205 18935 4899 1 7 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.067 -0.097 18935 4900 1 7 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.392 -0.829 18935 4901 1 7 . 1 1 12 12 ASN H H 12 8.203 8.203 7.847 0.356 18935 4902 1 7 . 1 1 13 13 HIS N N 13 117.659 117.659 117.625 0.034 18935 4903 1 7 . 1 1 13 13 HIS C C 13 177.287 177.287 176.852 0.435 18935 4904 1 7 . 1 1 13 13 HIS CA C 13 58.687 58.687 58.140 0.547 18935 4905 1 7 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.175 -0.154 18935 4906 1 7 . 1 1 13 13 HIS H H 13 7.861 7.861 7.868 -0.007 18935 4907 1 7 . 1 1 14 14 LEU N N 14 115.595 115.595 119.501 -3.906 18935 4908 1 7 . 1 1 14 14 LEU C C 14 179.092 179.092 177.831 1.261 18935 4909 1 7 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.246 0.395 18935 4910 1 7 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.753 -1.733 18935 4911 1 7 . 1 1 14 14 LEU H H 14 8.376 8.376 8.404 -0.028 18935 4912 1 7 . 1 1 15 15 ARG N N 15 115.006 115.006 119.490 -4.484 18935 4913 1 7 . 1 1 15 15 ARG C C 15 176.265 176.265 176.814 -0.549 18935 4914 1 7 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.736 1.148 18935 4915 1 7 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.898 -0.826 18935 4916 1 7 . 1 1 15 15 ARG H H 15 8.074 8.074 8.139 -0.065 18935 4917 1 7 . 1 1 16 16 SER N N 16 107.778 107.778 111.443 -3.665 18935 4918 1 7 . 1 1 16 16 SER C C 16 176.009 176.009 174.883 1.126 18935 4919 1 7 . 1 1 16 16 SER CA C 16 57.244 57.244 58.664 -1.420 18935 4920 1 7 . 1 1 16 16 SER CB C 16 63.525 63.525 63.503 0.022 18935 4921 1 7 . 1 1 16 16 SER H H 16 7.136 7.136 7.968 -0.832 18935 4922 1 7 . 1 1 17 17 ARG N N 17 121.532 121.532 121.935 -0.403 18935 4923 1 7 . 1 1 17 17 ARG C C 17 174.482 174.482 175.626 -1.144 18935 4924 1 7 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.435 0.887 18935 4925 1 7 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.085 0.745 18935 4926 1 7 . 1 1 17 17 ARG H H 17 7.913 7.913 7.325 0.588 18935 4927 1 7 . 1 1 18 18 LEU N N 18 121.305 121.305 120.979 0.326 18935 4928 1 7 . 1 1 18 18 LEU C C 18 176.283 176.283 175.463 0.820 18935 4929 1 7 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.769 -1.071 18935 4930 1 7 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.185 -0.130 18935 4931 1 7 . 1 1 18 18 LEU H H 18 8.812 8.812 7.579 1.233 18935 4932 1 7 . 1 1 19 19 ALA N N 19 125.293 125.293 123.954 1.339 18935 4933 1 7 . 1 1 19 19 ALA C C 19 173.780 173.780 175.027 -1.247 18935 4934 1 7 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.465 -0.663 18935 4935 1 7 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.256 0.597 18935 4936 1 7 . 1 1 19 19 ALA H H 19 8.790 8.790 8.067 0.723 18935 4937 1 7 . 1 1 20 20 PHE N N 20 113.117 113.117 115.295 -2.178 18935 4938 1 7 . 1 1 20 20 PHE C C 20 172.708 172.708 173.378 -0.670 18935 4939 1 7 . 1 1 20 20 PHE CA C 20 55.598 55.598 55.885 -0.287 18935 4940 1 7 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.052 -0.327 18935 4941 1 7 . 1 1 20 20 PHE H H 20 8.925 8.925 8.863 0.062 18935 4942 1 7 . 1 1 21 21 GLU N N 21 121.532 121.532 120.461 1.071 18935 4943 1 7 . 1 1 21 21 GLU C C 21 174.830 174.830 175.375 -0.545 18935 4944 1 7 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.157 -0.194 18935 4945 1 7 . 1 1 21 21 GLU CB C 21 30.343 30.343 33.215 -2.873 18935 4946 1 7 . 1 1 21 21 GLU H H 21 7.972 7.972 8.824 -0.852 18935 4947 1 7 . 1 1 22 22 TYR N N 22 125.339 125.339 120.584 4.755 18935 4948 1 7 . 1 1 22 22 TYR C C 22 174.864 174.864 174.892 -0.028 18935 4949 1 7 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.569 -3.281 18935 4950 1 7 . 1 1 22 22 TYR CB C 22 39.859 39.859 39.398 0.461 18935 4951 1 7 . 1 1 22 22 TYR H H 22 9.016 9.016 8.758 0.258 18935 4952 1 7 . 1 1 23 23 ASN N N 23 127.024 127.024 125.312 1.712 18935 4953 1 7 . 1 1 23 23 ASN C C 23 175.410 175.410 175.114 0.296 18935 4954 1 7 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.283 -1.229 18935 4955 1 7 . 1 1 23 23 ASN CB C 23 36.261 36.261 38.128 -1.867 18935 4956 1 7 . 1 1 23 23 ASN H H 23 9.181 9.181 9.016 0.165 18935 4957 1 7 . 1 1 24 24 GLY N N 24 102.755 102.755 103.167 -0.412 18935 4958 1 7 . 1 1 24 24 GLY C C 24 173.626 173.626 174.455 -0.829 18935 4959 1 7 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.048 -0.113 18935 4960 1 7 . 1 1 24 24 GLY H H 24 8.666 8.666 8.370 0.296 18935 4961 1 7 . 1 1 25 25 GLN N N 25 118.722 118.722 121.367 -2.645 18935 4962 1 7 . 1 1 25 25 GLN C C 25 173.657 173.657 175.530 -1.873 18935 4963 1 7 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.142 -0.909 18935 4964 1 7 . 1 1 25 25 GLN CB C 25 30.805 30.805 29.010 1.795 18935 4965 1 7 . 1 1 25 25 GLN H H 25 7.708 7.708 8.260 -0.552 18935 4966 1 7 . 1 1 26 26 LEU N N 26 123.526 123.526 125.498 -1.972 18935 4967 1 7 . 1 1 26 26 LEU C C 26 175.842 175.842 176.508 -0.666 18935 4968 1 7 . 1 1 26 26 LEU CA C 26 53.986 53.986 55.105 -1.119 18935 4969 1 7 . 1 1 26 26 LEU CB C 26 40.807 40.807 42.305 -1.498 18935 4970 1 7 . 1 1 26 26 LEU H H 26 8.543 8.543 8.640 -0.097 18935 4971 1 7 . 1 1 27 27 ILE N N 27 129.462 129.462 124.594 4.868 18935 4972 1 7 . 1 1 27 27 ILE C C 27 175.085 175.085 174.246 0.839 18935 4973 1 7 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.474 0.499 18935 4974 1 7 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.039 -2.487 18935 4975 1 7 . 1 1 27 27 ILE H H 27 8.989 8.989 8.930 0.059 18935 4976 1 7 . 1 1 28 28 LYS N N 28 125.157 125.157 127.130 -1.973 18935 4977 1 7 . 1 1 28 28 LYS C C 28 176.725 176.725 175.293 1.432 18935 4978 1 7 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.633 1.177 18935 4979 1 7 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.422 -1.605 18935 4980 1 7 . 1 1 28 28 LYS H H 28 8.311 8.311 8.276 0.035 18935 4981 1 7 . 1 1 29 29 ILE N N 29 125.565 125.565 114.541 11.024 18935 4982 1 7 . 1 1 29 29 ILE C C 29 175.685 175.685 174.145 1.540 18935 4983 1 7 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.449 0.956 18935 4984 1 7 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.485 -3.454 18935 4985 1 7 . 1 1 29 29 ILE H H 29 8.209 8.209 7.941 0.268 18935 4986 1 7 . 1 1 30 30 LEU N N 30 127.831 127.831 119.142 8.689 18935 4987 1 7 . 1 1 30 30 LEU C C 30 178.794 178.794 177.793 1.001 18935 4988 1 7 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.021 1.422 18935 4989 1 7 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.928 -5.092 18935 4990 1 7 . 1 1 30 30 LEU H H 30 9.027 9.027 8.012 1.015 18935 4991 1 7 . 1 1 31 31 SER N N 31 116.864 116.864 118.407 -1.543 18935 4992 1 7 . 1 1 31 31 SER C C 31 177.464 177.464 176.257 1.207 18935 4993 1 7 . 1 1 31 31 SER CA C 31 61.180 61.180 62.419 -1.239 18935 4994 1 7 . 1 1 31 31 SER CB C 31 62.105 62.105 62.842 -0.737 18935 4995 1 7 . 1 1 31 31 SER H H 31 8.887 8.887 8.845 0.042 18935 4996 1 7 . 1 1 32 32 LYS N N 32 114.825 114.825 120.979 -6.154 18935 4997 1 7 . 1 1 32 32 LYS C C 32 176.243 176.243 176.557 -0.314 18935 4998 1 7 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.666 -1.374 18935 4999 1 7 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.166 -1.900 18935 5000 1 7 . 1 1 32 32 LYS H H 32 8.290 8.290 8.419 -0.129 18935 5001 1 7 . 1 1 33 33 ASN N N 33 117.564 117.564 115.499 2.065 18935 5002 1 7 . 1 1 33 33 ASN C C 33 172.253 172.253 173.946 -1.693 18935 5003 1 7 . 1 1 33 33 ASN CA C 33 52.091 52.091 52.089 0.002 18935 5004 1 7 . 1 1 33 33 ASN CB C 33 38.339 38.339 38.887 -0.548 18935 5005 1 7 . 1 1 33 33 ASN H H 33 8.051 8.051 7.859 0.192 18935 5006 1 7 . 1 1 34 34 ILE N N 34 118.949 118.949 120.870 -1.921 18935 5007 1 7 . 1 1 34 34 ILE C C 34 175.343 175.343 174.573 0.770 18935 5008 1 7 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.936 -0.383 18935 5009 1 7 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.597 -2.730 18935 5010 1 7 . 1 1 34 34 ILE H H 34 7.670 7.670 7.827 -0.157 18935 5011 1 7 . 1 1 35 35 VAL N N 35 128.355 128.355 127.143 1.212 18935 5012 1 7 . 1 1 35 35 VAL C C 35 175.543 175.543 174.596 0.947 18935 5013 1 7 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.359 -0.345 18935 5014 1 7 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.678 -1.448 18935 5015 1 7 . 1 1 35 35 VAL H H 35 9.698 9.698 9.244 0.454 18935 5016 1 7 . 1 1 36 36 ALA N N 36 129.553 129.553 131.187 -1.634 18935 5017 1 7 . 1 1 36 36 ALA C C 36 177.015 177.015 176.809 0.206 18935 5018 1 7 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.328 1.068 18935 5019 1 7 . 1 1 36 36 ALA CB C 36 17.622 17.622 17.931 -0.309 18935 5020 1 7 . 1 1 36 36 ALA H H 36 8.917 8.917 8.518 0.399 18935 5021 1 7 . 1 1 37 37 VAL N N 37 115.006 115.006 119.481 -4.475 18935 5022 1 7 . 1 1 37 37 VAL C C 37 174.649 174.649 176.114 -1.465 18935 5023 1 7 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.883 -0.562 18935 5024 1 7 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.094 -0.708 18935 5025 1 7 . 1 1 37 37 VAL H H 37 8.214 8.214 7.624 0.590 18935 5026 1 7 . 1 1 38 38 GLY N N 38 109.387 109.387 108.041 1.346 18935 5027 1 7 . 1 1 38 38 GLY C C 38 174.152 174.152 176.117 -1.965 18935 5028 1 7 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.929 -0.432 18935 5029 1 7 . 1 1 38 38 GLY H H 38 8.677 8.677 7.920 0.757 18935 5030 1 7 . 1 1 39 39 SER N N 39 116.776 116.776 120.029 -3.253 18935 5031 1 7 . 1 1 39 39 SER C C 39 175.129 175.129 176.458 -1.329 18935 5032 1 7 . 1 1 39 39 SER CA C 39 60.036 60.036 62.065 -2.029 18935 5033 1 7 . 1 1 39 39 SER CB C 39 61.522 61.522 63.062 -1.540 18935 5034 1 7 . 1 1 39 39 SER H H 39 9.705 9.705 8.452 1.253 18935 5035 1 7 . 1 1 40 40 LEU N N 40 113.696 113.696 120.252 -6.556 18935 5036 1 7 . 1 1 40 40 LEU C C 40 180.558 180.558 178.019 2.539 18935 5037 1 7 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.066 1.307 18935 5038 1 7 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.119 0.758 18935 5039 1 7 . 1 1 40 40 LEU H H 40 7.311 7.311 7.642 -0.331 18935 5040 1 7 . 1 1 41 41 ARG N N 41 121.162 121.162 115.530 5.632 18935 5041 1 7 . 1 1 41 41 ARG C C 41 176.964 176.964 177.110 -0.146 18935 5042 1 7 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.315 2.136 18935 5043 1 7 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.753 -2.548 18935 5044 1 7 . 1 1 41 41 ARG H H 41 6.999 6.999 7.692 -0.693 18935 5045 1 7 . 1 1 42 42 ARG N N 42 111.109 111.109 118.563 -7.454 18935 5046 1 7 . 1 1 42 42 ARG C C 42 172.564 172.564 175.778 -3.214 18935 5047 1 7 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.920 0.460 18935 5048 1 7 . 1 1 42 42 ARG CB C 42 28.349 28.349 31.194 -2.845 18935 5049 1 7 . 1 1 42 42 ARG H H 42 7.041 7.041 7.353 -0.312 18935 5050 1 7 . 1 1 43 43 GLU N N 43 111.924 111.924 116.985 -5.061 18935 5051 1 7 . 1 1 43 43 GLU C C 43 176.202 176.202 174.872 1.330 18935 5052 1 7 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.313 -0.859 18935 5053 1 7 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.023 -1.722 18935 5054 1 7 . 1 1 43 43 GLU H H 43 7.757 7.757 8.045 -0.288 18935 5055 1 7 . 1 1 44 44 GLU N N 44 117.861 117.861 118.974 -1.113 18935 5056 1 7 . 1 1 44 44 GLU C C 44 175.197 175.197 176.387 -1.190 18935 5057 1 7 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.864 -0.736 18935 5058 1 7 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.340 -1.781 18935 5059 1 7 . 1 1 44 44 GLU H H 44 7.461 7.461 7.645 -0.184 18935 5060 1 7 . 1 1 45 45 LYS N N 45 115.051 115.051 121.796 -6.745 18935 5061 1 7 . 1 1 45 45 LYS C C 45 177.733 177.733 176.933 0.800 18935 5062 1 7 . 1 1 45 45 LYS CA C 45 59.055 59.055 58.366 0.689 18935 5063 1 7 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.300 -1.273 18935 5064 1 7 . 1 1 45 45 LYS H H 45 8.123 8.123 8.658 -0.535 18935 5065 1 7 . 1 1 46 46 MET N N 46 114.009 114.009 117.293 -3.284 18935 5066 1 7 . 1 1 46 46 MET C C 46 174.067 174.067 174.436 -0.369 18935 5067 1 7 . 1 1 46 46 MET CA C 46 52.477 52.477 54.050 -1.573 18935 5068 1 7 . 1 1 46 46 MET CB C 46 33.974 33.974 35.300 -1.326 18935 5069 1 7 . 1 1 46 46 MET H H 46 7.767 7.767 7.448 0.319 18935 5070 1 7 . 1 1 47 47 LEU N N 47 120.263 120.263 118.451 1.812 18935 5071 1 7 . 1 1 47 47 LEU C C 47 177.669 177.669 174.973 2.696 18935 5072 1 7 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.650 -1.449 18935 5073 1 7 . 1 1 47 47 LEU CB C 47 42.908 42.908 44.919 -2.011 18935 5074 1 7 . 1 1 47 47 LEU H H 47 9.481 9.481 9.052 0.429 18935 5075 1 7 . 1 1 48 48 ASN N N 48 118.632 118.632 118.469 0.163 18935 5076 1 7 . 1 1 48 48 ASN C C 48 174.715 174.715 174.817 -0.102 18935 5077 1 7 . 1 1 48 48 ASN CA C 48 55.501 55.501 54.562 0.939 18935 5078 1 7 . 1 1 48 48 ASN CB C 48 38.828 38.828 39.948 -1.120 18935 5079 1 7 . 1 1 48 48 ASN H H 48 9.388 9.388 9.056 0.331 18935 5080 1 7 . 1 1 49 49 ASP N N 49 115.867 115.867 118.085 -2.218 18935 5081 1 7 . 1 1 49 49 ASP C C 49 174.111 174.111 174.385 -0.274 18935 5082 1 7 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.794 -1.593 18935 5083 1 7 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.708 -3.631 18935 5084 1 7 . 1 1 49 49 ASP H H 49 7.670 7.670 7.874 -0.204 18935 5085 1 7 . 1 1 50 50 VAL N N 50 119.185 119.185 119.007 0.178 18935 5086 1 7 . 1 1 50 50 VAL C C 50 172.333 172.333 174.531 -2.198 18935 5087 1 7 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.550 0.365 18935 5088 1 7 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.142 -0.178 18935 5089 1 7 . 1 1 50 50 VAL H H 50 8.339 8.339 7.870 0.469 18935 5090 1 7 . 1 1 51 51 ASP N N 51 124.704 124.704 126.070 -1.366 18935 5091 1 7 . 1 1 51 51 ASP C C 51 173.725 173.725 174.888 -1.163 18935 5092 1 7 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.531 -0.503 18935 5093 1 7 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.705 0.124 18935 5094 1 7 . 1 1 51 51 ASP H H 51 8.984 8.984 8.501 0.483 18935 5095 1 7 . 1 1 52 52 LEU N N 52 120.943 120.943 123.014 -2.071 18935 5096 1 7 . 1 1 52 52 LEU C C 52 173.045 173.045 174.046 -1.001 18935 5097 1 7 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.197 -1.326 18935 5098 1 7 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.696 -2.443 18935 5099 1 7 . 1 1 52 52 LEU H H 52 9.081 9.081 8.311 0.770 18935 5100 1 7 . 1 1 53 53 LEU N N 53 123.027 123.027 126.614 -3.587 18935 5101 1 7 . 1 1 53 53 LEU C C 53 173.750 173.750 174.674 -0.924 18935 5102 1 7 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.006 -0.673 18935 5103 1 7 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.461 -0.452 18935 5104 1 7 . 1 1 53 53 LEU H H 53 9.146 9.146 9.278 -0.132 18935 5105 1 7 . 1 1 54 54 ILE N N 54 126.562 126.562 128.592 -2.030 18935 5106 1 7 . 1 1 54 54 ILE C C 54 175.132 175.132 175.021 0.111 18935 5107 1 7 . 1 1 54 54 ILE CA C 54 58.598 58.598 60.196 -1.598 18935 5108 1 7 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.867 -1.306 18935 5109 1 7 . 1 1 54 54 ILE H H 54 9.440 9.440 9.290 0.150 18935 5110 1 7 . 1 1 55 55 ILE N N 55 126.879 126.879 128.047 -1.168 18935 5111 1 7 . 1 1 55 55 ILE C C 55 175.655 175.655 175.487 0.168 18935 5112 1 7 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.481 -2.920 18935 5113 1 7 . 1 1 55 55 ILE CB C 55 34.306 34.306 40.320 -6.014 18935 5114 1 7 . 1 1 55 55 ILE H H 55 9.381 9.381 8.480 0.901 18935 5115 1 7 . 1 1 56 56 VAL N N 56 128.936 128.936 125.765 3.171 18935 5116 1 7 . 1 1 56 56 VAL C C 56 176.389 176.389 174.095 2.294 18935 5117 1 7 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.802 -0.172 18935 5118 1 7 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.032 -0.248 18935 5119 1 7 . 1 1 56 56 VAL H H 56 9.227 9.227 9.009 0.218 18935 5120 1 7 . 1 1 58 58 GLU N N 58 112.423 112.423 119.227 -6.804 18935 5121 1 7 . 1 1 58 58 GLU C C 58 175.946 175.946 176.588 -0.642 18935 5122 1 7 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.264 -0.964 18935 5123 1 7 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.285 0.812 18935 5124 1 7 . 1 1 58 58 GLU H H 58 6.685 6.685 8.005 -1.320 18935 5125 1 7 . 1 1 59 59 LYS N N 59 125.293 125.293 120.477 4.816 18935 5126 1 7 . 1 1 59 59 LYS C C 59 179.248 179.248 176.200 3.048 18935 5127 1 7 . 1 1 59 59 LYS CA C 59 59.774 59.774 56.837 2.937 18935 5128 1 7 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.118 -1.041 18935 5129 1 7 . 1 1 59 59 LYS H H 59 9.108 9.108 8.583 0.525 18935 5130 1 7 . 1 1 60 60 LYS N N 60 117.408 117.408 118.008 -0.600 18935 5131 1 7 . 1 1 60 60 LYS C C 60 177.198 177.198 178.043 -0.845 18935 5132 1 7 . 1 1 60 60 LYS CA C 60 58.213 58.213 57.302 0.911 18935 5133 1 7 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.880 -2.297 18935 5134 1 7 . 1 1 60 60 LYS H H 60 9.102 9.102 7.521 1.581 18935 5135 1 7 . 1 1 61 61 LEU N N 61 114.779 114.779 120.540 -5.761 18935 5136 1 7 . 1 1 61 61 LEU C C 61 178.790 178.790 178.531 0.259 18935 5137 1 7 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.710 -2.686 18935 5138 1 7 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.010 -0.146 18935 5139 1 7 . 1 1 61 61 LEU H H 61 7.455 7.455 8.273 -0.818 18935 5140 1 7 . 1 1 62 62 LEU N N 62 119.629 119.629 118.355 1.274 18935 5141 1 7 . 1 1 62 62 LEU C C 62 177.762 177.762 177.642 0.120 18935 5142 1 7 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.756 0.442 18935 5143 1 7 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.976 -1.245 18935 5144 1 7 . 1 1 62 62 LEU H H 62 7.714 7.714 7.568 0.146 18935 5145 1 7 . 1 1 63 63 LYS N N 63 112.921 112.921 116.109 -3.188 18935 5146 1 7 . 1 1 63 63 LYS C C 63 175.386 175.386 177.701 -2.315 18935 5147 1 7 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.313 0.043 18935 5148 1 7 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.688 -1.725 18935 5149 1 7 . 1 1 63 63 LYS H H 63 7.751 7.751 8.306 -0.555 18935 5150 1 7 . 1 1 64 64 HIS N N 64 112.468 112.468 117.746 -5.278 18935 5151 1 7 . 1 1 64 64 HIS C C 64 176.081 176.081 176.451 -0.370 18935 5152 1 7 . 1 1 64 64 HIS CA C 64 55.769 55.769 58.727 -2.958 18935 5153 1 7 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.446 0.924 18935 5154 1 7 . 1 1 64 64 HIS H H 64 7.697 7.697 7.707 -0.010 18935 5155 1 7 . 1 1 65 65 VAL N N 65 117.499 117.499 119.219 -1.720 18935 5156 1 7 . 1 1 65 65 VAL C C 65 174.301 174.301 176.982 -2.681 18935 5157 1 7 . 1 1 65 65 VAL CA C 65 66.330 66.330 64.827 1.503 18935 5158 1 7 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.672 -2.312 18935 5159 1 7 . 1 1 65 65 VAL H H 65 6.917 6.917 7.285 -0.368 18935 5160 1 7 . 1 1 66 66 LEU N N 66 113.873 113.873 118.956 -5.083 18935 5161 1 7 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.751 0.099 18935 5162 1 7 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.095 -3.037 18935 5163 1 7 . 1 1 66 66 LEU H H 66 9.102 9.102 8.024 1.078 18935 5164 1 7 . 1 1 68 68 ASN N N 68 110.792 110.792 116.197 -5.405 18935 5165 1 7 . 1 1 68 68 ASN C C 68 174.877 174.877 173.363 1.514 18935 5166 1 7 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.685 -1.870 18935 5167 1 7 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.693 -1.382 18935 5168 1 7 . 1 1 68 68 ASN H H 68 7.234 7.234 8.287 -1.053 18935 5169 1 7 . 1 1 69 69 ILE N N 69 122.348 122.348 124.847 -2.499 18935 5170 1 7 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.180 -0.268 18935 5171 1 7 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.635 -2.597 18935 5172 1 7 . 1 1 69 69 ILE H H 69 7.428 7.428 8.713 -1.285 18935 5173 1 7 . 1 1 70 70 ARG N N 70 125.701 125.701 127.028 -1.327 18935 5174 1 7 . 1 1 70 70 ARG C C 70 174.596 174.596 173.211 1.385 18935 5175 1 7 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.653 -1.492 18935 5176 1 7 . 1 1 70 70 ARG CB C 70 32.453 32.453 33.260 -0.807 18935 5177 1 7 . 1 1 70 70 ARG H H 70 9.083 9.083 9.051 0.032 18935 5178 1 7 . 1 1 71 71 ILE N N 71 118.496 118.496 119.551 -1.055 18935 5179 1 7 . 1 1 71 71 ILE C C 71 175.625 175.625 174.509 1.116 18935 5180 1 7 . 1 1 71 71 ILE CA C 71 59.776 59.776 58.772 1.004 18935 5181 1 7 . 1 1 71 71 ILE CB C 71 37.967 37.967 41.207 -3.240 18935 5182 1 7 . 1 1 71 71 ILE H H 71 7.864 7.864 7.634 0.230 18935 5183 1 7 . 1 1 72 72 LYS N N 72 127.423 127.423 127.110 0.313 18935 5184 1 7 . 1 1 72 72 LYS C C 72 177.659 177.659 176.456 1.203 18935 5185 1 7 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.068 2.360 18935 5186 1 7 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.812 -1.438 18935 5187 1 7 . 1 1 72 72 LYS H H 72 8.720 8.720 8.908 -0.188 18935 5188 1 7 . 1 1 73 73 GLY N N 73 112.604 112.604 112.413 0.191 18935 5189 1 7 . 1 1 73 73 GLY C C 73 173.729 173.729 173.999 -0.270 18935 5190 1 7 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.366 0.465 18935 5191 1 7 . 1 1 73 73 GLY H H 73 8.930 8.930 8.842 0.088 18935 5192 1 7 . 1 1 74 74 LEU N N 74 119.538 119.538 120.806 -1.268 18935 5193 1 7 . 1 1 74 74 LEU C C 74 175.802 175.802 175.693 0.109 18935 5194 1 7 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.832 -0.171 18935 5195 1 7 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.762 -0.709 18935 5196 1 7 . 1 1 74 74 LEU H H 74 7.547 7.547 8.066 -0.519 18935 5197 1 7 . 1 1 75 75 SER N N 75 118.994 118.994 115.538 3.456 18935 5198 1 7 . 1 1 75 75 SER C C 75 173.111 173.111 172.633 0.478 18935 5199 1 7 . 1 1 75 75 SER CA C 75 57.696 57.696 58.256 -0.560 18935 5200 1 7 . 1 1 75 75 SER CB C 75 63.073 63.073 64.868 -1.796 18935 5201 1 7 . 1 1 75 75 SER H H 75 9.076 9.076 8.637 0.439 18935 5202 1 7 . 1 1 76 76 PHE N N 76 117.802 117.802 119.646 -1.844 18935 5203 1 7 . 1 1 76 76 PHE C C 76 173.564 173.564 174.529 -0.965 18935 5204 1 7 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.546 -1.137 18935 5205 1 7 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.289 -0.446 18935 5206 1 7 . 1 1 76 76 PHE H H 76 8.119 8.119 7.735 0.384 18935 5207 1 7 . 1 1 77 77 SER N N 77 113.918 113.918 118.137 -4.219 18935 5208 1 7 . 1 1 77 77 SER C C 77 173.194 173.194 173.510 -0.316 18935 5209 1 7 . 1 1 77 77 SER CA C 77 55.999 55.999 57.183 -1.184 18935 5210 1 7 . 1 1 77 77 SER CB C 77 65.218 65.218 65.254 -0.036 18935 5211 1 7 . 1 1 77 77 SER H H 77 8.989 8.989 8.571 0.418 18935 5212 1 7 . 1 1 78 78 VAL N N 78 123.662 123.662 126.550 -2.888 18935 5213 1 7 . 1 1 78 78 VAL C C 78 176.057 176.057 176.161 -0.104 18935 5214 1 7 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.326 -0.235 18935 5215 1 7 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.500 0.794 18935 5216 1 7 . 1 1 78 78 VAL H H 78 8.995 8.995 8.926 0.069 18935 5217 1 7 . 1 1 79 79 LYS N N 79 129.417 129.417 130.616 -1.199 18935 5218 1 7 . 1 1 79 79 LYS C C 79 176.436 176.436 174.899 1.537 18935 5219 1 7 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.402 3.250 18935 5220 1 7 . 1 1 79 79 LYS CB C 79 32.473 32.473 32.894 -0.421 18935 5221 1 7 . 1 1 79 79 LYS H H 79 9.425 9.425 9.252 0.173 18935 5222 1 7 . 1 1 80 80 VAL N N 80 108.616 108.616 122.909 -14.293 18935 5223 1 7 . 1 1 80 80 VAL CA C 80 59.097 59.097 63.751 -4.654 18935 5224 1 7 . 1 1 80 80 VAL CB C 80 34.082 34.082 32.613 1.469 18935 5225 1 7 . 1 1 80 80 VAL H H 80 7.380 7.380 8.605 -1.225 18935 5226 1 7 . 1 1 81 81 CYS N N 81 123.254 123.254 129.441 -6.187 18935 5227 1 7 . 1 1 81 81 CYS C C 81 172.053 172.053 173.566 -1.513 18935 5228 1 7 . 1 1 81 81 CYS CA C 81 59.739 59.739 58.018 1.721 18935 5229 1 7 . 1 1 81 81 CYS CB C 81 27.332 27.332 27.149 0.183 18935 5230 1 7 . 1 1 81 81 CYS H H 81 9.759 9.759 8.700 1.059 18935 5231 1 7 . 1 1 82 82 GLY N N 82 118.450 118.450 111.632 6.818 18935 5232 1 7 . 1 1 82 82 GLY C C 82 171.814 171.814 174.032 -2.218 18935 5233 1 7 . 1 1 82 82 GLY CA C 82 44.353 44.353 45.147 -0.794 18935 5234 1 7 . 1 1 82 82 GLY H H 82 8.537 8.537 7.785 0.752 18935 5235 1 7 . 1 1 83 83 GLU N N 83 113.964 113.964 121.526 -7.562 18935 5236 1 7 . 1 1 83 83 GLU C C 83 179.320 179.320 176.659 2.661 18935 5237 1 7 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.020 0.655 18935 5238 1 7 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.663 0.244 18935 5239 1 7 . 1 1 83 83 GLU H H 83 8.473 8.473 8.678 -0.205 18935 5240 1 7 . 1 1 84 84 ARG N N 84 117.544 117.544 116.141 1.403 18935 5241 1 7 . 1 1 84 84 ARG C C 84 177.252 177.252 175.912 1.340 18935 5242 1 7 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.907 -1.403 18935 5243 1 7 . 1 1 84 84 ARG CB C 84 31.546 31.546 32.636 -1.090 18935 5244 1 7 . 1 1 84 84 ARG H H 84 9.760 9.760 7.690 2.070 18935 5245 1 7 . 1 1 85 85 LYS N N 85 124.160 124.160 120.029 4.131 18935 5246 1 7 . 1 1 85 85 LYS C C 85 173.379 173.379 174.967 -1.588 18935 5247 1 7 . 1 1 85 85 LYS CA C 85 55.232 55.232 55.456 -0.224 18935 5248 1 7 . 1 1 85 85 LYS CB C 85 34.212 34.212 35.132 -0.920 18935 5249 1 7 . 1 1 85 85 LYS H H 85 8.494 8.494 7.840 0.654 18935 5250 1 7 . 1 1 86 86 CYS N N 86 126.472 126.472 122.343 4.129 18935 5251 1 7 . 1 1 86 86 CYS C C 86 171.935 171.935 173.175 -1.240 18935 5252 1 7 . 1 1 86 86 CYS CA C 86 55.878 55.878 58.042 -2.164 18935 5253 1 7 . 1 1 86 86 CYS CB C 86 30.304 30.304 28.949 1.355 18935 5254 1 7 . 1 1 86 86 CYS H H 86 9.221 9.221 8.708 0.513 18935 5255 1 7 . 1 1 87 87 VAL N N 87 126.426 126.426 126.008 0.418 18935 5256 1 7 . 1 1 87 87 VAL C C 87 173.760 173.760 174.594 -0.834 18935 5257 1 7 . 1 1 87 87 VAL CA C 87 61.333 61.333 62.335 -1.002 18935 5258 1 7 . 1 1 87 87 VAL CB C 87 33.338 33.338 32.550 0.788 18935 5259 1 7 . 1 1 87 87 VAL H H 87 8.623 8.623 8.196 0.427 18935 5260 1 7 . 1 1 88 88 LEU N N 88 125.701 125.701 127.192 -1.491 18935 5261 1 7 . 1 1 88 88 LEU C C 88 175.424 175.424 175.444 -0.020 18935 5262 1 7 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.424 -1.339 18935 5263 1 7 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.980 -2.436 18935 5264 1 7 . 1 1 88 88 LEU H H 88 9.592 9.592 9.019 0.573 18935 5265 1 7 . 1 1 89 89 PHE N N 89 118.314 118.314 121.217 -2.903 18935 5266 1 7 . 1 1 89 89 PHE C C 89 177.068 177.068 175.761 1.307 18935 5267 1 7 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.754 -0.879 18935 5268 1 7 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.878 -1.041 18935 5269 1 7 . 1 1 89 89 PHE H H 89 8.979 8.979 8.834 0.145 18935 5270 1 7 . 1 1 90 90 ILE N N 90 119.039 119.039 118.461 0.578 18935 5271 1 7 . 1 1 90 90 ILE C C 90 173.692 173.692 174.634 -0.942 18935 5272 1 7 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.227 -0.555 18935 5273 1 7 . 1 1 90 90 ILE CB C 90 40.183 40.183 41.049 -0.866 18935 5274 1 7 . 1 1 90 90 ILE H H 90 9.447 9.447 8.682 0.765 18935 5275 1 7 . 1 1 91 91 GLU N N 91 122.801 122.801 123.842 -1.041 18935 5276 1 7 . 1 1 91 91 GLU C C 91 175.565 175.565 174.445 1.120 18935 5277 1 7 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.132 -0.667 18935 5278 1 7 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.638 -3.976 18935 5279 1 7 . 1 1 91 91 GLU H H 91 8.360 8.360 8.365 -0.005 18935 5280 1 7 . 1 1 92 92 TRP N N 92 126.018 126.018 122.924 3.094 18935 5281 1 7 . 1 1 92 92 TRP C C 92 175.070 175.070 175.251 -0.181 18935 5282 1 7 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.645 -0.455 18935 5283 1 7 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.814 -1.232 18935 5284 1 7 . 1 1 92 92 TRP H H 92 9.425 9.425 8.552 0.873 18935 5285 1 7 . 1 1 93 93 GLU N N 93 126.381 126.381 120.077 6.304 18935 5286 1 7 . 1 1 93 93 GLU C C 93 175.637 175.637 175.991 -0.354 18935 5287 1 7 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.596 -0.827 18935 5288 1 7 . 1 1 93 93 GLU CB C 93 25.944 25.944 29.025 -3.081 18935 5289 1 7 . 1 1 93 93 GLU H H 93 8.914 8.914 9.067 -0.153 18935 5290 1 7 . 1 1 94 94 LYS N N 94 107.891 107.891 112.330 -4.439 18935 5291 1 7 . 1 1 94 94 LYS C C 94 175.359 175.359 175.660 -0.301 18935 5292 1 7 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.210 0.219 18935 5293 1 7 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.714 -2.072 18935 5294 1 7 . 1 1 94 94 LYS H H 94 8.634 8.634 8.487 0.147 18935 5295 1 7 . 1 1 95 95 LYS N N 95 120.490 120.490 119.274 1.216 18935 5296 1 7 . 1 1 95 95 LYS C C 95 174.369 174.369 174.438 -0.069 18935 5297 1 7 . 1 1 95 95 LYS CA C 95 54.353 54.353 55.181 -0.828 18935 5298 1 7 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.575 -1.111 18935 5299 1 7 . 1 1 95 95 LYS H H 95 7.924 7.924 7.665 0.259 18935 5300 1 7 . 1 1 96 96 THR N N 96 115.278 115.278 114.873 0.405 18935 5301 1 7 . 1 1 96 96 THR C C 96 174.317 174.317 173.296 1.021 18935 5302 1 7 . 1 1 96 96 THR CA C 96 61.203 61.203 60.550 0.653 18935 5303 1 7 . 1 1 96 96 THR CB C 96 69.348 69.348 69.901 -0.553 18935 5304 1 7 . 1 1 96 96 THR H H 96 7.967 7.967 7.826 0.141 18935 5305 1 7 . 1 1 97 97 TYR N N 97 123.254 123.254 125.836 -2.582 18935 5306 1 7 . 1 1 97 97 TYR C C 97 173.320 173.320 174.608 -1.288 18935 5307 1 7 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.385 -0.501 18935 5308 1 7 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.275 -0.139 18935 5309 1 7 . 1 1 97 97 TYR H H 97 9.232 9.232 8.653 0.579 18935 5310 1 7 . 1 1 98 98 GLN N N 98 122.574 122.574 118.158 4.416 18935 5311 1 7 . 1 1 98 98 GLN C C 98 172.781 172.781 174.617 -1.836 18935 5312 1 7 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.062 0.109 18935 5313 1 7 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.544 -2.145 18935 5314 1 7 . 1 1 98 98 GLN H H 98 9.000 9.000 8.804 0.196 18935 5315 1 7 . 1 1 99 99 LEU N N 99 130.218 130.218 124.217 6.001 18935 5316 1 7 . 1 1 99 99 LEU C C 99 172.806 172.806 174.370 -1.564 18935 5317 1 7 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.721 -1.671 18935 5318 1 7 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.450 -0.698 18935 5319 1 7 . 1 1 99 99 LEU H H 99 9.246 9.246 8.931 0.315 18935 5320 1 7 . 1 1 100 100 ASP N N 100 124.931 124.931 127.111 -2.180 18935 5321 1 7 . 1 1 100 100 ASP C C 100 172.626 172.626 174.276 -1.650 18935 5322 1 7 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.282 -2.852 18935 5323 1 7 . 1 1 100 100 ASP CB C 100 37.328 37.328 42.176 -4.848 18935 5324 1 7 . 1 1 100 100 ASP H H 100 9.253 9.253 8.420 0.833 18935 5325 1 7 . 1 1 101 101 LEU N N 101 119.402 119.402 123.936 -4.534 18935 5326 1 7 . 1 1 101 101 LEU C C 101 173.869 173.869 175.136 -1.267 18935 5327 1 7 . 1 1 101 101 LEU CA C 101 51.655 51.655 53.765 -2.110 18935 5328 1 7 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.902 0.264 18935 5329 1 7 . 1 1 101 101 LEU H H 101 8.726 8.726 7.722 1.004 18935 5330 1 7 . 1 1 102 102 PHE N N 102 117.952 117.952 118.396 -0.444 18935 5331 1 7 . 1 1 102 102 PHE C C 102 175.853 175.853 175.284 0.569 18935 5332 1 7 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.656 -2.374 18935 5333 1 7 . 1 1 102 102 PHE CB C 102 41.824 41.824 41.170 0.654 18935 5334 1 7 . 1 1 102 102 PHE H H 102 8.236 8.236 8.893 -0.657 18935 5335 1 7 . 1 1 103 103 THR N N 103 106.853 106.853 118.350 -11.497 18935 5336 1 7 . 1 1 103 103 THR C C 103 175.154 175.154 174.177 0.977 18935 5337 1 7 . 1 1 103 103 THR CA C 103 57.685 57.685 60.444 -2.759 18935 5338 1 7 . 1 1 103 103 THR CB C 103 71.037 71.037 69.351 1.686 18935 5339 1 7 . 1 1 103 103 THR H H 103 7.917 7.917 8.852 -0.935 18935 5340 1 7 . 1 1 104 104 ALA N N 104 122.348 122.348 128.298 -5.950 18935 5341 1 7 . 1 1 104 104 ALA C C 104 175.947 175.947 174.765 1.182 18935 5342 1 7 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.337 -0.529 18935 5343 1 7 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.468 -0.040 18935 5344 1 7 . 1 1 104 104 ALA H H 104 8.930 8.930 8.781 0.149 18935 5345 1 7 . 1 1 105 105 LEU N N 105 119.855 119.855 119.132 0.723 18935 5346 1 7 . 1 1 105 105 LEU C C 105 179.628 179.628 179.025 0.603 18935 5347 1 7 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.158 -1.035 18935 5348 1 7 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.474 -2.140 18935 5349 1 7 . 1 1 105 105 LEU H H 105 8.316 8.316 9.073 -0.757 18935 5350 1 7 . 1 1 106 106 ALA N N 106 123.662 123.662 124.578 -0.916 18935 5351 1 7 . 1 1 106 106 ALA C C 106 181.056 181.056 179.341 1.715 18935 5352 1 7 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.253 1.096 18935 5353 1 7 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.440 -1.125 18935 5354 1 7 . 1 1 106 106 ALA H H 106 8.306 8.306 8.493 -0.187 18935 5355 1 7 . 1 1 107 107 GLU N N 107 114.825 114.825 115.603 -0.778 18935 5356 1 7 . 1 1 107 107 GLU C C 107 177.854 177.854 176.733 1.121 18935 5357 1 7 . 1 1 107 107 GLU CA C 107 58.386 58.386 58.216 0.170 18935 5358 1 7 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.581 -0.737 18935 5359 1 7 . 1 1 107 107 GLU H H 107 9.754 9.754 8.893 0.861 18935 5360 1 7 . 1 1 108 108 GLU N N 108 115.097 115.097 117.853 -2.756 18935 5361 1 7 . 1 1 108 108 GLU C C 108 178.001 178.001 177.306 0.695 18935 5362 1 7 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.102 -1.176 18935 5363 1 7 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.974 0.027 18935 5364 1 7 . 1 1 108 108 GLU H H 108 7.859 7.859 7.819 0.040 18935 5365 1 7 . 1 1 109 109 LYS N N 109 118.360 118.360 121.773 -3.413 18935 5366 1 7 . 1 1 109 109 LYS C C 109 172.691 172.691 176.346 -3.655 18935 5367 1 7 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.343 0.560 18935 5368 1 7 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.765 -0.224 18935 5369 1 7 . 1 1 109 109 LYS H H 109 7.660 7.660 7.516 0.144 18935 5370 1 7 . 1 1 111 111 TYR N N 111 114.054 114.054 118.064 -4.010 18935 5371 1 7 . 1 1 111 111 TYR C C 111 179.764 179.764 178.006 1.758 18935 5372 1 7 . 1 1 111 111 TYR CA C 111 58.998 58.998 61.588 -2.590 18935 5373 1 7 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.474 -1.518 18935 5374 1 7 . 1 1 111 111 TYR H H 111 6.583 6.583 8.041 -1.458 18935 5375 1 7 . 1 1 112 112 ALA N N 112 124.749 124.749 122.303 2.446 18935 5376 1 7 . 1 1 112 112 ALA C C 112 179.430 179.430 179.346 0.084 18935 5377 1 7 . 1 1 112 112 ALA CA C 112 54.969 54.969 55.069 -0.100 18935 5378 1 7 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.702 0.110 18935 5379 1 7 . 1 1 112 112 ALA H H 112 8.753 8.753 8.719 0.034 18935 5380 1 7 . 1 1 113 113 ILE N N 113 119.130 119.130 119.949 -0.819 18935 5381 1 7 . 1 1 113 113 ILE C C 113 178.646 178.646 178.528 0.118 18935 5382 1 7 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.223 2.178 18935 5383 1 7 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.589 0.648 18935 5384 1 7 . 1 1 113 113 ILE H H 113 8.946 8.946 8.212 0.734 18935 5385 1 7 . 1 1 114 114 PHE N N 114 121.758 121.758 121.385 0.373 18935 5386 1 7 . 1 1 114 114 PHE C C 114 177.954 177.954 177.724 0.230 18935 5387 1 7 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.820 -2.043 18935 5388 1 7 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.457 0.607 18935 5389 1 7 . 1 1 114 114 PHE H H 114 7.940 7.940 8.468 -0.528 18935 5390 1 7 . 1 1 115 115 HIS N N 115 116.547 116.547 119.940 -3.393 18935 5391 1 7 . 1 1 115 115 HIS C C 115 176.161 176.161 177.361 -1.200 18935 5392 1 7 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.359 -0.240 18935 5393 1 7 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.623 1.444 18935 5394 1 7 . 1 1 115 115 HIS H H 115 7.767 7.767 8.093 -0.326 18935 5395 1 7 . 1 1 116 116 PHE N N 116 109.387 109.387 115.170 -5.783 18935 5396 1 7 . 1 1 116 116 PHE C C 116 177.282 177.282 176.072 1.210 18935 5397 1 7 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.306 2.128 18935 5398 1 7 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.280 -2.025 18935 5399 1 7 . 1 1 116 116 PHE H H 116 8.989 8.989 8.218 0.771 18935 5400 1 7 . 1 1 117 117 THR N N 117 116.864 116.864 114.374 2.490 18935 5401 1 7 . 1 1 117 117 THR C C 117 172.889 172.889 173.595 -0.706 18935 5402 1 7 . 1 1 117 117 THR CA C 117 66.997 66.997 62.164 4.833 18935 5403 1 7 . 1 1 117 117 THR CB C 117 67.948 67.948 68.494 -0.546 18935 5404 1 7 . 1 1 117 117 THR H H 117 7.988 7.988 7.759 0.229 18935 5405 1 7 . 1 1 118 118 GLY N N 118 103.320 103.320 109.080 -5.760 18935 5406 1 7 . 1 1 118 118 GLY C C 118 176.912 176.912 171.270 5.642 18935 5407 1 7 . 1 1 118 118 GLY CA C 118 44.182 44.182 44.391 -0.209 18935 5408 1 7 . 1 1 118 118 GLY H H 118 6.550 6.550 7.104 -0.554 18935 5409 1 7 . 1 1 120 120 VAL N N 120 120.671 120.671 120.982 -0.311 18935 5410 1 7 . 1 1 120 120 VAL C C 120 176.283 176.283 176.961 -0.678 18935 5411 1 7 . 1 1 120 120 VAL CA C 120 66.940 66.940 64.667 2.273 18935 5412 1 7 . 1 1 120 120 VAL CB C 120 29.852 29.852 32.083 -2.231 18935 5413 1 7 . 1 1 120 120 VAL H H 120 8.408 8.408 8.314 0.094 18935 5414 1 7 . 1 1 121 121 SER N N 121 111.789 111.789 116.661 -4.872 18935 5415 1 7 . 1 1 121 121 SER C C 121 175.658 175.658 176.485 -0.827 18935 5416 1 7 . 1 1 121 121 SER CA C 121 60.814 60.814 61.469 -0.655 18935 5417 1 7 . 1 1 121 121 SER CB C 121 60.253 60.253 62.102 -1.849 18935 5418 1 7 . 1 1 121 121 SER H H 121 8.290 8.290 8.361 -0.071 18935 5419 1 7 . 1 1 122 122 TYR N N 122 123.254 123.254 122.577 0.677 18935 5420 1 7 . 1 1 122 122 TYR C C 122 174.611 174.611 177.426 -2.815 18935 5421 1 7 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.849 -2.303 18935 5422 1 7 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.078 0.061 18935 5423 1 7 . 1 1 122 122 TYR H H 122 6.303 6.303 8.227 -1.924 18935 5424 1 7 . 1 1 123 123 LEU N N 123 114.825 114.825 119.248 -4.423 18935 5425 1 7 . 1 1 123 123 LEU C C 123 178.891 178.891 179.224 -0.333 18935 5426 1 7 . 1 1 123 123 LEU CA C 123 56.779 56.779 58.096 -1.317 18935 5427 1 7 . 1 1 123 123 LEU CB C 123 40.638 40.638 41.205 -0.567 18935 5428 1 7 . 1 1 123 123 LEU H H 123 6.965 6.965 7.693 -0.728 18935 5429 1 7 . 1 1 124 124 ILE N N 124 114.915 114.915 118.764 -3.849 18935 5430 1 7 . 1 1 124 124 ILE C C 124 177.187 177.187 177.875 -0.688 18935 5431 1 7 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.519 -1.087 18935 5432 1 7 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.390 -0.835 18935 5433 1 7 . 1 1 124 124 ILE H H 124 7.531 7.531 7.902 -0.371 18935 5434 1 7 . 1 1 125 125 ARG N N 125 115.278 115.278 118.938 -3.660 18935 5435 1 7 . 1 1 125 125 ARG C C 125 178.473 178.473 179.291 -0.818 18935 5436 1 7 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.950 -0.491 18935 5437 1 7 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.413 -2.334 18935 5438 1 7 . 1 1 125 125 ARG H H 125 6.809 6.809 8.027 -1.218 18935 5439 1 7 . 1 1 126 126 ILE N N 126 124.160 124.160 119.473 4.687 18935 5440 1 7 . 1 1 126 126 ILE C C 126 178.172 178.172 177.184 0.988 18935 5441 1 7 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.847 -1.920 18935 5442 1 7 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.507 -3.041 18935 5443 1 7 . 1 1 126 126 ILE H H 126 7.408 7.408 7.883 -0.475 18935 5444 1 7 . 1 1 127 127 ARG N N 127 117.136 117.136 121.854 -4.718 18935 5445 1 7 . 1 1 127 127 ARG C C 127 179.227 179.227 178.414 0.813 18935 5446 1 7 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.694 0.522 18935 5447 1 7 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.690 -1.901 18935 5448 1 7 . 1 1 127 127 ARG H H 127 8.230 8.230 8.144 0.086 18935 5449 1 7 . 1 1 128 128 ALA N N 128 121.305 121.305 120.753 0.552 18935 5450 1 7 . 1 1 128 128 ALA C C 128 179.933 179.933 178.956 0.977 18935 5451 1 7 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.176 -0.470 18935 5452 1 7 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.228 0.110 18935 5453 1 7 . 1 1 128 128 ALA H H 128 8.666 8.666 8.018 0.648 18935 5454 1 7 . 1 1 129 129 ALA N N 129 120.943 120.943 122.007 -1.064 18935 5455 1 7 . 1 1 129 129 ALA C C 129 181.336 181.336 179.980 1.356 18935 5456 1 7 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.956 -0.248 18935 5457 1 7 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.292 -1.432 18935 5458 1 7 . 1 1 129 129 ALA H H 129 7.837 7.837 7.512 0.325 18935 5459 1 7 . 1 1 130 130 LEU N N 130 117.726 117.726 118.011 -0.285 18935 5460 1 7 . 1 1 130 130 LEU C C 130 179.432 179.432 179.480 -0.048 18935 5461 1 7 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.978 -0.802 18935 5462 1 7 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.745 -1.179 18935 5463 1 7 . 1 1 130 130 LEU H H 130 8.114 8.114 8.207 -0.093 18935 5464 1 7 . 1 1 131 131 LYS N N 131 124.115 124.115 121.162 2.953 18935 5465 1 7 . 1 1 131 131 LYS C C 131 181.452 181.452 179.548 1.904 18935 5466 1 7 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.928 -0.042 18935 5467 1 7 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.919 0.279 18935 5468 1 7 . 1 1 131 131 LYS H H 131 8.849 8.849 7.867 0.982 18935 5469 1 7 . 1 1 132 132 LYS N N 132 119.447 119.447 118.402 1.045 18935 5470 1 7 . 1 1 132 132 LYS C C 132 177.607 177.607 177.888 -0.281 18935 5471 1 7 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.711 -0.759 18935 5472 1 7 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.946 -0.521 18935 5473 1 7 . 1 1 132 132 LYS H H 132 7.778 7.778 8.296 -0.518 18935 5474 1 7 . 1 1 133 133 LYS N N 133 116.638 116.638 115.437 1.201 18935 5475 1 7 . 1 1 133 133 LYS C C 133 174.681 174.681 176.140 -1.459 18935 5476 1 7 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.385 -0.307 18935 5477 1 7 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.396 -0.756 18935 5478 1 7 . 1 1 133 133 LYS H H 133 7.617 7.617 7.651 -0.034 18935 5479 1 7 . 1 1 134 134 ASN N N 134 110.792 110.792 116.866 -6.074 18935 5480 1 7 . 1 1 134 134 ASN C C 134 174.034 174.034 173.359 0.675 18935 5481 1 7 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.272 0.343 18935 5482 1 7 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.148 -1.096 18935 5483 1 7 . 1 1 134 134 ASN H H 134 8.123 8.123 8.511 -0.388 18935 5484 1 7 . 1 1 135 135 TYR N N 135 115.867 115.867 116.599 -0.732 18935 5485 1 7 . 1 1 135 135 TYR C C 135 175.122 175.122 174.034 1.088 18935 5486 1 7 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.486 -0.734 18935 5487 1 7 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.867 -1.950 18935 5488 1 7 . 1 1 135 135 TYR H H 135 8.133 8.133 7.978 0.155 18935 5489 1 7 . 1 1 136 136 LYS N N 136 119.870 119.870 122.996 -3.126 18935 5490 1 7 . 1 1 136 136 LYS C C 136 174.324 174.324 175.576 -1.252 18935 5491 1 7 . 1 1 136 136 LYS CA C 136 55.181 55.181 55.778 -0.597 18935 5492 1 7 . 1 1 136 136 LYS CB C 136 34.073 34.073 34.279 -0.206 18935 5493 1 7 . 1 1 136 136 LYS H H 136 9.234 9.234 8.534 0.700 18935 5494 1 7 . 1 1 137 137 LEU N N 137 129.708 129.708 122.693 7.015 18935 5495 1 7 . 1 1 137 137 LEU C C 137 173.798 173.798 175.014 -1.216 18935 5496 1 7 . 1 1 137 137 LEU CA C 137 52.834 52.834 55.851 -3.017 18935 5497 1 7 . 1 1 137 137 LEU CB C 137 44.983 44.983 41.841 3.142 18935 5498 1 7 . 1 1 137 137 LEU H H 137 8.959 8.959 8.331 0.628 18935 5499 1 7 . 1 1 140 140 TYR N N 140 120.580 120.580 113.342 7.238 18935 5500 1 7 . 1 1 140 140 TYR C C 140 174.705 174.705 175.426 -0.721 18935 5501 1 7 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.581 -1.129 18935 5502 1 7 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.225 0.076 18935 5503 1 7 . 1 1 140 140 TYR H H 140 8.962 8.962 7.322 1.640 18935 5504 1 7 . 1 1 141 141 GLY N N 141 104.986 104.986 105.671 -0.685 18935 5505 1 7 . 1 1 141 141 GLY C C 141 181.854 181.854 172.195 9.659 18935 5506 1 7 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.512 -0.390 18935 5507 1 7 . 1 1 141 141 GLY H H 141 7.555 7.555 7.073 0.482 18935 5508 1 7 . 1 1 142 142 LEU N N 142 118.269 118.269 122.534 -4.265 18935 5509 1 7 . 1 1 142 142 LEU C C 142 174.067 174.067 175.651 -1.584 18935 5510 1 7 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.925 -1.423 18935 5511 1 7 . 1 1 142 142 LEU CB C 142 44.542 44.542 42.947 1.595 18935 5512 1 7 . 1 1 142 142 LEU H H 142 7.794 7.794 8.373 -0.579 18935 5513 1 7 . 1 1 143 143 PHE N N 143 122.076 122.076 125.538 -3.462 18935 5514 1 7 . 1 1 143 143 PHE C C 143 175.199 175.199 175.037 0.162 18935 5515 1 7 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.352 -1.320 18935 5516 1 7 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.324 2.746 18935 5517 1 7 . 1 1 143 143 PHE H H 143 9.522 9.522 8.906 0.616 18935 5518 1 7 . 1 1 144 144 LYS N N 144 121.305 121.305 125.956 -4.651 18935 5519 1 7 . 1 1 144 144 LYS C C 144 176.917 176.917 176.099 0.818 18935 5520 1 7 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.270 1.086 18935 5521 1 7 . 1 1 144 144 LYS CB C 144 33.679 33.679 32.324 1.355 18935 5522 1 7 . 1 1 144 144 LYS H H 144 9.076 9.076 8.923 0.153 18935 5523 1 7 . 1 1 145 145 ASN N N 145 126.834 126.834 122.935 3.899 18935 5524 1 7 . 1 1 145 145 ASN C C 145 175.070 175.070 175.269 -0.199 18935 5525 1 7 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.436 0.328 18935 5526 1 7 . 1 1 145 145 ASN CB C 145 36.430 36.430 38.016 -1.586 18935 5527 1 7 . 1 1 145 145 ASN H H 145 9.618 9.618 9.109 0.509 18935 5528 1 7 . 1 1 146 146 GLN N N 146 110.112 110.112 110.822 -0.710 18935 5529 1 7 . 1 1 146 146 GLN C C 146 175.198 175.198 174.830 0.368 18935 5530 1 7 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.360 -0.464 18935 5531 1 7 . 1 1 146 146 GLN CB C 146 26.368 26.368 28.034 -1.666 18935 5532 1 7 . 1 1 146 146 GLN H H 146 9.140 9.140 8.761 0.379 18935 5533 1 7 . 1 1 147 147 THR N N 147 116.003 116.003 116.331 -0.328 18935 5534 1 7 . 1 1 147 147 THR C C 147 173.224 173.224 173.413 -0.189 18935 5535 1 7 . 1 1 147 147 THR CA C 147 61.450 61.450 61.214 0.236 18935 5536 1 7 . 1 1 147 147 THR CB C 147 70.285 70.285 69.811 0.474 18935 5537 1 7 . 1 1 147 147 THR H H 147 8.069 8.069 7.533 0.536 18935 5538 1 7 . 1 1 148 148 LEU N N 148 129.281 129.281 130.742 -1.461 18935 5539 1 7 . 1 1 148 148 LEU C C 148 176.703 176.703 175.528 1.175 18935 5540 1 7 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.399 0.067 18935 5541 1 7 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.774 -1.049 18935 5542 1 7 . 1 1 148 148 LEU H H 148 8.831 8.831 8.916 -0.085 18935 5543 1 7 . 1 1 149 149 VAL N N 149 130.189 130.189 127.480 2.709 18935 5544 1 7 . 1 1 149 149 VAL C C 149 175.012 175.012 173.619 1.393 18935 5545 1 7 . 1 1 149 149 VAL CA C 149 59.269 59.269 59.139 0.130 18935 5546 1 7 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.142 -3.686 18935 5547 1 7 . 1 1 149 149 VAL H H 149 9.243 9.243 8.467 0.776 18935 5548 1 7 . 1 1 151 151 LEU N N 151 123.481 123.481 121.953 1.528 18935 5549 1 7 . 1 1 151 151 LEU C C 151 177.679 177.679 177.335 0.344 18935 5550 1 7 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.445 -0.448 18935 5551 1 7 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.819 0.799 18935 5552 1 7 . 1 1 151 151 LEU H H 151 8.080 8.080 8.163 -0.083 18935 5553 1 7 . 1 1 152 152 LYS N N 152 126.381 126.381 120.322 6.059 18935 5554 1 7 . 1 1 152 152 LYS C C 152 175.115 175.115 175.358 -0.243 18935 5555 1 7 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.600 -2.004 18935 5556 1 7 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.736 -3.671 18935 5557 1 7 . 1 1 152 152 LYS H H 152 9.112 9.112 8.379 0.733 18935 5558 1 7 . 1 1 153 153 ILE N N 153 113.737 113.737 115.509 -1.772 18935 5559 1 7 . 1 1 153 153 ILE C C 153 175.748 175.748 174.515 1.233 18935 5560 1 7 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.317 -0.928 18935 5561 1 7 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.205 1.598 18935 5562 1 7 . 1 1 153 153 ILE H H 153 7.304 7.304 7.346 -0.042 18935 5563 1 7 . 1 1 154 154 THR N N 154 110.656 110.656 113.347 -2.691 18935 5564 1 7 . 1 1 154 154 THR C C 154 174.864 174.864 173.468 1.396 18935 5565 1 7 . 1 1 154 154 THR CA C 154 62.141 62.141 62.224 -0.083 18935 5566 1 7 . 1 1 154 154 THR CB C 154 70.413 70.413 71.173 -0.760 18935 5567 1 7 . 1 1 154 154 THR H H 154 9.382 9.382 9.315 0.067 18935 5568 1 7 . 1 1 155 155 THR N N 155 110.746 110.746 118.528 -7.782 18935 5569 1 7 . 1 1 155 155 THR C C 155 174.718 174.718 174.848 -0.130 18935 5570 1 7 . 1 1 155 155 THR CA C 155 58.785 58.785 61.674 -2.889 18935 5571 1 7 . 1 1 155 155 THR CB C 155 72.277 72.277 71.194 1.083 18935 5572 1 7 . 1 1 155 155 THR H H 155 7.746 7.746 8.259 -0.513 18935 5573 1 7 . 1 1 156 156 GLU N N 156 122.302 122.302 123.987 -1.685 18935 5574 1 7 . 1 1 156 156 GLU C C 156 177.289 177.289 178.303 -1.014 18935 5575 1 7 . 1 1 156 156 GLU CA C 156 58.824 58.824 61.101 -2.277 18935 5576 1 7 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.000 -0.619 18935 5577 1 7 . 1 1 156 156 GLU H H 156 9.490 9.490 9.011 0.479 18935 5578 1 7 . 1 1 157 157 LYS N N 157 118.905 118.905 117.403 1.502 18935 5579 1 7 . 1 1 157 157 LYS C C 157 178.241 178.241 178.739 -0.498 18935 5580 1 7 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.774 0.991 18935 5581 1 7 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.842 -0.564 18935 5582 1 7 . 1 1 157 157 LYS H H 157 8.329 8.329 8.336 -0.007 18935 5583 1 7 . 1 1 158 158 GLU N N 158 116.230 116.230 121.032 -4.802 18935 5584 1 7 . 1 1 158 158 GLU C C 158 178.988 178.988 178.764 0.224 18935 5585 1 7 . 1 1 158 158 GLU CA C 158 58.256 58.256 59.222 -0.966 18935 5586 1 7 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.388 -0.330 18935 5587 1 7 . 1 1 158 158 GLU H H 158 7.611 7.611 7.831 -0.220 18935 5588 1 7 . 1 1 159 159 LEU N N 159 118.978 118.978 120.726 -1.748 18935 5589 1 7 . 1 1 159 159 LEU C C 159 176.347 176.347 178.353 -2.006 18935 5590 1 7 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.371 -5.132 18935 5591 1 7 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.736 -2.193 18935 5592 1 7 . 1 1 159 159 LEU H H 159 7.704 7.704 8.099 -0.395 18935 5593 1 7 . 1 1 160 160 ILE N N 160 117.227 117.227 116.228 0.999 18935 5594 1 7 . 1 1 160 160 ILE C C 160 177.219 177.219 178.042 -0.823 18935 5595 1 7 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.999 0.616 18935 5596 1 7 . 1 1 160 160 ILE CB C 160 37.557 37.557 36.974 0.583 18935 5597 1 7 . 1 1 160 160 ILE H H 160 7.886 7.886 7.302 0.584 18935 5598 1 7 . 1 1 161 161 LYS N N 161 115.912 115.912 120.077 -4.165 18935 5599 1 7 . 1 1 161 161 LYS C C 161 180.990 180.990 179.271 1.719 18935 5600 1 7 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.492 0.139 18935 5601 1 7 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.636 -0.888 18935 5602 1 7 . 1 1 161 161 LYS H H 161 7.536 7.536 8.299 -0.763 18935 5603 1 7 . 1 1 162 162 GLU N N 162 120.852 120.852 119.118 1.734 18935 5604 1 7 . 1 1 162 162 GLU C C 162 178.793 178.793 178.656 0.137 18935 5605 1 7 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.620 -0.638 18935 5606 1 7 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.749 -1.957 18935 5607 1 7 . 1 1 162 162 GLU H H 162 8.392 8.392 7.876 0.516 18935 5608 1 7 . 1 1 163 163 LEU N N 163 115.912 115.912 116.457 -0.545 18935 5609 1 7 . 1 1 163 163 LEU C C 163 176.370 176.370 177.015 -0.645 18935 5610 1 7 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.370 -0.276 18935 5611 1 7 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.897 -1.723 18935 5612 1 7 . 1 1 163 163 LEU H H 163 8.031 8.031 7.971 0.060 18935 5613 1 7 . 1 1 164 164 GLY N N 164 103.160 103.160 104.720 -1.560 18935 5614 1 7 . 1 1 164 164 GLY C C 164 174.240 174.240 174.208 0.032 18935 5615 1 7 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.850 -0.548 18935 5616 1 7 . 1 1 164 164 GLY H H 164 7.625 7.625 7.623 0.002 18935 5617 1 7 . 1 1 165 165 PHE N N 165 117.952 117.952 118.885 -0.933 18935 5618 1 7 . 1 1 165 165 PHE C C 165 174.556 174.556 174.506 0.050 18935 5619 1 7 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.955 -0.490 18935 5620 1 7 . 1 1 165 165 PHE CB C 165 40.762 40.762 42.589 -1.827 18935 5621 1 7 . 1 1 165 165 PHE H H 165 7.283 7.283 8.446 -1.163 18935 5622 1 7 . 1 1 166 166 THR N N 166 118.178 118.178 113.218 4.960 18935 5623 1 7 . 1 1 166 166 THR C C 166 175.306 175.306 173.864 1.442 18935 5624 1 7 . 1 1 166 166 THR CA C 166 63.466 63.466 61.346 2.120 18935 5625 1 7 . 1 1 166 166 THR CB C 166 68.721 68.721 70.330 -1.609 18935 5626 1 7 . 1 1 166 166 THR H H 166 9.678 9.678 8.575 1.103 18935 5627 1 7 . 1 1 167 167 TYR N N 167 128.239 128.239 123.414 4.825 18935 5628 1 7 . 1 1 167 167 TYR C C 167 173.297 173.297 175.613 -2.316 18935 5629 1 7 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.618 0.794 18935 5630 1 7 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.497 -2.775 18935 5631 1 7 . 1 1 167 167 TYR H H 167 9.264 9.264 8.565 0.699 18935 5632 1 7 . 1 1 168 168 ARG N N 168 126.789 126.789 124.502 2.287 18935 5633 1 7 . 1 1 168 168 ARG C C 168 175.297 175.297 174.250 1.047 18935 5634 1 7 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.368 -1.603 18935 5635 1 7 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.519 -1.193 18935 5636 1 7 . 1 1 168 168 ARG H H 168 7.030 7.030 7.893 -0.863 18935 5637 1 7 . 1 1 169 169 ILE N N 169 119.221 119.221 116.405 2.816 18935 5638 1 7 . 1 1 169 169 ILE C C 169 174.522 174.522 175.054 -0.532 18935 5639 1 7 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.177 3.102 18935 5640 1 7 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.372 -4.725 18935 5641 1 7 . 1 1 169 169 ILE H H 169 8.349 8.349 8.206 0.143 18935 5642 1 7 . 1 1 171 171 LYS N N 171 111.335 111.335 117.834 -6.499 18935 5643 1 7 . 1 1 171 171 LYS C C 171 176.638 176.638 177.763 -1.125 18935 5644 1 7 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.072 -1.534 18935 5645 1 7 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.501 0.466 18935 5646 1 7 . 1 1 171 171 LYS H H 171 8.198 8.198 8.612 -0.414 18935 5647 1 7 . 1 1 172 172 LYS N N 172 116.411 116.411 115.915 0.496 18935 5648 1 7 . 1 1 172 172 LYS C C 172 175.331 175.331 175.637 -0.306 18935 5649 1 7 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.181 -1.180 18935 5650 1 7 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.439 -1.621 18935 5651 1 7 . 1 1 172 172 LYS H H 172 7.843 7.843 7.556 0.287 18935 5652 1 7 . 1 1 173 173 ARG N N 173 120.490 120.490 117.783 2.707 18935 5653 1 7 . 1 1 173 173 ARG C C 173 172.830 172.830 175.268 -2.438 18935 5654 1 7 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.483 0.692 18935 5655 1 7 . 1 1 173 173 ARG CB C 173 28.829 28.829 28.685 0.144 18935 5656 1 7 . 1 1 173 173 ARG H H 173 6.917 6.917 7.600 -0.683 18935 5657 1 8 . 1 1 2 2 LEU N N 2 119.937 119.937 117.693 2.244 18935 5658 1 8 . 1 1 2 2 LEU C C 2 175.307 175.307 175.319 -0.012 18935 5659 1 8 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.951 0.341 18935 5660 1 8 . 1 1 2 2 LEU CB C 2 42.684 42.684 43.878 -1.194 18935 5661 1 8 . 1 1 2 2 LEU H H 2 9.251 9.251 8.037 1.214 18935 5662 1 8 . 1 1 3 3 THR N N 3 111.335 111.335 108.909 2.426 18935 5663 1 8 . 1 1 3 3 THR C C 3 175.854 175.854 175.479 0.375 18935 5664 1 8 . 1 1 3 3 THR CA C 3 60.540 60.540 60.048 0.492 18935 5665 1 8 . 1 1 3 3 THR CB C 3 70.782 70.782 70.767 0.015 18935 5666 1 8 . 1 1 3 3 THR H H 3 8.677 8.677 8.115 0.562 18935 5667 1 8 . 1 1 4 4 LEU N N 4 120.988 120.988 122.630 -1.642 18935 5668 1 8 . 1 1 4 4 LEU C C 4 178.391 178.391 178.291 0.100 18935 5669 1 8 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.068 -0.004 18935 5670 1 8 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.174 -2.913 18935 5671 1 8 . 1 1 4 4 LEU H H 4 7.746 7.746 8.003 -0.257 18935 5672 1 8 . 1 1 5 5 ILE N N 5 114.236 114.236 114.051 0.185 18935 5673 1 8 . 1 1 5 5 ILE C C 5 178.339 178.339 177.721 0.618 18935 5674 1 8 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.400 -0.818 18935 5675 1 8 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.152 -0.353 18935 5676 1 8 . 1 1 5 5 ILE H H 5 7.821 7.821 7.885 -0.064 18935 5677 1 8 . 1 1 6 6 GLN N N 6 120.399 120.399 120.186 0.213 18935 5678 1 8 . 1 1 6 6 GLN C C 6 178.783 178.783 178.681 0.102 18935 5679 1 8 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.873 -0.653 18935 5680 1 8 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.192 -0.077 18935 5681 1 8 . 1 1 6 6 GLN H H 6 7.810 7.810 7.805 0.005 18935 5682 1 8 . 1 1 7 7 GLY N N 7 106.277 106.277 106.653 -0.376 18935 5683 1 8 . 1 1 7 7 GLY C C 7 174.554 174.554 175.985 -1.431 18935 5684 1 8 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.316 -0.383 18935 5685 1 8 . 1 1 7 7 GLY H H 7 8.733 8.733 8.074 0.659 18935 5686 1 8 . 1 1 8 8 LYS N N 8 119.991 119.991 120.869 -0.878 18935 5687 1 8 . 1 1 8 8 LYS C C 8 179.433 179.433 177.978 1.455 18935 5688 1 8 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.105 1.787 18935 5689 1 8 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.220 -0.888 18935 5690 1 8 . 1 1 8 8 LYS H H 8 8.688 8.688 7.110 1.578 18935 5691 1 8 . 1 1 9 9 LYS N N 9 119.175 119.175 120.776 -1.601 18935 5692 1 8 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.969 -0.587 18935 5693 1 8 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.527 -1.092 18935 5694 1 8 . 1 1 9 9 LYS H H 9 8.015 8.015 7.926 0.089 18935 5695 1 8 . 1 1 10 10 ILE N N 10 120.308 120.308 116.261 4.047 18935 5696 1 8 . 1 1 10 10 ILE C C 10 177.766 177.766 177.751 0.015 18935 5697 1 8 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.925 -0.249 18935 5698 1 8 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.560 -1.247 18935 5699 1 8 . 1 1 10 10 ILE H H 10 7.967 7.967 8.510 -0.543 18935 5700 1 8 . 1 1 11 11 VAL N N 11 119.130 119.130 120.470 -1.340 18935 5701 1 8 . 1 1 11 11 VAL C C 11 176.606 176.606 178.194 -1.588 18935 5702 1 8 . 1 1 11 11 VAL CA C 11 67.640 67.640 67.076 0.564 18935 5703 1 8 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.213 -1.004 18935 5704 1 8 . 1 1 11 11 VAL H H 11 8.128 8.128 7.649 0.479 18935 5705 1 8 . 1 1 12 12 ASN N N 12 115.822 115.822 116.768 -0.946 18935 5706 1 8 . 1 1 12 12 ASN C C 12 177.375 177.375 176.404 0.971 18935 5707 1 8 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.160 -0.190 18935 5708 1 8 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.706 -1.143 18935 5709 1 8 . 1 1 12 12 ASN H H 12 8.203 8.203 7.797 0.406 18935 5710 1 8 . 1 1 13 13 HIS N N 13 117.659 117.659 114.375 3.284 18935 5711 1 8 . 1 1 13 13 HIS C C 13 177.287 177.287 176.202 1.085 18935 5712 1 8 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.092 1.595 18935 5713 1 8 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.679 -0.658 18935 5714 1 8 . 1 1 13 13 HIS H H 13 7.861 7.861 7.834 0.027 18935 5715 1 8 . 1 1 14 14 LEU N N 14 115.595 115.595 119.872 -4.277 18935 5716 1 8 . 1 1 14 14 LEU C C 14 179.092 179.092 177.801 1.291 18935 5717 1 8 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.550 0.090 18935 5718 1 8 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.288 -1.268 18935 5719 1 8 . 1 1 14 14 LEU H H 14 8.376 8.376 8.299 0.077 18935 5720 1 8 . 1 1 15 15 ARG N N 15 115.006 115.006 118.147 -3.141 18935 5721 1 8 . 1 1 15 15 ARG C C 15 176.265 176.265 176.628 -0.363 18935 5722 1 8 . 1 1 15 15 ARG CA C 15 59.884 59.884 57.049 2.835 18935 5723 1 8 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.979 -0.907 18935 5724 1 8 . 1 1 15 15 ARG H H 15 8.074 8.074 7.881 0.193 18935 5725 1 8 . 1 1 16 16 SER N N 16 107.778 107.778 111.658 -3.880 18935 5726 1 8 . 1 1 16 16 SER C C 16 176.009 176.009 175.335 0.674 18935 5727 1 8 . 1 1 16 16 SER CA C 16 57.244 57.244 59.923 -2.679 18935 5728 1 8 . 1 1 16 16 SER CB C 16 63.525 63.525 63.943 -0.418 18935 5729 1 8 . 1 1 16 16 SER H H 16 7.136 7.136 8.056 -0.920 18935 5730 1 8 . 1 1 17 17 ARG N N 17 121.532 121.532 122.276 -0.744 18935 5731 1 8 . 1 1 17 17 ARG C C 17 174.482 174.482 175.150 -0.668 18935 5732 1 8 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.020 1.302 18935 5733 1 8 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.325 1.506 18935 5734 1 8 . 1 1 17 17 ARG H H 17 7.913 7.913 7.980 -0.067 18935 5735 1 8 . 1 1 18 18 LEU N N 18 121.305 121.305 118.720 2.585 18935 5736 1 8 . 1 1 18 18 LEU C C 18 176.283 176.283 175.587 0.696 18935 5737 1 8 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.169 -0.471 18935 5738 1 8 . 1 1 18 18 LEU CB C 18 43.055 43.055 42.923 0.132 18935 5739 1 8 . 1 1 18 18 LEU H H 18 8.812 8.812 7.531 1.281 18935 5740 1 8 . 1 1 19 19 ALA N N 19 125.293 125.293 122.069 3.224 18935 5741 1 8 . 1 1 19 19 ALA C C 19 173.780 173.780 175.100 -1.320 18935 5742 1 8 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.920 -1.118 18935 5743 1 8 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.735 1.118 18935 5744 1 8 . 1 1 19 19 ALA H H 19 8.790 8.790 7.821 0.969 18935 5745 1 8 . 1 1 20 20 PHE N N 20 113.117 113.117 114.091 -0.974 18935 5746 1 8 . 1 1 20 20 PHE C C 20 172.708 172.708 173.313 -0.605 18935 5747 1 8 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.199 -0.601 18935 5748 1 8 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.488 -0.763 18935 5749 1 8 . 1 1 20 20 PHE H H 20 8.925 8.925 8.625 0.300 18935 5750 1 8 . 1 1 21 21 GLU N N 21 121.532 121.532 121.929 -0.397 18935 5751 1 8 . 1 1 21 21 GLU C C 21 174.830 174.830 174.900 -0.070 18935 5752 1 8 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.199 -0.236 18935 5753 1 8 . 1 1 21 21 GLU CB C 21 30.343 30.343 31.734 -1.391 18935 5754 1 8 . 1 1 21 21 GLU H H 21 7.972 7.972 9.028 -1.056 18935 5755 1 8 . 1 1 22 22 TYR N N 22 125.339 125.339 126.386 -1.047 18935 5756 1 8 . 1 1 22 22 TYR C C 22 174.864 174.864 175.577 -0.713 18935 5757 1 8 . 1 1 22 22 TYR CA C 22 55.288 55.288 56.270 -0.982 18935 5758 1 8 . 1 1 22 22 TYR CB C 22 39.859 39.859 41.104 -1.245 18935 5759 1 8 . 1 1 22 22 TYR H H 22 9.016 9.016 8.315 0.701 18935 5760 1 8 . 1 1 23 23 ASN N N 23 127.024 127.024 127.258 -0.234 18935 5761 1 8 . 1 1 23 23 ASN C C 23 175.410 175.410 175.002 0.408 18935 5762 1 8 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.960 -0.906 18935 5763 1 8 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.469 -1.208 18935 5764 1 8 . 1 1 23 23 ASN H H 23 9.181 9.181 9.468 -0.287 18935 5765 1 8 . 1 1 24 24 GLY N N 24 102.755 102.755 102.835 -0.080 18935 5766 1 8 . 1 1 24 24 GLY C C 24 173.626 173.626 174.625 -0.999 18935 5767 1 8 . 1 1 24 24 GLY CA C 24 44.935 44.935 44.911 0.024 18935 5768 1 8 . 1 1 24 24 GLY H H 24 8.666 8.666 8.433 0.233 18935 5769 1 8 . 1 1 25 25 GLN N N 25 118.722 118.722 120.337 -1.615 18935 5770 1 8 . 1 1 25 25 GLN C C 25 173.657 173.657 174.947 -1.290 18935 5771 1 8 . 1 1 25 25 GLN CA C 25 53.233 53.233 55.039 -1.806 18935 5772 1 8 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.414 0.391 18935 5773 1 8 . 1 1 25 25 GLN H H 25 7.708 7.708 7.992 -0.284 18935 5774 1 8 . 1 1 26 26 LEU N N 26 123.526 123.526 120.960 2.566 18935 5775 1 8 . 1 1 26 26 LEU C C 26 175.842 175.842 176.382 -0.540 18935 5776 1 8 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.876 0.110 18935 5777 1 8 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.431 -2.624 18935 5778 1 8 . 1 1 26 26 LEU H H 26 8.543 8.543 8.326 0.217 18935 5779 1 8 . 1 1 27 27 ILE N N 27 129.462 129.462 124.088 5.374 18935 5780 1 8 . 1 1 27 27 ILE C C 27 175.085 175.085 173.947 1.138 18935 5781 1 8 . 1 1 27 27 ILE CA C 27 58.973 58.973 60.135 -1.162 18935 5782 1 8 . 1 1 27 27 ILE CB C 27 35.552 35.552 39.868 -4.316 18935 5783 1 8 . 1 1 27 27 ILE H H 27 8.989 8.989 8.695 0.294 18935 5784 1 8 . 1 1 28 28 LYS N N 28 125.157 125.157 126.161 -1.004 18935 5785 1 8 . 1 1 28 28 LYS C C 28 176.725 176.725 175.709 1.016 18935 5786 1 8 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.692 1.118 18935 5787 1 8 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.342 -1.525 18935 5788 1 8 . 1 1 28 28 LYS H H 28 8.311 8.311 8.149 0.162 18935 5789 1 8 . 1 1 29 29 ILE N N 29 125.565 125.565 116.581 8.984 18935 5790 1 8 . 1 1 29 29 ILE C C 29 175.685 175.685 174.580 1.105 18935 5791 1 8 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.451 0.954 18935 5792 1 8 . 1 1 29 29 ILE CB C 29 37.031 37.031 39.815 -2.784 18935 5793 1 8 . 1 1 29 29 ILE H H 29 8.209 8.209 7.861 0.348 18935 5794 1 8 . 1 1 30 30 LEU N N 30 127.831 127.831 121.424 6.407 18935 5795 1 8 . 1 1 30 30 LEU C C 30 178.794 178.794 178.300 0.494 18935 5796 1 8 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.088 1.355 18935 5797 1 8 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.546 -4.710 18935 5798 1 8 . 1 1 30 30 LEU H H 30 9.027 9.027 8.581 0.446 18935 5799 1 8 . 1 1 31 31 SER N N 31 116.864 116.864 119.976 -3.112 18935 5800 1 8 . 1 1 31 31 SER C C 31 177.464 177.464 176.413 1.051 18935 5801 1 8 . 1 1 31 31 SER CA C 31 61.180 61.180 61.719 -0.539 18935 5802 1 8 . 1 1 31 31 SER CB C 31 62.105 62.105 63.048 -0.943 18935 5803 1 8 . 1 1 31 31 SER H H 31 8.887 8.887 8.769 0.118 18935 5804 1 8 . 1 1 32 32 LYS N N 32 114.825 114.825 122.111 -7.286 18935 5805 1 8 . 1 1 32 32 LYS C C 32 176.243 176.243 177.366 -1.123 18935 5806 1 8 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.313 -1.022 18935 5807 1 8 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.331 -2.065 18935 5808 1 8 . 1 1 32 32 LYS H H 32 8.290 8.290 8.280 0.010 18935 5809 1 8 . 1 1 33 33 ASN N N 33 117.564 117.564 116.748 0.816 18935 5810 1 8 . 1 1 33 33 ASN C C 33 172.253 172.253 173.614 -1.361 18935 5811 1 8 . 1 1 33 33 ASN CA C 33 52.091 52.091 52.990 -0.899 18935 5812 1 8 . 1 1 33 33 ASN CB C 33 38.339 38.339 38.988 -0.649 18935 5813 1 8 . 1 1 33 33 ASN H H 33 8.051 8.051 7.928 0.123 18935 5814 1 8 . 1 1 34 34 ILE N N 34 118.949 118.949 118.862 0.087 18935 5815 1 8 . 1 1 34 34 ILE C C 34 175.343 175.343 174.940 0.403 18935 5816 1 8 . 1 1 34 34 ILE CA C 34 60.553 60.553 59.087 1.466 18935 5817 1 8 . 1 1 34 34 ILE CB C 34 38.867 38.867 40.191 -1.324 18935 5818 1 8 . 1 1 34 34 ILE H H 34 7.670 7.670 7.670 0.000 18935 5819 1 8 . 1 1 35 35 VAL N N 35 128.355 128.355 124.954 3.401 18935 5820 1 8 . 1 1 35 35 VAL C C 35 175.543 175.543 174.688 0.855 18935 5821 1 8 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.174 -0.160 18935 5822 1 8 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.124 -0.893 18935 5823 1 8 . 1 1 35 35 VAL H H 35 9.698 9.698 9.270 0.428 18935 5824 1 8 . 1 1 36 36 ALA N N 36 129.553 129.553 131.281 -1.728 18935 5825 1 8 . 1 1 36 36 ALA C C 36 177.015 177.015 176.991 0.024 18935 5826 1 8 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.190 1.206 18935 5827 1 8 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.254 -0.632 18935 5828 1 8 . 1 1 36 36 ALA H H 36 8.917 8.917 8.594 0.323 18935 5829 1 8 . 1 1 37 37 VAL N N 37 115.006 115.006 118.291 -3.285 18935 5830 1 8 . 1 1 37 37 VAL C C 37 174.649 174.649 176.023 -1.374 18935 5831 1 8 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.546 -0.225 18935 5832 1 8 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.122 -0.736 18935 5833 1 8 . 1 1 37 37 VAL H H 37 8.214 8.214 7.738 0.476 18935 5834 1 8 . 1 1 38 38 GLY N N 38 109.387 109.387 108.339 1.048 18935 5835 1 8 . 1 1 38 38 GLY C C 38 174.152 174.152 175.888 -1.736 18935 5836 1 8 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.627 -0.130 18935 5837 1 8 . 1 1 38 38 GLY H H 38 8.677 8.677 8.106 0.571 18935 5838 1 8 . 1 1 39 39 SER N N 39 116.776 116.776 119.199 -2.423 18935 5839 1 8 . 1 1 39 39 SER C C 39 175.129 175.129 176.407 -1.278 18935 5840 1 8 . 1 1 39 39 SER CA C 39 60.036 60.036 61.620 -1.584 18935 5841 1 8 . 1 1 39 39 SER CB C 39 61.522 61.522 62.984 -1.462 18935 5842 1 8 . 1 1 39 39 SER H H 39 9.705 9.705 8.594 1.111 18935 5843 1 8 . 1 1 40 40 LEU N N 40 113.696 113.696 120.483 -6.787 18935 5844 1 8 . 1 1 40 40 LEU C C 40 180.558 180.558 178.285 2.273 18935 5845 1 8 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.792 1.581 18935 5846 1 8 . 1 1 40 40 LEU CB C 40 41.877 41.877 40.846 1.031 18935 5847 1 8 . 1 1 40 40 LEU H H 40 7.311 7.311 7.861 -0.550 18935 5848 1 8 . 1 1 41 41 ARG N N 41 121.162 121.162 115.503 5.659 18935 5849 1 8 . 1 1 41 41 ARG C C 41 176.964 176.964 176.639 0.325 18935 5850 1 8 . 1 1 41 41 ARG CA C 41 58.451 58.451 55.178 3.273 18935 5851 1 8 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.656 -2.451 18935 5852 1 8 . 1 1 41 41 ARG H H 41 6.999 6.999 7.544 -0.545 18935 5853 1 8 . 1 1 42 42 ARG N N 42 111.109 111.109 118.777 -7.668 18935 5854 1 8 . 1 1 42 42 ARG C C 42 172.564 172.564 175.303 -2.739 18935 5855 1 8 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.635 0.745 18935 5856 1 8 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.611 -2.262 18935 5857 1 8 . 1 1 42 42 ARG H H 42 7.041 7.041 7.284 -0.243 18935 5858 1 8 . 1 1 43 43 GLU N N 43 111.924 111.924 114.941 -3.017 18935 5859 1 8 . 1 1 43 43 GLU C C 43 176.202 176.202 175.234 0.968 18935 5860 1 8 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.224 -0.770 18935 5861 1 8 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.007 -1.706 18935 5862 1 8 . 1 1 43 43 GLU H H 43 7.757 7.757 8.088 -0.331 18935 5863 1 8 . 1 1 44 44 GLU N N 44 117.861 117.861 119.066 -1.205 18935 5864 1 8 . 1 1 44 44 GLU C C 44 175.197 175.197 176.664 -1.467 18935 5865 1 8 . 1 1 44 44 GLU CA C 44 56.128 56.128 55.920 0.207 18935 5866 1 8 . 1 1 44 44 GLU CB C 44 28.559 28.559 31.020 -2.461 18935 5867 1 8 . 1 1 44 44 GLU H H 44 7.461 7.461 7.921 -0.460 18935 5868 1 8 . 1 1 45 45 LYS N N 45 115.051 115.051 116.784 -1.733 18935 5869 1 8 . 1 1 45 45 LYS C C 45 177.733 177.733 176.221 1.512 18935 5870 1 8 . 1 1 45 45 LYS CA C 45 59.055 59.055 56.623 2.432 18935 5871 1 8 . 1 1 45 45 LYS CB C 45 32.027 32.027 34.183 -2.156 18935 5872 1 8 . 1 1 45 45 LYS H H 45 8.123 8.123 8.384 -0.261 18935 5873 1 8 . 1 1 46 46 MET N N 46 114.009 114.009 121.170 -7.161 18935 5874 1 8 . 1 1 46 46 MET C C 46 174.067 174.067 174.194 -0.127 18935 5875 1 8 . 1 1 46 46 MET CA C 46 52.477 52.477 55.009 -2.532 18935 5876 1 8 . 1 1 46 46 MET CB C 46 33.974 33.974 34.914 -0.940 18935 5877 1 8 . 1 1 46 46 MET H H 46 7.767 7.767 8.058 -0.291 18935 5878 1 8 . 1 1 47 47 LEU N N 47 120.263 120.263 121.507 -1.244 18935 5879 1 8 . 1 1 47 47 LEU C C 47 177.669 177.669 175.434 2.235 18935 5880 1 8 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.146 -0.945 18935 5881 1 8 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.336 -0.428 18935 5882 1 8 . 1 1 47 47 LEU H H 47 9.481 9.481 8.345 1.136 18935 5883 1 8 . 1 1 48 48 ASN N N 48 118.632 118.632 116.483 2.149 18935 5884 1 8 . 1 1 48 48 ASN C C 48 174.715 174.715 174.030 0.685 18935 5885 1 8 . 1 1 48 48 ASN CA C 48 55.501 55.501 54.218 1.283 18935 5886 1 8 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.865 -2.037 18935 5887 1 8 . 1 1 48 48 ASN H H 48 9.388 9.388 8.735 0.653 18935 5888 1 8 . 1 1 49 49 ASP N N 49 115.867 115.867 115.363 0.504 18935 5889 1 8 . 1 1 49 49 ASP C C 49 174.111 174.111 173.932 0.179 18935 5890 1 8 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.527 -1.326 18935 5891 1 8 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.351 -3.274 18935 5892 1 8 . 1 1 49 49 ASP H H 49 7.670 7.670 7.593 0.077 18935 5893 1 8 . 1 1 50 50 VAL N N 50 119.185 119.185 118.681 0.504 18935 5894 1 8 . 1 1 50 50 VAL C C 50 172.333 172.333 174.628 -2.295 18935 5895 1 8 . 1 1 50 50 VAL CA C 50 61.915 61.915 60.796 1.119 18935 5896 1 8 . 1 1 50 50 VAL CB C 50 32.965 32.965 32.880 0.085 18935 5897 1 8 . 1 1 50 50 VAL H H 50 8.339 8.339 7.658 0.681 18935 5898 1 8 . 1 1 51 51 ASP N N 51 124.704 124.704 126.663 -1.959 18935 5899 1 8 . 1 1 51 51 ASP C C 51 173.725 173.725 175.139 -1.414 18935 5900 1 8 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.451 -0.423 18935 5901 1 8 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.952 -0.123 18935 5902 1 8 . 1 1 51 51 ASP H H 51 8.984 8.984 8.415 0.569 18935 5903 1 8 . 1 1 52 52 LEU N N 52 120.943 120.943 121.448 -0.505 18935 5904 1 8 . 1 1 52 52 LEU C C 52 173.045 173.045 174.238 -1.193 18935 5905 1 8 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.972 -1.101 18935 5906 1 8 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.481 -2.228 18935 5907 1 8 . 1 1 52 52 LEU H H 52 9.081 9.081 8.022 1.059 18935 5908 1 8 . 1 1 53 53 LEU N N 53 123.027 123.027 123.907 -0.880 18935 5909 1 8 . 1 1 53 53 LEU C C 53 173.750 173.750 174.903 -1.153 18935 5910 1 8 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.354 -1.021 18935 5911 1 8 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.605 -0.597 18935 5912 1 8 . 1 1 53 53 LEU H H 53 9.146 9.146 9.139 0.007 18935 5913 1 8 . 1 1 54 54 ILE N N 54 126.562 126.562 126.335 0.227 18935 5914 1 8 . 1 1 54 54 ILE C C 54 175.132 175.132 175.371 -0.239 18935 5915 1 8 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.826 -1.228 18935 5916 1 8 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.494 -0.933 18935 5917 1 8 . 1 1 54 54 ILE H H 54 9.440 9.440 9.039 0.401 18935 5918 1 8 . 1 1 55 55 ILE N N 55 126.879 126.879 127.001 -0.122 18935 5919 1 8 . 1 1 55 55 ILE C C 55 175.655 175.655 175.840 -0.185 18935 5920 1 8 . 1 1 55 55 ILE CA C 55 57.561 57.561 59.319 -1.758 18935 5921 1 8 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.625 -5.319 18935 5922 1 8 . 1 1 55 55 ILE H H 55 9.381 9.381 7.919 1.462 18935 5923 1 8 . 1 1 56 56 VAL N N 56 128.936 128.936 122.852 6.084 18935 5924 1 8 . 1 1 56 56 VAL C C 56 176.389 176.389 174.698 1.691 18935 5925 1 8 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.916 -0.286 18935 5926 1 8 . 1 1 56 56 VAL CB C 56 32.784 32.784 34.341 -1.557 18935 5927 1 8 . 1 1 56 56 VAL H H 56 9.227 9.227 8.699 0.528 18935 5928 1 8 . 1 1 58 58 GLU N N 58 112.423 112.423 117.699 -5.276 18935 5929 1 8 . 1 1 58 58 GLU C C 58 175.946 175.946 176.231 -0.285 18935 5930 1 8 . 1 1 58 58 GLU CA C 58 54.300 54.300 54.914 -0.614 18935 5931 1 8 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.838 0.259 18935 5932 1 8 . 1 1 58 58 GLU H H 58 6.685 6.685 7.986 -1.301 18935 5933 1 8 . 1 1 59 59 LYS N N 59 125.293 125.293 120.537 4.756 18935 5934 1 8 . 1 1 59 59 LYS C C 59 179.248 179.248 175.911 3.337 18935 5935 1 8 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.122 2.652 18935 5936 1 8 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.490 -1.413 18935 5937 1 8 . 1 1 59 59 LYS H H 59 9.108 9.108 8.483 0.625 18935 5938 1 8 . 1 1 60 60 LYS N N 60 117.408 117.408 117.572 -0.164 18935 5939 1 8 . 1 1 60 60 LYS C C 60 177.198 177.198 177.202 -0.004 18935 5940 1 8 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.922 1.291 18935 5941 1 8 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.553 -1.970 18935 5942 1 8 . 1 1 60 60 LYS H H 60 9.102 9.102 7.345 1.757 18935 5943 1 8 . 1 1 61 61 LEU N N 61 114.779 114.779 120.524 -5.745 18935 5944 1 8 . 1 1 61 61 LEU C C 61 178.790 178.790 178.569 0.221 18935 5945 1 8 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.748 -2.724 18935 5946 1 8 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.219 -0.355 18935 5947 1 8 . 1 1 61 61 LEU H H 61 7.455 7.455 8.027 -0.572 18935 5948 1 8 . 1 1 62 62 LEU N N 62 119.629 119.629 118.239 1.390 18935 5949 1 8 . 1 1 62 62 LEU C C 62 177.762 177.762 177.805 -0.043 18935 5950 1 8 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.758 0.440 18935 5951 1 8 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.932 -1.201 18935 5952 1 8 . 1 1 62 62 LEU H H 62 7.714 7.714 7.409 0.305 18935 5953 1 8 . 1 1 63 63 LYS N N 63 112.921 112.921 116.126 -3.205 18935 5954 1 8 . 1 1 63 63 LYS C C 63 175.386 175.386 177.603 -2.217 18935 5955 1 8 . 1 1 63 63 LYS CA C 63 57.356 57.356 56.937 0.419 18935 5956 1 8 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.648 -1.685 18935 5957 1 8 . 1 1 63 63 LYS H H 63 7.751 7.751 8.383 -0.632 18935 5958 1 8 . 1 1 64 64 HIS N N 64 112.468 112.468 117.480 -5.012 18935 5959 1 8 . 1 1 64 64 HIS C C 64 176.081 176.081 176.455 -0.374 18935 5960 1 8 . 1 1 64 64 HIS CA C 64 55.769 55.769 56.996 -1.227 18935 5961 1 8 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.179 1.191 18935 5962 1 8 . 1 1 64 64 HIS H H 64 7.697 7.697 7.688 0.009 18935 5963 1 8 . 1 1 65 65 VAL N N 65 117.499 117.499 115.248 2.251 18935 5964 1 8 . 1 1 65 65 VAL C C 65 174.301 174.301 176.415 -2.114 18935 5965 1 8 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.185 3.145 18935 5966 1 8 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.053 -1.693 18935 5967 1 8 . 1 1 65 65 VAL H H 65 6.917 6.917 7.225 -0.308 18935 5968 1 8 . 1 1 66 66 LEU N N 66 113.873 113.873 119.393 -5.520 18935 5969 1 8 . 1 1 66 66 LEU CA C 66 57.850 57.850 58.714 -0.864 18935 5970 1 8 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.273 -3.215 18935 5971 1 8 . 1 1 66 66 LEU H H 66 9.102 9.102 8.048 1.054 18935 5972 1 8 . 1 1 68 68 ASN N N 68 110.792 110.792 117.160 -6.368 18935 5973 1 8 . 1 1 68 68 ASN C C 68 174.877 174.877 173.608 1.269 18935 5974 1 8 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.383 -1.568 18935 5975 1 8 . 1 1 68 68 ASN CB C 68 40.311 40.311 39.533 0.778 18935 5976 1 8 . 1 1 68 68 ASN H H 68 7.234 7.234 8.565 -1.331 18935 5977 1 8 . 1 1 69 69 ILE N N 69 122.348 122.348 122.823 -0.475 18935 5978 1 8 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.801 -0.889 18935 5979 1 8 . 1 1 69 69 ILE CB C 69 38.038 38.038 39.121 -1.083 18935 5980 1 8 . 1 1 69 69 ILE H H 69 7.428 7.428 7.926 -0.498 18935 5981 1 8 . 1 1 70 70 ARG N N 70 125.701 125.701 126.865 -1.164 18935 5982 1 8 . 1 1 70 70 ARG C C 70 174.596 174.596 173.428 1.168 18935 5983 1 8 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.338 -1.177 18935 5984 1 8 . 1 1 70 70 ARG CB C 70 32.453 32.453 32.287 0.166 18935 5985 1 8 . 1 1 70 70 ARG H H 70 9.083 9.083 8.913 0.170 18935 5986 1 8 . 1 1 71 71 ILE N N 71 118.496 118.496 120.056 -1.560 18935 5987 1 8 . 1 1 71 71 ILE C C 71 175.625 175.625 175.054 0.571 18935 5988 1 8 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.584 0.192 18935 5989 1 8 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.077 -2.110 18935 5990 1 8 . 1 1 71 71 ILE H H 71 7.864 7.864 7.790 0.074 18935 5991 1 8 . 1 1 72 72 LYS N N 72 127.423 127.423 127.086 0.337 18935 5992 1 8 . 1 1 72 72 LYS C C 72 177.659 177.659 176.688 0.971 18935 5993 1 8 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.782 1.646 18935 5994 1 8 . 1 1 72 72 LYS CB C 72 31.374 31.374 33.563 -2.189 18935 5995 1 8 . 1 1 72 72 LYS H H 72 8.720 8.720 8.110 0.610 18935 5996 1 8 . 1 1 73 73 GLY N N 73 112.604 112.604 111.094 1.510 18935 5997 1 8 . 1 1 73 73 GLY C C 73 173.729 173.729 174.217 -0.488 18935 5998 1 8 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.989 -0.158 18935 5999 1 8 . 1 1 73 73 GLY H H 73 8.930 8.930 8.714 0.216 18935 6000 1 8 . 1 1 74 74 LEU N N 74 119.538 119.538 119.133 0.405 18935 6001 1 8 . 1 1 74 74 LEU C C 74 175.802 175.802 175.629 0.173 18935 6002 1 8 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.482 0.179 18935 6003 1 8 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.868 -0.815 18935 6004 1 8 . 1 1 74 74 LEU H H 74 7.547 7.547 7.935 -0.388 18935 6005 1 8 . 1 1 75 75 SER N N 75 118.994 118.994 116.876 2.118 18935 6006 1 8 . 1 1 75 75 SER C C 75 173.111 173.111 172.906 0.205 18935 6007 1 8 . 1 1 75 75 SER CA C 75 57.696 57.696 57.774 -0.078 18935 6008 1 8 . 1 1 75 75 SER CB C 75 63.073 63.073 64.052 -0.979 18935 6009 1 8 . 1 1 75 75 SER H H 75 9.076 9.076 8.834 0.242 18935 6010 1 8 . 1 1 76 76 PHE N N 76 117.802 117.802 120.995 -3.193 18935 6011 1 8 . 1 1 76 76 PHE C C 76 173.564 173.564 174.689 -1.125 18935 6012 1 8 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.513 -1.104 18935 6013 1 8 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.284 -0.441 18935 6014 1 8 . 1 1 76 76 PHE H H 76 8.119 8.119 7.977 0.142 18935 6015 1 8 . 1 1 77 77 SER N N 77 113.918 113.918 117.210 -3.292 18935 6016 1 8 . 1 1 77 77 SER C C 77 173.194 173.194 174.326 -1.132 18935 6017 1 8 . 1 1 77 77 SER CA C 77 55.999 55.999 57.670 -1.671 18935 6018 1 8 . 1 1 77 77 SER CB C 77 65.218 65.218 63.923 1.294 18935 6019 1 8 . 1 1 77 77 SER H H 77 8.989 8.989 8.580 0.409 18935 6020 1 8 . 1 1 78 78 VAL N N 78 123.662 123.662 125.036 -1.374 18935 6021 1 8 . 1 1 78 78 VAL C C 78 176.057 176.057 176.132 -0.075 18935 6022 1 8 . 1 1 78 78 VAL CA C 78 62.091 62.091 64.296 -2.205 18935 6023 1 8 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.672 0.621 18935 6024 1 8 . 1 1 78 78 VAL H H 78 8.995 8.995 8.740 0.255 18935 6025 1 8 . 1 1 79 79 LYS N N 79 129.417 129.417 128.812 0.605 18935 6026 1 8 . 1 1 79 79 LYS C C 79 176.436 176.436 174.917 1.519 18935 6027 1 8 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.765 2.887 18935 6028 1 8 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.136 -3.663 18935 6029 1 8 . 1 1 79 79 LYS H H 79 9.425 9.425 8.836 0.589 18935 6030 1 8 . 1 1 80 80 VAL N N 80 108.616 108.616 120.000 -11.384 18935 6031 1 8 . 1 1 80 80 VAL CA C 80 59.097 59.097 60.719 -1.622 18935 6032 1 8 . 1 1 80 80 VAL CB C 80 34.082 34.082 34.083 -0.001 18935 6033 1 8 . 1 1 80 80 VAL H H 80 7.380 7.380 8.409 -1.029 18935 6034 1 8 . 1 1 81 81 CYS N N 81 123.254 123.254 127.833 -4.579 18935 6035 1 8 . 1 1 81 81 CYS C C 81 172.053 172.053 174.316 -2.263 18935 6036 1 8 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.940 1.799 18935 6037 1 8 . 1 1 81 81 CYS CB C 81 27.332 27.332 29.055 -1.723 18935 6038 1 8 . 1 1 81 81 CYS H H 81 9.759 9.759 8.394 1.365 18935 6039 1 8 . 1 1 82 82 GLY N N 82 118.450 118.450 115.179 3.271 18935 6040 1 8 . 1 1 82 82 GLY C C 82 171.814 171.814 174.574 -2.760 18935 6041 1 8 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.815 -2.462 18935 6042 1 8 . 1 1 82 82 GLY H H 82 8.537 8.537 8.675 -0.138 18935 6043 1 8 . 1 1 83 83 GLU N N 83 113.964 113.964 121.394 -7.430 18935 6044 1 8 . 1 1 83 83 GLU C C 83 179.320 179.320 177.516 1.804 18935 6045 1 8 . 1 1 83 83 GLU CA C 83 57.675 57.675 56.969 0.706 18935 6046 1 8 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.379 -0.472 18935 6047 1 8 . 1 1 83 83 GLU H H 83 8.473 8.473 8.741 -0.268 18935 6048 1 8 . 1 1 84 84 ARG N N 84 117.544 117.544 117.838 -0.294 18935 6049 1 8 . 1 1 84 84 ARG C C 84 177.252 177.252 176.336 0.916 18935 6050 1 8 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.554 -1.050 18935 6051 1 8 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.350 0.196 18935 6052 1 8 . 1 1 84 84 ARG H H 84 9.760 9.760 8.207 1.553 18935 6053 1 8 . 1 1 85 85 LYS N N 85 124.160 124.160 119.721 4.439 18935 6054 1 8 . 1 1 85 85 LYS C C 85 173.379 173.379 175.782 -2.403 18935 6055 1 8 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.440 -1.208 18935 6056 1 8 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.226 -0.014 18935 6057 1 8 . 1 1 85 85 LYS H H 85 8.494 8.494 7.851 0.643 18935 6058 1 8 . 1 1 86 86 CYS N N 86 126.472 126.472 118.064 8.408 18935 6059 1 8 . 1 1 86 86 CYS C C 86 171.935 171.935 172.861 -0.926 18935 6060 1 8 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.908 -2.030 18935 6061 1 8 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.099 0.205 18935 6062 1 8 . 1 1 86 86 CYS H H 86 9.221 9.221 8.502 0.719 18935 6063 1 8 . 1 1 87 87 VAL N N 87 126.426 126.426 124.035 2.391 18935 6064 1 8 . 1 1 87 87 VAL C C 87 173.760 173.760 173.302 0.458 18935 6065 1 8 . 1 1 87 87 VAL CA C 87 61.333 61.333 59.400 1.933 18935 6066 1 8 . 1 1 87 87 VAL CB C 87 33.338 33.338 35.857 -2.519 18935 6067 1 8 . 1 1 87 87 VAL H H 87 8.623 8.623 8.058 0.565 18935 6068 1 8 . 1 1 88 88 LEU N N 88 125.701 125.701 127.872 -2.171 18935 6069 1 8 . 1 1 88 88 LEU C C 88 175.424 175.424 174.981 0.443 18935 6070 1 8 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.608 -1.523 18935 6071 1 8 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.497 -1.953 18935 6072 1 8 . 1 1 88 88 LEU H H 88 9.592 9.592 8.998 0.594 18935 6073 1 8 . 1 1 89 89 PHE N N 89 118.314 118.314 123.342 -5.028 18935 6074 1 8 . 1 1 89 89 PHE C C 89 177.068 177.068 176.247 0.821 18935 6075 1 8 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.991 -1.116 18935 6076 1 8 . 1 1 89 89 PHE CB C 89 38.837 38.837 38.450 0.387 18935 6077 1 8 . 1 1 89 89 PHE H H 89 8.979 8.979 8.403 0.576 18935 6078 1 8 . 1 1 90 90 ILE N N 90 119.039 119.039 119.288 -0.249 18935 6079 1 8 . 1 1 90 90 ILE C C 90 173.692 173.692 175.732 -2.040 18935 6080 1 8 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.694 -1.022 18935 6081 1 8 . 1 1 90 90 ILE CB C 90 40.183 40.183 40.162 0.021 18935 6082 1 8 . 1 1 90 90 ILE H H 90 9.447 9.447 8.203 1.244 18935 6083 1 8 . 1 1 91 91 GLU N N 91 122.801 122.801 120.919 1.882 18935 6084 1 8 . 1 1 91 91 GLU C C 91 175.565 175.565 175.147 0.418 18935 6085 1 8 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.132 -0.666 18935 6086 1 8 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.150 -3.488 18935 6087 1 8 . 1 1 91 91 GLU H H 91 8.360 8.360 8.511 -0.151 18935 6088 1 8 . 1 1 92 92 TRP N N 92 126.018 126.018 123.134 2.884 18935 6089 1 8 . 1 1 92 92 TRP C C 92 175.070 175.070 174.773 0.297 18935 6090 1 8 . 1 1 92 92 TRP CA C 92 56.190 56.190 57.187 -0.997 18935 6091 1 8 . 1 1 92 92 TRP CB C 92 30.582 30.582 32.303 -1.721 18935 6092 1 8 . 1 1 92 92 TRP H H 92 9.425 9.425 8.820 0.605 18935 6093 1 8 . 1 1 93 93 GLU N N 93 126.381 126.381 125.301 1.080 18935 6094 1 8 . 1 1 93 93 GLU C C 93 175.637 175.637 175.822 -0.185 18935 6095 1 8 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.201 -0.432 18935 6096 1 8 . 1 1 93 93 GLU CB C 93 25.944 25.944 27.386 -1.442 18935 6097 1 8 . 1 1 93 93 GLU H H 93 8.914 8.914 8.981 -0.067 18935 6098 1 8 . 1 1 94 94 LYS N N 94 107.891 107.891 112.473 -4.582 18935 6099 1 8 . 1 1 94 94 LYS C C 94 175.359 175.359 175.659 -0.300 18935 6100 1 8 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.314 0.115 18935 6101 1 8 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.471 -1.829 18935 6102 1 8 . 1 1 94 94 LYS H H 94 8.634 8.634 8.378 0.256 18935 6103 1 8 . 1 1 95 95 LYS N N 95 120.490 120.490 118.812 1.678 18935 6104 1 8 . 1 1 95 95 LYS C C 95 174.369 174.369 174.642 -0.273 18935 6105 1 8 . 1 1 95 95 LYS CA C 95 54.353 54.353 55.006 -0.653 18935 6106 1 8 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.059 -0.596 18935 6107 1 8 . 1 1 95 95 LYS H H 95 7.924 7.924 7.485 0.439 18935 6108 1 8 . 1 1 96 96 THR N N 96 115.278 115.278 113.768 1.510 18935 6109 1 8 . 1 1 96 96 THR C C 96 174.317 174.317 173.676 0.641 18935 6110 1 8 . 1 1 96 96 THR CA C 96 61.203 61.203 60.698 0.505 18935 6111 1 8 . 1 1 96 96 THR CB C 96 69.348 69.348 70.620 -1.272 18935 6112 1 8 . 1 1 96 96 THR H H 96 7.967 7.967 8.312 -0.345 18935 6113 1 8 . 1 1 97 97 TYR N N 97 123.254 123.254 124.427 -1.173 18935 6114 1 8 . 1 1 97 97 TYR C C 97 173.320 173.320 173.609 -0.289 18935 6115 1 8 . 1 1 97 97 TYR CA C 97 55.884 55.884 54.311 1.573 18935 6116 1 8 . 1 1 97 97 TYR CB C 97 41.136 41.136 39.716 1.420 18935 6117 1 8 . 1 1 97 97 TYR H H 97 9.232 9.232 9.094 0.138 18935 6118 1 8 . 1 1 98 98 GLN N N 98 122.574 122.574 118.073 4.501 18935 6119 1 8 . 1 1 98 98 GLN C C 98 172.781 172.781 174.291 -1.510 18935 6120 1 8 . 1 1 98 98 GLN CA C 98 55.171 55.171 54.441 0.730 18935 6121 1 8 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.402 -3.003 18935 6122 1 8 . 1 1 98 98 GLN H H 98 9.000 9.000 8.686 0.314 18935 6123 1 8 . 1 1 99 99 LEU N N 99 130.218 130.218 124.315 5.903 18935 6124 1 8 . 1 1 99 99 LEU C C 99 172.806 172.806 174.292 -1.486 18935 6125 1 8 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.295 -1.245 18935 6126 1 8 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.048 -0.296 18935 6127 1 8 . 1 1 99 99 LEU H H 99 9.246 9.246 8.890 0.356 18935 6128 1 8 . 1 1 100 100 ASP N N 100 124.931 124.931 127.532 -2.601 18935 6129 1 8 . 1 1 100 100 ASP C C 100 172.626 172.626 174.443 -1.817 18935 6130 1 8 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.196 -2.765 18935 6131 1 8 . 1 1 100 100 ASP CB C 100 37.328 37.328 42.839 -5.511 18935 6132 1 8 . 1 1 100 100 ASP H H 100 9.253 9.253 8.351 0.902 18935 6133 1 8 . 1 1 101 101 LEU N N 101 119.402 119.402 119.824 -0.422 18935 6134 1 8 . 1 1 101 101 LEU C C 101 173.869 173.869 174.671 -0.802 18935 6135 1 8 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.788 -1.133 18935 6136 1 8 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.275 0.891 18935 6137 1 8 . 1 1 101 101 LEU H H 101 8.726 8.726 7.800 0.926 18935 6138 1 8 . 1 1 102 102 PHE N N 102 117.952 117.952 117.943 0.009 18935 6139 1 8 . 1 1 102 102 PHE C C 102 175.853 175.853 175.326 0.527 18935 6140 1 8 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.743 -2.461 18935 6141 1 8 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.173 1.651 18935 6142 1 8 . 1 1 102 102 PHE H H 102 8.236 8.236 8.532 -0.296 18935 6143 1 8 . 1 1 103 103 THR N N 103 106.853 106.853 118.217 -11.364 18935 6144 1 8 . 1 1 103 103 THR C C 103 175.154 175.154 174.286 0.868 18935 6145 1 8 . 1 1 103 103 THR CA C 103 57.685 57.685 61.015 -3.330 18935 6146 1 8 . 1 1 103 103 THR CB C 103 71.037 71.037 69.033 2.004 18935 6147 1 8 . 1 1 103 103 THR H H 103 7.917 7.917 8.583 -0.666 18935 6148 1 8 . 1 1 104 104 ALA N N 104 122.348 122.348 129.081 -6.733 18935 6149 1 8 . 1 1 104 104 ALA C C 104 175.947 175.947 174.810 1.137 18935 6150 1 8 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.278 -0.471 18935 6151 1 8 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.460 -0.032 18935 6152 1 8 . 1 1 104 104 ALA H H 104 8.930 8.930 9.123 -0.193 18935 6153 1 8 . 1 1 105 105 LEU N N 105 119.855 119.855 119.417 0.438 18935 6154 1 8 . 1 1 105 105 LEU C C 105 179.628 179.628 178.834 0.794 18935 6155 1 8 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.050 -0.927 18935 6156 1 8 . 1 1 105 105 LEU CB C 105 41.334 41.334 42.967 -1.633 18935 6157 1 8 . 1 1 105 105 LEU H H 105 8.316 8.316 9.223 -0.907 18935 6158 1 8 . 1 1 106 106 ALA N N 106 123.662 123.662 125.308 -1.646 18935 6159 1 8 . 1 1 106 106 ALA C C 106 181.056 181.056 178.108 2.948 18935 6160 1 8 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.280 1.069 18935 6161 1 8 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.626 -1.311 18935 6162 1 8 . 1 1 106 106 ALA H H 106 8.306 8.306 8.221 0.085 18935 6163 1 8 . 1 1 107 107 GLU N N 107 114.825 114.825 114.809 0.016 18935 6164 1 8 . 1 1 107 107 GLU C C 107 177.854 177.854 176.855 0.999 18935 6165 1 8 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.975 0.411 18935 6166 1 8 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.920 -1.076 18935 6167 1 8 . 1 1 107 107 GLU H H 107 9.754 9.754 8.678 1.076 18935 6168 1 8 . 1 1 108 108 GLU N N 108 115.097 115.097 118.062 -2.965 18935 6169 1 8 . 1 1 108 108 GLU C C 108 178.001 178.001 177.292 0.709 18935 6170 1 8 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.472 -1.546 18935 6171 1 8 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.657 0.344 18935 6172 1 8 . 1 1 108 108 GLU H H 108 7.859 7.859 7.730 0.129 18935 6173 1 8 . 1 1 109 109 LYS N N 109 118.360 118.360 122.028 -3.668 18935 6174 1 8 . 1 1 109 109 LYS C C 109 172.691 172.691 176.403 -3.712 18935 6175 1 8 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.035 0.867 18935 6176 1 8 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.696 -0.155 18935 6177 1 8 . 1 1 109 109 LYS H H 109 7.660 7.660 7.306 0.354 18935 6178 1 8 . 1 1 111 111 TYR N N 111 114.054 114.054 118.223 -4.169 18935 6179 1 8 . 1 1 111 111 TYR C C 111 179.764 179.764 177.950 1.814 18935 6180 1 8 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.840 -1.842 18935 6181 1 8 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.334 -1.378 18935 6182 1 8 . 1 1 111 111 TYR H H 111 6.583 6.583 8.389 -1.806 18935 6183 1 8 . 1 1 112 112 ALA N N 112 124.749 124.749 122.387 2.362 18935 6184 1 8 . 1 1 112 112 ALA C C 112 179.430 179.430 179.500 -0.070 18935 6185 1 8 . 1 1 112 112 ALA CA C 112 54.969 54.969 55.169 -0.200 18935 6186 1 8 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.682 0.130 18935 6187 1 8 . 1 1 112 112 ALA H H 112 8.753 8.753 8.553 0.200 18935 6188 1 8 . 1 1 113 113 ILE N N 113 119.130 119.130 119.787 -0.657 18935 6189 1 8 . 1 1 113 113 ILE C C 113 178.646 178.646 178.067 0.579 18935 6190 1 8 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.717 2.684 18935 6191 1 8 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.574 0.663 18935 6192 1 8 . 1 1 113 113 ILE H H 113 8.946 8.946 8.336 0.610 18935 6193 1 8 . 1 1 114 114 PHE N N 114 121.758 121.758 120.538 1.220 18935 6194 1 8 . 1 1 114 114 PHE C C 114 177.954 177.954 178.118 -0.164 18935 6195 1 8 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.732 -1.955 18935 6196 1 8 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.662 0.402 18935 6197 1 8 . 1 1 114 114 PHE H H 114 7.940 7.940 8.208 -0.268 18935 6198 1 8 . 1 1 115 115 HIS N N 115 116.547 116.547 119.201 -2.654 18935 6199 1 8 . 1 1 115 115 HIS C C 115 176.161 176.161 177.265 -1.104 18935 6200 1 8 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.761 -0.642 18935 6201 1 8 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.595 1.472 18935 6202 1 8 . 1 1 115 115 HIS H H 115 7.767 7.767 8.052 -0.285 18935 6203 1 8 . 1 1 116 116 PHE N N 116 109.387 109.387 115.363 -5.976 18935 6204 1 8 . 1 1 116 116 PHE C C 116 177.282 177.282 176.751 0.531 18935 6205 1 8 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.231 1.203 18935 6206 1 8 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.605 -2.350 18935 6207 1 8 . 1 1 116 116 PHE H H 116 8.989 8.989 8.287 0.702 18935 6208 1 8 . 1 1 117 117 THR N N 117 116.864 116.864 108.786 8.078 18935 6209 1 8 . 1 1 117 117 THR C C 117 172.889 172.889 174.465 -1.576 18935 6210 1 8 . 1 1 117 117 THR CA C 117 66.997 66.997 62.613 4.384 18935 6211 1 8 . 1 1 117 117 THR CB C 117 67.948 67.948 69.398 -1.450 18935 6212 1 8 . 1 1 117 117 THR H H 117 7.988 7.988 7.993 -0.005 18935 6213 1 8 . 1 1 118 118 GLY N N 118 103.320 103.320 108.709 -5.389 18935 6214 1 8 . 1 1 118 118 GLY C C 118 176.912 176.912 171.470 5.442 18935 6215 1 8 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.825 1.357 18935 6216 1 8 . 1 1 118 118 GLY H H 118 6.550 6.550 7.000 -0.450 18935 6217 1 8 . 1 1 120 120 VAL N N 120 120.671 120.671 126.871 -6.200 18935 6218 1 8 . 1 1 120 120 VAL C C 120 176.283 176.283 177.347 -1.064 18935 6219 1 8 . 1 1 120 120 VAL CA C 120 66.940 66.940 65.603 1.337 18935 6220 1 8 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.859 -2.007 18935 6221 1 8 . 1 1 120 120 VAL H H 120 8.408 8.408 8.462 -0.054 18935 6222 1 8 . 1 1 121 121 SER N N 121 111.789 111.789 114.118 -2.329 18935 6223 1 8 . 1 1 121 121 SER C C 121 175.658 175.658 176.739 -1.081 18935 6224 1 8 . 1 1 121 121 SER CA C 121 60.814 60.814 61.828 -1.014 18935 6225 1 8 . 1 1 121 121 SER CB C 121 60.253 60.253 62.269 -2.016 18935 6226 1 8 . 1 1 121 121 SER H H 121 8.290 8.290 8.379 -0.089 18935 6227 1 8 . 1 1 122 122 TYR N N 122 123.254 123.254 122.686 0.568 18935 6228 1 8 . 1 1 122 122 TYR C C 122 174.611 174.611 177.205 -2.594 18935 6229 1 8 . 1 1 122 122 TYR CA C 122 58.546 58.546 61.035 -2.489 18935 6230 1 8 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.418 -0.279 18935 6231 1 8 . 1 1 122 122 TYR H H 122 6.303 6.303 7.540 -1.237 18935 6232 1 8 . 1 1 123 123 LEU N N 123 114.825 114.825 119.945 -5.120 18935 6233 1 8 . 1 1 123 123 LEU C C 123 178.891 178.891 179.174 -0.283 18935 6234 1 8 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.887 -1.108 18935 6235 1 8 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.726 -0.088 18935 6236 1 8 . 1 1 123 123 LEU H H 123 6.965 6.965 7.373 -0.408 18935 6237 1 8 . 1 1 124 124 ILE N N 124 114.915 114.915 118.323 -3.408 18935 6238 1 8 . 1 1 124 124 ILE C C 124 177.187 177.187 177.819 -0.632 18935 6239 1 8 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.569 -1.138 18935 6240 1 8 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.385 -0.830 18935 6241 1 8 . 1 1 124 124 ILE H H 124 7.531 7.531 8.227 -0.696 18935 6242 1 8 . 1 1 125 125 ARG N N 125 115.278 115.278 120.152 -4.874 18935 6243 1 8 . 1 1 125 125 ARG C C 125 178.473 178.473 178.694 -0.221 18935 6244 1 8 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.835 -0.376 18935 6245 1 8 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.403 -2.324 18935 6246 1 8 . 1 1 125 125 ARG H H 125 6.809 6.809 7.422 -0.613 18935 6247 1 8 . 1 1 126 126 ILE N N 126 124.160 124.160 118.915 5.245 18935 6248 1 8 . 1 1 126 126 ILE C C 126 178.172 178.172 177.882 0.290 18935 6249 1 8 . 1 1 126 126 ILE CA C 126 60.927 60.927 63.740 -2.813 18935 6250 1 8 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.162 -2.696 18935 6251 1 8 . 1 1 126 126 ILE H H 126 7.408 7.408 7.778 -0.370 18935 6252 1 8 . 1 1 127 127 ARG N N 127 117.136 117.136 120.473 -3.337 18935 6253 1 8 . 1 1 127 127 ARG C C 127 179.227 179.227 178.615 0.612 18935 6254 1 8 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.039 1.177 18935 6255 1 8 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.900 -2.111 18935 6256 1 8 . 1 1 127 127 ARG H H 127 8.230 8.230 7.924 0.306 18935 6257 1 8 . 1 1 128 128 ALA N N 128 121.305 121.305 118.748 2.557 18935 6258 1 8 . 1 1 128 128 ALA C C 128 179.933 179.933 178.586 1.347 18935 6259 1 8 . 1 1 128 128 ALA CA C 128 54.706 54.706 54.384 0.322 18935 6260 1 8 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.509 -0.171 18935 6261 1 8 . 1 1 128 128 ALA H H 128 8.666 8.666 8.570 0.096 18935 6262 1 8 . 1 1 129 129 ALA N N 129 120.943 120.943 120.857 0.086 18935 6263 1 8 . 1 1 129 129 ALA C C 129 181.336 181.336 179.102 2.234 18935 6264 1 8 . 1 1 129 129 ALA CA C 129 54.708 54.708 53.790 0.918 18935 6265 1 8 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.844 -1.984 18935 6266 1 8 . 1 1 129 129 ALA H H 129 7.837 7.837 7.358 0.479 18935 6267 1 8 . 1 1 130 130 LEU N N 130 117.726 117.726 119.404 -1.678 18935 6268 1 8 . 1 1 130 130 LEU C C 130 179.432 179.432 179.181 0.251 18935 6269 1 8 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.653 -0.477 18935 6270 1 8 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.832 -1.266 18935 6271 1 8 . 1 1 130 130 LEU H H 130 8.114 8.114 7.835 0.279 18935 6272 1 8 . 1 1 131 131 LYS N N 131 124.115 124.115 120.183 3.932 18935 6273 1 8 . 1 1 131 131 LYS C C 131 181.452 181.452 179.168 2.284 18935 6274 1 8 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.851 0.035 18935 6275 1 8 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.865 0.333 18935 6276 1 8 . 1 1 131 131 LYS H H 131 8.849 8.849 7.837 1.012 18935 6277 1 8 . 1 1 132 132 LYS N N 132 119.447 119.447 118.036 1.411 18935 6278 1 8 . 1 1 132 132 LYS C C 132 177.607 177.607 177.555 0.052 18935 6279 1 8 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.461 -0.509 18935 6280 1 8 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.722 -0.297 18935 6281 1 8 . 1 1 132 132 LYS H H 132 7.778 7.778 7.992 -0.214 18935 6282 1 8 . 1 1 133 133 LYS N N 133 116.638 116.638 115.016 1.622 18935 6283 1 8 . 1 1 133 133 LYS C C 133 174.681 174.681 175.889 -1.208 18935 6284 1 8 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.154 -0.076 18935 6285 1 8 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.201 -0.561 18935 6286 1 8 . 1 1 133 133 LYS H H 133 7.617 7.617 7.520 0.097 18935 6287 1 8 . 1 1 134 134 ASN N N 134 110.792 110.792 115.733 -4.941 18935 6288 1 8 . 1 1 134 134 ASN C C 134 174.034 174.034 172.858 1.176 18935 6289 1 8 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.000 0.615 18935 6290 1 8 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.201 -1.149 18935 6291 1 8 . 1 1 134 134 ASN H H 134 8.123 8.123 8.469 -0.346 18935 6292 1 8 . 1 1 135 135 TYR N N 135 115.867 115.867 116.453 -0.586 18935 6293 1 8 . 1 1 135 135 TYR C C 135 175.122 175.122 175.061 0.061 18935 6294 1 8 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.859 -0.107 18935 6295 1 8 . 1 1 135 135 TYR CB C 135 41.916 41.916 41.450 0.466 18935 6296 1 8 . 1 1 135 135 TYR H H 135 8.133 8.133 8.053 0.080 18935 6297 1 8 . 1 1 136 136 LYS N N 136 119.870 119.870 124.702 -4.832 18935 6298 1 8 . 1 1 136 136 LYS C C 136 174.324 174.324 175.584 -1.260 18935 6299 1 8 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.843 0.338 18935 6300 1 8 . 1 1 136 136 LYS CB C 136 34.073 34.073 33.536 0.537 18935 6301 1 8 . 1 1 136 136 LYS H H 136 9.234 9.234 8.417 0.817 18935 6302 1 8 . 1 1 137 137 LEU N N 137 129.708 129.708 122.230 7.478 18935 6303 1 8 . 1 1 137 137 LEU C C 137 173.798 173.798 175.223 -1.425 18935 6304 1 8 . 1 1 137 137 LEU CA C 137 52.834 52.834 56.108 -3.274 18935 6305 1 8 . 1 1 137 137 LEU CB C 137 44.983 44.983 41.438 3.545 18935 6306 1 8 . 1 1 137 137 LEU H H 137 8.959 8.959 7.996 0.963 18935 6307 1 8 . 1 1 140 140 TYR N N 140 120.580 120.580 113.278 7.302 18935 6308 1 8 . 1 1 140 140 TYR C C 140 174.705 174.705 175.638 -0.933 18935 6309 1 8 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.111 -1.659 18935 6310 1 8 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.099 0.202 18935 6311 1 8 . 1 1 140 140 TYR H H 140 8.962 8.962 7.383 1.579 18935 6312 1 8 . 1 1 141 141 GLY N N 141 104.986 104.986 105.796 -0.810 18935 6313 1 8 . 1 1 141 141 GLY C C 141 181.854 181.854 172.432 9.422 18935 6314 1 8 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.360 -0.238 18935 6315 1 8 . 1 1 141 141 GLY H H 141 7.555 7.555 7.462 0.093 18935 6316 1 8 . 1 1 142 142 LEU N N 142 118.269 118.269 123.088 -4.819 18935 6317 1 8 . 1 1 142 142 LEU C C 142 174.067 174.067 175.557 -1.490 18935 6318 1 8 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.278 -0.776 18935 6319 1 8 . 1 1 142 142 LEU CB C 142 44.542 44.542 42.617 1.925 18935 6320 1 8 . 1 1 142 142 LEU H H 142 7.794 7.794 8.323 -0.529 18935 6321 1 8 . 1 1 143 143 PHE N N 143 122.076 122.076 125.650 -3.574 18935 6322 1 8 . 1 1 143 143 PHE C C 143 175.199 175.199 175.308 -0.109 18935 6323 1 8 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.488 -1.456 18935 6324 1 8 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.142 2.928 18935 6325 1 8 . 1 1 143 143 PHE H H 143 9.522 9.522 9.052 0.470 18935 6326 1 8 . 1 1 144 144 LYS N N 144 121.305 121.305 125.731 -4.426 18935 6327 1 8 . 1 1 144 144 LYS C C 144 176.917 176.917 177.027 -0.110 18935 6328 1 8 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.531 0.825 18935 6329 1 8 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.412 0.267 18935 6330 1 8 . 1 1 144 144 LYS H H 144 9.076 9.076 9.199 -0.123 18935 6331 1 8 . 1 1 145 145 ASN N N 145 126.834 126.834 126.158 0.676 18935 6332 1 8 . 1 1 145 145 ASN C C 145 175.070 175.070 174.692 0.378 18935 6333 1 8 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.392 0.373 18935 6334 1 8 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.428 -0.998 18935 6335 1 8 . 1 1 145 145 ASN H H 145 9.618 9.618 8.918 0.700 18935 6336 1 8 . 1 1 146 146 GLN N N 146 110.112 110.112 110.915 -0.803 18935 6337 1 8 . 1 1 146 146 GLN C C 146 175.198 175.198 175.043 0.155 18935 6338 1 8 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.318 -0.422 18935 6339 1 8 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.849 -1.481 18935 6340 1 8 . 1 1 146 146 GLN H H 146 9.140 9.140 8.763 0.377 18935 6341 1 8 . 1 1 147 147 THR N N 147 116.003 116.003 116.610 -0.607 18935 6342 1 8 . 1 1 147 147 THR C C 147 173.224 173.224 173.270 -0.046 18935 6343 1 8 . 1 1 147 147 THR CA C 147 61.450 61.450 61.280 0.170 18935 6344 1 8 . 1 1 147 147 THR CB C 147 70.285 70.285 70.175 0.110 18935 6345 1 8 . 1 1 147 147 THR H H 147 8.069 8.069 7.769 0.300 18935 6346 1 8 . 1 1 148 148 LEU N N 148 129.281 129.281 130.473 -1.192 18935 6347 1 8 . 1 1 148 148 LEU C C 148 176.703 176.703 175.495 1.208 18935 6348 1 8 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.350 0.116 18935 6349 1 8 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.449 -0.724 18935 6350 1 8 . 1 1 148 148 LEU H H 148 8.831 8.831 8.862 -0.031 18935 6351 1 8 . 1 1 149 149 VAL N N 149 130.189 130.189 127.888 2.301 18935 6352 1 8 . 1 1 149 149 VAL C C 149 175.012 175.012 174.056 0.956 18935 6353 1 8 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.900 0.369 18935 6354 1 8 . 1 1 149 149 VAL CB C 149 31.456 31.456 34.709 -3.253 18935 6355 1 8 . 1 1 149 149 VAL H H 149 9.243 9.243 8.451 0.792 18935 6356 1 8 . 1 1 151 151 LEU N N 151 123.481 123.481 115.574 7.907 18935 6357 1 8 . 1 1 151 151 LEU C C 151 177.679 177.679 176.844 0.835 18935 6358 1 8 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.472 0.525 18935 6359 1 8 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.678 0.941 18935 6360 1 8 . 1 1 151 151 LEU H H 151 8.080 8.080 8.113 -0.033 18935 6361 1 8 . 1 1 152 152 LYS N N 152 126.381 126.381 122.503 3.878 18935 6362 1 8 . 1 1 152 152 LYS C C 152 175.115 175.115 175.090 0.025 18935 6363 1 8 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.143 -1.547 18935 6364 1 8 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.385 -2.320 18935 6365 1 8 . 1 1 152 152 LYS H H 152 9.112 9.112 8.761 0.351 18935 6366 1 8 . 1 1 153 153 ILE N N 153 113.737 113.737 116.572 -2.835 18935 6367 1 8 . 1 1 153 153 ILE C C 153 175.748 175.748 173.755 1.993 18935 6368 1 8 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.429 -1.040 18935 6369 1 8 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.509 1.294 18935 6370 1 8 . 1 1 153 153 ILE H H 153 7.304 7.304 7.498 -0.194 18935 6371 1 8 . 1 1 154 154 THR N N 154 110.656 110.656 112.724 -2.068 18935 6372 1 8 . 1 1 154 154 THR C C 154 174.864 174.864 173.148 1.716 18935 6373 1 8 . 1 1 154 154 THR CA C 154 62.141 62.141 62.638 -0.497 18935 6374 1 8 . 1 1 154 154 THR CB C 154 70.413 70.413 70.122 0.291 18935 6375 1 8 . 1 1 154 154 THR H H 154 9.382 9.382 8.414 0.968 18935 6376 1 8 . 1 1 155 155 THR N N 155 110.746 110.746 116.610 -5.864 18935 6377 1 8 . 1 1 155 155 THR C C 155 174.718 174.718 174.889 -0.171 18935 6378 1 8 . 1 1 155 155 THR CA C 155 58.785 58.785 61.121 -2.336 18935 6379 1 8 . 1 1 155 155 THR CB C 155 72.277 72.277 71.025 1.252 18935 6380 1 8 . 1 1 155 155 THR H H 155 7.746 7.746 7.767 -0.021 18935 6381 1 8 . 1 1 156 156 GLU N N 156 122.302 122.302 124.696 -2.394 18935 6382 1 8 . 1 1 156 156 GLU C C 156 177.289 177.289 178.266 -0.977 18935 6383 1 8 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.896 -2.072 18935 6384 1 8 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.251 -0.870 18935 6385 1 8 . 1 1 156 156 GLU H H 156 9.490 9.490 9.114 0.376 18935 6386 1 8 . 1 1 157 157 LYS N N 157 118.905 118.905 116.654 2.251 18935 6387 1 8 . 1 1 157 157 LYS C C 157 178.241 178.241 179.214 -0.973 18935 6388 1 8 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.559 1.206 18935 6389 1 8 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.801 -0.523 18935 6390 1 8 . 1 1 157 157 LYS H H 157 8.329 8.329 8.490 -0.161 18935 6391 1 8 . 1 1 158 158 GLU N N 158 116.230 116.230 120.669 -4.439 18935 6392 1 8 . 1 1 158 158 GLU C C 158 178.988 178.988 178.566 0.422 18935 6393 1 8 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.011 0.245 18935 6394 1 8 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.139 -0.081 18935 6395 1 8 . 1 1 158 158 GLU H H 158 7.611 7.611 7.427 0.184 18935 6396 1 8 . 1 1 159 159 LEU N N 159 118.978 118.978 121.590 -2.612 18935 6397 1 8 . 1 1 159 159 LEU C C 159 176.347 176.347 178.423 -2.076 18935 6398 1 8 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.282 -5.043 18935 6399 1 8 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.704 -2.161 18935 6400 1 8 . 1 1 159 159 LEU H H 159 7.704 7.704 8.303 -0.599 18935 6401 1 8 . 1 1 160 160 ILE N N 160 117.227 117.227 114.340 2.887 18935 6402 1 8 . 1 1 160 160 ILE C C 160 177.219 177.219 177.366 -0.147 18935 6403 1 8 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.914 0.701 18935 6404 1 8 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.062 0.495 18935 6405 1 8 . 1 1 160 160 ILE H H 160 7.886 7.886 7.503 0.383 18935 6406 1 8 . 1 1 161 161 LYS N N 161 115.912 115.912 119.831 -3.919 18935 6407 1 8 . 1 1 161 161 LYS C C 161 180.990 180.990 178.891 2.099 18935 6408 1 8 . 1 1 161 161 LYS CA C 161 58.631 58.631 59.164 -0.533 18935 6409 1 8 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.237 -1.489 18935 6410 1 8 . 1 1 161 161 LYS H H 161 7.536 7.536 7.342 0.194 18935 6411 1 8 . 1 1 162 162 GLU N N 162 120.852 120.852 119.952 0.900 18935 6412 1 8 . 1 1 162 162 GLU C C 162 178.793 178.793 177.957 0.836 18935 6413 1 8 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.499 -0.517 18935 6414 1 8 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.358 -1.566 18935 6415 1 8 . 1 1 162 162 GLU H H 162 8.392 8.392 7.849 0.543 18935 6416 1 8 . 1 1 163 163 LEU N N 163 115.912 115.912 115.860 0.052 18935 6417 1 8 . 1 1 163 163 LEU C C 163 176.370 176.370 177.038 -0.668 18935 6418 1 8 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.730 -0.635 18935 6419 1 8 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.617 -1.443 18935 6420 1 8 . 1 1 163 163 LEU H H 163 8.031 8.031 7.911 0.120 18935 6421 1 8 . 1 1 164 164 GLY N N 164 103.160 103.160 103.151 0.009 18935 6422 1 8 . 1 1 164 164 GLY C C 164 174.240 174.240 174.414 -0.174 18935 6423 1 8 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.492 -0.190 18935 6424 1 8 . 1 1 164 164 GLY H H 164 7.625 7.625 7.568 0.057 18935 6425 1 8 . 1 1 165 165 PHE N N 165 117.952 117.952 119.216 -1.264 18935 6426 1 8 . 1 1 165 165 PHE C C 165 174.556 174.556 175.255 -0.699 18935 6427 1 8 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.732 -0.267 18935 6428 1 8 . 1 1 165 165 PHE CB C 165 40.762 40.762 40.360 0.402 18935 6429 1 8 . 1 1 165 165 PHE H H 165 7.283 7.283 7.324 -0.041 18935 6430 1 8 . 1 1 166 166 THR N N 166 118.178 118.178 113.135 5.043 18935 6431 1 8 . 1 1 166 166 THR C C 166 175.306 175.306 173.839 1.467 18935 6432 1 8 . 1 1 166 166 THR CA C 166 63.466 63.466 59.871 3.595 18935 6433 1 8 . 1 1 166 166 THR CB C 166 68.721 68.721 71.145 -2.424 18935 6434 1 8 . 1 1 166 166 THR H H 166 9.678 9.678 8.592 1.086 18935 6435 1 8 . 1 1 167 167 TYR N N 167 128.239 128.239 124.619 3.620 18935 6436 1 8 . 1 1 167 167 TYR C C 167 173.297 173.297 175.404 -2.107 18935 6437 1 8 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.269 1.143 18935 6438 1 8 . 1 1 167 167 TYR CB C 167 36.722 36.722 38.729 -2.007 18935 6439 1 8 . 1 1 167 167 TYR H H 167 9.264 9.264 8.771 0.493 18935 6440 1 8 . 1 1 168 168 ARG N N 168 126.789 126.789 126.606 0.183 18935 6441 1 8 . 1 1 168 168 ARG C C 168 175.297 175.297 174.185 1.112 18935 6442 1 8 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.084 -1.319 18935 6443 1 8 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.537 -1.211 18935 6444 1 8 . 1 1 168 168 ARG H H 168 7.030 7.030 8.128 -1.098 18935 6445 1 8 . 1 1 169 169 ILE N N 169 119.221 119.221 115.510 3.711 18935 6446 1 8 . 1 1 169 169 ILE C C 169 174.522 174.522 174.917 -0.395 18935 6447 1 8 . 1 1 169 169 ILE CA C 169 60.279 60.279 56.755 3.524 18935 6448 1 8 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.532 -4.885 18935 6449 1 8 . 1 1 169 169 ILE H H 169 8.349 8.349 8.176 0.173 18935 6450 1 8 . 1 1 171 171 LYS N N 171 111.335 111.335 116.677 -5.342 18935 6451 1 8 . 1 1 171 171 LYS C C 171 176.638 176.638 178.533 -1.895 18935 6452 1 8 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.628 -2.090 18935 6453 1 8 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.666 0.301 18935 6454 1 8 . 1 1 171 171 LYS H H 171 8.198 8.198 8.627 -0.429 18935 6455 1 8 . 1 1 172 172 LYS N N 172 116.411 116.411 117.762 -1.351 18935 6456 1 8 . 1 1 172 172 LYS C C 172 175.331 175.331 176.068 -0.737 18935 6457 1 8 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.214 -1.212 18935 6458 1 8 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.097 -1.279 18935 6459 1 8 . 1 1 172 172 LYS H H 172 7.843 7.843 7.371 0.472 18935 6460 1 8 . 1 1 173 173 ARG N N 173 120.490 120.490 116.982 3.508 18935 6461 1 8 . 1 1 173 173 ARG C C 173 172.830 172.830 174.796 -1.966 18935 6462 1 8 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.743 0.431 18935 6463 1 8 . 1 1 173 173 ARG CB C 173 28.829 28.829 29.542 -0.713 18935 6464 1 8 . 1 1 173 173 ARG H H 173 6.917 6.917 7.551 -0.634 18935 6465 1 9 . 1 1 2 2 LEU N N 2 119.937 119.937 119.372 0.565 18935 6466 1 9 . 1 1 2 2 LEU C C 2 175.307 175.307 175.628 -0.321 18935 6467 1 9 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.955 0.337 18935 6468 1 9 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.752 -2.068 18935 6469 1 9 . 1 1 2 2 LEU H H 2 9.251 9.251 7.810 1.441 18935 6470 1 9 . 1 1 3 3 THR N N 3 111.335 111.335 113.009 -1.674 18935 6471 1 9 . 1 1 3 3 THR C C 3 175.854 175.854 175.811 0.043 18935 6472 1 9 . 1 1 3 3 THR CA C 3 60.540 60.540 60.496 0.044 18935 6473 1 9 . 1 1 3 3 THR CB C 3 70.782 70.782 70.249 0.533 18935 6474 1 9 . 1 1 3 3 THR H H 3 8.677 8.677 8.238 0.439 18935 6475 1 9 . 1 1 4 4 LEU N N 4 120.988 120.988 123.347 -2.359 18935 6476 1 9 . 1 1 4 4 LEU C C 4 178.391 178.391 178.563 -0.172 18935 6477 1 9 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.343 -0.279 18935 6478 1 9 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.656 -2.394 18935 6479 1 9 . 1 1 4 4 LEU H H 4 7.746 7.746 7.804 -0.058 18935 6480 1 9 . 1 1 5 5 ILE N N 5 114.236 114.236 114.211 0.025 18935 6481 1 9 . 1 1 5 5 ILE C C 5 178.339 178.339 177.947 0.392 18935 6482 1 9 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.525 -0.943 18935 6483 1 9 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.123 -0.324 18935 6484 1 9 . 1 1 5 5 ILE H H 5 7.821 7.821 7.859 -0.038 18935 6485 1 9 . 1 1 6 6 GLN N N 6 120.399 120.399 120.829 -0.430 18935 6486 1 9 . 1 1 6 6 GLN C C 6 178.783 178.783 178.478 0.305 18935 6487 1 9 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.001 -0.781 18935 6488 1 9 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.067 0.048 18935 6489 1 9 . 1 1 6 6 GLN H H 6 7.810 7.810 7.651 0.159 18935 6490 1 9 . 1 1 7 7 GLY N N 7 106.277 106.277 106.543 -0.266 18935 6491 1 9 . 1 1 7 7 GLY C C 7 174.554 174.554 176.117 -1.563 18935 6492 1 9 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.185 -0.251 18935 6493 1 9 . 1 1 7 7 GLY H H 7 8.733 8.733 8.154 0.579 18935 6494 1 9 . 1 1 8 8 LYS N N 8 119.991 119.991 121.699 -1.708 18935 6495 1 9 . 1 1 8 8 LYS C C 8 179.433 179.433 178.130 1.303 18935 6496 1 9 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.052 1.840 18935 6497 1 9 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.112 -0.780 18935 6498 1 9 . 1 1 8 8 LYS H H 8 8.688 8.688 7.490 1.198 18935 6499 1 9 . 1 1 9 9 LYS N N 9 119.175 119.175 120.881 -1.706 18935 6500 1 9 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.906 -0.523 18935 6501 1 9 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.334 -0.899 18935 6502 1 9 . 1 1 9 9 LYS H H 9 8.015 8.015 7.813 0.202 18935 6503 1 9 . 1 1 10 10 ILE N N 10 120.308 120.308 116.378 3.930 18935 6504 1 9 . 1 1 10 10 ILE C C 10 177.766 177.766 177.467 0.299 18935 6505 1 9 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.944 -0.268 18935 6506 1 9 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.461 -1.148 18935 6507 1 9 . 1 1 10 10 ILE H H 10 7.967 7.967 8.267 -0.300 18935 6508 1 9 . 1 1 11 11 VAL N N 11 119.130 119.130 121.570 -2.440 18935 6509 1 9 . 1 1 11 11 VAL C C 11 176.606 176.606 178.071 -1.465 18935 6510 1 9 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.875 0.765 18935 6511 1 9 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.248 -1.039 18935 6512 1 9 . 1 1 11 11 VAL H H 11 8.128 8.128 7.685 0.443 18935 6513 1 9 . 1 1 12 12 ASN N N 12 115.822 115.822 116.415 -0.593 18935 6514 1 9 . 1 1 12 12 ASN C C 12 177.375 177.375 177.557 -0.182 18935 6515 1 9 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.387 -0.417 18935 6516 1 9 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.596 -1.033 18935 6517 1 9 . 1 1 12 12 ASN H H 12 8.203 8.203 8.050 0.153 18935 6518 1 9 . 1 1 13 13 HIS N N 13 117.659 117.659 118.821 -1.162 18935 6519 1 9 . 1 1 13 13 HIS C C 13 177.287 177.287 177.809 -0.522 18935 6520 1 9 . 1 1 13 13 HIS CA C 13 58.687 58.687 59.565 -0.878 18935 6521 1 9 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.460 -0.439 18935 6522 1 9 . 1 1 13 13 HIS H H 13 7.861 7.861 7.780 0.081 18935 6523 1 9 . 1 1 14 14 LEU N N 14 115.595 115.595 119.854 -4.259 18935 6524 1 9 . 1 1 14 14 LEU C C 14 179.092 179.092 178.611 0.481 18935 6525 1 9 . 1 1 14 14 LEU CA C 14 56.641 56.641 57.743 -1.102 18935 6526 1 9 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.753 -0.733 18935 6527 1 9 . 1 1 14 14 LEU H H 14 8.376 8.376 8.960 -0.584 18935 6528 1 9 . 1 1 15 15 ARG N N 15 115.006 115.006 116.880 -1.874 18935 6529 1 9 . 1 1 15 15 ARG C C 15 176.265 176.265 177.664 -1.399 18935 6530 1 9 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.264 1.620 18935 6531 1 9 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.310 -0.238 18935 6532 1 9 . 1 1 15 15 ARG H H 15 8.074 8.074 8.335 -0.261 18935 6533 1 9 . 1 1 16 16 SER N N 16 107.778 107.778 113.632 -5.854 18935 6534 1 9 . 1 1 16 16 SER C C 16 176.009 176.009 175.769 0.240 18935 6535 1 9 . 1 1 16 16 SER CA C 16 57.244 57.244 59.836 -2.592 18935 6536 1 9 . 1 1 16 16 SER CB C 16 63.525 63.525 64.907 -1.382 18935 6537 1 9 . 1 1 16 16 SER H H 16 7.136 7.136 7.883 -0.747 18935 6538 1 9 . 1 1 17 17 ARG N N 17 121.532 121.532 121.184 0.348 18935 6539 1 9 . 1 1 17 17 ARG C C 17 174.482 174.482 176.128 -1.646 18935 6540 1 9 . 1 1 17 17 ARG CA C 17 56.322 56.322 54.922 1.400 18935 6541 1 9 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.176 1.654 18935 6542 1 9 . 1 1 17 17 ARG H H 17 7.913 7.913 7.653 0.260 18935 6543 1 9 . 1 1 18 18 LEU N N 18 121.305 121.305 119.726 1.579 18935 6544 1 9 . 1 1 18 18 LEU C C 18 176.283 176.283 175.768 0.515 18935 6545 1 9 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.068 -0.370 18935 6546 1 9 . 1 1 18 18 LEU CB C 18 43.055 43.055 42.850 0.205 18935 6547 1 9 . 1 1 18 18 LEU H H 18 8.812 8.812 7.545 1.267 18935 6548 1 9 . 1 1 19 19 ALA N N 19 125.293 125.293 120.875 4.418 18935 6549 1 9 . 1 1 19 19 ALA C C 19 173.780 173.780 175.207 -1.427 18935 6550 1 9 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.915 -1.113 18935 6551 1 9 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.558 1.295 18935 6552 1 9 . 1 1 19 19 ALA H H 19 8.790 8.790 7.655 1.135 18935 6553 1 9 . 1 1 20 20 PHE N N 20 113.117 113.117 114.735 -1.618 18935 6554 1 9 . 1 1 20 20 PHE C C 20 172.708 172.708 172.693 0.015 18935 6555 1 9 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.912 -1.314 18935 6556 1 9 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.310 -0.585 18935 6557 1 9 . 1 1 20 20 PHE H H 20 8.925 8.925 8.373 0.552 18935 6558 1 9 . 1 1 21 21 GLU N N 21 121.532 121.532 122.191 -0.659 18935 6559 1 9 . 1 1 21 21 GLU C C 21 174.830 174.830 174.504 0.326 18935 6560 1 9 . 1 1 21 21 GLU CA C 21 54.963 54.963 54.518 0.445 18935 6561 1 9 . 1 1 21 21 GLU CB C 21 30.343 30.343 33.459 -3.116 18935 6562 1 9 . 1 1 21 21 GLU H H 21 7.972 7.972 9.347 -1.375 18935 6563 1 9 . 1 1 22 22 TYR N N 22 125.339 125.339 128.043 -2.704 18935 6564 1 9 . 1 1 22 22 TYR C C 22 174.864 174.864 175.314 -0.450 18935 6565 1 9 . 1 1 22 22 TYR CA C 22 55.288 55.288 56.354 -1.066 18935 6566 1 9 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.514 -0.655 18935 6567 1 9 . 1 1 22 22 TYR H H 22 9.016 9.016 9.029 -0.013 18935 6568 1 9 . 1 1 23 23 ASN N N 23 127.024 127.024 127.037 -0.013 18935 6569 1 9 . 1 1 23 23 ASN C C 23 175.410 175.410 174.809 0.601 18935 6570 1 9 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.239 -0.185 18935 6571 1 9 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.529 -1.268 18935 6572 1 9 . 1 1 23 23 ASN H H 23 9.181 9.181 9.342 -0.161 18935 6573 1 9 . 1 1 24 24 GLY N N 24 102.755 102.755 103.359 -0.604 18935 6574 1 9 . 1 1 24 24 GLY C C 24 173.626 173.626 174.590 -0.964 18935 6575 1 9 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.034 -0.099 18935 6576 1 9 . 1 1 24 24 GLY H H 24 8.666 8.666 8.464 0.202 18935 6577 1 9 . 1 1 25 25 GLN N N 25 118.722 118.722 120.167 -1.445 18935 6578 1 9 . 1 1 25 25 GLN C C 25 173.657 173.657 175.071 -1.414 18935 6579 1 9 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.541 -1.308 18935 6580 1 9 . 1 1 25 25 GLN CB C 25 30.805 30.805 29.939 0.865 18935 6581 1 9 . 1 1 25 25 GLN H H 25 7.708 7.708 8.007 -0.299 18935 6582 1 9 . 1 1 26 26 LEU N N 26 123.526 123.526 122.008 1.518 18935 6583 1 9 . 1 1 26 26 LEU C C 26 175.842 175.842 176.725 -0.883 18935 6584 1 9 . 1 1 26 26 LEU CA C 26 53.986 53.986 54.072 -0.085 18935 6585 1 9 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.688 -2.881 18935 6586 1 9 . 1 1 26 26 LEU H H 26 8.543 8.543 8.367 0.176 18935 6587 1 9 . 1 1 27 27 ILE N N 27 129.462 129.462 124.481 4.981 18935 6588 1 9 . 1 1 27 27 ILE C C 27 175.085 175.085 173.965 1.120 18935 6589 1 9 . 1 1 27 27 ILE CA C 27 58.973 58.973 59.947 -0.974 18935 6590 1 9 . 1 1 27 27 ILE CB C 27 35.552 35.552 39.633 -4.081 18935 6591 1 9 . 1 1 27 27 ILE H H 27 8.989 8.989 8.887 0.102 18935 6592 1 9 . 1 1 28 28 LYS N N 28 125.157 125.157 126.116 -0.959 18935 6593 1 9 . 1 1 28 28 LYS C C 28 176.725 176.725 175.678 1.047 18935 6594 1 9 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.714 1.096 18935 6595 1 9 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.169 -1.352 18935 6596 1 9 . 1 1 28 28 LYS H H 28 8.311 8.311 8.129 0.182 18935 6597 1 9 . 1 1 29 29 ILE N N 29 125.565 125.565 118.249 7.316 18935 6598 1 9 . 1 1 29 29 ILE C C 29 175.685 175.685 174.683 1.002 18935 6599 1 9 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.595 0.810 18935 6600 1 9 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.205 -3.174 18935 6601 1 9 . 1 1 29 29 ILE H H 29 8.209 8.209 7.891 0.318 18935 6602 1 9 . 1 1 30 30 LEU N N 30 127.831 127.831 115.844 11.987 18935 6603 1 9 . 1 1 30 30 LEU C C 30 178.794 178.794 178.020 0.774 18935 6604 1 9 . 1 1 30 30 LEU CA C 30 54.443 54.443 52.864 1.579 18935 6605 1 9 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.242 -4.406 18935 6606 1 9 . 1 1 30 30 LEU H H 30 9.027 9.027 8.239 0.788 18935 6607 1 9 . 1 1 31 31 SER N N 31 116.864 116.864 117.016 -0.152 18935 6608 1 9 . 1 1 31 31 SER C C 31 177.464 177.464 176.793 0.671 18935 6609 1 9 . 1 1 31 31 SER CA C 31 61.180 61.180 62.106 -0.926 18935 6610 1 9 . 1 1 31 31 SER CB C 31 62.105 62.105 62.610 -0.505 18935 6611 1 9 . 1 1 31 31 SER H H 31 8.887 8.887 8.913 -0.026 18935 6612 1 9 . 1 1 32 32 LYS N N 32 114.825 114.825 121.113 -6.288 18935 6613 1 9 . 1 1 32 32 LYS C C 32 176.243 176.243 177.330 -1.087 18935 6614 1 9 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.352 -1.060 18935 6615 1 9 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.235 -1.969 18935 6616 1 9 . 1 1 32 32 LYS H H 32 8.290 8.290 8.362 -0.072 18935 6617 1 9 . 1 1 33 33 ASN N N 33 117.564 117.564 114.718 2.846 18935 6618 1 9 . 1 1 33 33 ASN C C 33 172.253 172.253 173.518 -1.265 18935 6619 1 9 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.049 -0.958 18935 6620 1 9 . 1 1 33 33 ASN CB C 33 38.339 38.339 40.186 -1.847 18935 6621 1 9 . 1 1 33 33 ASN H H 33 8.051 8.051 8.063 -0.012 18935 6622 1 9 . 1 1 34 34 ILE N N 34 118.949 118.949 120.417 -1.468 18935 6623 1 9 . 1 1 34 34 ILE C C 34 175.343 175.343 174.918 0.425 18935 6624 1 9 . 1 1 34 34 ILE CA C 34 60.553 60.553 59.939 0.614 18935 6625 1 9 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.695 -2.828 18935 6626 1 9 . 1 1 34 34 ILE H H 34 7.670 7.670 7.720 -0.050 18935 6627 1 9 . 1 1 35 35 VAL N N 35 128.355 128.355 126.847 1.508 18935 6628 1 9 . 1 1 35 35 VAL C C 35 175.543 175.543 174.326 1.217 18935 6629 1 9 . 1 1 35 35 VAL CA C 35 60.014 60.014 59.987 0.027 18935 6630 1 9 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.100 -0.869 18935 6631 1 9 . 1 1 35 35 VAL H H 35 9.698 9.698 9.161 0.537 18935 6632 1 9 . 1 1 36 36 ALA N N 36 129.553 129.553 130.594 -1.041 18935 6633 1 9 . 1 1 36 36 ALA C C 36 177.015 177.015 176.091 0.924 18935 6634 1 9 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.711 0.685 18935 6635 1 9 . 1 1 36 36 ALA CB C 36 17.622 17.622 19.421 -1.799 18935 6636 1 9 . 1 1 36 36 ALA H H 36 8.917 8.917 8.384 0.533 18935 6637 1 9 . 1 1 37 37 VAL N N 37 115.006 115.006 120.697 -5.691 18935 6638 1 9 . 1 1 37 37 VAL C C 37 174.649 174.649 175.022 -0.373 18935 6639 1 9 . 1 1 37 37 VAL CA C 37 59.321 59.321 60.725 -1.404 18935 6640 1 9 . 1 1 37 37 VAL CB C 37 32.386 32.386 35.376 -2.990 18935 6641 1 9 . 1 1 37 37 VAL H H 37 8.214 8.214 7.947 0.267 18935 6642 1 9 . 1 1 38 38 GLY N N 38 109.387 109.387 110.314 -0.927 18935 6643 1 9 . 1 1 38 38 GLY C C 38 174.152 174.152 175.862 -1.710 18935 6644 1 9 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.050 0.447 18935 6645 1 9 . 1 1 38 38 GLY H H 38 8.677 8.677 8.318 0.359 18935 6646 1 9 . 1 1 39 39 SER N N 39 116.776 116.776 117.180 -0.404 18935 6647 1 9 . 1 1 39 39 SER C C 39 175.129 175.129 176.930 -1.801 18935 6648 1 9 . 1 1 39 39 SER CA C 39 60.036 60.036 62.217 -2.181 18935 6649 1 9 . 1 1 39 39 SER CB C 39 61.522 61.522 63.350 -1.828 18935 6650 1 9 . 1 1 39 39 SER H H 39 9.705 9.705 8.775 0.930 18935 6651 1 9 . 1 1 40 40 LEU N N 40 113.696 113.696 116.305 -2.609 18935 6652 1 9 . 1 1 40 40 LEU C C 40 180.558 180.558 177.894 2.664 18935 6653 1 9 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.059 1.315 18935 6654 1 9 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.500 0.377 18935 6655 1 9 . 1 1 40 40 LEU H H 40 7.311 7.311 8.308 -0.997 18935 6656 1 9 . 1 1 41 41 ARG N N 41 121.162 121.162 117.260 3.902 18935 6657 1 9 . 1 1 41 41 ARG C C 41 176.964 176.964 177.083 -0.119 18935 6658 1 9 . 1 1 41 41 ARG CA C 41 58.451 58.451 55.737 2.714 18935 6659 1 9 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.017 -1.812 18935 6660 1 9 . 1 1 41 41 ARG H H 41 6.999 6.999 7.640 -0.641 18935 6661 1 9 . 1 1 42 42 ARG N N 42 111.109 111.109 117.822 -6.713 18935 6662 1 9 . 1 1 42 42 ARG C C 42 172.564 172.564 175.072 -2.508 18935 6663 1 9 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.493 0.887 18935 6664 1 9 . 1 1 42 42 ARG CB C 42 28.349 28.349 31.032 -2.683 18935 6665 1 9 . 1 1 42 42 ARG H H 42 7.041 7.041 7.738 -0.697 18935 6666 1 9 . 1 1 43 43 GLU N N 43 111.924 111.924 114.367 -2.443 18935 6667 1 9 . 1 1 43 43 GLU C C 43 176.202 176.202 175.082 1.120 18935 6668 1 9 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.379 -0.925 18935 6669 1 9 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.573 -2.272 18935 6670 1 9 . 1 1 43 43 GLU H H 43 7.757 7.757 7.859 -0.102 18935 6671 1 9 . 1 1 44 44 GLU N N 44 117.861 117.861 119.450 -1.589 18935 6672 1 9 . 1 1 44 44 GLU C C 44 175.197 175.197 177.154 -1.957 18935 6673 1 9 . 1 1 44 44 GLU CA C 44 56.128 56.128 57.104 -0.976 18935 6674 1 9 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.301 -1.742 18935 6675 1 9 . 1 1 44 44 GLU H H 44 7.461 7.461 7.910 -0.449 18935 6676 1 9 . 1 1 45 45 LYS N N 45 115.051 115.051 122.376 -7.325 18935 6677 1 9 . 1 1 45 45 LYS C C 45 177.733 177.733 176.192 1.541 18935 6678 1 9 . 1 1 45 45 LYS CA C 45 59.055 59.055 58.616 0.439 18935 6679 1 9 . 1 1 45 45 LYS CB C 45 32.027 32.027 32.847 -0.820 18935 6680 1 9 . 1 1 45 45 LYS H H 45 8.123 8.123 8.707 -0.584 18935 6681 1 9 . 1 1 46 46 MET N N 46 114.009 114.009 117.017 -3.008 18935 6682 1 9 . 1 1 46 46 MET C C 46 174.067 174.067 174.390 -0.323 18935 6683 1 9 . 1 1 46 46 MET CA C 46 52.477 52.477 54.474 -1.997 18935 6684 1 9 . 1 1 46 46 MET CB C 46 33.974 33.974 34.435 -0.461 18935 6685 1 9 . 1 1 46 46 MET H H 46 7.767 7.767 7.450 0.317 18935 6686 1 9 . 1 1 47 47 LEU N N 47 120.263 120.263 121.065 -0.802 18935 6687 1 9 . 1 1 47 47 LEU C C 47 177.669 177.669 176.448 1.221 18935 6688 1 9 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.191 -0.990 18935 6689 1 9 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.896 -0.988 18935 6690 1 9 . 1 1 47 47 LEU H H 47 9.481 9.481 8.836 0.645 18935 6691 1 9 . 1 1 48 48 ASN N N 48 118.632 118.632 117.240 1.392 18935 6692 1 9 . 1 1 48 48 ASN C C 48 174.715 174.715 174.907 -0.192 18935 6693 1 9 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.786 1.715 18935 6694 1 9 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.939 -2.111 18935 6695 1 9 . 1 1 48 48 ASN H H 48 9.388 9.388 9.029 0.359 18935 6696 1 9 . 1 1 49 49 ASP N N 49 115.867 115.867 118.954 -3.087 18935 6697 1 9 . 1 1 49 49 ASP C C 49 174.111 174.111 174.609 -0.498 18935 6698 1 9 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.956 -1.755 18935 6699 1 9 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.708 -3.631 18935 6700 1 9 . 1 1 49 49 ASP H H 49 7.670 7.670 7.787 -0.117 18935 6701 1 9 . 1 1 50 50 VAL N N 50 119.185 119.185 118.653 0.532 18935 6702 1 9 . 1 1 50 50 VAL C C 50 172.333 172.333 174.598 -2.265 18935 6703 1 9 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.331 0.584 18935 6704 1 9 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.370 -1.405 18935 6705 1 9 . 1 1 50 50 VAL H H 50 8.339 8.339 7.981 0.358 18935 6706 1 9 . 1 1 51 51 ASP N N 51 124.704 124.704 126.106 -1.402 18935 6707 1 9 . 1 1 51 51 ASP C C 51 173.725 173.725 174.982 -1.257 18935 6708 1 9 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.046 -0.018 18935 6709 1 9 . 1 1 51 51 ASP CB C 51 43.829 43.829 44.169 -0.340 18935 6710 1 9 . 1 1 51 51 ASP H H 51 8.984 8.984 8.251 0.733 18935 6711 1 9 . 1 1 52 52 LEU N N 52 120.943 120.943 121.681 -0.738 18935 6712 1 9 . 1 1 52 52 LEU C C 52 173.045 173.045 173.890 -0.845 18935 6713 1 9 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.708 -1.837 18935 6714 1 9 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.477 -2.224 18935 6715 1 9 . 1 1 52 52 LEU H H 52 9.081 9.081 7.912 1.169 18935 6716 1 9 . 1 1 53 53 LEU N N 53 123.027 123.027 125.802 -2.775 18935 6717 1 9 . 1 1 53 53 LEU C C 53 173.750 173.750 175.269 -1.519 18935 6718 1 9 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.569 -1.236 18935 6719 1 9 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.547 -0.539 18935 6720 1 9 . 1 1 53 53 LEU H H 53 9.146 9.146 9.077 0.069 18935 6721 1 9 . 1 1 54 54 ILE N N 54 126.562 126.562 124.737 1.825 18935 6722 1 9 . 1 1 54 54 ILE C C 54 175.132 175.132 175.221 -0.089 18935 6723 1 9 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.864 -1.266 18935 6724 1 9 . 1 1 54 54 ILE CB C 54 38.561 38.561 40.516 -1.955 18935 6725 1 9 . 1 1 54 54 ILE H H 54 9.440 9.440 9.219 0.221 18935 6726 1 9 . 1 1 55 55 ILE N N 55 126.879 126.879 128.931 -2.052 18935 6727 1 9 . 1 1 55 55 ILE C C 55 175.655 175.655 175.229 0.426 18935 6728 1 9 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.029 -2.468 18935 6729 1 9 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.976 -5.670 18935 6730 1 9 . 1 1 55 55 ILE H H 55 9.381 9.381 8.089 1.292 18935 6731 1 9 . 1 1 56 56 VAL N N 56 128.936 128.936 125.518 3.418 18935 6732 1 9 . 1 1 56 56 VAL C C 56 176.389 176.389 174.489 1.900 18935 6733 1 9 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.498 0.132 18935 6734 1 9 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.603 -0.819 18935 6735 1 9 . 1 1 56 56 VAL H H 56 9.227 9.227 8.925 0.302 18935 6736 1 9 . 1 1 58 58 GLU N N 58 112.423 112.423 117.809 -5.386 18935 6737 1 9 . 1 1 58 58 GLU C C 58 175.946 175.946 176.509 -0.563 18935 6738 1 9 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.372 -1.072 18935 6739 1 9 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.521 0.576 18935 6740 1 9 . 1 1 58 58 GLU H H 58 6.685 6.685 8.145 -1.460 18935 6741 1 9 . 1 1 59 59 LYS N N 59 125.293 125.293 120.965 4.328 18935 6742 1 9 . 1 1 59 59 LYS C C 59 179.248 179.248 175.821 3.427 18935 6743 1 9 . 1 1 59 59 LYS CA C 59 59.774 59.774 56.697 3.077 18935 6744 1 9 . 1 1 59 59 LYS CB C 59 31.077 31.077 31.913 -0.836 18935 6745 1 9 . 1 1 59 59 LYS H H 59 9.108 9.108 8.554 0.554 18935 6746 1 9 . 1 1 60 60 LYS N N 60 117.408 117.408 116.452 0.956 18935 6747 1 9 . 1 1 60 60 LYS C C 60 177.198 177.198 176.998 0.200 18935 6748 1 9 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.114 2.099 18935 6749 1 9 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.968 -2.385 18935 6750 1 9 . 1 1 60 60 LYS H H 60 9.102 9.102 7.292 1.810 18935 6751 1 9 . 1 1 61 61 LEU N N 61 114.779 114.779 121.686 -6.907 18935 6752 1 9 . 1 1 61 61 LEU C C 61 178.790 178.790 178.667 0.123 18935 6753 1 9 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.501 -2.477 18935 6754 1 9 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.529 -0.665 18935 6755 1 9 . 1 1 61 61 LEU H H 61 7.455 7.455 7.577 -0.122 18935 6756 1 9 . 1 1 62 62 LEU N N 62 119.629 119.629 118.238 1.391 18935 6757 1 9 . 1 1 62 62 LEU C C 62 177.762 177.762 177.899 -0.137 18935 6758 1 9 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.883 0.315 18935 6759 1 9 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.848 -1.117 18935 6760 1 9 . 1 1 62 62 LEU H H 62 7.714 7.714 7.297 0.417 18935 6761 1 9 . 1 1 63 63 LYS N N 63 112.921 112.921 114.807 -1.886 18935 6762 1 9 . 1 1 63 63 LYS C C 63 175.386 175.386 177.645 -2.259 18935 6763 1 9 . 1 1 63 63 LYS CA C 63 57.356 57.356 56.725 0.631 18935 6764 1 9 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.793 -1.830 18935 6765 1 9 . 1 1 63 63 LYS H H 63 7.751 7.751 8.025 -0.274 18935 6766 1 9 . 1 1 64 64 HIS N N 64 112.468 112.468 117.423 -4.955 18935 6767 1 9 . 1 1 64 64 HIS C C 64 176.081 176.081 176.789 -0.708 18935 6768 1 9 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.445 -1.676 18935 6769 1 9 . 1 1 64 64 HIS CB C 64 32.370 32.370 30.767 1.603 18935 6770 1 9 . 1 1 64 64 HIS H H 64 7.697 7.697 7.666 0.031 18935 6771 1 9 . 1 1 65 65 VAL N N 65 117.499 117.499 116.331 1.168 18935 6772 1 9 . 1 1 65 65 VAL C C 65 174.301 174.301 176.411 -2.110 18935 6773 1 9 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.635 2.695 18935 6774 1 9 . 1 1 65 65 VAL CB C 65 29.360 29.360 30.954 -1.594 18935 6775 1 9 . 1 1 65 65 VAL H H 65 6.917 6.917 7.146 -0.229 18935 6776 1 9 . 1 1 66 66 LEU N N 66 113.873 113.873 119.187 -5.314 18935 6777 1 9 . 1 1 66 66 LEU CA C 66 57.850 57.850 58.139 -0.289 18935 6778 1 9 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.521 -3.463 18935 6779 1 9 . 1 1 66 66 LEU H H 66 9.102 9.102 8.086 1.016 18935 6780 1 9 . 1 1 68 68 ASN N N 68 110.792 110.792 117.578 -6.786 18935 6781 1 9 . 1 1 68 68 ASN C C 68 174.877 174.877 173.260 1.617 18935 6782 1 9 . 1 1 68 68 ASN CA C 68 50.815 50.815 53.092 -2.277 18935 6783 1 9 . 1 1 68 68 ASN CB C 68 40.311 40.311 40.577 -0.266 18935 6784 1 9 . 1 1 68 68 ASN H H 68 7.234 7.234 8.400 -1.166 18935 6785 1 9 . 1 1 69 69 ILE N N 69 122.348 122.348 124.979 -2.631 18935 6786 1 9 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.337 -0.425 18935 6787 1 9 . 1 1 69 69 ILE CB C 69 38.038 38.038 39.808 -1.770 18935 6788 1 9 . 1 1 69 69 ILE H H 69 7.428 7.428 8.535 -1.107 18935 6789 1 9 . 1 1 70 70 ARG N N 70 125.701 125.701 125.556 0.145 18935 6790 1 9 . 1 1 70 70 ARG C C 70 174.596 174.596 173.585 1.011 18935 6791 1 9 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.565 -1.404 18935 6792 1 9 . 1 1 70 70 ARG CB C 70 32.453 32.453 30.277 2.176 18935 6793 1 9 . 1 1 70 70 ARG H H 70 9.083 9.083 8.458 0.625 18935 6794 1 9 . 1 1 71 71 ILE N N 71 118.496 118.496 118.746 -0.250 18935 6795 1 9 . 1 1 71 71 ILE C C 71 175.625 175.625 176.611 -0.986 18935 6796 1 9 . 1 1 71 71 ILE CA C 71 59.776 59.776 60.552 -0.776 18935 6797 1 9 . 1 1 71 71 ILE CB C 71 37.967 37.967 39.366 -1.399 18935 6798 1 9 . 1 1 71 71 ILE H H 71 7.864 7.864 8.024 -0.160 18935 6799 1 9 . 1 1 72 72 LYS N N 72 127.423 127.423 123.687 3.736 18935 6800 1 9 . 1 1 72 72 LYS C C 72 177.659 177.659 176.764 0.895 18935 6801 1 9 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.821 1.607 18935 6802 1 9 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.289 -0.915 18935 6803 1 9 . 1 1 72 72 LYS H H 72 8.720 8.720 8.704 0.016 18935 6804 1 9 . 1 1 73 73 GLY N N 73 112.604 112.604 112.982 -0.378 18935 6805 1 9 . 1 1 73 73 GLY C C 73 173.729 173.729 174.143 -0.414 18935 6806 1 9 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.078 0.753 18935 6807 1 9 . 1 1 73 73 GLY H H 73 8.930 8.930 8.686 0.244 18935 6808 1 9 . 1 1 74 74 LEU N N 74 119.538 119.538 118.635 0.903 18935 6809 1 9 . 1 1 74 74 LEU C C 74 175.802 175.802 175.579 0.223 18935 6810 1 9 . 1 1 74 74 LEU CA C 74 53.661 53.661 52.774 0.887 18935 6811 1 9 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.867 -0.814 18935 6812 1 9 . 1 1 74 74 LEU H H 74 7.547 7.547 7.463 0.084 18935 6813 1 9 . 1 1 75 75 SER N N 75 118.994 118.994 117.530 1.464 18935 6814 1 9 . 1 1 75 75 SER C C 75 173.111 173.111 172.819 0.292 18935 6815 1 9 . 1 1 75 75 SER CA C 75 57.696 57.696 57.899 -0.203 18935 6816 1 9 . 1 1 75 75 SER CB C 75 63.073 63.073 62.725 0.348 18935 6817 1 9 . 1 1 75 75 SER H H 75 9.076 9.076 8.529 0.547 18935 6818 1 9 . 1 1 76 76 PHE N N 76 117.802 117.802 120.989 -3.187 18935 6819 1 9 . 1 1 76 76 PHE C C 76 173.564 173.564 174.278 -0.714 18935 6820 1 9 . 1 1 76 76 PHE CA C 76 55.409 55.409 55.247 0.162 18935 6821 1 9 . 1 1 76 76 PHE CB C 76 41.843 41.843 41.433 0.410 18935 6822 1 9 . 1 1 76 76 PHE H H 76 8.119 8.119 7.626 0.493 18935 6823 1 9 . 1 1 77 77 SER N N 77 113.918 113.918 116.413 -2.495 18935 6824 1 9 . 1 1 77 77 SER C C 77 173.194 173.194 173.149 0.045 18935 6825 1 9 . 1 1 77 77 SER CA C 77 55.999 55.999 56.681 -0.682 18935 6826 1 9 . 1 1 77 77 SER CB C 77 65.218 65.218 65.619 -0.401 18935 6827 1 9 . 1 1 77 77 SER H H 77 8.989 8.989 8.408 0.581 18935 6828 1 9 . 1 1 78 78 VAL N N 78 123.662 123.662 127.116 -3.454 18935 6829 1 9 . 1 1 78 78 VAL C C 78 176.057 176.057 175.773 0.284 18935 6830 1 9 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.583 -0.492 18935 6831 1 9 . 1 1 78 78 VAL CB C 78 32.294 32.294 32.080 0.214 18935 6832 1 9 . 1 1 78 78 VAL H H 78 8.995 8.995 8.774 0.221 18935 6833 1 9 . 1 1 79 79 LYS N N 79 129.417 129.417 128.960 0.457 18935 6834 1 9 . 1 1 79 79 LYS C C 79 176.436 176.436 174.622 1.814 18935 6835 1 9 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.520 3.132 18935 6836 1 9 . 1 1 79 79 LYS CB C 79 32.473 32.473 35.757 -3.284 18935 6837 1 9 . 1 1 79 79 LYS H H 79 9.425 9.425 9.000 0.425 18935 6838 1 9 . 1 1 80 80 VAL N N 80 108.616 108.616 120.162 -11.546 18935 6839 1 9 . 1 1 80 80 VAL CA C 80 59.097 59.097 60.887 -1.790 18935 6840 1 9 . 1 1 80 80 VAL CB C 80 34.082 34.082 34.238 -0.156 18935 6841 1 9 . 1 1 80 80 VAL H H 80 7.380 7.380 8.339 -0.959 18935 6842 1 9 . 1 1 81 81 CYS N N 81 123.254 123.254 127.243 -3.989 18935 6843 1 9 . 1 1 81 81 CYS C C 81 172.053 172.053 173.908 -1.855 18935 6844 1 9 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.786 1.953 18935 6845 1 9 . 1 1 81 81 CYS CB C 81 27.332 27.332 30.035 -2.703 18935 6846 1 9 . 1 1 81 81 CYS H H 81 9.759 9.759 8.410 1.349 18935 6847 1 9 . 1 1 82 82 GLY N N 82 118.450 118.450 115.251 3.199 18935 6848 1 9 . 1 1 82 82 GLY C C 82 171.814 171.814 174.524 -2.710 18935 6849 1 9 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.652 -2.299 18935 6850 1 9 . 1 1 82 82 GLY H H 82 8.537 8.537 8.576 -0.039 18935 6851 1 9 . 1 1 83 83 GLU N N 83 113.964 113.964 120.649 -6.685 18935 6852 1 9 . 1 1 83 83 GLU C C 83 179.320 179.320 177.456 1.864 18935 6853 1 9 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.539 0.136 18935 6854 1 9 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.297 -0.390 18935 6855 1 9 . 1 1 83 83 GLU H H 83 8.473 8.473 8.691 -0.218 18935 6856 1 9 . 1 1 84 84 ARG N N 84 117.544 117.544 117.624 -0.080 18935 6857 1 9 . 1 1 84 84 ARG C C 84 177.252 177.252 175.744 1.508 18935 6858 1 9 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.511 -1.007 18935 6859 1 9 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.178 0.367 18935 6860 1 9 . 1 1 84 84 ARG H H 84 9.760 9.760 8.322 1.438 18935 6861 1 9 . 1 1 85 85 LYS N N 85 124.160 124.160 119.783 4.377 18935 6862 1 9 . 1 1 85 85 LYS C C 85 173.379 173.379 175.887 -2.508 18935 6863 1 9 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.690 -1.458 18935 6864 1 9 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.535 -0.323 18935 6865 1 9 . 1 1 85 85 LYS H H 85 8.494 8.494 7.718 0.776 18935 6866 1 9 . 1 1 86 86 CYS N N 86 126.472 126.472 118.602 7.870 18935 6867 1 9 . 1 1 86 86 CYS C C 86 171.935 171.935 172.854 -0.919 18935 6868 1 9 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.770 -1.891 18935 6869 1 9 . 1 1 86 86 CYS CB C 86 30.304 30.304 31.116 -0.812 18935 6870 1 9 . 1 1 86 86 CYS H H 86 9.221 9.221 8.376 0.845 18935 6871 1 9 . 1 1 87 87 VAL N N 87 126.426 126.426 122.408 4.018 18935 6872 1 9 . 1 1 87 87 VAL C C 87 173.760 173.760 174.238 -0.478 18935 6873 1 9 . 1 1 87 87 VAL CA C 87 61.333 61.333 60.967 0.366 18935 6874 1 9 . 1 1 87 87 VAL CB C 87 33.338 33.338 34.369 -1.031 18935 6875 1 9 . 1 1 87 87 VAL H H 87 8.623 8.623 8.466 0.157 18935 6876 1 9 . 1 1 88 88 LEU N N 88 125.701 125.701 127.217 -1.516 18935 6877 1 9 . 1 1 88 88 LEU C C 88 175.424 175.424 175.005 0.419 18935 6878 1 9 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.610 -1.525 18935 6879 1 9 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.825 -2.281 18935 6880 1 9 . 1 1 88 88 LEU H H 88 9.592 9.592 9.307 0.285 18935 6881 1 9 . 1 1 89 89 PHE N N 89 118.314 118.314 124.740 -6.426 18935 6882 1 9 . 1 1 89 89 PHE C C 89 177.068 177.068 173.791 3.277 18935 6883 1 9 . 1 1 89 89 PHE CA C 89 55.875 55.875 55.342 0.533 18935 6884 1 9 . 1 1 89 89 PHE CB C 89 38.837 38.837 40.756 -1.919 18935 6885 1 9 . 1 1 89 89 PHE H H 89 8.979 8.979 8.449 0.530 18935 6886 1 9 . 1 1 90 90 ILE N N 90 119.039 119.039 121.979 -2.940 18935 6887 1 9 . 1 1 90 90 ILE C C 90 173.692 173.692 174.023 -0.331 18935 6888 1 9 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.177 -0.505 18935 6889 1 9 . 1 1 90 90 ILE CB C 90 40.183 40.183 40.704 -0.521 18935 6890 1 9 . 1 1 90 90 ILE H H 90 9.447 9.447 8.441 1.006 18935 6891 1 9 . 1 1 91 91 GLU N N 91 122.801 122.801 125.379 -2.578 18935 6892 1 9 . 1 1 91 91 GLU C C 91 175.565 175.565 174.625 0.940 18935 6893 1 9 . 1 1 91 91 GLU CA C 91 54.465 54.465 54.834 -0.369 18935 6894 1 9 . 1 1 91 91 GLU CB C 91 29.662 29.662 32.883 -3.220 18935 6895 1 9 . 1 1 91 91 GLU H H 91 8.360 8.360 8.230 0.130 18935 6896 1 9 . 1 1 92 92 TRP N N 92 126.018 126.018 122.717 3.301 18935 6897 1 9 . 1 1 92 92 TRP C C 92 175.070 175.070 175.134 -0.064 18935 6898 1 9 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.499 -0.309 18935 6899 1 9 . 1 1 92 92 TRP CB C 92 30.582 30.582 30.929 -0.347 18935 6900 1 9 . 1 1 92 92 TRP H H 92 9.425 9.425 8.098 1.327 18935 6901 1 9 . 1 1 93 93 GLU N N 93 126.381 126.381 120.494 5.887 18935 6902 1 9 . 1 1 93 93 GLU C C 93 175.637 175.637 175.688 -0.051 18935 6903 1 9 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.939 -1.170 18935 6904 1 9 . 1 1 93 93 GLU CB C 93 25.944 25.944 27.792 -1.848 18935 6905 1 9 . 1 1 93 93 GLU H H 93 8.914 8.914 9.142 -0.228 18935 6906 1 9 . 1 1 94 94 LYS N N 94 107.891 107.891 112.522 -4.631 18935 6907 1 9 . 1 1 94 94 LYS C C 94 175.359 175.359 175.567 -0.208 18935 6908 1 9 . 1 1 94 94 LYS CA C 94 57.429 57.429 56.973 0.456 18935 6909 1 9 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.780 -2.138 18935 6910 1 9 . 1 1 94 94 LYS H H 94 8.634 8.634 8.576 0.058 18935 6911 1 9 . 1 1 95 95 LYS N N 95 120.490 120.490 118.226 2.264 18935 6912 1 9 . 1 1 95 95 LYS C C 95 174.369 174.369 174.142 0.227 18935 6913 1 9 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.992 -0.638 18935 6914 1 9 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.889 -1.426 18935 6915 1 9 . 1 1 95 95 LYS H H 95 7.924 7.924 7.604 0.320 18935 6916 1 9 . 1 1 96 96 THR N N 96 115.278 115.278 112.393 2.885 18935 6917 1 9 . 1 1 96 96 THR C C 96 174.317 174.317 173.199 1.118 18935 6918 1 9 . 1 1 96 96 THR CA C 96 61.203 61.203 60.776 0.427 18935 6919 1 9 . 1 1 96 96 THR CB C 96 69.348 69.348 70.422 -1.074 18935 6920 1 9 . 1 1 96 96 THR H H 96 7.967 7.967 7.763 0.204 18935 6921 1 9 . 1 1 97 97 TYR N N 97 123.254 123.254 124.605 -1.351 18935 6922 1 9 . 1 1 97 97 TYR C C 97 173.320 173.320 174.794 -1.474 18935 6923 1 9 . 1 1 97 97 TYR CA C 97 55.884 55.884 55.826 0.058 18935 6924 1 9 . 1 1 97 97 TYR CB C 97 41.136 41.136 42.131 -0.995 18935 6925 1 9 . 1 1 97 97 TYR H H 97 9.232 9.232 9.110 0.122 18935 6926 1 9 . 1 1 98 98 GLN N N 98 122.574 122.574 119.128 3.446 18935 6927 1 9 . 1 1 98 98 GLN C C 98 172.781 172.781 174.292 -1.511 18935 6928 1 9 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.050 0.122 18935 6929 1 9 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.023 -2.623 18935 6930 1 9 . 1 1 98 98 GLN H H 98 9.000 9.000 8.917 0.083 18935 6931 1 9 . 1 1 99 99 LEU N N 99 130.218 130.218 126.465 3.753 18935 6932 1 9 . 1 1 99 99 LEU C C 99 172.806 172.806 174.718 -1.912 18935 6933 1 9 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.203 -1.153 18935 6934 1 9 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.244 -0.492 18935 6935 1 9 . 1 1 99 99 LEU H H 99 9.246 9.246 9.299 -0.053 18935 6936 1 9 . 1 1 100 100 ASP N N 100 124.931 124.931 127.222 -2.291 18935 6937 1 9 . 1 1 100 100 ASP C C 100 172.626 172.626 174.684 -2.058 18935 6938 1 9 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.796 -3.366 18935 6939 1 9 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.162 -5.834 18935 6940 1 9 . 1 1 100 100 ASP H H 100 9.253 9.253 8.526 0.727 18935 6941 1 9 . 1 1 101 101 LEU N N 101 119.402 119.402 120.176 -0.774 18935 6942 1 9 . 1 1 101 101 LEU C C 101 173.869 173.869 174.975 -1.106 18935 6943 1 9 . 1 1 101 101 LEU CA C 101 51.655 51.655 53.197 -1.542 18935 6944 1 9 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.660 0.506 18935 6945 1 9 . 1 1 101 101 LEU H H 101 8.726 8.726 8.081 0.645 18935 6946 1 9 . 1 1 102 102 PHE N N 102 117.952 117.952 119.436 -1.484 18935 6947 1 9 . 1 1 102 102 PHE C C 102 175.853 175.853 175.386 0.467 18935 6948 1 9 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.246 -1.964 18935 6949 1 9 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.248 1.576 18935 6950 1 9 . 1 1 102 102 PHE H H 102 8.236 8.236 8.960 -0.724 18935 6951 1 9 . 1 1 103 103 THR N N 103 106.853 106.853 118.925 -12.072 18935 6952 1 9 . 1 1 103 103 THR C C 103 175.154 175.154 174.217 0.937 18935 6953 1 9 . 1 1 103 103 THR CA C 103 57.685 57.685 60.780 -3.095 18935 6954 1 9 . 1 1 103 103 THR CB C 103 71.037 71.037 69.539 1.498 18935 6955 1 9 . 1 1 103 103 THR H H 103 7.917 7.917 8.530 -0.613 18935 6956 1 9 . 1 1 104 104 ALA N N 104 122.348 122.348 128.286 -5.938 18935 6957 1 9 . 1 1 104 104 ALA C C 104 175.947 175.947 175.108 0.839 18935 6958 1 9 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.215 -0.408 18935 6959 1 9 . 1 1 104 104 ALA CB C 104 22.428 22.428 21.987 0.441 18935 6960 1 9 . 1 1 104 104 ALA H H 104 8.930 8.930 8.968 -0.038 18935 6961 1 9 . 1 1 105 105 LEU N N 105 119.855 119.855 118.749 1.106 18935 6962 1 9 . 1 1 105 105 LEU C C 105 179.628 179.628 178.957 0.671 18935 6963 1 9 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.098 -0.975 18935 6964 1 9 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.019 -1.685 18935 6965 1 9 . 1 1 105 105 LEU H H 105 8.316 8.316 8.615 -0.299 18935 6966 1 9 . 1 1 106 106 ALA N N 106 123.662 123.662 123.625 0.037 18935 6967 1 9 . 1 1 106 106 ALA C C 106 181.056 181.056 178.919 2.137 18935 6968 1 9 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.086 1.264 18935 6969 1 9 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.571 -1.256 18935 6970 1 9 . 1 1 106 106 ALA H H 106 8.306 8.306 8.438 -0.132 18935 6971 1 9 . 1 1 107 107 GLU N N 107 114.825 114.825 114.779 0.046 18935 6972 1 9 . 1 1 107 107 GLU C C 107 177.854 177.854 176.853 1.001 18935 6973 1 9 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.816 0.570 18935 6974 1 9 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.507 -0.663 18935 6975 1 9 . 1 1 107 107 GLU H H 107 9.754 9.754 8.728 1.026 18935 6976 1 9 . 1 1 108 108 GLU N N 108 115.097 115.097 118.600 -3.503 18935 6977 1 9 . 1 1 108 108 GLU C C 108 178.001 178.001 177.290 0.711 18935 6978 1 9 . 1 1 108 108 GLU CA C 108 54.926 54.926 55.285 -0.360 18935 6979 1 9 . 1 1 108 108 GLU CB C 108 30.001 30.001 28.596 1.405 18935 6980 1 9 . 1 1 108 108 GLU H H 108 7.859 7.859 7.640 0.219 18935 6981 1 9 . 1 1 109 109 LYS N N 109 118.360 118.360 120.861 -2.501 18935 6982 1 9 . 1 1 109 109 LYS C C 109 172.691 172.691 176.717 -4.026 18935 6983 1 9 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.414 0.488 18935 6984 1 9 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.092 0.449 18935 6985 1 9 . 1 1 109 109 LYS H H 109 7.660 7.660 7.280 0.380 18935 6986 1 9 . 1 1 111 111 TYR N N 111 114.054 114.054 118.577 -4.523 18935 6987 1 9 . 1 1 111 111 TYR C C 111 179.764 179.764 177.932 1.832 18935 6988 1 9 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.300 -1.302 18935 6989 1 9 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.131 -1.175 18935 6990 1 9 . 1 1 111 111 TYR H H 111 6.583 6.583 8.259 -1.676 18935 6991 1 9 . 1 1 112 112 ALA N N 112 124.749 124.749 122.553 2.196 18935 6992 1 9 . 1 1 112 112 ALA C C 112 179.430 179.430 179.532 -0.102 18935 6993 1 9 . 1 1 112 112 ALA CA C 112 54.969 54.969 55.224 -0.254 18935 6994 1 9 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.550 0.262 18935 6995 1 9 . 1 1 112 112 ALA H H 112 8.753 8.753 8.938 -0.185 18935 6996 1 9 . 1 1 113 113 ILE N N 113 119.130 119.130 119.718 -0.588 18935 6997 1 9 . 1 1 113 113 ILE C C 113 178.646 178.646 178.071 0.575 18935 6998 1 9 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.641 2.760 18935 6999 1 9 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.420 0.817 18935 7000 1 9 . 1 1 113 113 ILE H H 113 8.946 8.946 8.273 0.673 18935 7001 1 9 . 1 1 114 114 PHE N N 114 121.758 121.758 121.331 0.427 18935 7002 1 9 . 1 1 114 114 PHE C C 114 177.954 177.954 177.215 0.739 18935 7003 1 9 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.507 -1.730 18935 7004 1 9 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.502 0.562 18935 7005 1 9 . 1 1 114 114 PHE H H 114 7.940 7.940 8.315 -0.375 18935 7006 1 9 . 1 1 115 115 HIS N N 115 116.547 116.547 118.364 -1.817 18935 7007 1 9 . 1 1 115 115 HIS C C 115 176.161 176.161 177.851 -1.690 18935 7008 1 9 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.724 -0.605 18935 7009 1 9 . 1 1 115 115 HIS CB C 115 31.067 31.067 30.092 0.975 18935 7010 1 9 . 1 1 115 115 HIS H H 115 7.767 7.767 8.133 -0.366 18935 7011 1 9 . 1 1 116 116 PHE N N 116 109.387 109.387 120.078 -10.691 18935 7012 1 9 . 1 1 116 116 PHE C C 116 177.282 177.282 176.384 0.898 18935 7013 1 9 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.484 0.950 18935 7014 1 9 . 1 1 116 116 PHE CB C 116 37.255 37.255 38.904 -1.649 18935 7015 1 9 . 1 1 116 116 PHE H H 116 8.989 8.989 8.474 0.515 18935 7016 1 9 . 1 1 117 117 THR N N 117 116.864 116.864 113.684 3.180 18935 7017 1 9 . 1 1 117 117 THR C C 117 172.889 172.889 173.594 -0.705 18935 7018 1 9 . 1 1 117 117 THR CA C 117 66.997 66.997 62.374 4.623 18935 7019 1 9 . 1 1 117 117 THR CB C 117 67.948 67.948 68.256 -0.308 18935 7020 1 9 . 1 1 117 117 THR H H 117 7.988 7.988 7.911 0.077 18935 7021 1 9 . 1 1 118 118 GLY N N 118 103.320 103.320 109.551 -6.231 18935 7022 1 9 . 1 1 118 118 GLY C C 118 176.912 176.912 171.257 5.655 18935 7023 1 9 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.094 2.088 18935 7024 1 9 . 1 1 118 118 GLY H H 118 6.550 6.550 7.019 -0.469 18935 7025 1 9 . 1 1 120 120 VAL N N 120 120.671 120.671 124.315 -3.644 18935 7026 1 9 . 1 1 120 120 VAL C C 120 176.283 176.283 176.945 -0.662 18935 7027 1 9 . 1 1 120 120 VAL CA C 120 66.940 66.940 64.507 2.433 18935 7028 1 9 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.591 -1.740 18935 7029 1 9 . 1 1 120 120 VAL H H 120 8.408 8.408 8.444 -0.036 18935 7030 1 9 . 1 1 121 121 SER N N 121 111.789 111.789 115.308 -3.519 18935 7031 1 9 . 1 1 121 121 SER C C 121 175.658 175.658 176.282 -0.624 18935 7032 1 9 . 1 1 121 121 SER CA C 121 60.814 60.814 61.210 -0.396 18935 7033 1 9 . 1 1 121 121 SER CB C 121 60.253 60.253 62.700 -2.447 18935 7034 1 9 . 1 1 121 121 SER H H 121 8.290 8.290 8.161 0.129 18935 7035 1 9 . 1 1 122 122 TYR N N 122 123.254 123.254 123.809 -0.555 18935 7036 1 9 . 1 1 122 122 TYR C C 122 174.611 174.611 177.219 -2.608 18935 7037 1 9 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.569 -2.023 18935 7038 1 9 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.621 -0.482 18935 7039 1 9 . 1 1 122 122 TYR H H 122 6.303 6.303 7.560 -1.257 18935 7040 1 9 . 1 1 123 123 LEU N N 123 114.825 114.825 120.693 -5.868 18935 7041 1 9 . 1 1 123 123 LEU C C 123 178.891 178.891 179.049 -0.158 18935 7042 1 9 . 1 1 123 123 LEU CA C 123 56.779 56.779 58.212 -1.433 18935 7043 1 9 . 1 1 123 123 LEU CB C 123 40.638 40.638 41.040 -0.402 18935 7044 1 9 . 1 1 123 123 LEU H H 123 6.965 6.965 8.069 -1.104 18935 7045 1 9 . 1 1 124 124 ILE N N 124 114.915 114.915 118.362 -3.447 18935 7046 1 9 . 1 1 124 124 ILE C C 124 177.187 177.187 177.859 -0.672 18935 7047 1 9 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.118 -0.687 18935 7048 1 9 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.630 -1.075 18935 7049 1 9 . 1 1 124 124 ILE H H 124 7.531 7.531 7.304 0.227 18935 7050 1 9 . 1 1 125 125 ARG N N 125 115.278 115.278 119.655 -4.377 18935 7051 1 9 . 1 1 125 125 ARG C C 125 178.473 178.473 178.554 -0.081 18935 7052 1 9 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.813 -0.354 18935 7053 1 9 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.285 -2.206 18935 7054 1 9 . 1 1 125 125 ARG H H 125 6.809 6.809 7.425 -0.616 18935 7055 1 9 . 1 1 126 126 ILE N N 126 124.160 124.160 117.945 6.215 18935 7056 1 9 . 1 1 126 126 ILE C C 126 178.172 178.172 177.732 0.440 18935 7057 1 9 . 1 1 126 126 ILE CA C 126 60.927 60.927 64.146 -3.219 18935 7058 1 9 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.660 -3.194 18935 7059 1 9 . 1 1 126 126 ILE H H 126 7.408 7.408 7.843 -0.434 18935 7060 1 9 . 1 1 127 127 ARG N N 127 117.136 117.136 120.558 -3.422 18935 7061 1 9 . 1 1 127 127 ARG C C 127 179.227 179.227 177.985 1.242 18935 7062 1 9 . 1 1 127 127 ARG CA C 127 60.216 60.216 58.031 2.185 18935 7063 1 9 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.380 -1.591 18935 7064 1 9 . 1 1 127 127 ARG H H 127 8.230 8.230 8.238 -0.008 18935 7065 1 9 . 1 1 128 128 ALA N N 128 121.305 121.305 120.941 0.364 18935 7066 1 9 . 1 1 128 128 ALA C C 128 179.933 179.933 178.670 1.263 18935 7067 1 9 . 1 1 128 128 ALA CA C 128 54.706 54.706 53.945 0.761 18935 7068 1 9 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.319 0.019 18935 7069 1 9 . 1 1 128 128 ALA H H 128 8.666 8.666 8.181 0.485 18935 7070 1 9 . 1 1 129 129 ALA N N 129 120.943 120.943 121.012 -0.069 18935 7071 1 9 . 1 1 129 129 ALA C C 129 181.336 181.336 179.178 2.158 18935 7072 1 9 . 1 1 129 129 ALA CA C 129 54.708 54.708 53.720 0.988 18935 7073 1 9 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.980 -2.120 18935 7074 1 9 . 1 1 129 129 ALA H H 129 7.837 7.837 7.612 0.225 18935 7075 1 9 . 1 1 130 130 LEU N N 130 117.726 117.726 120.357 -2.631 18935 7076 1 9 . 1 1 130 130 LEU C C 130 179.432 179.432 178.853 0.579 18935 7077 1 9 . 1 1 130 130 LEU CA C 130 57.176 57.176 58.265 -1.089 18935 7078 1 9 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.857 -1.291 18935 7079 1 9 . 1 1 130 130 LEU H H 130 8.114 8.114 7.965 0.149 18935 7080 1 9 . 1 1 131 131 LYS N N 131 124.115 124.115 119.400 4.715 18935 7081 1 9 . 1 1 131 131 LYS C C 131 181.452 181.452 179.214 2.238 18935 7082 1 9 . 1 1 131 131 LYS CA C 131 58.886 58.886 59.072 -0.186 18935 7083 1 9 . 1 1 131 131 LYS CB C 131 32.198 32.198 32.029 0.170 18935 7084 1 9 . 1 1 131 131 LYS H H 131 8.849 8.849 7.778 1.071 18935 7085 1 9 . 1 1 132 132 LYS N N 132 119.447 119.447 118.346 1.101 18935 7086 1 9 . 1 1 132 132 LYS C C 132 177.607 177.607 178.095 -0.488 18935 7087 1 9 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.554 -0.602 18935 7088 1 9 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.707 -0.282 18935 7089 1 9 . 1 1 132 132 LYS H H 132 7.778 7.778 8.248 -0.470 18935 7090 1 9 . 1 1 133 133 LYS N N 133 116.638 116.638 116.409 0.229 18935 7091 1 9 . 1 1 133 133 LYS C C 133 174.681 174.681 175.781 -1.100 18935 7092 1 9 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.718 -0.640 18935 7093 1 9 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.175 -0.535 18935 7094 1 9 . 1 1 133 133 LYS H H 133 7.617 7.617 7.473 0.144 18935 7095 1 9 . 1 1 134 134 ASN N N 134 110.792 110.792 116.013 -5.221 18935 7096 1 9 . 1 1 134 134 ASN C C 134 174.034 174.034 173.662 0.372 18935 7097 1 9 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.045 0.570 18935 7098 1 9 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.272 -1.220 18935 7099 1 9 . 1 1 134 134 ASN H H 134 8.123 8.123 8.465 -0.342 18935 7100 1 9 . 1 1 135 135 TYR N N 135 115.867 115.867 118.353 -2.486 18935 7101 1 9 . 1 1 135 135 TYR C C 135 175.122 175.122 174.184 0.938 18935 7102 1 9 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.102 0.650 18935 7103 1 9 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.311 -1.395 18935 7104 1 9 . 1 1 135 135 TYR H H 135 8.133 8.133 8.110 0.023 18935 7105 1 9 . 1 1 136 136 LYS N N 136 119.870 119.870 122.862 -2.992 18935 7106 1 9 . 1 1 136 136 LYS C C 136 174.324 174.324 174.467 -0.143 18935 7107 1 9 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.923 0.258 18935 7108 1 9 . 1 1 136 136 LYS CB C 136 34.073 34.073 35.452 -1.379 18935 7109 1 9 . 1 1 136 136 LYS H H 136 9.234 9.234 9.034 0.200 18935 7110 1 9 . 1 1 137 137 LEU N N 137 129.708 129.708 127.568 2.140 18935 7111 1 9 . 1 1 137 137 LEU C C 137 173.798 173.798 175.360 -1.562 18935 7112 1 9 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.101 -1.267 18935 7113 1 9 . 1 1 137 137 LEU CB C 137 44.983 44.983 44.060 0.923 18935 7114 1 9 . 1 1 137 137 LEU H H 137 8.959 8.959 8.818 0.141 18935 7115 1 9 . 1 1 140 140 TYR N N 140 120.580 120.580 113.163 7.417 18935 7116 1 9 . 1 1 140 140 TYR C C 140 174.705 174.705 175.532 -0.827 18935 7117 1 9 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.302 -0.850 18935 7118 1 9 . 1 1 140 140 TYR CB C 140 38.301 38.301 39.949 -1.647 18935 7119 1 9 . 1 1 140 140 TYR H H 140 8.962 8.962 7.506 1.456 18935 7120 1 9 . 1 1 141 141 GLY N N 141 104.986 104.986 106.686 -1.700 18935 7121 1 9 . 1 1 141 141 GLY C C 141 181.854 181.854 172.139 9.715 18935 7122 1 9 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.770 -0.648 18935 7123 1 9 . 1 1 141 141 GLY H H 141 7.555 7.555 7.661 -0.106 18935 7124 1 9 . 1 1 142 142 LEU N N 142 118.269 118.269 121.368 -3.099 18935 7125 1 9 . 1 1 142 142 LEU C C 142 174.067 174.067 175.712 -1.645 18935 7126 1 9 . 1 1 142 142 LEU CA C 142 52.502 52.502 52.975 -0.473 18935 7127 1 9 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.094 1.448 18935 7128 1 9 . 1 1 142 142 LEU H H 142 7.794 7.794 8.334 -0.540 18935 7129 1 9 . 1 1 143 143 PHE N N 143 122.076 122.076 125.050 -2.974 18935 7130 1 9 . 1 1 143 143 PHE C C 143 175.199 175.199 175.420 -0.221 18935 7131 1 9 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.547 -1.515 18935 7132 1 9 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.902 2.168 18935 7133 1 9 . 1 1 143 143 PHE H H 143 9.522 9.522 9.605 -0.083 18935 7134 1 9 . 1 1 144 144 LYS N N 144 121.305 121.305 125.072 -3.767 18935 7135 1 9 . 1 1 144 144 LYS C C 144 176.917 176.917 176.561 0.356 18935 7136 1 9 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.300 1.056 18935 7137 1 9 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.514 0.165 18935 7138 1 9 . 1 1 144 144 LYS H H 144 9.076 9.076 9.142 -0.066 18935 7139 1 9 . 1 1 145 145 ASN N N 145 126.834 126.834 126.209 0.625 18935 7140 1 9 . 1 1 145 145 ASN C C 145 175.070 175.070 175.244 -0.174 18935 7141 1 9 . 1 1 145 145 ASN CA C 145 54.764 54.764 53.848 0.916 18935 7142 1 9 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.886 -1.456 18935 7143 1 9 . 1 1 145 145 ASN H H 145 9.618 9.618 9.299 0.319 18935 7144 1 9 . 1 1 146 146 GLN N N 146 110.112 110.112 113.219 -3.107 18935 7145 1 9 . 1 1 146 146 GLN C C 146 175.198 175.198 175.188 0.010 18935 7146 1 9 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.624 -0.728 18935 7147 1 9 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.740 -1.372 18935 7148 1 9 . 1 1 146 146 GLN H H 146 9.140 9.140 8.870 0.270 18935 7149 1 9 . 1 1 147 147 THR N N 147 116.003 116.003 115.586 0.417 18935 7150 1 9 . 1 1 147 147 THR C C 147 173.224 173.224 173.222 0.002 18935 7151 1 9 . 1 1 147 147 THR CA C 147 61.450 61.450 61.805 -0.355 18935 7152 1 9 . 1 1 147 147 THR CB C 147 70.285 70.285 70.188 0.097 18935 7153 1 9 . 1 1 147 147 THR H H 147 8.069 8.069 7.582 0.487 18935 7154 1 9 . 1 1 148 148 LEU N N 148 129.281 129.281 129.953 -0.672 18935 7155 1 9 . 1 1 148 148 LEU C C 148 176.703 176.703 175.539 1.164 18935 7156 1 9 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.530 -0.064 18935 7157 1 9 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.768 -1.043 18935 7158 1 9 . 1 1 148 148 LEU H H 148 8.831 8.831 8.901 -0.070 18935 7159 1 9 . 1 1 149 149 VAL N N 149 130.189 130.189 128.558 1.631 18935 7160 1 9 . 1 1 149 149 VAL C C 149 175.012 175.012 174.014 0.998 18935 7161 1 9 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.956 0.313 18935 7162 1 9 . 1 1 149 149 VAL CB C 149 31.456 31.456 34.521 -3.065 18935 7163 1 9 . 1 1 149 149 VAL H H 149 9.243 9.243 8.526 0.717 18935 7164 1 9 . 1 1 151 151 LEU N N 151 123.481 123.481 114.726 8.755 18935 7165 1 9 . 1 1 151 151 LEU C C 151 177.679 177.679 176.810 0.869 18935 7166 1 9 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.083 0.914 18935 7167 1 9 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.401 1.218 18935 7168 1 9 . 1 1 151 151 LEU H H 151 8.080 8.080 8.125 -0.045 18935 7169 1 9 . 1 1 152 152 LYS N N 152 126.381 126.381 121.088 5.293 18935 7170 1 9 . 1 1 152 152 LYS C C 152 175.115 175.115 175.439 -0.324 18935 7171 1 9 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.356 -1.760 18935 7172 1 9 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.505 -3.440 18935 7173 1 9 . 1 1 152 152 LYS H H 152 9.112 9.112 8.846 0.266 18935 7174 1 9 . 1 1 153 153 ILE N N 153 113.737 113.737 116.251 -2.514 18935 7175 1 9 . 1 1 153 153 ILE C C 153 175.748 175.748 173.706 2.042 18935 7176 1 9 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.360 -0.971 18935 7177 1 9 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.415 1.388 18935 7178 1 9 . 1 1 153 153 ILE H H 153 7.304 7.304 7.421 -0.117 18935 7179 1 9 . 1 1 154 154 THR N N 154 110.656 110.656 114.227 -3.571 18935 7180 1 9 . 1 1 154 154 THR C C 154 174.864 174.864 174.307 0.557 18935 7181 1 9 . 1 1 154 154 THR CA C 154 62.141 62.141 61.764 0.377 18935 7182 1 9 . 1 1 154 154 THR CB C 154 70.413 70.413 70.958 -0.545 18935 7183 1 9 . 1 1 154 154 THR H H 154 9.382 9.382 9.422 -0.040 18935 7184 1 9 . 1 1 155 155 THR N N 155 110.746 110.746 116.914 -6.168 18935 7185 1 9 . 1 1 155 155 THR C C 155 174.718 174.718 174.843 -0.125 18935 7186 1 9 . 1 1 155 155 THR CA C 155 58.785 58.785 60.504 -1.719 18935 7187 1 9 . 1 1 155 155 THR CB C 155 72.277 72.277 71.780 0.497 18935 7188 1 9 . 1 1 155 155 THR H H 155 7.746 7.746 8.056 -0.310 18935 7189 1 9 . 1 1 156 156 GLU N N 156 122.302 122.302 122.912 -0.610 18935 7190 1 9 . 1 1 156 156 GLU C C 156 177.289 177.289 178.040 -0.751 18935 7191 1 9 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.966 -2.142 18935 7192 1 9 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.164 -0.783 18935 7193 1 9 . 1 1 156 156 GLU H H 156 9.490 9.490 9.063 0.427 18935 7194 1 9 . 1 1 157 157 LYS N N 157 118.905 118.905 117.243 1.662 18935 7195 1 9 . 1 1 157 157 LYS C C 157 178.241 178.241 178.765 -0.524 18935 7196 1 9 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.343 1.423 18935 7197 1 9 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.692 -0.414 18935 7198 1 9 . 1 1 157 157 LYS H H 157 8.329 8.329 8.495 -0.166 18935 7199 1 9 . 1 1 158 158 GLU N N 158 116.230 116.230 120.509 -4.279 18935 7200 1 9 . 1 1 158 158 GLU C C 158 178.988 178.988 178.398 0.590 18935 7201 1 9 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.686 -0.430 18935 7202 1 9 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.735 -0.677 18935 7203 1 9 . 1 1 158 158 GLU H H 158 7.611 7.611 7.640 -0.029 18935 7204 1 9 . 1 1 159 159 LEU N N 159 118.978 118.978 121.400 -2.422 18935 7205 1 9 . 1 1 159 159 LEU C C 159 176.347 176.347 178.518 -2.171 18935 7206 1 9 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.297 -5.058 18935 7207 1 9 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.973 -2.430 18935 7208 1 9 . 1 1 159 159 LEU H H 159 7.704 7.704 8.217 -0.513 18935 7209 1 9 . 1 1 160 160 ILE N N 160 117.227 117.227 113.525 3.702 18935 7210 1 9 . 1 1 160 160 ILE C C 160 177.219 177.219 177.245 -0.026 18935 7211 1 9 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.097 0.518 18935 7212 1 9 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.157 0.400 18935 7213 1 9 . 1 1 160 160 ILE H H 160 7.886 7.886 7.680 0.206 18935 7214 1 9 . 1 1 161 161 LYS N N 161 115.912 115.912 118.227 -2.315 18935 7215 1 9 . 1 1 161 161 LYS C C 161 180.990 180.990 178.703 2.287 18935 7216 1 9 . 1 1 161 161 LYS CA C 161 58.631 58.631 57.096 1.535 18935 7217 1 9 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.789 -1.041 18935 7218 1 9 . 1 1 161 161 LYS H H 161 7.536 7.536 7.557 -0.021 18935 7219 1 9 . 1 1 162 162 GLU N N 162 120.852 120.852 120.130 0.722 18935 7220 1 9 . 1 1 162 162 GLU C C 162 178.793 178.793 177.945 0.848 18935 7221 1 9 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.440 -0.458 18935 7222 1 9 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.514 -1.722 18935 7223 1 9 . 1 1 162 162 GLU H H 162 8.392 8.392 7.811 0.581 18935 7224 1 9 . 1 1 163 163 LEU N N 163 115.912 115.912 116.497 -0.585 18935 7225 1 9 . 1 1 163 163 LEU C C 163 176.370 176.370 177.250 -0.880 18935 7226 1 9 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.529 -0.435 18935 7227 1 9 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.685 -1.511 18935 7228 1 9 . 1 1 163 163 LEU H H 163 8.031 8.031 8.023 0.008 18935 7229 1 9 . 1 1 164 164 GLY N N 164 103.160 103.160 104.258 -1.098 18935 7230 1 9 . 1 1 164 164 GLY C C 164 174.240 174.240 174.136 0.104 18935 7231 1 9 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.792 -0.490 18935 7232 1 9 . 1 1 164 164 GLY H H 164 7.625 7.625 7.622 0.003 18935 7233 1 9 . 1 1 165 165 PHE N N 165 117.952 117.952 119.479 -1.527 18935 7234 1 9 . 1 1 165 165 PHE C C 165 174.556 174.556 174.475 0.081 18935 7235 1 9 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.206 -0.741 18935 7236 1 9 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.324 -0.562 18935 7237 1 9 . 1 1 165 165 PHE H H 165 7.283 7.283 8.310 -1.027 18935 7238 1 9 . 1 1 166 166 THR N N 166 118.178 118.178 113.766 4.412 18935 7239 1 9 . 1 1 166 166 THR C C 166 175.306 175.306 173.477 1.829 18935 7240 1 9 . 1 1 166 166 THR CA C 166 63.466 63.466 60.085 3.381 18935 7241 1 9 . 1 1 166 166 THR CB C 166 68.721 68.721 70.749 -2.028 18935 7242 1 9 . 1 1 166 166 THR H H 166 9.678 9.678 8.222 1.456 18935 7243 1 9 . 1 1 167 167 TYR N N 167 128.239 128.239 123.239 5.000 18935 7244 1 9 . 1 1 167 167 TYR C C 167 173.297 173.297 175.090 -1.793 18935 7245 1 9 . 1 1 167 167 TYR CA C 167 60.412 60.412 58.449 1.963 18935 7246 1 9 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.331 -2.609 18935 7247 1 9 . 1 1 167 167 TYR H H 167 9.264 9.264 8.674 0.590 18935 7248 1 9 . 1 1 168 168 ARG N N 168 126.789 126.789 125.420 1.369 18935 7249 1 9 . 1 1 168 168 ARG C C 168 175.297 175.297 174.607 0.690 18935 7250 1 9 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.078 -1.313 18935 7251 1 9 . 1 1 168 168 ARG CB C 168 31.326 31.326 33.709 -2.383 18935 7252 1 9 . 1 1 168 168 ARG H H 168 7.030 7.030 8.676 -1.646 18935 7253 1 9 . 1 1 169 169 ILE N N 169 119.221 119.221 118.763 0.458 18935 7254 1 9 . 1 1 169 169 ILE C C 169 174.522 174.522 176.005 -1.483 18935 7255 1 9 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.534 2.745 18935 7256 1 9 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.474 -4.827 18935 7257 1 9 . 1 1 169 169 ILE H H 169 8.349 8.349 8.521 -0.172 18935 7258 1 9 . 1 1 171 171 LYS N N 171 111.335 111.335 116.754 -5.419 18935 7259 1 9 . 1 1 171 171 LYS C C 171 176.638 176.638 178.931 -2.293 18935 7260 1 9 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.435 -1.897 18935 7261 1 9 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.600 0.367 18935 7262 1 9 . 1 1 171 171 LYS H H 171 8.198 8.198 8.593 -0.395 18935 7263 1 9 . 1 1 172 172 LYS N N 172 116.411 116.411 116.828 -0.417 18935 7264 1 9 . 1 1 172 172 LYS C C 172 175.331 175.331 175.980 -0.649 18935 7265 1 9 . 1 1 172 172 LYS CA C 172 54.001 54.001 54.836 -0.835 18935 7266 1 9 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.344 -1.526 18935 7267 1 9 . 1 1 172 172 LYS H H 172 7.843 7.843 7.419 0.424 18935 7268 1 9 . 1 1 173 173 ARG N N 173 120.490 120.490 119.285 1.205 18935 7269 1 9 . 1 1 173 173 ARG C C 173 172.830 172.830 174.900 -2.070 18935 7270 1 9 . 1 1 173 173 ARG CA C 173 57.175 57.175 57.079 0.096 18935 7271 1 9 . 1 1 173 173 ARG CB C 173 28.829 28.829 29.217 -0.388 18935 7272 1 9 . 1 1 173 173 ARG H H 173 6.917 6.917 7.648 -0.731 18935 7273 1 10 . 1 1 2 2 LEU N N 2 119.937 119.937 112.791 7.146 18935 7274 1 10 . 1 1 2 2 LEU C C 2 175.307 175.307 174.878 0.429 18935 7275 1 10 . 1 1 2 2 LEU CA C 2 54.292 54.292 54.354 -0.062 18935 7276 1 10 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.083 -1.399 18935 7277 1 10 . 1 1 2 2 LEU H H 2 9.251 9.251 8.433 0.818 18935 7278 1 10 . 1 1 3 3 THR N N 3 111.335 111.335 109.880 1.455 18935 7279 1 10 . 1 1 3 3 THR C C 3 175.854 175.854 175.070 0.784 18935 7280 1 10 . 1 1 3 3 THR CA C 3 60.540 60.540 60.292 0.248 18935 7281 1 10 . 1 1 3 3 THR CB C 3 70.782 70.782 71.400 -0.618 18935 7282 1 10 . 1 1 3 3 THR H H 3 8.677 8.677 8.070 0.607 18935 7283 1 10 . 1 1 4 4 LEU N N 4 120.988 120.988 123.200 -2.212 18935 7284 1 10 . 1 1 4 4 LEU C C 4 178.391 178.391 178.203 0.188 18935 7285 1 10 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.388 -0.324 18935 7286 1 10 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.146 -2.885 18935 7287 1 10 . 1 1 4 4 LEU H H 4 7.746 7.746 7.978 -0.232 18935 7288 1 10 . 1 1 5 5 ILE N N 5 114.236 114.236 115.354 -1.118 18935 7289 1 10 . 1 1 5 5 ILE C C 5 178.339 178.339 177.943 0.396 18935 7290 1 10 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.680 -1.098 18935 7291 1 10 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.009 -0.210 18935 7292 1 10 . 1 1 5 5 ILE H H 5 7.821 7.821 7.808 0.013 18935 7293 1 10 . 1 1 6 6 GLN N N 6 120.399 120.399 121.454 -1.055 18935 7294 1 10 . 1 1 6 6 GLN C C 6 178.783 178.783 178.360 0.423 18935 7295 1 10 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.662 -1.442 18935 7296 1 10 . 1 1 6 6 GLN CB C 6 28.115 28.115 27.901 0.214 18935 7297 1 10 . 1 1 6 6 GLN H H 6 7.810 7.810 7.882 -0.072 18935 7298 1 10 . 1 1 7 7 GLY N N 7 106.277 106.277 106.050 0.227 18935 7299 1 10 . 1 1 7 7 GLY C C 7 174.554 174.554 176.118 -1.564 18935 7300 1 10 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.023 -0.089 18935 7301 1 10 . 1 1 7 7 GLY H H 7 8.733 8.733 7.973 0.760 18935 7302 1 10 . 1 1 8 8 LYS N N 8 119.991 119.991 121.899 -1.908 18935 7303 1 10 . 1 1 8 8 LYS C C 8 179.433 179.433 178.170 1.263 18935 7304 1 10 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.235 1.657 18935 7305 1 10 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.082 -0.750 18935 7306 1 10 . 1 1 8 8 LYS H H 8 8.688 8.688 7.517 1.171 18935 7307 1 10 . 1 1 9 9 LYS N N 9 119.175 119.175 120.644 -1.469 18935 7308 1 10 . 1 1 9 9 LYS CA C 9 59.382 59.382 60.004 -0.622 18935 7309 1 10 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.386 -0.951 18935 7310 1 10 . 1 1 9 9 LYS H H 9 8.015 8.015 7.827 0.188 18935 7311 1 10 . 1 1 10 10 ILE N N 10 120.308 120.308 116.695 3.613 18935 7312 1 10 . 1 1 10 10 ILE C C 10 177.766 177.766 177.534 0.232 18935 7313 1 10 . 1 1 10 10 ILE CA C 10 64.676 64.676 65.018 -0.342 18935 7314 1 10 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.442 -1.129 18935 7315 1 10 . 1 1 10 10 ILE H H 10 7.967 7.967 8.116 -0.149 18935 7316 1 10 . 1 1 11 11 VAL N N 11 119.130 119.130 121.105 -1.975 18935 7317 1 10 . 1 1 11 11 VAL C C 11 176.606 176.606 178.142 -1.536 18935 7318 1 10 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.650 0.990 18935 7319 1 10 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.621 -0.412 18935 7320 1 10 . 1 1 11 11 VAL H H 11 8.128 8.128 7.883 0.245 18935 7321 1 10 . 1 1 12 12 ASN N N 12 115.822 115.822 117.345 -1.523 18935 7322 1 10 . 1 1 12 12 ASN C C 12 177.375 177.375 177.165 0.210 18935 7323 1 10 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.389 -0.419 18935 7324 1 10 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.690 -1.127 18935 7325 1 10 . 1 1 12 12 ASN H H 12 8.203 8.203 7.949 0.254 18935 7326 1 10 . 1 1 13 13 HIS N N 13 117.659 117.659 119.098 -1.439 18935 7327 1 10 . 1 1 13 13 HIS C C 13 177.287 177.287 178.245 -0.958 18935 7328 1 10 . 1 1 13 13 HIS CA C 13 58.687 58.687 59.593 -0.906 18935 7329 1 10 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.411 -0.390 18935 7330 1 10 . 1 1 13 13 HIS H H 13 7.861 7.861 7.756 0.105 18935 7331 1 10 . 1 1 14 14 LEU N N 14 115.595 115.595 119.515 -3.920 18935 7332 1 10 . 1 1 14 14 LEU C C 14 179.092 179.092 178.697 0.395 18935 7333 1 10 . 1 1 14 14 LEU CA C 14 56.641 56.641 57.561 -0.920 18935 7334 1 10 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.513 -0.493 18935 7335 1 10 . 1 1 14 14 LEU H H 14 8.376 8.376 9.010 -0.634 18935 7336 1 10 . 1 1 15 15 ARG N N 15 115.006 115.006 117.536 -2.530 18935 7337 1 10 . 1 1 15 15 ARG C C 15 176.265 176.265 176.847 -0.582 18935 7338 1 10 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.977 0.907 18935 7339 1 10 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.832 -0.760 18935 7340 1 10 . 1 1 15 15 ARG H H 15 8.074 8.074 8.373 -0.299 18935 7341 1 10 . 1 1 16 16 SER N N 16 107.778 107.778 111.793 -4.015 18935 7342 1 10 . 1 1 16 16 SER C C 16 176.009 176.009 174.796 1.213 18935 7343 1 10 . 1 1 16 16 SER CA C 16 57.244 57.244 58.231 -0.987 18935 7344 1 10 . 1 1 16 16 SER CB C 16 63.525 63.525 65.211 -1.686 18935 7345 1 10 . 1 1 16 16 SER H H 16 7.136 7.136 7.852 -0.716 18935 7346 1 10 . 1 1 17 17 ARG N N 17 121.532 121.532 122.961 -1.429 18935 7347 1 10 . 1 1 17 17 ARG C C 17 174.482 174.482 175.713 -1.231 18935 7348 1 10 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.345 0.977 18935 7349 1 10 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.653 1.177 18935 7350 1 10 . 1 1 17 17 ARG H H 17 7.913 7.913 7.535 0.378 18935 7351 1 10 . 1 1 18 18 LEU N N 18 121.305 121.305 119.981 1.324 18935 7352 1 10 . 1 1 18 18 LEU C C 18 176.283 176.283 175.291 0.992 18935 7353 1 10 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.593 -0.895 18935 7354 1 10 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.309 -0.254 18935 7355 1 10 . 1 1 18 18 LEU H H 18 8.812 8.812 7.611 1.201 18935 7356 1 10 . 1 1 19 19 ALA N N 19 125.293 125.293 122.197 3.096 18935 7357 1 10 . 1 1 19 19 ALA C C 19 173.780 173.780 175.203 -1.423 18935 7358 1 10 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.657 -0.855 18935 7359 1 10 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.780 1.073 18935 7360 1 10 . 1 1 19 19 ALA H H 19 8.790 8.790 7.757 1.033 18935 7361 1 10 . 1 1 20 20 PHE N N 20 113.117 113.117 115.139 -2.022 18935 7362 1 10 . 1 1 20 20 PHE C C 20 172.708 172.708 173.162 -0.454 18935 7363 1 10 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.539 -0.941 18935 7364 1 10 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.236 0.489 18935 7365 1 10 . 1 1 20 20 PHE H H 20 8.925 8.925 8.682 0.243 18935 7366 1 10 . 1 1 21 21 GLU N N 21 121.532 121.532 119.276 2.256 18935 7367 1 10 . 1 1 21 21 GLU C C 21 174.830 174.830 175.194 -0.364 18935 7368 1 10 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.518 -0.555 18935 7369 1 10 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.950 -2.607 18935 7370 1 10 . 1 1 21 21 GLU H H 21 7.972 7.972 9.270 -1.298 18935 7371 1 10 . 1 1 22 22 TYR N N 22 125.339 125.339 120.114 5.225 18935 7372 1 10 . 1 1 22 22 TYR C C 22 174.864 174.864 174.394 0.470 18935 7373 1 10 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.525 -3.237 18935 7374 1 10 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.100 -0.241 18935 7375 1 10 . 1 1 22 22 TYR H H 22 9.016 9.016 8.367 0.649 18935 7376 1 10 . 1 1 23 23 ASN N N 23 127.024 127.024 126.082 0.942 18935 7377 1 10 . 1 1 23 23 ASN C C 23 175.410 175.410 175.435 -0.025 18935 7378 1 10 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.980 -0.926 18935 7379 1 10 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.539 -1.278 18935 7380 1 10 . 1 1 23 23 ASN H H 23 9.181 9.181 9.148 0.033 18935 7381 1 10 . 1 1 24 24 GLY N N 24 102.755 102.755 102.047 0.708 18935 7382 1 10 . 1 1 24 24 GLY C C 24 173.626 173.626 174.744 -1.118 18935 7383 1 10 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.058 -0.123 18935 7384 1 10 . 1 1 24 24 GLY H H 24 8.666 8.666 8.445 0.221 18935 7385 1 10 . 1 1 25 25 GLN N N 25 118.722 118.722 120.733 -2.011 18935 7386 1 10 . 1 1 25 25 GLN C C 25 173.657 173.657 174.995 -1.338 18935 7387 1 10 . 1 1 25 25 GLN CA C 25 53.233 53.233 55.017 -1.784 18935 7388 1 10 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.556 0.249 18935 7389 1 10 . 1 1 25 25 GLN H H 25 7.708 7.708 7.999 -0.291 18935 7390 1 10 . 1 1 26 26 LEU N N 26 123.526 123.526 120.687 2.839 18935 7391 1 10 . 1 1 26 26 LEU C C 26 175.842 175.842 176.241 -0.399 18935 7392 1 10 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.759 0.227 18935 7393 1 10 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.793 -2.986 18935 7394 1 10 . 1 1 26 26 LEU H H 26 8.543 8.543 8.348 0.195 18935 7395 1 10 . 1 1 27 27 ILE N N 27 129.462 129.462 123.977 5.485 18935 7396 1 10 . 1 1 27 27 ILE C C 27 175.085 175.085 174.190 0.895 18935 7397 1 10 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.483 0.490 18935 7398 1 10 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.380 -2.828 18935 7399 1 10 . 1 1 27 27 ILE H H 27 8.989 8.989 8.974 0.015 18935 7400 1 10 . 1 1 28 28 LYS N N 28 125.157 125.157 126.429 -1.272 18935 7401 1 10 . 1 1 28 28 LYS C C 28 176.725 176.725 175.420 1.305 18935 7402 1 10 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.513 1.297 18935 7403 1 10 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.397 -1.580 18935 7404 1 10 . 1 1 28 28 LYS H H 28 8.311 8.311 8.280 0.031 18935 7405 1 10 . 1 1 29 29 ILE N N 29 125.565 125.565 116.587 8.978 18935 7406 1 10 . 1 1 29 29 ILE C C 29 175.685 175.685 173.633 2.052 18935 7407 1 10 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.710 0.695 18935 7408 1 10 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.608 -3.577 18935 7409 1 10 . 1 1 29 29 ILE H H 29 8.209 8.209 8.000 0.209 18935 7410 1 10 . 1 1 30 30 LEU N N 30 127.831 127.831 119.763 8.068 18935 7411 1 10 . 1 1 30 30 LEU C C 30 178.794 178.794 177.131 1.663 18935 7412 1 10 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.016 1.427 18935 7413 1 10 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.429 -4.593 18935 7414 1 10 . 1 1 30 30 LEU H H 30 9.027 9.027 8.253 0.774 18935 7415 1 10 . 1 1 31 31 SER N N 31 116.864 116.864 115.473 1.391 18935 7416 1 10 . 1 1 31 31 SER C C 31 177.464 177.464 176.273 1.191 18935 7417 1 10 . 1 1 31 31 SER CA C 31 61.180 61.180 61.111 0.069 18935 7418 1 10 . 1 1 31 31 SER CB C 31 62.105 62.105 63.331 -1.226 18935 7419 1 10 . 1 1 31 31 SER H H 31 8.887 8.887 8.593 0.294 18935 7420 1 10 . 1 1 32 32 LYS N N 32 114.825 114.825 119.600 -4.775 18935 7421 1 10 . 1 1 32 32 LYS C C 32 176.243 176.243 175.781 0.462 18935 7422 1 10 . 1 1 32 32 LYS CA C 32 57.292 57.292 56.583 0.709 18935 7423 1 10 . 1 1 32 32 LYS CB C 32 30.266 30.266 30.682 -0.416 18935 7424 1 10 . 1 1 32 32 LYS H H 32 8.290 8.290 8.385 -0.095 18935 7425 1 10 . 1 1 33 33 ASN N N 33 117.564 117.564 113.684 3.880 18935 7426 1 10 . 1 1 33 33 ASN C C 33 172.253 172.253 173.725 -1.472 18935 7427 1 10 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.223 -1.132 18935 7428 1 10 . 1 1 33 33 ASN CB C 33 38.339 38.339 41.331 -2.991 18935 7429 1 10 . 1 1 33 33 ASN H H 33 8.051 8.051 8.146 -0.095 18935 7430 1 10 . 1 1 34 34 ILE N N 34 118.949 118.949 121.094 -2.145 18935 7431 1 10 . 1 1 34 34 ILE C C 34 175.343 175.343 174.737 0.606 18935 7432 1 10 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.373 0.180 18935 7433 1 10 . 1 1 34 34 ILE CB C 34 38.867 38.867 42.116 -3.249 18935 7434 1 10 . 1 1 34 34 ILE H H 34 7.670 7.670 7.946 -0.276 18935 7435 1 10 . 1 1 35 35 VAL N N 35 128.355 128.355 125.557 2.798 18935 7436 1 10 . 1 1 35 35 VAL C C 35 175.543 175.543 174.513 1.030 18935 7437 1 10 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.343 -0.329 18935 7438 1 10 . 1 1 35 35 VAL CB C 35 34.231 34.231 36.459 -2.228 18935 7439 1 10 . 1 1 35 35 VAL H H 35 9.698 9.698 8.866 0.832 18935 7440 1 10 . 1 1 36 36 ALA N N 36 129.553 129.553 131.901 -2.348 18935 7441 1 10 . 1 1 36 36 ALA C C 36 177.015 177.015 176.851 0.164 18935 7442 1 10 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.412 0.984 18935 7443 1 10 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.266 -0.644 18935 7444 1 10 . 1 1 36 36 ALA H H 36 8.917 8.917 8.549 0.368 18935 7445 1 10 . 1 1 37 37 VAL N N 37 115.006 115.006 119.508 -4.502 18935 7446 1 10 . 1 1 37 37 VAL C C 37 174.649 174.649 175.808 -1.159 18935 7447 1 10 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.780 -0.459 18935 7448 1 10 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.364 -0.978 18935 7449 1 10 . 1 1 37 37 VAL H H 37 8.214 8.214 7.845 0.369 18935 7450 1 10 . 1 1 38 38 GLY N N 38 109.387 109.387 107.744 1.643 18935 7451 1 10 . 1 1 38 38 GLY C C 38 174.152 174.152 176.286 -2.134 18935 7452 1 10 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.303 0.194 18935 7453 1 10 . 1 1 38 38 GLY H H 38 8.677 8.677 7.906 0.771 18935 7454 1 10 . 1 1 39 39 SER N N 39 116.776 116.776 119.287 -2.511 18935 7455 1 10 . 1 1 39 39 SER C C 39 175.129 175.129 175.810 -0.681 18935 7456 1 10 . 1 1 39 39 SER CA C 39 60.036 60.036 61.249 -1.213 18935 7457 1 10 . 1 1 39 39 SER CB C 39 61.522 61.522 63.105 -1.583 18935 7458 1 10 . 1 1 39 39 SER H H 39 9.705 9.705 8.627 1.078 18935 7459 1 10 . 1 1 40 40 LEU N N 40 113.696 113.696 120.157 -6.461 18935 7460 1 10 . 1 1 40 40 LEU C C 40 180.558 180.558 178.397 2.161 18935 7461 1 10 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.931 1.442 18935 7462 1 10 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.001 0.876 18935 7463 1 10 . 1 1 40 40 LEU H H 40 7.311 7.311 7.862 -0.551 18935 7464 1 10 . 1 1 41 41 ARG N N 41 121.162 121.162 116.654 4.508 18935 7465 1 10 . 1 1 41 41 ARG C C 41 176.964 176.964 177.492 -0.528 18935 7466 1 10 . 1 1 41 41 ARG CA C 41 58.451 58.451 57.195 1.256 18935 7467 1 10 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.397 -2.192 18935 7468 1 10 . 1 1 41 41 ARG H H 41 6.999 6.999 7.490 -0.491 18935 7469 1 10 . 1 1 42 42 ARG N N 42 111.109 111.109 118.579 -7.470 18935 7470 1 10 . 1 1 42 42 ARG C C 42 172.564 172.564 175.848 -3.284 18935 7471 1 10 . 1 1 42 42 ARG CA C 42 56.380 56.380 56.799 -0.419 18935 7472 1 10 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.866 -2.517 18935 7473 1 10 . 1 1 42 42 ARG H H 42 7.041 7.041 7.390 -0.349 18935 7474 1 10 . 1 1 43 43 GLU N N 43 111.924 111.924 116.200 -4.276 18935 7475 1 10 . 1 1 43 43 GLU C C 43 176.202 176.202 174.872 1.330 18935 7476 1 10 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.508 -1.054 18935 7477 1 10 . 1 1 43 43 GLU CB C 43 25.301 25.301 26.857 -1.556 18935 7478 1 10 . 1 1 43 43 GLU H H 43 7.757 7.757 8.000 -0.243 18935 7479 1 10 . 1 1 44 44 GLU N N 44 117.861 117.861 119.612 -1.751 18935 7480 1 10 . 1 1 44 44 GLU C C 44 175.197 175.197 176.129 -0.932 18935 7481 1 10 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.290 -0.162 18935 7482 1 10 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.978 -2.419 18935 7483 1 10 . 1 1 44 44 GLU H H 44 7.461 7.461 7.667 -0.206 18935 7484 1 10 . 1 1 45 45 LYS N N 45 115.051 115.051 119.774 -4.723 18935 7485 1 10 . 1 1 45 45 LYS C C 45 177.733 177.733 176.230 1.503 18935 7486 1 10 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.672 1.383 18935 7487 1 10 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.417 -1.390 18935 7488 1 10 . 1 1 45 45 LYS H H 45 8.123 8.123 8.585 -0.462 18935 7489 1 10 . 1 1 46 46 MET N N 46 114.009 114.009 118.430 -4.421 18935 7490 1 10 . 1 1 46 46 MET C C 46 174.067 174.067 174.490 -0.423 18935 7491 1 10 . 1 1 46 46 MET CA C 46 52.477 52.477 54.729 -2.252 18935 7492 1 10 . 1 1 46 46 MET CB C 46 33.974 33.974 34.587 -0.614 18935 7493 1 10 . 1 1 46 46 MET H H 46 7.767 7.767 7.791 -0.024 18935 7494 1 10 . 1 1 47 47 LEU N N 47 120.263 120.263 124.637 -4.374 18935 7495 1 10 . 1 1 47 47 LEU C C 47 177.669 177.669 175.744 1.925 18935 7496 1 10 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.457 -1.256 18935 7497 1 10 . 1 1 47 47 LEU CB C 47 42.908 42.908 45.578 -2.670 18935 7498 1 10 . 1 1 47 47 LEU H H 47 9.481 9.481 9.001 0.480 18935 7499 1 10 . 1 1 48 48 ASN N N 48 118.632 118.632 119.958 -1.326 18935 7500 1 10 . 1 1 48 48 ASN C C 48 174.715 174.715 174.255 0.460 18935 7501 1 10 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.862 1.639 18935 7502 1 10 . 1 1 48 48 ASN CB C 48 38.828 38.828 41.027 -2.199 18935 7503 1 10 . 1 1 48 48 ASN H H 48 9.388 9.388 8.776 0.612 18935 7504 1 10 . 1 1 49 49 ASP N N 49 115.867 115.867 116.864 -0.997 18935 7505 1 10 . 1 1 49 49 ASP C C 49 174.111 174.111 174.659 -0.548 18935 7506 1 10 . 1 1 49 49 ASP CA C 49 51.201 51.201 53.197 -1.996 18935 7507 1 10 . 1 1 49 49 ASP CB C 49 40.077 40.077 44.990 -4.913 18935 7508 1 10 . 1 1 49 49 ASP H H 49 7.670 7.670 7.950 -0.280 18935 7509 1 10 . 1 1 50 50 VAL N N 50 119.185 119.185 120.300 -1.115 18935 7510 1 10 . 1 1 50 50 VAL C C 50 172.333 172.333 173.911 -1.578 18935 7511 1 10 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.498 0.417 18935 7512 1 10 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.193 -1.228 18935 7513 1 10 . 1 1 50 50 VAL H H 50 8.339 8.339 7.940 0.399 18935 7514 1 10 . 1 1 51 51 ASP N N 51 124.704 124.704 126.390 -1.686 18935 7515 1 10 . 1 1 51 51 ASP C C 51 173.725 173.725 175.071 -1.346 18935 7516 1 10 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.510 -0.482 18935 7517 1 10 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.826 0.003 18935 7518 1 10 . 1 1 51 51 ASP H H 51 8.984 8.984 8.532 0.452 18935 7519 1 10 . 1 1 52 52 LEU N N 52 120.943 120.943 122.667 -1.724 18935 7520 1 10 . 1 1 52 52 LEU C C 52 173.045 173.045 174.450 -1.405 18935 7521 1 10 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.304 -1.433 18935 7522 1 10 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.843 -2.590 18935 7523 1 10 . 1 1 52 52 LEU H H 52 9.081 9.081 8.148 0.933 18935 7524 1 10 . 1 1 53 53 LEU N N 53 123.027 123.027 125.172 -2.145 18935 7525 1 10 . 1 1 53 53 LEU C C 53 173.750 173.750 175.379 -1.629 18935 7526 1 10 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.686 -1.353 18935 7527 1 10 . 1 1 53 53 LEU CB C 53 45.008 45.008 44.888 0.120 18935 7528 1 10 . 1 1 53 53 LEU H H 53 9.146 9.146 9.089 0.057 18935 7529 1 10 . 1 1 54 54 ILE N N 54 126.562 126.562 127.054 -0.492 18935 7530 1 10 . 1 1 54 54 ILE C C 54 175.132 175.132 175.218 -0.086 18935 7531 1 10 . 1 1 54 54 ILE CA C 54 58.598 58.598 60.015 -1.417 18935 7532 1 10 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.590 -1.029 18935 7533 1 10 . 1 1 54 54 ILE H H 54 9.440 9.440 9.223 0.217 18935 7534 1 10 . 1 1 55 55 ILE N N 55 126.879 126.879 128.546 -1.667 18935 7535 1 10 . 1 1 55 55 ILE C C 55 175.655 175.655 175.371 0.284 18935 7536 1 10 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.070 -2.509 18935 7537 1 10 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.922 -5.616 18935 7538 1 10 . 1 1 55 55 ILE H H 55 9.381 9.381 8.624 0.757 18935 7539 1 10 . 1 1 56 56 VAL N N 56 128.936 128.936 124.144 4.792 18935 7540 1 10 . 1 1 56 56 VAL C C 56 176.389 176.389 174.515 1.874 18935 7541 1 10 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.600 0.030 18935 7542 1 10 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.282 -0.498 18935 7543 1 10 . 1 1 56 56 VAL H H 56 9.227 9.227 8.844 0.383 18935 7544 1 10 . 1 1 58 58 GLU N N 58 112.423 112.423 119.232 -6.809 18935 7545 1 10 . 1 1 58 58 GLU C C 58 175.946 175.946 176.409 -0.463 18935 7546 1 10 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.053 -0.753 18935 7547 1 10 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.394 0.703 18935 7548 1 10 . 1 1 58 58 GLU H H 58 6.685 6.685 7.907 -1.222 18935 7549 1 10 . 1 1 59 59 LYS N N 59 125.293 125.293 119.866 5.427 18935 7550 1 10 . 1 1 59 59 LYS C C 59 179.248 179.248 176.241 3.007 18935 7551 1 10 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.051 2.723 18935 7552 1 10 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.319 -1.242 18935 7553 1 10 . 1 1 59 59 LYS H H 59 9.108 9.108 8.583 0.525 18935 7554 1 10 . 1 1 60 60 LYS N N 60 117.408 117.408 116.597 0.811 18935 7555 1 10 . 1 1 60 60 LYS C C 60 177.198 177.198 177.985 -0.787 18935 7556 1 10 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.911 1.302 18935 7557 1 10 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.874 -2.291 18935 7558 1 10 . 1 1 60 60 LYS H H 60 9.102 9.102 7.625 1.477 18935 7559 1 10 . 1 1 61 61 LEU N N 61 114.779 114.779 121.334 -6.555 18935 7560 1 10 . 1 1 61 61 LEU C C 61 178.790 178.790 178.755 0.035 18935 7561 1 10 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.495 -2.471 18935 7562 1 10 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.468 -0.604 18935 7563 1 10 . 1 1 61 61 LEU H H 61 7.455 7.455 8.278 -0.823 18935 7564 1 10 . 1 1 62 62 LEU N N 62 119.629 119.629 118.190 1.439 18935 7565 1 10 . 1 1 62 62 LEU C C 62 177.762 177.762 177.822 -0.060 18935 7566 1 10 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.751 0.447 18935 7567 1 10 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.975 -1.244 18935 7568 1 10 . 1 1 62 62 LEU H H 62 7.714 7.714 7.565 0.149 18935 7569 1 10 . 1 1 63 63 LYS N N 63 112.921 112.921 116.300 -3.379 18935 7570 1 10 . 1 1 63 63 LYS C C 63 175.386 175.386 177.845 -2.459 18935 7571 1 10 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.339 0.017 18935 7572 1 10 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.859 -1.896 18935 7573 1 10 . 1 1 63 63 LYS H H 63 7.751 7.751 8.268 -0.517 18935 7574 1 10 . 1 1 64 64 HIS N N 64 112.468 112.468 117.768 -5.300 18935 7575 1 10 . 1 1 64 64 HIS C C 64 176.081 176.081 176.201 -0.120 18935 7576 1 10 . 1 1 64 64 HIS CA C 64 55.769 55.769 58.211 -2.442 18935 7577 1 10 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.317 1.053 18935 7578 1 10 . 1 1 64 64 HIS H H 64 7.697 7.697 7.892 -0.195 18935 7579 1 10 . 1 1 65 65 VAL N N 65 117.499 117.499 119.220 -1.721 18935 7580 1 10 . 1 1 65 65 VAL C C 65 174.301 174.301 176.911 -2.610 18935 7581 1 10 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.914 2.416 18935 7582 1 10 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.297 -1.937 18935 7583 1 10 . 1 1 65 65 VAL H H 65 6.917 6.917 7.297 -0.380 18935 7584 1 10 . 1 1 66 66 LEU N N 66 113.873 113.873 119.018 -5.145 18935 7585 1 10 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.832 0.018 18935 7586 1 10 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.139 -3.081 18935 7587 1 10 . 1 1 66 66 LEU H H 66 9.102 9.102 7.972 1.130 18935 7588 1 10 . 1 1 68 68 ASN N N 68 110.792 110.792 115.886 -5.094 18935 7589 1 10 . 1 1 68 68 ASN C C 68 174.877 174.877 173.352 1.525 18935 7590 1 10 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.537 -1.722 18935 7591 1 10 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.463 -1.152 18935 7592 1 10 . 1 1 68 68 ASN H H 68 7.234 7.234 8.539 -1.305 18935 7593 1 10 . 1 1 69 69 ILE N N 69 122.348 122.348 125.387 -3.039 18935 7594 1 10 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.203 -0.291 18935 7595 1 10 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.044 -2.006 18935 7596 1 10 . 1 1 69 69 ILE H H 69 7.428 7.428 8.746 -1.318 18935 7597 1 10 . 1 1 70 70 ARG N N 70 125.701 125.701 125.554 0.147 18935 7598 1 10 . 1 1 70 70 ARG C C 70 174.596 174.596 173.262 1.334 18935 7599 1 10 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.538 -1.377 18935 7600 1 10 . 1 1 70 70 ARG CB C 70 32.453 32.453 32.164 0.289 18935 7601 1 10 . 1 1 70 70 ARG H H 70 9.083 9.083 8.756 0.327 18935 7602 1 10 . 1 1 71 71 ILE N N 71 118.496 118.496 119.176 -0.680 18935 7603 1 10 . 1 1 71 71 ILE C C 71 175.625 175.625 175.038 0.587 18935 7604 1 10 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.081 0.695 18935 7605 1 10 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.498 -2.531 18935 7606 1 10 . 1 1 71 71 ILE H H 71 7.864 7.864 7.796 0.068 18935 7607 1 10 . 1 1 72 72 LYS N N 72 127.423 127.423 125.245 2.178 18935 7608 1 10 . 1 1 72 72 LYS C C 72 177.659 177.659 176.936 0.723 18935 7609 1 10 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.459 1.969 18935 7610 1 10 . 1 1 72 72 LYS CB C 72 31.374 31.374 33.694 -2.320 18935 7611 1 10 . 1 1 72 72 LYS H H 72 8.720 8.720 8.788 -0.068 18935 7612 1 10 . 1 1 73 73 GLY N N 73 112.604 112.604 111.452 1.152 18935 7613 1 10 . 1 1 73 73 GLY C C 73 173.729 173.729 173.662 0.067 18935 7614 1 10 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.665 0.166 18935 7615 1 10 . 1 1 73 73 GLY H H 73 8.930 8.930 8.899 0.031 18935 7616 1 10 . 1 1 74 74 LEU N N 74 119.538 119.538 119.515 0.023 18935 7617 1 10 . 1 1 74 74 LEU C C 74 175.802 175.802 175.634 0.168 18935 7618 1 10 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.590 0.071 18935 7619 1 10 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.951 -0.898 18935 7620 1 10 . 1 1 74 74 LEU H H 74 7.547 7.547 7.764 -0.217 18935 7621 1 10 . 1 1 75 75 SER N N 75 118.994 118.994 117.075 1.919 18935 7622 1 10 . 1 1 75 75 SER C C 75 173.111 173.111 172.902 0.209 18935 7623 1 10 . 1 1 75 75 SER CA C 75 57.696 57.696 58.098 -0.402 18935 7624 1 10 . 1 1 75 75 SER CB C 75 63.073 63.073 64.078 -1.005 18935 7625 1 10 . 1 1 75 75 SER H H 75 9.076 9.076 8.844 0.232 18935 7626 1 10 . 1 1 76 76 PHE N N 76 117.802 117.802 120.766 -2.964 18935 7627 1 10 . 1 1 76 76 PHE C C 76 173.564 173.564 174.464 -0.900 18935 7628 1 10 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.131 -0.722 18935 7629 1 10 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.396 -0.553 18935 7630 1 10 . 1 1 76 76 PHE H H 76 8.119 8.119 7.913 0.206 18935 7631 1 10 . 1 1 77 77 SER N N 77 113.918 113.918 117.559 -3.641 18935 7632 1 10 . 1 1 77 77 SER C C 77 173.194 173.194 173.464 -0.270 18935 7633 1 10 . 1 1 77 77 SER CA C 77 55.999 55.999 57.283 -1.284 18935 7634 1 10 . 1 1 77 77 SER CB C 77 65.218 65.218 65.467 -0.249 18935 7635 1 10 . 1 1 77 77 SER H H 77 8.989 8.989 8.654 0.335 18935 7636 1 10 . 1 1 78 78 VAL N N 78 123.662 123.662 126.087 -2.425 18935 7637 1 10 . 1 1 78 78 VAL C C 78 176.057 176.057 176.226 -0.169 18935 7638 1 10 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.300 -0.209 18935 7639 1 10 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.595 0.699 18935 7640 1 10 . 1 1 78 78 VAL H H 78 8.995 8.995 8.907 0.088 18935 7641 1 10 . 1 1 79 79 LYS N N 79 129.417 129.417 128.509 0.908 18935 7642 1 10 . 1 1 79 79 LYS C C 79 176.436 176.436 174.607 1.829 18935 7643 1 10 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.753 2.899 18935 7644 1 10 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.788 -4.315 18935 7645 1 10 . 1 1 79 79 LYS H H 79 9.425 9.425 8.972 0.453 18935 7646 1 10 . 1 1 80 80 VAL N N 80 108.616 108.616 121.403 -12.787 18935 7647 1 10 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.571 -2.474 18935 7648 1 10 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.413 0.668 18935 7649 1 10 . 1 1 80 80 VAL H H 80 7.380 7.380 8.505 -1.125 18935 7650 1 10 . 1 1 81 81 CYS N N 81 123.254 123.254 129.075 -5.821 18935 7651 1 10 . 1 1 81 81 CYS C C 81 172.053 172.053 173.951 -1.898 18935 7652 1 10 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.630 2.110 18935 7653 1 10 . 1 1 81 81 CYS CB C 81 27.332 27.332 28.657 -1.325 18935 7654 1 10 . 1 1 81 81 CYS H H 81 9.759 9.759 8.452 1.307 18935 7655 1 10 . 1 1 82 82 GLY N N 82 118.450 118.450 116.476 1.974 18935 7656 1 10 . 1 1 82 82 GLY C C 82 171.814 171.814 174.430 -2.616 18935 7657 1 10 . 1 1 82 82 GLY CA C 82 44.353 44.353 45.881 -1.528 18935 7658 1 10 . 1 1 82 82 GLY H H 82 8.537 8.537 8.496 0.041 18935 7659 1 10 . 1 1 83 83 GLU N N 83 113.964 113.964 121.142 -7.178 18935 7660 1 10 . 1 1 83 83 GLU C C 83 179.320 179.320 177.685 1.635 18935 7661 1 10 . 1 1 83 83 GLU CA C 83 57.675 57.675 58.239 -0.564 18935 7662 1 10 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.805 0.102 18935 7663 1 10 . 1 1 83 83 GLU H H 83 8.473 8.473 8.707 -0.234 18935 7664 1 10 . 1 1 84 84 ARG N N 84 117.544 117.544 116.898 0.646 18935 7665 1 10 . 1 1 84 84 ARG C C 84 177.252 177.252 176.146 1.106 18935 7666 1 10 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.611 -1.107 18935 7667 1 10 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.019 0.527 18935 7668 1 10 . 1 1 84 84 ARG H H 84 9.760 9.760 8.364 1.396 18935 7669 1 10 . 1 1 85 85 LYS N N 85 124.160 124.160 119.672 4.488 18935 7670 1 10 . 1 1 85 85 LYS C C 85 173.379 173.379 175.493 -2.114 18935 7671 1 10 . 1 1 85 85 LYS CA C 85 55.232 55.232 55.928 -0.697 18935 7672 1 10 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.073 0.139 18935 7673 1 10 . 1 1 85 85 LYS H H 85 8.494 8.494 7.763 0.731 18935 7674 1 10 . 1 1 86 86 CYS N N 86 126.472 126.472 119.296 7.176 18935 7675 1 10 . 1 1 86 86 CYS C C 86 171.935 171.935 172.600 -0.665 18935 7676 1 10 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.044 -1.166 18935 7677 1 10 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.215 0.089 18935 7678 1 10 . 1 1 86 86 CYS H H 86 9.221 9.221 8.476 0.745 18935 7679 1 10 . 1 1 87 87 VAL N N 87 126.426 126.426 125.920 0.506 18935 7680 1 10 . 1 1 87 87 VAL C C 87 173.760 173.760 173.035 0.725 18935 7681 1 10 . 1 1 87 87 VAL CA C 87 61.333 61.333 59.805 1.528 18935 7682 1 10 . 1 1 87 87 VAL CB C 87 33.338 33.338 35.503 -2.165 18935 7683 1 10 . 1 1 87 87 VAL H H 87 8.623 8.623 8.885 -0.262 18935 7684 1 10 . 1 1 88 88 LEU N N 88 125.701 125.701 127.116 -1.415 18935 7685 1 10 . 1 1 88 88 LEU C C 88 175.424 175.424 175.271 0.153 18935 7686 1 10 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.382 -1.296 18935 7687 1 10 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.639 -2.095 18935 7688 1 10 . 1 1 88 88 LEU H H 88 9.592 9.592 9.123 0.469 18935 7689 1 10 . 1 1 89 89 PHE N N 89 118.314 118.314 122.679 -4.365 18935 7690 1 10 . 1 1 89 89 PHE C C 89 177.068 177.068 175.967 1.101 18935 7691 1 10 . 1 1 89 89 PHE CA C 89 55.875 55.875 57.015 -1.140 18935 7692 1 10 . 1 1 89 89 PHE CB C 89 38.837 38.837 38.991 -0.154 18935 7693 1 10 . 1 1 89 89 PHE H H 89 8.979 8.979 9.282 -0.303 18935 7694 1 10 . 1 1 90 90 ILE N N 90 119.039 119.039 118.698 0.341 18935 7695 1 10 . 1 1 90 90 ILE C C 90 173.692 173.692 174.745 -1.053 18935 7696 1 10 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.826 -1.154 18935 7697 1 10 . 1 1 90 90 ILE CB C 90 40.183 40.183 40.208 -0.025 18935 7698 1 10 . 1 1 90 90 ILE H H 90 9.447 9.447 8.468 0.979 18935 7699 1 10 . 1 1 91 91 GLU N N 91 122.801 122.801 125.457 -2.656 18935 7700 1 10 . 1 1 91 91 GLU C C 91 175.565 175.565 174.491 1.074 18935 7701 1 10 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.146 -0.681 18935 7702 1 10 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.417 -3.756 18935 7703 1 10 . 1 1 91 91 GLU H H 91 8.360 8.360 8.803 -0.443 18935 7704 1 10 . 1 1 92 92 TRP N N 92 126.018 126.018 122.319 3.699 18935 7705 1 10 . 1 1 92 92 TRP C C 92 175.070 175.070 175.080 -0.010 18935 7706 1 10 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.731 -0.541 18935 7707 1 10 . 1 1 92 92 TRP CB C 92 30.582 30.582 30.963 -0.381 18935 7708 1 10 . 1 1 92 92 TRP H H 92 9.425 9.425 8.354 1.071 18935 7709 1 10 . 1 1 93 93 GLU N N 93 126.381 126.381 120.606 5.775 18935 7710 1 10 . 1 1 93 93 GLU C C 93 175.637 175.637 175.633 0.004 18935 7711 1 10 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.893 -1.124 18935 7712 1 10 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.041 -2.097 18935 7713 1 10 . 1 1 93 93 GLU H H 93 8.914 8.914 9.228 -0.314 18935 7714 1 10 . 1 1 94 94 LYS N N 94 107.891 107.891 111.456 -3.565 18935 7715 1 10 . 1 1 94 94 LYS C C 94 175.359 175.359 175.672 -0.313 18935 7716 1 10 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.036 0.393 18935 7717 1 10 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.968 -2.326 18935 7718 1 10 . 1 1 94 94 LYS H H 94 8.634 8.634 8.465 0.169 18935 7719 1 10 . 1 1 95 95 LYS N N 95 120.490 120.490 118.597 1.893 18935 7720 1 10 . 1 1 95 95 LYS C C 95 174.369 174.369 174.174 0.195 18935 7721 1 10 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.202 0.151 18935 7722 1 10 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.639 -1.176 18935 7723 1 10 . 1 1 95 95 LYS H H 95 7.924 7.924 7.699 0.225 18935 7724 1 10 . 1 1 96 96 THR N N 96 115.278 115.278 113.677 1.601 18935 7725 1 10 . 1 1 96 96 THR C C 96 174.317 174.317 173.176 1.141 18935 7726 1 10 . 1 1 96 96 THR CA C 96 61.203 61.203 60.427 0.776 18935 7727 1 10 . 1 1 96 96 THR CB C 96 69.348 69.348 69.460 -0.112 18935 7728 1 10 . 1 1 96 96 THR H H 96 7.967 7.967 7.894 0.073 18935 7729 1 10 . 1 1 97 97 TYR N N 97 123.254 123.254 125.286 -2.032 18935 7730 1 10 . 1 1 97 97 TYR C C 97 173.320 173.320 174.452 -1.132 18935 7731 1 10 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.328 -0.444 18935 7732 1 10 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.279 -0.143 18935 7733 1 10 . 1 1 97 97 TYR H H 97 9.232 9.232 9.077 0.155 18935 7734 1 10 . 1 1 98 98 GLN N N 98 122.574 122.574 118.516 4.058 18935 7735 1 10 . 1 1 98 98 GLN C C 98 172.781 172.781 174.376 -1.595 18935 7736 1 10 . 1 1 98 98 GLN CA C 98 55.171 55.171 54.941 0.230 18935 7737 1 10 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.003 -2.604 18935 7738 1 10 . 1 1 98 98 GLN H H 98 9.000 9.000 8.660 0.340 18935 7739 1 10 . 1 1 99 99 LEU N N 99 130.218 130.218 125.202 5.016 18935 7740 1 10 . 1 1 99 99 LEU C C 99 172.806 172.806 174.415 -1.609 18935 7741 1 10 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.488 -1.438 18935 7742 1 10 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.239 -0.487 18935 7743 1 10 . 1 1 99 99 LEU H H 99 9.246 9.246 9.020 0.226 18935 7744 1 10 . 1 1 100 100 ASP N N 100 124.931 124.931 127.049 -2.118 18935 7745 1 10 . 1 1 100 100 ASP C C 100 172.626 172.626 174.135 -1.509 18935 7746 1 10 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.274 -2.844 18935 7747 1 10 . 1 1 100 100 ASP CB C 100 37.328 37.328 41.985 -4.657 18935 7748 1 10 . 1 1 100 100 ASP H H 100 9.253 9.253 8.442 0.811 18935 7749 1 10 . 1 1 101 101 LEU N N 101 119.402 119.402 122.718 -3.316 18935 7750 1 10 . 1 1 101 101 LEU C C 101 173.869 173.869 175.252 -1.383 18935 7751 1 10 . 1 1 101 101 LEU CA C 101 51.655 51.655 53.919 -2.264 18935 7752 1 10 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.486 0.680 18935 7753 1 10 . 1 1 101 101 LEU H H 101 8.726 8.726 7.863 0.863 18935 7754 1 10 . 1 1 102 102 PHE N N 102 117.952 117.952 119.267 -1.315 18935 7755 1 10 . 1 1 102 102 PHE C C 102 175.853 175.853 174.917 0.936 18935 7756 1 10 . 1 1 102 102 PHE CA C 102 53.282 53.282 56.068 -2.786 18935 7757 1 10 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.909 0.915 18935 7758 1 10 . 1 1 102 102 PHE H H 102 8.236 8.236 8.908 -0.672 18935 7759 1 10 . 1 1 103 103 THR N N 103 106.853 106.853 119.084 -12.231 18935 7760 1 10 . 1 1 103 103 THR C C 103 175.154 175.154 174.056 1.098 18935 7761 1 10 . 1 1 103 103 THR CA C 103 57.685 57.685 60.548 -2.863 18935 7762 1 10 . 1 1 103 103 THR CB C 103 71.037 71.037 68.983 2.054 18935 7763 1 10 . 1 1 103 103 THR H H 103 7.917 7.917 8.747 -0.830 18935 7764 1 10 . 1 1 104 104 ALA N N 104 122.348 122.348 129.361 -7.013 18935 7765 1 10 . 1 1 104 104 ALA C C 104 175.947 175.947 174.895 1.052 18935 7766 1 10 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.209 -0.402 18935 7767 1 10 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.723 -0.295 18935 7768 1 10 . 1 1 104 104 ALA H H 104 8.930 8.930 8.850 0.080 18935 7769 1 10 . 1 1 105 105 LEU N N 105 119.855 119.855 119.641 0.214 18935 7770 1 10 . 1 1 105 105 LEU C C 105 179.628 179.628 178.886 0.742 18935 7771 1 10 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.609 -1.486 18935 7772 1 10 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.331 -1.997 18935 7773 1 10 . 1 1 105 105 LEU H H 105 8.316 8.316 8.992 -0.676 18935 7774 1 10 . 1 1 106 106 ALA N N 106 123.662 123.662 125.273 -1.611 18935 7775 1 10 . 1 1 106 106 ALA C C 106 181.056 181.056 179.084 1.972 18935 7776 1 10 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.218 1.131 18935 7777 1 10 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.475 -1.160 18935 7778 1 10 . 1 1 106 106 ALA H H 106 8.306 8.306 8.384 -0.078 18935 7779 1 10 . 1 1 107 107 GLU N N 107 114.825 114.825 115.884 -1.059 18935 7780 1 10 . 1 1 107 107 GLU C C 107 177.854 177.854 176.540 1.314 18935 7781 1 10 . 1 1 107 107 GLU CA C 107 58.386 58.386 58.001 0.385 18935 7782 1 10 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.728 -0.884 18935 7783 1 10 . 1 1 107 107 GLU H H 107 9.754 9.754 8.847 0.907 18935 7784 1 10 . 1 1 108 108 GLU N N 108 115.097 115.097 117.309 -2.212 18935 7785 1 10 . 1 1 108 108 GLU C C 108 178.001 178.001 177.233 0.768 18935 7786 1 10 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.144 -1.218 18935 7787 1 10 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.751 0.250 18935 7788 1 10 . 1 1 108 108 GLU H H 108 7.859 7.859 7.629 0.230 18935 7789 1 10 . 1 1 109 109 LYS N N 109 118.360 118.360 122.301 -3.941 18935 7790 1 10 . 1 1 109 109 LYS C C 109 172.691 172.691 176.281 -3.590 18935 7791 1 10 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.577 1.325 18935 7792 1 10 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.310 0.231 18935 7793 1 10 . 1 1 109 109 LYS H H 109 7.660 7.660 7.289 0.371 18935 7794 1 10 . 1 1 111 111 TYR N N 111 114.054 114.054 118.254 -4.200 18935 7795 1 10 . 1 1 111 111 TYR C C 111 179.764 179.764 178.034 1.730 18935 7796 1 10 . 1 1 111 111 TYR CA C 111 58.998 58.998 59.554 -0.556 18935 7797 1 10 . 1 1 111 111 TYR CB C 111 35.956 35.956 36.969 -1.013 18935 7798 1 10 . 1 1 111 111 TYR H H 111 6.583 6.583 7.760 -1.177 18935 7799 1 10 . 1 1 112 112 ALA N N 112 124.749 124.749 122.475 2.274 18935 7800 1 10 . 1 1 112 112 ALA C C 112 179.430 179.430 179.613 -0.183 18935 7801 1 10 . 1 1 112 112 ALA CA C 112 54.969 54.969 55.228 -0.259 18935 7802 1 10 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.710 0.102 18935 7803 1 10 . 1 1 112 112 ALA H H 112 8.753 8.753 8.714 0.039 18935 7804 1 10 . 1 1 113 113 ILE N N 113 119.130 119.130 119.707 -0.577 18935 7805 1 10 . 1 1 113 113 ILE C C 113 178.646 178.646 178.520 0.126 18935 7806 1 10 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.465 1.936 18935 7807 1 10 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.628 0.609 18935 7808 1 10 . 1 1 113 113 ILE H H 113 8.946 8.946 8.780 0.166 18935 7809 1 10 . 1 1 114 114 PHE N N 114 121.758 121.758 121.163 0.595 18935 7810 1 10 . 1 1 114 114 PHE C C 114 177.954 177.954 177.448 0.506 18935 7811 1 10 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.243 -1.466 18935 7812 1 10 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.574 0.490 18935 7813 1 10 . 1 1 114 114 PHE H H 114 7.940 7.940 8.258 -0.318 18935 7814 1 10 . 1 1 115 115 HIS N N 115 116.547 116.547 119.156 -2.609 18935 7815 1 10 . 1 1 115 115 HIS C C 115 176.161 176.161 176.552 -0.391 18935 7816 1 10 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.583 -0.464 18935 7817 1 10 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.553 1.514 18935 7818 1 10 . 1 1 115 115 HIS H H 115 7.767 7.767 8.091 -0.324 18935 7819 1 10 . 1 1 116 116 PHE N N 116 109.387 109.387 113.380 -3.993 18935 7820 1 10 . 1 1 116 116 PHE C C 116 177.282 177.282 176.893 0.389 18935 7821 1 10 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.740 1.694 18935 7822 1 10 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.400 -2.145 18935 7823 1 10 . 1 1 116 116 PHE H H 116 8.989 8.989 8.174 0.815 18935 7824 1 10 . 1 1 117 117 THR N N 117 116.864 116.864 114.576 2.288 18935 7825 1 10 . 1 1 117 117 THR C C 117 172.889 172.889 175.174 -2.285 18935 7826 1 10 . 1 1 117 117 THR CA C 117 66.997 66.997 64.931 2.066 18935 7827 1 10 . 1 1 117 117 THR CB C 117 67.948 67.948 69.501 -1.553 18935 7828 1 10 . 1 1 117 117 THR H H 117 7.988 7.988 8.070 -0.082 18935 7829 1 10 . 1 1 118 118 GLY N N 118 103.320 103.320 108.966 -5.646 18935 7830 1 10 . 1 1 118 118 GLY C C 118 176.912 176.912 171.596 5.316 18935 7831 1 10 . 1 1 118 118 GLY CA C 118 44.182 44.182 43.032 1.150 18935 7832 1 10 . 1 1 118 118 GLY H H 118 6.550 6.550 7.296 -0.746 18935 7833 1 10 . 1 1 120 120 VAL N N 120 120.671 120.671 126.493 -5.822 18935 7834 1 10 . 1 1 120 120 VAL C C 120 176.283 176.283 177.323 -1.040 18935 7835 1 10 . 1 1 120 120 VAL CA C 120 66.940 66.940 66.434 0.506 18935 7836 1 10 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.948 -2.096 18935 7837 1 10 . 1 1 120 120 VAL H H 120 8.408 8.408 8.533 -0.125 18935 7838 1 10 . 1 1 121 121 SER N N 121 111.789 111.789 114.533 -2.744 18935 7839 1 10 . 1 1 121 121 SER C C 121 175.658 175.658 176.628 -0.970 18935 7840 1 10 . 1 1 121 121 SER CA C 121 60.814 60.814 61.762 -0.948 18935 7841 1 10 . 1 1 121 121 SER CB C 121 60.253 60.253 62.375 -2.122 18935 7842 1 10 . 1 1 121 121 SER H H 121 8.290 8.290 8.297 -0.007 18935 7843 1 10 . 1 1 122 122 TYR N N 122 123.254 123.254 123.031 0.223 18935 7844 1 10 . 1 1 122 122 TYR C C 122 174.611 174.611 177.650 -3.039 18935 7845 1 10 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.980 -2.434 18935 7846 1 10 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.271 -0.132 18935 7847 1 10 . 1 1 122 122 TYR H H 122 6.303 6.303 7.390 -1.087 18935 7848 1 10 . 1 1 123 123 LEU N N 123 114.825 114.825 119.951 -5.126 18935 7849 1 10 . 1 1 123 123 LEU C C 123 178.891 178.891 179.174 -0.283 18935 7850 1 10 . 1 1 123 123 LEU CA C 123 56.779 56.779 58.248 -1.469 18935 7851 1 10 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.956 -0.318 18935 7852 1 10 . 1 1 123 123 LEU H H 123 6.965 6.965 7.913 -0.948 18935 7853 1 10 . 1 1 124 124 ILE N N 124 114.915 114.915 119.018 -4.103 18935 7854 1 10 . 1 1 124 124 ILE C C 124 177.187 177.187 177.811 -0.624 18935 7855 1 10 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.553 -1.122 18935 7856 1 10 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.287 -0.732 18935 7857 1 10 . 1 1 124 124 ILE H H 124 7.531 7.531 7.903 -0.372 18935 7858 1 10 . 1 1 125 125 ARG N N 125 115.278 115.278 118.672 -3.394 18935 7859 1 10 . 1 1 125 125 ARG C C 125 178.473 178.473 179.167 -0.694 18935 7860 1 10 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.946 -0.487 18935 7861 1 10 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.300 -2.221 18935 7862 1 10 . 1 1 125 125 ARG H H 125 6.809 6.809 7.506 -0.697 18935 7863 1 10 . 1 1 126 126 ILE N N 126 124.160 124.160 119.719 4.441 18935 7864 1 10 . 1 1 126 126 ILE C C 126 178.172 178.172 177.458 0.714 18935 7865 1 10 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.867 -1.940 18935 7866 1 10 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.574 -3.108 18935 7867 1 10 . 1 1 126 126 ILE H H 126 7.408 7.408 7.518 -0.110 18935 7868 1 10 . 1 1 127 127 ARG N N 127 117.136 117.136 120.701 -3.565 18935 7869 1 10 . 1 1 127 127 ARG C C 127 179.227 179.227 178.501 0.726 18935 7870 1 10 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.736 0.480 18935 7871 1 10 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.584 -1.795 18935 7872 1 10 . 1 1 127 127 ARG H H 127 8.230 8.230 8.129 0.101 18935 7873 1 10 . 1 1 128 128 ALA N N 128 121.305 121.305 120.865 0.440 18935 7874 1 10 . 1 1 128 128 ALA C C 128 179.933 179.933 178.913 1.020 18935 7875 1 10 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.308 -0.602 18935 7876 1 10 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.181 0.157 18935 7877 1 10 . 1 1 128 128 ALA H H 128 8.666 8.666 8.009 0.657 18935 7878 1 10 . 1 1 129 129 ALA N N 129 120.943 120.943 121.298 -0.355 18935 7879 1 10 . 1 1 129 129 ALA C C 129 181.336 181.336 180.076 1.260 18935 7880 1 10 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.880 -0.172 18935 7881 1 10 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.212 -1.352 18935 7882 1 10 . 1 1 129 129 ALA H H 129 7.837 7.837 7.471 0.366 18935 7883 1 10 . 1 1 130 130 LEU N N 130 117.726 117.726 117.811 -0.085 18935 7884 1 10 . 1 1 130 130 LEU C C 130 179.432 179.432 179.395 0.037 18935 7885 1 10 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.873 -0.697 18935 7886 1 10 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.784 -1.218 18935 7887 1 10 . 1 1 130 130 LEU H H 130 8.114 8.114 8.095 0.019 18935 7888 1 10 . 1 1 131 131 LYS N N 131 124.115 124.115 121.198 2.917 18935 7889 1 10 . 1 1 131 131 LYS C C 131 181.452 181.452 179.675 1.777 18935 7890 1 10 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.881 0.005 18935 7891 1 10 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.802 0.396 18935 7892 1 10 . 1 1 131 131 LYS H H 131 8.849 8.849 8.017 0.832 18935 7893 1 10 . 1 1 132 132 LYS N N 132 119.447 119.447 118.362 1.085 18935 7894 1 10 . 1 1 132 132 LYS C C 132 177.607 177.607 178.196 -0.589 18935 7895 1 10 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.518 -0.566 18935 7896 1 10 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.849 -0.424 18935 7897 1 10 . 1 1 132 132 LYS H H 132 7.778 7.778 8.053 -0.275 18935 7898 1 10 . 1 1 133 133 LYS N N 133 116.638 116.638 116.156 0.482 18935 7899 1 10 . 1 1 133 133 LYS C C 133 174.681 174.681 175.914 -1.233 18935 7900 1 10 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.728 -0.650 18935 7901 1 10 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.882 -1.242 18935 7902 1 10 . 1 1 133 133 LYS H H 133 7.617 7.617 7.696 -0.079 18935 7903 1 10 . 1 1 134 134 ASN N N 134 110.792 110.792 115.365 -4.573 18935 7904 1 10 . 1 1 134 134 ASN C C 134 174.034 174.034 173.311 0.723 18935 7905 1 10 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.072 0.543 18935 7906 1 10 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.217 -1.165 18935 7907 1 10 . 1 1 134 134 ASN H H 134 8.123 8.123 8.399 -0.276 18935 7908 1 10 . 1 1 135 135 TYR N N 135 115.867 115.867 116.819 -0.952 18935 7909 1 10 . 1 1 135 135 TYR C C 135 175.122 175.122 173.993 1.129 18935 7910 1 10 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.787 -0.035 18935 7911 1 10 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.372 -1.456 18935 7912 1 10 . 1 1 135 135 TYR H H 135 8.133 8.133 7.910 0.223 18935 7913 1 10 . 1 1 136 136 LYS N N 136 119.870 119.870 124.303 -4.433 18935 7914 1 10 . 1 1 136 136 LYS C C 136 174.324 174.324 174.265 0.059 18935 7915 1 10 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.711 0.470 18935 7916 1 10 . 1 1 136 136 LYS CB C 136 34.073 34.073 35.798 -1.725 18935 7917 1 10 . 1 1 136 136 LYS H H 136 9.234 9.234 8.971 0.263 18935 7918 1 10 . 1 1 137 137 LEU N N 137 129.708 129.708 128.751 0.957 18935 7919 1 10 . 1 1 137 137 LEU C C 137 173.798 173.798 175.227 -1.429 18935 7920 1 10 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.406 -1.572 18935 7921 1 10 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.314 1.669 18935 7922 1 10 . 1 1 137 137 LEU H H 137 8.959 8.959 8.733 0.226 18935 7923 1 10 . 1 1 140 140 TYR N N 140 120.580 120.580 113.427 7.153 18935 7924 1 10 . 1 1 140 140 TYR C C 140 174.705 174.705 176.406 -1.701 18935 7925 1 10 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.052 -1.600 18935 7926 1 10 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.874 -0.573 18935 7927 1 10 . 1 1 140 140 TYR H H 140 8.962 8.962 7.455 1.507 18935 7928 1 10 . 1 1 141 141 GLY N N 141 104.986 104.986 106.435 -1.449 18935 7929 1 10 . 1 1 141 141 GLY C C 141 181.854 181.854 172.257 9.597 18935 7930 1 10 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.737 -0.615 18935 7931 1 10 . 1 1 141 141 GLY H H 141 7.555 7.555 7.584 -0.029 18935 7932 1 10 . 1 1 142 142 LEU N N 142 118.269 118.269 121.240 -2.971 18935 7933 1 10 . 1 1 142 142 LEU C C 142 174.067 174.067 175.644 -1.577 18935 7934 1 10 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.532 -1.030 18935 7935 1 10 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.595 0.947 18935 7936 1 10 . 1 1 142 142 LEU H H 142 7.794 7.794 8.060 -0.266 18935 7937 1 10 . 1 1 143 143 PHE N N 143 122.076 122.076 125.350 -3.274 18935 7938 1 10 . 1 1 143 143 PHE C C 143 175.199 175.199 174.930 0.269 18935 7939 1 10 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.502 -1.470 18935 7940 1 10 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.961 2.109 18935 7941 1 10 . 1 1 143 143 PHE H H 143 9.522 9.522 9.573 -0.051 18935 7942 1 10 . 1 1 144 144 LYS N N 144 121.305 121.305 124.860 -3.555 18935 7943 1 10 . 1 1 144 144 LYS C C 144 176.917 176.917 176.502 0.415 18935 7944 1 10 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.321 1.036 18935 7945 1 10 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.228 0.451 18935 7946 1 10 . 1 1 144 144 LYS H H 144 9.076 9.076 8.996 0.080 18935 7947 1 10 . 1 1 145 145 ASN N N 145 126.834 126.834 124.908 1.926 18935 7948 1 10 . 1 1 145 145 ASN C C 145 175.070 175.070 174.582 0.488 18935 7949 1 10 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.387 0.377 18935 7950 1 10 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.726 -1.296 18935 7951 1 10 . 1 1 145 145 ASN H H 145 9.618 9.618 9.197 0.421 18935 7952 1 10 . 1 1 146 146 GLN N N 146 110.112 110.112 109.403 0.709 18935 7953 1 10 . 1 1 146 146 GLN C C 146 175.198 175.198 175.078 0.120 18935 7954 1 10 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.597 -0.701 18935 7955 1 10 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.548 -1.180 18935 7956 1 10 . 1 1 146 146 GLN H H 146 9.140 9.140 8.680 0.460 18935 7957 1 10 . 1 1 147 147 THR N N 147 116.003 116.003 116.271 -0.268 18935 7958 1 10 . 1 1 147 147 THR C C 147 173.224 173.224 173.281 -0.057 18935 7959 1 10 . 1 1 147 147 THR CA C 147 61.450 61.450 61.369 0.081 18935 7960 1 10 . 1 1 147 147 THR CB C 147 70.285 70.285 70.080 0.205 18935 7961 1 10 . 1 1 147 147 THR H H 147 8.069 8.069 7.685 0.384 18935 7962 1 10 . 1 1 148 148 LEU N N 148 129.281 129.281 130.808 -1.527 18935 7963 1 10 . 1 1 148 148 LEU C C 148 176.703 176.703 175.665 1.038 18935 7964 1 10 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.606 -0.140 18935 7965 1 10 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.541 -0.816 18935 7966 1 10 . 1 1 148 148 LEU H H 148 8.831 8.831 8.855 -0.024 18935 7967 1 10 . 1 1 149 149 VAL N N 149 130.189 130.189 127.515 2.674 18935 7968 1 10 . 1 1 149 149 VAL C C 149 175.012 175.012 173.873 1.139 18935 7969 1 10 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.594 0.674 18935 7970 1 10 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.161 -3.705 18935 7971 1 10 . 1 1 149 149 VAL H H 149 9.243 9.243 9.158 0.085 18935 7972 1 10 . 1 1 151 151 LEU N N 151 123.481 123.481 117.616 5.865 18935 7973 1 10 . 1 1 151 151 LEU C C 151 177.679 177.679 176.886 0.793 18935 7974 1 10 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.550 -0.553 18935 7975 1 10 . 1 1 151 151 LEU CB C 151 43.619 43.619 43.044 0.575 18935 7976 1 10 . 1 1 151 151 LEU H H 151 8.080 8.080 8.150 -0.070 18935 7977 1 10 . 1 1 152 152 LYS N N 152 126.381 126.381 120.916 5.465 18935 7978 1 10 . 1 1 152 152 LYS C C 152 175.115 175.115 175.266 -0.151 18935 7979 1 10 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.311 -1.715 18935 7980 1 10 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.157 -3.092 18935 7981 1 10 . 1 1 152 152 LYS H H 152 9.112 9.112 8.781 0.331 18935 7982 1 10 . 1 1 153 153 ILE N N 153 113.737 113.737 116.882 -3.145 18935 7983 1 10 . 1 1 153 153 ILE C C 153 175.748 175.748 173.963 1.785 18935 7984 1 10 . 1 1 153 153 ILE CA C 153 58.389 58.389 58.964 -0.575 18935 7985 1 10 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.618 1.185 18935 7986 1 10 . 1 1 153 153 ILE H H 153 7.304 7.304 7.629 -0.325 18935 7987 1 10 . 1 1 154 154 THR N N 154 110.656 110.656 112.819 -2.163 18935 7988 1 10 . 1 1 154 154 THR C C 154 174.864 174.864 173.113 1.751 18935 7989 1 10 . 1 1 154 154 THR CA C 154 62.141 62.141 62.869 -0.728 18935 7990 1 10 . 1 1 154 154 THR CB C 154 70.413 70.413 70.324 0.089 18935 7991 1 10 . 1 1 154 154 THR H H 154 9.382 9.382 8.306 1.076 18935 7992 1 10 . 1 1 155 155 THR N N 155 110.746 110.746 116.947 -6.201 18935 7993 1 10 . 1 1 155 155 THR C C 155 174.718 174.718 174.790 -0.072 18935 7994 1 10 . 1 1 155 155 THR CA C 155 58.785 58.785 61.131 -2.346 18935 7995 1 10 . 1 1 155 155 THR CB C 155 72.277 72.277 70.993 1.284 18935 7996 1 10 . 1 1 155 155 THR H H 155 7.746 7.746 7.652 0.094 18935 7997 1 10 . 1 1 156 156 GLU N N 156 122.302 122.302 123.396 -1.094 18935 7998 1 10 . 1 1 156 156 GLU C C 156 177.289 177.289 177.807 -0.518 18935 7999 1 10 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.431 -1.607 18935 8000 1 10 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.346 -0.965 18935 8001 1 10 . 1 1 156 156 GLU H H 156 9.490 9.490 8.992 0.498 18935 8002 1 10 . 1 1 157 157 LYS N N 157 118.905 118.905 118.402 0.503 18935 8003 1 10 . 1 1 157 157 LYS C C 157 178.241 178.241 179.015 -0.774 18935 8004 1 10 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.147 1.618 18935 8005 1 10 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.898 -0.620 18935 8006 1 10 . 1 1 157 157 LYS H H 157 8.329 8.329 8.252 0.077 18935 8007 1 10 . 1 1 158 158 GLU N N 158 116.230 116.230 120.670 -4.440 18935 8008 1 10 . 1 1 158 158 GLU C C 158 178.988 178.988 178.538 0.450 18935 8009 1 10 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.492 -0.236 18935 8010 1 10 . 1 1 158 158 GLU CB C 158 29.058 29.058 28.840 0.218 18935 8011 1 10 . 1 1 158 158 GLU H H 158 7.611 7.611 8.123 -0.512 18935 8012 1 10 . 1 1 159 159 LEU N N 159 118.978 118.978 120.918 -1.940 18935 8013 1 10 . 1 1 159 159 LEU C C 159 176.347 176.347 178.468 -2.121 18935 8014 1 10 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.478 -5.239 18935 8015 1 10 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.899 -2.356 18935 8016 1 10 . 1 1 159 159 LEU H H 159 7.704 7.704 8.282 -0.578 18935 8017 1 10 . 1 1 160 160 ILE N N 160 117.227 117.227 114.264 2.963 18935 8018 1 10 . 1 1 160 160 ILE C C 160 177.219 177.219 177.308 -0.089 18935 8019 1 10 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.876 0.739 18935 8020 1 10 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.173 0.384 18935 8021 1 10 . 1 1 160 160 ILE H H 160 7.886 7.886 7.438 0.448 18935 8022 1 10 . 1 1 161 161 LYS N N 161 115.912 115.912 119.368 -3.456 18935 8023 1 10 . 1 1 161 161 LYS C C 161 180.990 180.990 178.811 2.179 18935 8024 1 10 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.445 0.186 18935 8025 1 10 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.151 -1.403 18935 8026 1 10 . 1 1 161 161 LYS H H 161 7.536 7.536 7.653 -0.117 18935 8027 1 10 . 1 1 162 162 GLU N N 162 120.852 120.852 120.787 0.065 18935 8028 1 10 . 1 1 162 162 GLU C C 162 178.793 178.793 177.978 0.815 18935 8029 1 10 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.265 -0.283 18935 8030 1 10 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.428 -1.637 18935 8031 1 10 . 1 1 162 162 GLU H H 162 8.392 8.392 8.007 0.385 18935 8032 1 10 . 1 1 163 163 LEU N N 163 115.912 115.912 116.943 -1.031 18935 8033 1 10 . 1 1 163 163 LEU C C 163 176.370 176.370 177.038 -0.668 18935 8034 1 10 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.599 -0.505 18935 8035 1 10 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.804 -1.630 18935 8036 1 10 . 1 1 163 163 LEU H H 163 8.031 8.031 7.956 0.075 18935 8037 1 10 . 1 1 164 164 GLY N N 164 103.160 103.160 105.087 -1.927 18935 8038 1 10 . 1 1 164 164 GLY C C 164 174.240 174.240 173.860 0.380 18935 8039 1 10 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.843 -0.541 18935 8040 1 10 . 1 1 164 164 GLY H H 164 7.625 7.625 7.639 -0.014 18935 8041 1 10 . 1 1 165 165 PHE N N 165 117.952 117.952 117.732 0.220 18935 8042 1 10 . 1 1 165 165 PHE C C 165 174.556 174.556 174.202 0.354 18935 8043 1 10 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.968 -0.503 18935 8044 1 10 . 1 1 165 165 PHE CB C 165 40.762 40.762 42.018 -1.256 18935 8045 1 10 . 1 1 165 165 PHE H H 165 7.283 7.283 8.214 -0.931 18935 8046 1 10 . 1 1 166 166 THR N N 166 118.178 118.178 113.808 4.370 18935 8047 1 10 . 1 1 166 166 THR C C 166 175.306 175.306 172.939 2.367 18935 8048 1 10 . 1 1 166 166 THR CA C 166 63.466 63.466 60.613 2.853 18935 8049 1 10 . 1 1 166 166 THR CB C 166 68.721 68.721 70.942 -2.221 18935 8050 1 10 . 1 1 166 166 THR H H 166 9.678 9.678 8.435 1.243 18935 8051 1 10 . 1 1 167 167 TYR N N 167 128.239 128.239 123.066 5.173 18935 8052 1 10 . 1 1 167 167 TYR C C 167 173.297 173.297 175.356 -2.059 18935 8053 1 10 . 1 1 167 167 TYR CA C 167 60.412 60.412 58.956 1.456 18935 8054 1 10 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.036 -2.314 18935 8055 1 10 . 1 1 167 167 TYR H H 167 9.264 9.264 8.674 0.590 18935 8056 1 10 . 1 1 168 168 ARG N N 168 126.789 126.789 127.245 -0.456 18935 8057 1 10 . 1 1 168 168 ARG C C 168 175.297 175.297 175.573 -0.276 18935 8058 1 10 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.984 -2.219 18935 8059 1 10 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.007 -0.680 18935 8060 1 10 . 1 1 168 168 ARG H H 168 7.030 7.030 8.458 -1.428 18935 8061 1 10 . 1 1 169 169 ILE N N 169 119.221 119.221 115.936 3.285 18935 8062 1 10 . 1 1 169 169 ILE C C 169 174.522 174.522 175.653 -1.131 18935 8063 1 10 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.397 2.882 18935 8064 1 10 . 1 1 169 169 ILE CB C 169 34.647 34.647 38.973 -4.326 18935 8065 1 10 . 1 1 169 169 ILE H H 169 8.349 8.349 8.267 0.082 18935 8066 1 10 . 1 1 171 171 LYS N N 171 111.335 111.335 117.896 -6.561 18935 8067 1 10 . 1 1 171 171 LYS C C 171 176.638 176.638 177.501 -0.863 18935 8068 1 10 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.928 -1.391 18935 8069 1 10 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.688 0.279 18935 8070 1 10 . 1 1 171 171 LYS H H 171 8.198 8.198 8.449 -0.251 18935 8071 1 10 . 1 1 172 172 LYS N N 172 116.411 116.411 118.088 -1.677 18935 8072 1 10 . 1 1 172 172 LYS C C 172 175.331 175.331 175.554 -0.223 18935 8073 1 10 . 1 1 172 172 LYS CA C 172 54.001 54.001 54.364 -0.363 18935 8074 1 10 . 1 1 172 172 LYS CB C 172 31.818 31.818 32.638 -0.820 18935 8075 1 10 . 1 1 172 172 LYS H H 172 7.843 7.843 7.540 0.303 18935 8076 1 10 . 1 1 173 173 ARG N N 173 120.490 120.490 120.210 0.280 18935 8077 1 10 . 1 1 173 173 ARG C C 173 172.830 172.830 175.599 -2.769 18935 8078 1 10 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.571 0.605 18935 8079 1 10 . 1 1 173 173 ARG CB C 173 28.829 28.829 29.801 -0.972 18935 8080 1 10 . 1 1 173 173 ARG H H 173 6.917 6.917 7.697 -0.780 18935 8081 1 11 . 1 1 2 2 LEU N N 2 119.937 119.937 116.733 3.204 18935 8082 1 11 . 1 1 2 2 LEU C C 2 175.307 175.307 175.064 0.243 18935 8083 1 11 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.685 0.607 18935 8084 1 11 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.529 -1.845 18935 8085 1 11 . 1 1 2 2 LEU H H 2 9.251 9.251 7.912 1.339 18935 8086 1 11 . 1 1 3 3 THR N N 3 111.335 111.335 109.799 1.536 18935 8087 1 11 . 1 1 3 3 THR C C 3 175.854 175.854 175.750 0.104 18935 8088 1 11 . 1 1 3 3 THR CA C 3 60.540 60.540 60.247 0.293 18935 8089 1 11 . 1 1 3 3 THR CB C 3 70.782 70.782 70.835 -0.053 18935 8090 1 11 . 1 1 3 3 THR H H 3 8.677 8.677 8.113 0.565 18935 8091 1 11 . 1 1 4 4 LEU N N 4 120.988 120.988 123.275 -2.287 18935 8092 1 11 . 1 1 4 4 LEU C C 4 178.391 178.391 178.322 0.069 18935 8093 1 11 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.930 0.134 18935 8094 1 11 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.982 -2.721 18935 8095 1 11 . 1 1 4 4 LEU H H 4 7.746 7.746 8.660 -0.914 18935 8096 1 11 . 1 1 5 5 ILE N N 5 114.236 114.236 114.453 -0.217 18935 8097 1 11 . 1 1 5 5 ILE C C 5 178.339 178.339 177.833 0.506 18935 8098 1 11 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.642 -1.060 18935 8099 1 11 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.094 -0.295 18935 8100 1 11 . 1 1 5 5 ILE H H 5 7.821 7.821 7.697 0.124 18935 8101 1 11 . 1 1 6 6 GLN N N 6 120.399 120.399 121.467 -1.068 18935 8102 1 11 . 1 1 6 6 GLN C C 6 178.783 178.783 178.354 0.429 18935 8103 1 11 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.572 -1.352 18935 8104 1 11 . 1 1 6 6 GLN CB C 6 28.115 28.115 27.999 0.116 18935 8105 1 11 . 1 1 6 6 GLN H H 6 7.810 7.810 8.181 -0.371 18935 8106 1 11 . 1 1 7 7 GLY N N 7 106.277 106.277 105.844 0.433 18935 8107 1 11 . 1 1 7 7 GLY C C 7 174.554 174.554 176.275 -1.721 18935 8108 1 11 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.016 -0.082 18935 8109 1 11 . 1 1 7 7 GLY H H 7 8.733 8.733 8.037 0.696 18935 8110 1 11 . 1 1 8 8 LYS N N 8 119.991 119.991 121.587 -1.596 18935 8111 1 11 . 1 1 8 8 LYS C C 8 179.433 179.433 178.118 1.315 18935 8112 1 11 . 1 1 8 8 LYS CA C 8 59.892 59.892 57.843 2.049 18935 8113 1 11 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.132 -0.800 18935 8114 1 11 . 1 1 8 8 LYS H H 8 8.688 8.688 7.545 1.143 18935 8115 1 11 . 1 1 9 9 LYS N N 9 119.175 119.175 120.802 -1.627 18935 8116 1 11 . 1 1 9 9 LYS CA C 9 59.382 59.382 60.050 -0.668 18935 8117 1 11 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.460 -1.025 18935 8118 1 11 . 1 1 9 9 LYS H H 9 8.015 8.015 7.908 0.107 18935 8119 1 11 . 1 1 10 10 ILE N N 10 120.308 120.308 116.274 4.034 18935 8120 1 11 . 1 1 10 10 ILE C C 10 177.766 177.766 177.382 0.384 18935 8121 1 11 . 1 1 10 10 ILE CA C 10 64.676 64.676 65.153 -0.477 18935 8122 1 11 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.275 -0.962 18935 8123 1 11 . 1 1 10 10 ILE H H 10 7.967 7.967 8.315 -0.348 18935 8124 1 11 . 1 1 11 11 VAL N N 11 119.130 119.130 120.847 -1.717 18935 8125 1 11 . 1 1 11 11 VAL C C 11 176.606 176.606 177.931 -1.325 18935 8126 1 11 . 1 1 11 11 VAL CA C 11 67.640 67.640 67.208 0.432 18935 8127 1 11 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.253 -1.044 18935 8128 1 11 . 1 1 11 11 VAL H H 11 8.128 8.128 7.662 0.466 18935 8129 1 11 . 1 1 12 12 ASN N N 12 115.822 115.822 117.304 -1.482 18935 8130 1 11 . 1 1 12 12 ASN C C 12 177.375 177.375 176.947 0.428 18935 8131 1 11 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.467 -0.497 18935 8132 1 11 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.608 -1.045 18935 8133 1 11 . 1 1 12 12 ASN H H 12 8.203 8.203 7.843 0.360 18935 8134 1 11 . 1 1 13 13 HIS N N 13 117.659 117.659 118.689 -1.030 18935 8135 1 11 . 1 1 13 13 HIS C C 13 177.287 177.287 178.320 -1.033 18935 8136 1 11 . 1 1 13 13 HIS CA C 13 58.687 58.687 59.272 -0.585 18935 8137 1 11 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.457 -0.436 18935 8138 1 11 . 1 1 13 13 HIS H H 13 7.861 7.861 7.781 0.080 18935 8139 1 11 . 1 1 14 14 LEU N N 14 115.595 115.595 120.208 -4.613 18935 8140 1 11 . 1 1 14 14 LEU C C 14 179.092 179.092 178.699 0.393 18935 8141 1 11 . 1 1 14 14 LEU CA C 14 56.641 56.641 57.596 -0.955 18935 8142 1 11 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.531 -0.511 18935 8143 1 11 . 1 1 14 14 LEU H H 14 8.376 8.376 8.937 -0.561 18935 8144 1 11 . 1 1 15 15 ARG N N 15 115.006 115.006 117.674 -2.668 18935 8145 1 11 . 1 1 15 15 ARG C C 15 176.265 176.265 177.205 -0.940 18935 8146 1 11 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.910 0.974 18935 8147 1 11 . 1 1 15 15 ARG CB C 15 29.072 29.072 30.289 -1.217 18935 8148 1 11 . 1 1 15 15 ARG H H 15 8.074 8.074 8.202 -0.128 18935 8149 1 11 . 1 1 16 16 SER N N 16 107.778 107.778 112.614 -4.836 18935 8150 1 11 . 1 1 16 16 SER C C 16 176.009 176.009 175.465 0.544 18935 8151 1 11 . 1 1 16 16 SER CA C 16 57.244 57.244 59.690 -2.446 18935 8152 1 11 . 1 1 16 16 SER CB C 16 63.525 63.525 63.977 -0.452 18935 8153 1 11 . 1 1 16 16 SER H H 16 7.136 7.136 7.822 -0.686 18935 8154 1 11 . 1 1 17 17 ARG N N 17 121.532 121.532 122.715 -1.183 18935 8155 1 11 . 1 1 17 17 ARG C C 17 174.482 174.482 175.702 -1.220 18935 8156 1 11 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.817 0.505 18935 8157 1 11 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.000 0.830 18935 8158 1 11 . 1 1 17 17 ARG H H 17 7.913 7.913 7.620 0.293 18935 8159 1 11 . 1 1 18 18 LEU N N 18 121.305 121.305 120.065 1.240 18935 8160 1 11 . 1 1 18 18 LEU C C 18 176.283 176.283 174.868 1.415 18935 8161 1 11 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.398 -0.700 18935 8162 1 11 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.394 -0.339 18935 8163 1 11 . 1 1 18 18 LEU H H 18 8.812 8.812 7.559 1.253 18935 8164 1 11 . 1 1 19 19 ALA N N 19 125.293 125.293 120.712 4.581 18935 8165 1 11 . 1 1 19 19 ALA C C 19 173.780 173.780 175.102 -1.322 18935 8166 1 11 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.794 -0.992 18935 8167 1 11 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.906 0.947 18935 8168 1 11 . 1 1 19 19 ALA H H 19 8.790 8.790 7.811 0.979 18935 8169 1 11 . 1 1 20 20 PHE N N 20 113.117 113.117 115.571 -2.454 18935 8170 1 11 . 1 1 20 20 PHE C C 20 172.708 172.708 172.836 -0.128 18935 8171 1 11 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.617 -1.019 18935 8172 1 11 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.349 0.376 18935 8173 1 11 . 1 1 20 20 PHE H H 20 8.925 8.925 8.791 0.134 18935 8174 1 11 . 1 1 21 21 GLU N N 21 121.532 121.532 120.095 1.437 18935 8175 1 11 . 1 1 21 21 GLU C C 21 174.830 174.830 175.637 -0.807 18935 8176 1 11 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.686 -0.723 18935 8177 1 11 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.622 -2.279 18935 8178 1 11 . 1 1 21 21 GLU H H 21 7.972 7.972 9.108 -1.136 18935 8179 1 11 . 1 1 22 22 TYR N N 22 125.339 125.339 120.902 4.437 18935 8180 1 11 . 1 1 22 22 TYR C C 22 174.864 174.864 174.819 0.045 18935 8181 1 11 . 1 1 22 22 TYR CA C 22 55.288 55.288 57.691 -2.403 18935 8182 1 11 . 1 1 22 22 TYR CB C 22 39.859 39.859 39.747 0.112 18935 8183 1 11 . 1 1 22 22 TYR H H 22 9.016 9.016 8.510 0.506 18935 8184 1 11 . 1 1 23 23 ASN N N 23 127.024 127.024 125.182 1.842 18935 8185 1 11 . 1 1 23 23 ASN C C 23 175.410 175.410 175.282 0.128 18935 8186 1 11 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.732 -0.678 18935 8187 1 11 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.904 -1.643 18935 8188 1 11 . 1 1 23 23 ASN H H 23 9.181 9.181 9.137 0.044 18935 8189 1 11 . 1 1 24 24 GLY N N 24 102.755 102.755 102.878 -0.123 18935 8190 1 11 . 1 1 24 24 GLY C C 24 173.626 173.626 174.153 -0.527 18935 8191 1 11 . 1 1 24 24 GLY CA C 24 44.935 44.935 44.914 0.021 18935 8192 1 11 . 1 1 24 24 GLY H H 24 8.666 8.666 8.203 0.463 18935 8193 1 11 . 1 1 25 25 GLN N N 25 118.722 118.722 120.922 -2.200 18935 8194 1 11 . 1 1 25 25 GLN C C 25 173.657 173.657 174.930 -1.273 18935 8195 1 11 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.530 -1.297 18935 8196 1 11 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.507 0.298 18935 8197 1 11 . 1 1 25 25 GLN H H 25 7.708 7.708 8.013 -0.305 18935 8198 1 11 . 1 1 26 26 LEU N N 26 123.526 123.526 120.935 2.591 18935 8199 1 11 . 1 1 26 26 LEU C C 26 175.842 175.842 176.203 -0.361 18935 8200 1 11 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.895 0.090 18935 8201 1 11 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.955 -3.148 18935 8202 1 11 . 1 1 26 26 LEU H H 26 8.543 8.543 8.341 0.202 18935 8203 1 11 . 1 1 27 27 ILE N N 27 129.462 129.462 124.334 5.128 18935 8204 1 11 . 1 1 27 27 ILE C C 27 175.085 175.085 174.122 0.963 18935 8205 1 11 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.274 0.699 18935 8206 1 11 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.241 -2.689 18935 8207 1 11 . 1 1 27 27 ILE H H 27 8.989 8.989 9.073 -0.084 18935 8208 1 11 . 1 1 28 28 LYS N N 28 125.157 125.157 126.751 -1.594 18935 8209 1 11 . 1 1 28 28 LYS C C 28 176.725 176.725 175.539 1.186 18935 8210 1 11 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.502 1.308 18935 8211 1 11 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.392 -1.575 18935 8212 1 11 . 1 1 28 28 LYS H H 28 8.311 8.311 8.233 0.078 18935 8213 1 11 . 1 1 29 29 ILE N N 29 125.565 125.565 116.326 9.239 18935 8214 1 11 . 1 1 29 29 ILE C C 29 175.685 175.685 174.079 1.606 18935 8215 1 11 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.924 0.481 18935 8216 1 11 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.714 -3.683 18935 8217 1 11 . 1 1 29 29 ILE H H 29 8.209 8.209 7.934 0.275 18935 8218 1 11 . 1 1 30 30 LEU N N 30 127.831 127.831 119.386 8.445 18935 8219 1 11 . 1 1 30 30 LEU C C 30 178.794 178.794 177.481 1.313 18935 8220 1 11 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.033 1.410 18935 8221 1 11 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.082 -4.246 18935 8222 1 11 . 1 1 30 30 LEU H H 30 9.027 9.027 8.147 0.880 18935 8223 1 11 . 1 1 31 31 SER N N 31 116.864 116.864 115.904 0.960 18935 8224 1 11 . 1 1 31 31 SER C C 31 177.464 177.464 175.610 1.854 18935 8225 1 11 . 1 1 31 31 SER CA C 31 61.180 61.180 61.423 -0.243 18935 8226 1 11 . 1 1 31 31 SER CB C 31 62.105 62.105 63.254 -1.149 18935 8227 1 11 . 1 1 31 31 SER H H 31 8.887 8.887 8.522 0.365 18935 8228 1 11 . 1 1 32 32 LYS N N 32 114.825 114.825 119.107 -4.282 18935 8229 1 11 . 1 1 32 32 LYS C C 32 176.243 176.243 175.739 0.504 18935 8230 1 11 . 1 1 32 32 LYS CA C 32 57.292 57.292 56.447 0.845 18935 8231 1 11 . 1 1 32 32 LYS CB C 32 30.266 30.266 30.438 -0.172 18935 8232 1 11 . 1 1 32 32 LYS H H 32 8.290 8.290 8.414 -0.124 18935 8233 1 11 . 1 1 33 33 ASN N N 33 117.564 117.564 113.852 3.712 18935 8234 1 11 . 1 1 33 33 ASN C C 33 172.253 172.253 173.617 -1.364 18935 8235 1 11 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.184 -1.093 18935 8236 1 11 . 1 1 33 33 ASN CB C 33 38.339 38.339 41.525 -3.186 18935 8237 1 11 . 1 1 33 33 ASN H H 33 8.051 8.051 8.197 -0.146 18935 8238 1 11 . 1 1 34 34 ILE N N 34 118.949 118.949 119.722 -0.773 18935 8239 1 11 . 1 1 34 34 ILE C C 34 175.343 175.343 174.955 0.388 18935 8240 1 11 . 1 1 34 34 ILE CA C 34 60.553 60.553 59.853 0.700 18935 8241 1 11 . 1 1 34 34 ILE CB C 34 38.867 38.867 40.581 -1.714 18935 8242 1 11 . 1 1 34 34 ILE H H 34 7.670 7.670 8.019 -0.349 18935 8243 1 11 . 1 1 35 35 VAL N N 35 128.355 128.355 123.800 4.555 18935 8244 1 11 . 1 1 35 35 VAL C C 35 175.543 175.543 174.610 0.933 18935 8245 1 11 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.154 -0.140 18935 8246 1 11 . 1 1 35 35 VAL CB C 35 34.231 34.231 36.389 -2.158 18935 8247 1 11 . 1 1 35 35 VAL H H 35 9.698 9.698 9.051 0.647 18935 8248 1 11 . 1 1 36 36 ALA N N 36 129.553 129.553 130.825 -1.272 18935 8249 1 11 . 1 1 36 36 ALA C C 36 177.015 177.015 176.859 0.156 18935 8250 1 11 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.351 1.045 18935 8251 1 11 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.261 -0.639 18935 8252 1 11 . 1 1 36 36 ALA H H 36 8.917 8.917 8.541 0.376 18935 8253 1 11 . 1 1 37 37 VAL N N 37 115.006 115.006 119.692 -4.686 18935 8254 1 11 . 1 1 37 37 VAL C C 37 174.649 174.649 176.087 -1.438 18935 8255 1 11 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.374 -0.053 18935 8256 1 11 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.707 -1.321 18935 8257 1 11 . 1 1 37 37 VAL H H 37 8.214 8.214 7.670 0.544 18935 8258 1 11 . 1 1 38 38 GLY N N 38 109.387 109.387 107.611 1.776 18935 8259 1 11 . 1 1 38 38 GLY C C 38 174.152 174.152 176.152 -2.000 18935 8260 1 11 . 1 1 38 38 GLY CA C 38 45.497 45.497 46.322 -0.825 18935 8261 1 11 . 1 1 38 38 GLY H H 38 8.677 8.677 7.958 0.719 18935 8262 1 11 . 1 1 39 39 SER N N 39 116.776 116.776 120.367 -3.591 18935 8263 1 11 . 1 1 39 39 SER C C 39 175.129 175.129 176.441 -1.312 18935 8264 1 11 . 1 1 39 39 SER CA C 39 60.036 60.036 62.084 -2.048 18935 8265 1 11 . 1 1 39 39 SER CB C 39 61.522 61.522 63.093 -1.571 18935 8266 1 11 . 1 1 39 39 SER H H 39 9.705 9.705 8.224 1.481 18935 8267 1 11 . 1 1 40 40 LEU N N 40 113.696 113.696 117.648 -3.952 18935 8268 1 11 . 1 1 40 40 LEU C C 40 180.558 180.558 177.941 2.617 18935 8269 1 11 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.560 1.813 18935 8270 1 11 . 1 1 40 40 LEU CB C 40 41.877 41.877 40.733 1.144 18935 8271 1 11 . 1 1 40 40 LEU H H 40 7.311 7.311 7.591 -0.280 18935 8272 1 11 . 1 1 41 41 ARG N N 41 121.162 121.162 116.500 4.662 18935 8273 1 11 . 1 1 41 41 ARG C C 41 176.964 176.964 177.318 -0.354 18935 8274 1 11 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.642 1.808 18935 8275 1 11 . 1 1 41 41 ARG CB C 41 28.205 28.205 31.672 -3.467 18935 8276 1 11 . 1 1 41 41 ARG H H 41 6.999 6.999 7.853 -0.854 18935 8277 1 11 . 1 1 42 42 ARG N N 42 111.109 111.109 118.925 -7.816 18935 8278 1 11 . 1 1 42 42 ARG C C 42 172.564 172.564 176.121 -3.557 18935 8279 1 11 . 1 1 42 42 ARG CA C 42 56.380 56.380 56.456 -0.076 18935 8280 1 11 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.863 -2.514 18935 8281 1 11 . 1 1 42 42 ARG H H 42 7.041 7.041 7.646 -0.605 18935 8282 1 11 . 1 1 43 43 GLU N N 43 111.924 111.924 116.978 -5.054 18935 8283 1 11 . 1 1 43 43 GLU C C 43 176.202 176.202 175.623 0.579 18935 8284 1 11 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.337 -0.883 18935 8285 1 11 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.679 -2.378 18935 8286 1 11 . 1 1 43 43 GLU H H 43 7.757 7.757 7.985 -0.228 18935 8287 1 11 . 1 1 44 44 GLU N N 44 117.861 117.861 121.035 -3.174 18935 8288 1 11 . 1 1 44 44 GLU C C 44 175.197 175.197 176.895 -1.698 18935 8289 1 11 . 1 1 44 44 GLU CA C 44 56.128 56.128 55.764 0.364 18935 8290 1 11 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.602 -2.043 18935 8291 1 11 . 1 1 44 44 GLU H H 44 7.461 7.461 8.043 -0.582 18935 8292 1 11 . 1 1 45 45 LYS N N 45 115.051 115.051 116.732 -1.681 18935 8293 1 11 . 1 1 45 45 LYS C C 45 177.733 177.733 175.361 2.372 18935 8294 1 11 . 1 1 45 45 LYS CA C 45 59.055 59.055 56.486 2.568 18935 8295 1 11 . 1 1 45 45 LYS CB C 45 32.027 32.027 34.581 -2.554 18935 8296 1 11 . 1 1 45 45 LYS H H 45 8.123 8.123 8.491 -0.367 18935 8297 1 11 . 1 1 46 46 MET N N 46 114.009 114.009 120.419 -6.410 18935 8298 1 11 . 1 1 46 46 MET C C 46 174.067 174.067 174.150 -0.083 18935 8299 1 11 . 1 1 46 46 MET CA C 46 52.477 52.477 55.827 -3.350 18935 8300 1 11 . 1 1 46 46 MET CB C 46 33.974 33.974 34.666 -0.692 18935 8301 1 11 . 1 1 46 46 MET H H 46 7.767 7.767 7.720 0.047 18935 8302 1 11 . 1 1 47 47 LEU N N 47 120.263 120.263 121.853 -1.590 18935 8303 1 11 . 1 1 47 47 LEU C C 47 177.669 177.669 175.338 2.331 18935 8304 1 11 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.317 -1.116 18935 8305 1 11 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.375 -0.467 18935 8306 1 11 . 1 1 47 47 LEU H H 47 9.481 9.481 8.047 1.434 18935 8307 1 11 . 1 1 48 48 ASN N N 48 118.632 118.632 117.317 1.315 18935 8308 1 11 . 1 1 48 48 ASN C C 48 174.715 174.715 174.029 0.686 18935 8309 1 11 . 1 1 48 48 ASN CA C 48 55.501 55.501 54.113 1.388 18935 8310 1 11 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.746 -1.918 18935 8311 1 11 . 1 1 48 48 ASN H H 48 9.388 9.388 9.062 0.326 18935 8312 1 11 . 1 1 49 49 ASP N N 49 115.867 115.867 115.393 0.474 18935 8313 1 11 . 1 1 49 49 ASP C C 49 174.111 174.111 174.039 0.072 18935 8314 1 11 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.592 -1.391 18935 8315 1 11 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.753 -3.676 18935 8316 1 11 . 1 1 49 49 ASP H H 49 7.670 7.670 7.937 -0.267 18935 8317 1 11 . 1 1 50 50 VAL N N 50 119.185 119.185 118.988 0.197 18935 8318 1 11 . 1 1 50 50 VAL C C 50 172.333 172.333 174.639 -2.306 18935 8319 1 11 . 1 1 50 50 VAL CA C 50 61.915 61.915 60.898 1.017 18935 8320 1 11 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.081 -0.116 18935 8321 1 11 . 1 1 50 50 VAL H H 50 8.339 8.339 7.766 0.573 18935 8322 1 11 . 1 1 51 51 ASP N N 51 124.704 124.704 126.528 -1.824 18935 8323 1 11 . 1 1 51 51 ASP C C 51 173.725 173.725 175.377 -1.652 18935 8324 1 11 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.288 -0.259 18935 8325 1 11 . 1 1 51 51 ASP CB C 51 43.829 43.829 42.829 1.000 18935 8326 1 11 . 1 1 51 51 ASP H H 51 8.984 8.984 8.665 0.319 18935 8327 1 11 . 1 1 52 52 LEU N N 52 120.943 120.943 122.081 -1.138 18935 8328 1 11 . 1 1 52 52 LEU C C 52 173.045 173.045 174.538 -1.493 18935 8329 1 11 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.612 -0.741 18935 8330 1 11 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.090 -1.837 18935 8331 1 11 . 1 1 52 52 LEU H H 52 9.081 9.081 8.395 0.686 18935 8332 1 11 . 1 1 53 53 LEU N N 53 123.027 123.027 124.224 -1.197 18935 8333 1 11 . 1 1 53 53 LEU C C 53 173.750 173.750 175.156 -1.406 18935 8334 1 11 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.536 -1.203 18935 8335 1 11 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.128 -0.120 18935 8336 1 11 . 1 1 53 53 LEU H H 53 9.146 9.146 8.996 0.149 18935 8337 1 11 . 1 1 54 54 ILE N N 54 126.562 126.562 126.837 -0.275 18935 8338 1 11 . 1 1 54 54 ILE C C 54 175.132 175.132 175.019 0.113 18935 8339 1 11 . 1 1 54 54 ILE CA C 54 58.598 58.598 60.079 -1.481 18935 8340 1 11 . 1 1 54 54 ILE CB C 54 38.561 38.561 40.235 -1.674 18935 8341 1 11 . 1 1 54 54 ILE H H 54 9.440 9.440 9.221 0.219 18935 8342 1 11 . 1 1 55 55 ILE N N 55 126.879 126.879 127.980 -1.101 18935 8343 1 11 . 1 1 55 55 ILE C C 55 175.655 175.655 175.189 0.466 18935 8344 1 11 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.102 -2.541 18935 8345 1 11 . 1 1 55 55 ILE CB C 55 34.306 34.306 40.410 -6.104 18935 8346 1 11 . 1 1 55 55 ILE H H 55 9.381 9.381 8.598 0.783 18935 8347 1 11 . 1 1 56 56 VAL N N 56 128.936 128.936 124.380 4.556 18935 8348 1 11 . 1 1 56 56 VAL C C 56 176.389 176.389 174.561 1.828 18935 8349 1 11 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.725 -0.095 18935 8350 1 11 . 1 1 56 56 VAL CB C 56 32.784 32.784 32.679 0.105 18935 8351 1 11 . 1 1 56 56 VAL H H 56 9.227 9.227 8.906 0.321 18935 8352 1 11 . 1 1 58 58 GLU N N 58 112.423 112.423 120.025 -7.602 18935 8353 1 11 . 1 1 58 58 GLU C C 58 175.946 175.946 176.346 -0.400 18935 8354 1 11 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.344 -1.044 18935 8355 1 11 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.232 0.865 18935 8356 1 11 . 1 1 58 58 GLU H H 58 6.685 6.685 7.904 -1.219 18935 8357 1 11 . 1 1 59 59 LYS N N 59 125.293 125.293 120.626 4.667 18935 8358 1 11 . 1 1 59 59 LYS C C 59 179.248 179.248 176.257 2.991 18935 8359 1 11 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.524 2.250 18935 8360 1 11 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.527 -1.450 18935 8361 1 11 . 1 1 59 59 LYS H H 59 9.108 9.108 8.560 0.548 18935 8362 1 11 . 1 1 60 60 LYS N N 60 117.408 117.408 118.446 -1.038 18935 8363 1 11 . 1 1 60 60 LYS C C 60 177.198 177.198 177.579 -0.381 18935 8364 1 11 . 1 1 60 60 LYS CA C 60 58.213 58.213 58.158 0.055 18935 8365 1 11 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.983 -2.400 18935 8366 1 11 . 1 1 60 60 LYS H H 60 9.102 9.102 7.757 1.345 18935 8367 1 11 . 1 1 61 61 LEU N N 61 114.779 114.779 121.519 -6.740 18935 8368 1 11 . 1 1 61 61 LEU C C 61 178.790 178.790 178.675 0.115 18935 8369 1 11 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.441 -2.417 18935 8370 1 11 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.520 -0.656 18935 8371 1 11 . 1 1 61 61 LEU H H 61 7.455 7.455 8.417 -0.962 18935 8372 1 11 . 1 1 62 62 LEU N N 62 119.629 119.629 117.824 1.805 18935 8373 1 11 . 1 1 62 62 LEU C C 62 177.762 177.762 177.692 0.070 18935 8374 1 11 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.678 0.520 18935 8375 1 11 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.778 -1.047 18935 8376 1 11 . 1 1 62 62 LEU H H 62 7.714 7.714 7.623 0.091 18935 8377 1 11 . 1 1 63 63 LYS N N 63 112.921 112.921 115.162 -2.241 18935 8378 1 11 . 1 1 63 63 LYS C C 63 175.386 175.386 177.481 -2.095 18935 8379 1 11 . 1 1 63 63 LYS CA C 63 57.356 57.356 56.732 0.624 18935 8380 1 11 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.943 -1.980 18935 8381 1 11 . 1 1 63 63 LYS H H 63 7.751 7.751 8.248 -0.497 18935 8382 1 11 . 1 1 64 64 HIS N N 64 112.468 112.468 117.755 -5.287 18935 8383 1 11 . 1 1 64 64 HIS C C 64 176.081 176.081 176.802 -0.721 18935 8384 1 11 . 1 1 64 64 HIS CA C 64 55.769 55.769 58.969 -3.200 18935 8385 1 11 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.433 0.936 18935 8386 1 11 . 1 1 64 64 HIS H H 64 7.697 7.697 7.636 0.061 18935 8387 1 11 . 1 1 65 65 VAL N N 65 117.499 117.499 119.201 -1.702 18935 8388 1 11 . 1 1 65 65 VAL C C 65 174.301 174.301 177.023 -2.722 18935 8389 1 11 . 1 1 65 65 VAL CA C 65 66.330 66.330 64.666 1.664 18935 8390 1 11 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.105 -1.745 18935 8391 1 11 . 1 1 65 65 VAL H H 65 6.917 6.917 7.359 -0.442 18935 8392 1 11 . 1 1 66 66 LEU N N 66 113.873 113.873 118.699 -4.826 18935 8393 1 11 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.627 0.223 18935 8394 1 11 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.185 -3.127 18935 8395 1 11 . 1 1 66 66 LEU H H 66 9.102 9.102 7.889 1.213 18935 8396 1 11 . 1 1 68 68 ASN N N 68 110.792 110.792 115.790 -4.998 18935 8397 1 11 . 1 1 68 68 ASN C C 68 174.877 174.877 173.475 1.402 18935 8398 1 11 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.962 -2.147 18935 8399 1 11 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.772 -1.461 18935 8400 1 11 . 1 1 68 68 ASN H H 68 7.234 7.234 8.224 -0.990 18935 8401 1 11 . 1 1 69 69 ILE N N 69 122.348 122.348 124.310 -1.962 18935 8402 1 11 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.225 -0.313 18935 8403 1 11 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.514 -2.476 18935 8404 1 11 . 1 1 69 69 ILE H H 69 7.428 7.428 8.596 -1.168 18935 8405 1 11 . 1 1 70 70 ARG N N 70 125.701 125.701 125.606 0.095 18935 8406 1 11 . 1 1 70 70 ARG C C 70 174.596 174.596 173.812 0.784 18935 8407 1 11 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.451 -1.290 18935 8408 1 11 . 1 1 70 70 ARG CB C 70 32.453 32.453 32.272 0.181 18935 8409 1 11 . 1 1 70 70 ARG H H 70 9.083 9.083 8.697 0.386 18935 8410 1 11 . 1 1 71 71 ILE N N 71 118.496 118.496 118.798 -0.302 18935 8411 1 11 . 1 1 71 71 ILE C C 71 175.625 175.625 176.488 -0.863 18935 8412 1 11 . 1 1 71 71 ILE CA C 71 59.776 59.776 60.136 -0.360 18935 8413 1 11 . 1 1 71 71 ILE CB C 71 37.967 37.967 39.711 -1.744 18935 8414 1 11 . 1 1 71 71 ILE H H 71 7.864 7.864 8.066 -0.202 18935 8415 1 11 . 1 1 72 72 LYS N N 72 127.423 127.423 122.915 4.508 18935 8416 1 11 . 1 1 72 72 LYS C C 72 177.659 177.659 176.338 1.321 18935 8417 1 11 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.793 1.635 18935 8418 1 11 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.479 -1.105 18935 8419 1 11 . 1 1 72 72 LYS H H 72 8.720 8.720 8.951 -0.231 18935 8420 1 11 . 1 1 73 73 GLY N N 73 112.604 112.604 112.345 0.259 18935 8421 1 11 . 1 1 73 73 GLY C C 73 173.729 173.729 173.613 0.116 18935 8422 1 11 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.155 0.676 18935 8423 1 11 . 1 1 73 73 GLY H H 73 8.930 8.930 8.793 0.137 18935 8424 1 11 . 1 1 74 74 LEU N N 74 119.538 119.538 119.412 0.126 18935 8425 1 11 . 1 1 74 74 LEU C C 74 175.802 175.802 174.837 0.965 18935 8426 1 11 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.769 -0.108 18935 8427 1 11 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.895 -0.842 18935 8428 1 11 . 1 1 74 74 LEU H H 74 7.547 7.547 7.783 -0.236 18935 8429 1 11 . 1 1 75 75 SER N N 75 118.994 118.994 116.355 2.639 18935 8430 1 11 . 1 1 75 75 SER C C 75 173.111 173.111 172.769 0.342 18935 8431 1 11 . 1 1 75 75 SER CA C 75 57.696 57.696 57.866 -0.170 18935 8432 1 11 . 1 1 75 75 SER CB C 75 63.073 63.073 64.188 -1.115 18935 8433 1 11 . 1 1 75 75 SER H H 75 9.076 9.076 8.497 0.579 18935 8434 1 11 . 1 1 76 76 PHE N N 76 117.802 117.802 120.680 -2.878 18935 8435 1 11 . 1 1 76 76 PHE C C 76 173.564 173.564 175.011 -1.447 18935 8436 1 11 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.054 -0.645 18935 8437 1 11 . 1 1 76 76 PHE CB C 76 41.843 41.843 41.837 0.006 18935 8438 1 11 . 1 1 76 76 PHE H H 76 8.119 8.119 7.998 0.121 18935 8439 1 11 . 1 1 77 77 SER N N 77 113.918 113.918 117.694 -3.776 18935 8440 1 11 . 1 1 77 77 SER C C 77 173.194 173.194 174.581 -1.387 18935 8441 1 11 . 1 1 77 77 SER CA C 77 55.999 55.999 57.866 -1.867 18935 8442 1 11 . 1 1 77 77 SER CB C 77 65.218 65.218 63.928 1.290 18935 8443 1 11 . 1 1 77 77 SER H H 77 8.989 8.989 8.651 0.338 18935 8444 1 11 . 1 1 78 78 VAL N N 78 123.662 123.662 124.257 -0.595 18935 8445 1 11 . 1 1 78 78 VAL C C 78 176.057 176.057 176.262 -0.205 18935 8446 1 11 . 1 1 78 78 VAL CA C 78 62.091 62.091 64.245 -2.154 18935 8447 1 11 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.508 0.786 18935 8448 1 11 . 1 1 78 78 VAL H H 78 8.995 8.995 8.362 0.633 18935 8449 1 11 . 1 1 79 79 LYS N N 79 129.417 129.417 128.608 0.809 18935 8450 1 11 . 1 1 79 79 LYS C C 79 176.436 176.436 174.596 1.840 18935 8451 1 11 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.981 2.671 18935 8452 1 11 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.698 -4.225 18935 8453 1 11 . 1 1 79 79 LYS H H 79 9.425 9.425 8.624 0.801 18935 8454 1 11 . 1 1 80 80 VAL N N 80 108.616 108.616 122.147 -13.531 18935 8455 1 11 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.483 -2.386 18935 8456 1 11 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.706 0.376 18935 8457 1 11 . 1 1 80 80 VAL H H 80 7.380 7.380 8.450 -1.070 18935 8458 1 11 . 1 1 81 81 CYS N N 81 123.254 123.254 127.888 -4.634 18935 8459 1 11 . 1 1 81 81 CYS C C 81 172.053 172.053 173.681 -1.628 18935 8460 1 11 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.719 2.020 18935 8461 1 11 . 1 1 81 81 CYS CB C 81 27.332 27.332 28.040 -0.708 18935 8462 1 11 . 1 1 81 81 CYS H H 81 9.759 9.759 8.807 0.952 18935 8463 1 11 . 1 1 82 82 GLY N N 82 118.450 118.450 112.164 6.286 18935 8464 1 11 . 1 1 82 82 GLY C C 82 171.814 171.814 174.486 -2.672 18935 8465 1 11 . 1 1 82 82 GLY CA C 82 44.353 44.353 44.919 -0.566 18935 8466 1 11 . 1 1 82 82 GLY H H 82 8.537 8.537 8.055 0.482 18935 8467 1 11 . 1 1 83 83 GLU N N 83 113.964 113.964 120.390 -6.426 18935 8468 1 11 . 1 1 83 83 GLU C C 83 179.320 179.320 176.476 2.844 18935 8469 1 11 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.194 0.481 18935 8470 1 11 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.541 0.366 18935 8471 1 11 . 1 1 83 83 GLU H H 83 8.473 8.473 8.698 -0.225 18935 8472 1 11 . 1 1 84 84 ARG N N 84 117.544 117.544 115.513 2.031 18935 8473 1 11 . 1 1 84 84 ARG C C 84 177.252 177.252 175.537 1.715 18935 8474 1 11 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.239 -0.734 18935 8475 1 11 . 1 1 84 84 ARG CB C 84 31.546 31.546 32.222 -0.676 18935 8476 1 11 . 1 1 84 84 ARG H H 84 9.760 9.760 8.212 1.548 18935 8477 1 11 . 1 1 85 85 LYS N N 85 124.160 124.160 119.555 4.605 18935 8478 1 11 . 1 1 85 85 LYS C C 85 173.379 173.379 174.927 -1.548 18935 8479 1 11 . 1 1 85 85 LYS CA C 85 55.232 55.232 55.482 -0.250 18935 8480 1 11 . 1 1 85 85 LYS CB C 85 34.212 34.212 36.502 -2.290 18935 8481 1 11 . 1 1 85 85 LYS H H 85 8.494 8.494 7.679 0.815 18935 8482 1 11 . 1 1 86 86 CYS N N 86 126.472 126.472 120.460 6.012 18935 8483 1 11 . 1 1 86 86 CYS C C 86 171.935 171.935 173.257 -1.322 18935 8484 1 11 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.416 -1.538 18935 8485 1 11 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.206 0.098 18935 8486 1 11 . 1 1 86 86 CYS H H 86 9.221 9.221 9.118 0.102 18935 8487 1 11 . 1 1 87 87 VAL N N 87 126.426 126.426 124.858 1.568 18935 8488 1 11 . 1 1 87 87 VAL C C 87 173.760 173.760 174.264 -0.504 18935 8489 1 11 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.453 -0.119 18935 8490 1 11 . 1 1 87 87 VAL CB C 87 33.338 33.338 33.073 0.265 18935 8491 1 11 . 1 1 87 87 VAL H H 87 8.623 8.623 8.745 -0.122 18935 8492 1 11 . 1 1 88 88 LEU N N 88 125.701 125.701 128.003 -2.302 18935 8493 1 11 . 1 1 88 88 LEU C C 88 175.424 175.424 175.139 0.285 18935 8494 1 11 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.769 -1.684 18935 8495 1 11 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.274 -1.730 18935 8496 1 11 . 1 1 88 88 LEU H H 88 9.592 9.592 8.933 0.659 18935 8497 1 11 . 1 1 89 89 PHE N N 89 118.314 118.314 124.168 -5.854 18935 8498 1 11 . 1 1 89 89 PHE C C 89 177.068 177.068 176.132 0.936 18935 8499 1 11 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.893 -1.018 18935 8500 1 11 . 1 1 89 89 PHE CB C 89 38.837 38.837 38.938 -0.100 18935 8501 1 11 . 1 1 89 89 PHE H H 89 8.979 8.979 9.126 -0.147 18935 8502 1 11 . 1 1 90 90 ILE N N 90 119.039 119.039 119.463 -0.424 18935 8503 1 11 . 1 1 90 90 ILE C C 90 173.692 173.692 174.750 -1.058 18935 8504 1 11 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.879 -1.207 18935 8505 1 11 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.745 0.438 18935 8506 1 11 . 1 1 90 90 ILE H H 90 9.447 9.447 8.316 1.131 18935 8507 1 11 . 1 1 91 91 GLU N N 91 122.801 122.801 126.165 -3.364 18935 8508 1 11 . 1 1 91 91 GLU C C 91 175.565 175.565 174.682 0.883 18935 8509 1 11 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.061 -0.596 18935 8510 1 11 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.189 -3.527 18935 8511 1 11 . 1 1 91 91 GLU H H 91 8.360 8.360 8.371 -0.011 18935 8512 1 11 . 1 1 92 92 TRP N N 92 126.018 126.018 122.436 3.582 18935 8513 1 11 . 1 1 92 92 TRP C C 92 175.070 175.070 175.062 0.008 18935 8514 1 11 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.722 -0.532 18935 8515 1 11 . 1 1 92 92 TRP CB C 92 30.582 30.582 30.825 -0.243 18935 8516 1 11 . 1 1 92 92 TRP H H 92 9.425 9.425 8.473 0.952 18935 8517 1 11 . 1 1 93 93 GLU N N 93 126.381 126.381 120.056 6.325 18935 8518 1 11 . 1 1 93 93 GLU C C 93 175.637 175.637 175.636 0.001 18935 8519 1 11 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.962 -1.193 18935 8520 1 11 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.058 -2.114 18935 8521 1 11 . 1 1 93 93 GLU H H 93 8.914 8.914 9.191 -0.277 18935 8522 1 11 . 1 1 94 94 LYS N N 94 107.891 107.891 111.287 -3.396 18935 8523 1 11 . 1 1 94 94 LYS C C 94 175.359 175.359 175.958 -0.599 18935 8524 1 11 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.126 0.303 18935 8525 1 11 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.456 -1.814 18935 8526 1 11 . 1 1 94 94 LYS H H 94 8.634 8.634 8.565 0.069 18935 8527 1 11 . 1 1 95 95 LYS N N 95 120.490 120.490 118.713 1.777 18935 8528 1 11 . 1 1 95 95 LYS C C 95 174.369 174.369 174.263 0.106 18935 8529 1 11 . 1 1 95 95 LYS CA C 95 54.353 54.353 55.074 -0.721 18935 8530 1 11 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.804 -1.341 18935 8531 1 11 . 1 1 95 95 LYS H H 95 7.924 7.924 7.620 0.304 18935 8532 1 11 . 1 1 96 96 THR N N 96 115.278 115.278 114.221 1.057 18935 8533 1 11 . 1 1 96 96 THR C C 96 174.317 174.317 173.322 0.995 18935 8534 1 11 . 1 1 96 96 THR CA C 96 61.203 61.203 60.574 0.629 18935 8535 1 11 . 1 1 96 96 THR CB C 96 69.348 69.348 70.060 -0.712 18935 8536 1 11 . 1 1 96 96 THR H H 96 7.967 7.967 7.824 0.143 18935 8537 1 11 . 1 1 97 97 TYR N N 97 123.254 123.254 125.228 -1.974 18935 8538 1 11 . 1 1 97 97 TYR C C 97 173.320 173.320 175.015 -1.695 18935 8539 1 11 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.117 -0.233 18935 8540 1 11 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.641 -0.505 18935 8541 1 11 . 1 1 97 97 TYR H H 97 9.232 9.232 8.931 0.301 18935 8542 1 11 . 1 1 98 98 GLN N N 98 122.574 122.574 118.602 3.972 18935 8543 1 11 . 1 1 98 98 GLN C C 98 172.781 172.781 174.311 -1.530 18935 8544 1 11 . 1 1 98 98 GLN CA C 98 55.171 55.171 54.819 0.352 18935 8545 1 11 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.550 -2.151 18935 8546 1 11 . 1 1 98 98 GLN H H 98 9.000 9.000 8.801 0.199 18935 8547 1 11 . 1 1 99 99 LEU N N 99 130.218 130.218 125.998 4.220 18935 8548 1 11 . 1 1 99 99 LEU C C 99 172.806 172.806 174.225 -1.419 18935 8549 1 11 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.435 -1.385 18935 8550 1 11 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.336 -0.584 18935 8551 1 11 . 1 1 99 99 LEU H H 99 9.246 9.246 8.985 0.261 18935 8552 1 11 . 1 1 100 100 ASP N N 100 124.931 124.931 127.682 -2.751 18935 8553 1 11 . 1 1 100 100 ASP C C 100 172.626 172.626 174.494 -1.868 18935 8554 1 11 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.491 -3.061 18935 8555 1 11 . 1 1 100 100 ASP CB C 100 37.328 37.328 42.977 -5.649 18935 8556 1 11 . 1 1 100 100 ASP H H 100 9.253 9.253 8.628 0.625 18935 8557 1 11 . 1 1 101 101 LEU N N 101 119.402 119.402 119.876 -0.474 18935 8558 1 11 . 1 1 101 101 LEU C C 101 173.869 173.869 174.529 -0.660 18935 8559 1 11 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.916 -1.261 18935 8560 1 11 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.826 0.340 18935 8561 1 11 . 1 1 101 101 LEU H H 101 8.726 8.726 7.827 0.899 18935 8562 1 11 . 1 1 102 102 PHE N N 102 117.952 117.952 120.239 -2.287 18935 8563 1 11 . 1 1 102 102 PHE C C 102 175.853 175.853 175.531 0.322 18935 8564 1 11 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.201 -1.919 18935 8565 1 11 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.688 1.136 18935 8566 1 11 . 1 1 102 102 PHE H H 102 8.236 8.236 8.917 -0.681 18935 8567 1 11 . 1 1 103 103 THR N N 103 106.853 106.853 119.324 -12.471 18935 8568 1 11 . 1 1 103 103 THR C C 103 175.154 175.154 173.778 1.376 18935 8569 1 11 . 1 1 103 103 THR CA C 103 57.685 57.685 60.167 -2.482 18935 8570 1 11 . 1 1 103 103 THR CB C 103 71.037 71.037 69.070 1.966 18935 8571 1 11 . 1 1 103 103 THR H H 103 7.917 7.917 8.448 -0.531 18935 8572 1 11 . 1 1 104 104 ALA N N 104 122.348 122.348 128.413 -6.065 18935 8573 1 11 . 1 1 104 104 ALA C C 104 175.947 175.947 174.596 1.351 18935 8574 1 11 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.525 -0.718 18935 8575 1 11 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.136 0.292 18935 8576 1 11 . 1 1 104 104 ALA H H 104 8.930 8.930 8.990 -0.060 18935 8577 1 11 . 1 1 105 105 LEU N N 105 119.855 119.855 119.059 0.796 18935 8578 1 11 . 1 1 105 105 LEU C C 105 179.628 179.628 178.990 0.638 18935 8579 1 11 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.188 -1.065 18935 8580 1 11 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.382 -2.048 18935 8581 1 11 . 1 1 105 105 LEU H H 105 8.316 8.316 9.097 -0.781 18935 8582 1 11 . 1 1 106 106 ALA N N 106 123.662 123.662 124.289 -0.627 18935 8583 1 11 . 1 1 106 106 ALA C C 106 181.056 181.056 179.186 1.870 18935 8584 1 11 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.217 1.132 18935 8585 1 11 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.385 -1.070 18935 8586 1 11 . 1 1 106 106 ALA H H 106 8.306 8.306 8.635 -0.329 18935 8587 1 11 . 1 1 107 107 GLU N N 107 114.825 114.825 115.465 -0.640 18935 8588 1 11 . 1 1 107 107 GLU C C 107 177.854 177.854 176.677 1.177 18935 8589 1 11 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.990 0.396 18935 8590 1 11 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.292 -0.448 18935 8591 1 11 . 1 1 107 107 GLU H H 107 9.754 9.754 8.775 0.979 18935 8592 1 11 . 1 1 108 108 GLU N N 108 115.097 115.097 118.147 -3.050 18935 8593 1 11 . 1 1 108 108 GLU C C 108 178.001 178.001 177.302 0.699 18935 8594 1 11 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.384 -1.458 18935 8595 1 11 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.725 0.276 18935 8596 1 11 . 1 1 108 108 GLU H H 108 7.859 7.859 7.573 0.286 18935 8597 1 11 . 1 1 109 109 LYS N N 109 118.360 118.360 121.356 -2.996 18935 8598 1 11 . 1 1 109 109 LYS C C 109 172.691 172.691 176.311 -3.620 18935 8599 1 11 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.552 1.350 18935 8600 1 11 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.192 0.349 18935 8601 1 11 . 1 1 109 109 LYS H H 109 7.660 7.660 7.349 0.311 18935 8602 1 11 . 1 1 111 111 TYR N N 111 114.054 114.054 118.246 -4.192 18935 8603 1 11 . 1 1 111 111 TYR C C 111 179.764 179.764 178.118 1.646 18935 8604 1 11 . 1 1 111 111 TYR CA C 111 58.998 58.998 59.751 -0.753 18935 8605 1 11 . 1 1 111 111 TYR CB C 111 35.956 35.956 36.821 -0.864 18935 8606 1 11 . 1 1 111 111 TYR H H 111 6.583 6.583 7.818 -1.235 18935 8607 1 11 . 1 1 112 112 ALA N N 112 124.749 124.749 122.140 2.609 18935 8608 1 11 . 1 1 112 112 ALA C C 112 179.430 179.430 179.499 -0.069 18935 8609 1 11 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.853 0.116 18935 8610 1 11 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.811 0.001 18935 8611 1 11 . 1 1 112 112 ALA H H 112 8.753 8.753 8.616 0.137 18935 8612 1 11 . 1 1 113 113 ILE N N 113 119.130 119.130 119.946 -0.816 18935 8613 1 11 . 1 1 113 113 ILE C C 113 178.646 178.646 178.598 0.048 18935 8614 1 11 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.492 1.909 18935 8615 1 11 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.582 0.655 18935 8616 1 11 . 1 1 113 113 ILE H H 113 8.946 8.946 8.563 0.383 18935 8617 1 11 . 1 1 114 114 PHE N N 114 121.758 121.758 120.976 0.782 18935 8618 1 11 . 1 1 114 114 PHE C C 114 177.954 177.954 176.954 1.000 18935 8619 1 11 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.880 -2.103 18935 8620 1 11 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.360 0.704 18935 8621 1 11 . 1 1 114 114 PHE H H 114 7.940 7.940 8.444 -0.504 18935 8622 1 11 . 1 1 115 115 HIS N N 115 116.547 116.547 119.137 -2.590 18935 8623 1 11 . 1 1 115 115 HIS C C 115 176.161 176.161 176.648 -0.487 18935 8624 1 11 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.543 -0.424 18935 8625 1 11 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.659 1.408 18935 8626 1 11 . 1 1 115 115 HIS H H 115 7.767 7.767 7.915 -0.148 18935 8627 1 11 . 1 1 116 116 PHE N N 116 109.387 109.387 112.933 -3.546 18935 8628 1 11 . 1 1 116 116 PHE C C 116 177.282 177.282 176.986 0.296 18935 8629 1 11 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.014 1.420 18935 8630 1 11 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.126 -1.871 18935 8631 1 11 . 1 1 116 116 PHE H H 116 8.989 8.989 8.403 0.586 18935 8632 1 11 . 1 1 117 117 THR N N 117 116.864 116.864 115.138 1.726 18935 8633 1 11 . 1 1 117 117 THR C C 117 172.889 172.889 175.192 -2.303 18935 8634 1 11 . 1 1 117 117 THR CA C 117 66.997 66.997 65.273 1.724 18935 8635 1 11 . 1 1 117 117 THR CB C 117 67.948 67.948 69.281 -1.333 18935 8636 1 11 . 1 1 117 117 THR H H 117 7.988 7.988 7.977 0.011 18935 8637 1 11 . 1 1 118 118 GLY N N 118 103.320 103.320 108.243 -4.923 18935 8638 1 11 . 1 1 118 118 GLY C C 118 176.912 176.912 171.697 5.215 18935 8639 1 11 . 1 1 118 118 GLY CA C 118 44.182 44.182 43.099 1.083 18935 8640 1 11 . 1 1 118 118 GLY H H 118 6.550 6.550 7.608 -1.058 18935 8641 1 11 . 1 1 120 120 VAL N N 120 120.671 120.671 125.561 -4.890 18935 8642 1 11 . 1 1 120 120 VAL C C 120 176.283 176.283 177.141 -0.858 18935 8643 1 11 . 1 1 120 120 VAL CA C 120 66.940 66.940 65.642 1.298 18935 8644 1 11 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.595 -1.743 18935 8645 1 11 . 1 1 120 120 VAL H H 120 8.408 8.408 8.549 -0.141 18935 8646 1 11 . 1 1 121 121 SER N N 121 111.789 111.789 114.339 -2.550 18935 8647 1 11 . 1 1 121 121 SER C C 121 175.658 175.658 176.841 -1.183 18935 8648 1 11 . 1 1 121 121 SER CA C 121 60.814 60.814 61.915 -1.101 18935 8649 1 11 . 1 1 121 121 SER CB C 121 60.253 60.253 62.101 -1.848 18935 8650 1 11 . 1 1 121 121 SER H H 121 8.290 8.290 8.422 -0.132 18935 8651 1 11 . 1 1 122 122 TYR N N 122 123.254 123.254 122.630 0.624 18935 8652 1 11 . 1 1 122 122 TYR C C 122 174.611 174.611 177.735 -3.124 18935 8653 1 11 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.789 -2.243 18935 8654 1 11 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.249 -0.110 18935 8655 1 11 . 1 1 122 122 TYR H H 122 6.303 6.303 7.468 -1.165 18935 8656 1 11 . 1 1 123 123 LEU N N 123 114.825 114.825 119.911 -5.086 18935 8657 1 11 . 1 1 123 123 LEU C C 123 178.891 178.891 179.177 -0.286 18935 8658 1 11 . 1 1 123 123 LEU CA C 123 56.779 56.779 58.122 -1.343 18935 8659 1 11 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.924 -0.286 18935 8660 1 11 . 1 1 123 123 LEU H H 123 6.965 6.965 7.491 -0.526 18935 8661 1 11 . 1 1 124 124 ILE N N 124 114.915 114.915 118.886 -3.971 18935 8662 1 11 . 1 1 124 124 ILE C C 124 177.187 177.187 177.821 -0.634 18935 8663 1 11 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.493 -1.062 18935 8664 1 11 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.265 -0.710 18935 8665 1 11 . 1 1 124 124 ILE H H 124 7.531 7.531 7.880 -0.349 18935 8666 1 11 . 1 1 125 125 ARG N N 125 115.278 115.278 118.367 -3.089 18935 8667 1 11 . 1 1 125 125 ARG C C 125 178.473 178.473 178.967 -0.494 18935 8668 1 11 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.990 -0.531 18935 8669 1 11 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.425 -2.346 18935 8670 1 11 . 1 1 125 125 ARG H H 125 6.809 6.809 7.604 -0.795 18935 8671 1 11 . 1 1 126 126 ILE N N 126 124.160 124.160 119.027 5.133 18935 8672 1 11 . 1 1 126 126 ILE C C 126 178.172 178.172 177.540 0.632 18935 8673 1 11 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.741 -1.814 18935 8674 1 11 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.510 -3.044 18935 8675 1 11 . 1 1 126 126 ILE H H 126 7.408 7.408 6.935 0.473 18935 8676 1 11 . 1 1 127 127 ARG N N 127 117.136 117.136 121.093 -3.957 18935 8677 1 11 . 1 1 127 127 ARG C C 127 179.227 179.227 178.606 0.621 18935 8678 1 11 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.583 0.633 18935 8679 1 11 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.294 -1.505 18935 8680 1 11 . 1 1 127 127 ARG H H 127 8.230 8.230 8.158 0.072 18935 8681 1 11 . 1 1 128 128 ALA N N 128 121.305 121.305 120.539 0.766 18935 8682 1 11 . 1 1 128 128 ALA C C 128 179.933 179.933 179.326 0.607 18935 8683 1 11 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.028 -0.322 18935 8684 1 11 . 1 1 128 128 ALA CB C 128 18.338 18.338 17.955 0.383 18935 8685 1 11 . 1 1 128 128 ALA H H 128 8.666 8.666 7.907 0.759 18935 8686 1 11 . 1 1 129 129 ALA N N 129 120.943 120.943 121.768 -0.825 18935 8687 1 11 . 1 1 129 129 ALA C C 129 181.336 181.336 179.529 1.807 18935 8688 1 11 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.933 -0.225 18935 8689 1 11 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.319 -1.459 18935 8690 1 11 . 1 1 129 129 ALA H H 129 7.837 7.837 7.426 0.411 18935 8691 1 11 . 1 1 130 130 LEU N N 130 117.726 117.726 117.512 0.214 18935 8692 1 11 . 1 1 130 130 LEU C C 130 179.432 179.432 179.786 -0.354 18935 8693 1 11 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.818 -0.642 18935 8694 1 11 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.806 -1.240 18935 8695 1 11 . 1 1 130 130 LEU H H 130 8.114 8.114 8.078 0.036 18935 8696 1 11 . 1 1 131 131 LYS N N 131 124.115 124.115 121.823 2.292 18935 8697 1 11 . 1 1 131 131 LYS C C 131 181.452 181.452 179.350 2.102 18935 8698 1 11 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.999 -0.113 18935 8699 1 11 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.840 0.358 18935 8700 1 11 . 1 1 131 131 LYS H H 131 8.849 8.849 8.132 0.717 18935 8701 1 11 . 1 1 132 132 LYS N N 132 119.447 119.447 118.196 1.251 18935 8702 1 11 . 1 1 132 132 LYS C C 132 177.607 177.607 177.987 -0.380 18935 8703 1 11 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.424 -0.472 18935 8704 1 11 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.849 -0.424 18935 8705 1 11 . 1 1 132 132 LYS H H 132 7.778 7.778 7.969 -0.191 18935 8706 1 11 . 1 1 133 133 LYS N N 133 116.638 116.638 115.644 0.994 18935 8707 1 11 . 1 1 133 133 LYS C C 133 174.681 174.681 175.751 -1.070 18935 8708 1 11 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.425 -0.347 18935 8709 1 11 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.606 -0.966 18935 8710 1 11 . 1 1 133 133 LYS H H 133 7.617 7.617 7.766 -0.149 18935 8711 1 11 . 1 1 134 134 ASN N N 134 110.792 110.792 116.387 -5.595 18935 8712 1 11 . 1 1 134 134 ASN C C 134 174.034 174.034 173.275 0.759 18935 8713 1 11 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.085 0.530 18935 8714 1 11 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.277 -1.225 18935 8715 1 11 . 1 1 134 134 ASN H H 134 8.123 8.123 8.347 -0.224 18935 8716 1 11 . 1 1 135 135 TYR N N 135 115.867 115.867 117.869 -2.002 18935 8717 1 11 . 1 1 135 135 TYR C C 135 175.122 175.122 174.186 0.936 18935 8718 1 11 . 1 1 135 135 TYR CA C 135 56.752 56.752 55.993 0.758 18935 8719 1 11 . 1 1 135 135 TYR CB C 135 41.916 41.916 42.943 -1.026 18935 8720 1 11 . 1 1 135 135 TYR H H 135 8.133 8.133 7.718 0.415 18935 8721 1 11 . 1 1 136 136 LYS N N 136 119.870 119.870 123.179 -3.309 18935 8722 1 11 . 1 1 136 136 LYS C C 136 174.324 174.324 174.325 -0.001 18935 8723 1 11 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.829 0.352 18935 8724 1 11 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.106 -2.033 18935 8725 1 11 . 1 1 136 136 LYS H H 136 9.234 9.234 8.953 0.281 18935 8726 1 11 . 1 1 137 137 LEU N N 137 129.708 129.708 126.882 2.826 18935 8727 1 11 . 1 1 137 137 LEU C C 137 173.798 173.798 174.660 -0.862 18935 8728 1 11 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.127 -1.293 18935 8729 1 11 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.688 1.296 18935 8730 1 11 . 1 1 137 137 LEU H H 137 8.959 8.959 8.663 0.296 18935 8731 1 11 . 1 1 140 140 TYR N N 140 120.580 120.580 114.168 6.412 18935 8732 1 11 . 1 1 140 140 TYR C C 140 174.705 174.705 176.081 -1.376 18935 8733 1 11 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.108 -1.655 18935 8734 1 11 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.465 -0.164 18935 8735 1 11 . 1 1 140 140 TYR H H 140 8.962 8.962 7.363 1.599 18935 8736 1 11 . 1 1 141 141 GLY N N 141 104.986 104.986 105.735 -0.749 18935 8737 1 11 . 1 1 141 141 GLY C C 141 181.854 181.854 172.321 9.533 18935 8738 1 11 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.461 -0.339 18935 8739 1 11 . 1 1 141 141 GLY H H 141 7.555 7.555 7.473 0.082 18935 8740 1 11 . 1 1 142 142 LEU N N 142 118.269 118.269 121.500 -3.231 18935 8741 1 11 . 1 1 142 142 LEU C C 142 174.067 174.067 175.771 -1.704 18935 8742 1 11 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.150 -0.648 18935 8743 1 11 . 1 1 142 142 LEU CB C 142 44.542 44.542 42.851 1.691 18935 8744 1 11 . 1 1 142 142 LEU H H 142 7.794 7.794 8.202 -0.408 18935 8745 1 11 . 1 1 143 143 PHE N N 143 122.076 122.076 125.435 -3.359 18935 8746 1 11 . 1 1 143 143 PHE C C 143 175.199 175.199 175.257 -0.058 18935 8747 1 11 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.558 -1.526 18935 8748 1 11 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.738 2.332 18935 8749 1 11 . 1 1 143 143 PHE H H 143 9.522 9.522 9.553 -0.031 18935 8750 1 11 . 1 1 144 144 LYS N N 144 121.305 121.305 125.125 -3.820 18935 8751 1 11 . 1 1 144 144 LYS C C 144 176.917 176.917 176.786 0.131 18935 8752 1 11 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.195 1.161 18935 8753 1 11 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.280 0.399 18935 8754 1 11 . 1 1 144 144 LYS H H 144 9.076 9.076 9.265 -0.189 18935 8755 1 11 . 1 1 145 145 ASN N N 145 126.834 126.834 126.769 0.065 18935 8756 1 11 . 1 1 145 145 ASN C C 145 175.070 175.070 174.742 0.328 18935 8757 1 11 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.112 0.652 18935 8758 1 11 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.713 -1.283 18935 8759 1 11 . 1 1 145 145 ASN H H 145 9.618 9.618 9.008 0.610 18935 8760 1 11 . 1 1 146 146 GLN N N 146 110.112 110.112 110.156 -0.044 18935 8761 1 11 . 1 1 146 146 GLN C C 146 175.198 175.198 175.375 -0.177 18935 8762 1 11 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.651 -0.756 18935 8763 1 11 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.317 -0.949 18935 8764 1 11 . 1 1 146 146 GLN H H 146 9.140 9.140 8.759 0.381 18935 8765 1 11 . 1 1 147 147 THR N N 147 116.003 116.003 116.936 -0.933 18935 8766 1 11 . 1 1 147 147 THR C C 147 173.224 173.224 173.505 -0.281 18935 8767 1 11 . 1 1 147 147 THR CA C 147 61.450 61.450 61.757 -0.307 18935 8768 1 11 . 1 1 147 147 THR CB C 147 70.285 70.285 69.933 0.352 18935 8769 1 11 . 1 1 147 147 THR H H 147 8.069 8.069 7.700 0.369 18935 8770 1 11 . 1 1 148 148 LEU N N 148 129.281 129.281 129.390 -0.109 18935 8771 1 11 . 1 1 148 148 LEU C C 148 176.703 176.703 175.426 1.277 18935 8772 1 11 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.232 0.234 18935 8773 1 11 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.786 -1.061 18935 8774 1 11 . 1 1 148 148 LEU H H 148 8.831 8.831 8.786 0.045 18935 8775 1 11 . 1 1 149 149 VAL N N 149 130.189 130.189 127.049 3.140 18935 8776 1 11 . 1 1 149 149 VAL C C 149 175.012 175.012 173.633 1.379 18935 8777 1 11 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.571 0.698 18935 8778 1 11 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.300 -3.844 18935 8779 1 11 . 1 1 149 149 VAL H H 149 9.243 9.243 8.607 0.636 18935 8780 1 11 . 1 1 151 151 LEU N N 151 123.481 123.481 117.818 5.663 18935 8781 1 11 . 1 1 151 151 LEU C C 151 177.679 177.679 176.706 0.973 18935 8782 1 11 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.756 -0.759 18935 8783 1 11 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.644 0.975 18935 8784 1 11 . 1 1 151 151 LEU H H 151 8.080 8.080 8.135 -0.055 18935 8785 1 11 . 1 1 152 152 LYS N N 152 126.381 126.381 122.454 3.927 18935 8786 1 11 . 1 1 152 152 LYS C C 152 175.115 175.115 174.878 0.237 18935 8787 1 11 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.008 -1.413 18935 8788 1 11 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.167 -2.102 18935 8789 1 11 . 1 1 152 152 LYS H H 152 9.112 9.112 8.659 0.453 18935 8790 1 11 . 1 1 153 153 ILE N N 153 113.737 113.737 114.967 -1.230 18935 8791 1 11 . 1 1 153 153 ILE C C 153 175.748 175.748 173.463 2.285 18935 8792 1 11 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.594 -1.205 18935 8793 1 11 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.805 0.998 18935 8794 1 11 . 1 1 153 153 ILE H H 153 7.304 7.304 7.327 -0.023 18935 8795 1 11 . 1 1 154 154 THR N N 154 110.656 110.656 111.442 -0.786 18935 8796 1 11 . 1 1 154 154 THR C C 154 174.864 174.864 173.088 1.776 18935 8797 1 11 . 1 1 154 154 THR CA C 154 62.141 62.141 62.324 -0.183 18935 8798 1 11 . 1 1 154 154 THR CB C 154 70.413 70.413 70.000 0.413 18935 8799 1 11 . 1 1 154 154 THR H H 154 9.382 9.382 8.289 1.093 18935 8800 1 11 . 1 1 155 155 THR N N 155 110.746 110.746 115.864 -5.118 18935 8801 1 11 . 1 1 155 155 THR C C 155 174.718 174.718 175.368 -0.650 18935 8802 1 11 . 1 1 155 155 THR CA C 155 58.785 58.785 61.016 -2.231 18935 8803 1 11 . 1 1 155 155 THR CB C 155 72.277 72.277 71.173 1.104 18935 8804 1 11 . 1 1 155 155 THR H H 155 7.746 7.746 7.698 0.048 18935 8805 1 11 . 1 1 156 156 GLU N N 156 122.302 122.302 124.418 -2.116 18935 8806 1 11 . 1 1 156 156 GLU C C 156 177.289 177.289 178.174 -0.885 18935 8807 1 11 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.906 -2.082 18935 8808 1 11 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.345 -0.964 18935 8809 1 11 . 1 1 156 156 GLU H H 156 9.490 9.490 9.075 0.415 18935 8810 1 11 . 1 1 157 157 LYS N N 157 118.905 118.905 118.191 0.714 18935 8811 1 11 . 1 1 157 157 LYS C C 157 178.241 178.241 179.112 -0.871 18935 8812 1 11 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.226 1.539 18935 8813 1 11 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.918 -0.640 18935 8814 1 11 . 1 1 157 157 LYS H H 157 8.329 8.329 8.288 0.041 18935 8815 1 11 . 1 1 158 158 GLU N N 158 116.230 116.230 120.617 -4.387 18935 8816 1 11 . 1 1 158 158 GLU C C 158 178.988 178.988 178.617 0.371 18935 8817 1 11 . 1 1 158 158 GLU CA C 158 58.256 58.256 59.081 -0.825 18935 8818 1 11 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.003 0.055 18935 8819 1 11 . 1 1 158 158 GLU H H 158 7.611 7.611 8.131 -0.520 18935 8820 1 11 . 1 1 159 159 LEU N N 159 118.978 118.978 120.763 -1.785 18935 8821 1 11 . 1 1 159 159 LEU C C 159 176.347 176.347 178.513 -2.166 18935 8822 1 11 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.415 -5.176 18935 8823 1 11 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.912 -2.369 18935 8824 1 11 . 1 1 159 159 LEU H H 159 7.704 7.704 8.271 -0.567 18935 8825 1 11 . 1 1 160 160 ILE N N 160 117.227 117.227 114.776 2.451 18935 8826 1 11 . 1 1 160 160 ILE C C 160 177.219 177.219 177.445 -0.226 18935 8827 1 11 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.852 0.763 18935 8828 1 11 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.126 0.431 18935 8829 1 11 . 1 1 160 160 ILE H H 160 7.886 7.886 7.390 0.496 18935 8830 1 11 . 1 1 161 161 LYS N N 161 115.912 115.912 119.886 -3.974 18935 8831 1 11 . 1 1 161 161 LYS C C 161 180.990 180.990 178.888 2.102 18935 8832 1 11 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.758 -0.127 18935 8833 1 11 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.093 -1.345 18935 8834 1 11 . 1 1 161 161 LYS H H 161 7.536 7.536 7.665 -0.129 18935 8835 1 11 . 1 1 162 162 GLU N N 162 120.852 120.852 121.033 -0.181 18935 8836 1 11 . 1 1 162 162 GLU C C 162 178.793 178.793 177.773 1.020 18935 8837 1 11 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.659 -0.677 18935 8838 1 11 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.321 -1.529 18935 8839 1 11 . 1 1 162 162 GLU H H 162 8.392 8.392 8.011 0.381 18935 8840 1 11 . 1 1 163 163 LEU N N 163 115.912 115.912 117.834 -1.922 18935 8841 1 11 . 1 1 163 163 LEU C C 163 176.370 176.370 177.970 -1.600 18935 8842 1 11 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.841 -0.747 18935 8843 1 11 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.961 -1.787 18935 8844 1 11 . 1 1 163 163 LEU H H 163 8.031 8.031 7.876 0.155 18935 8845 1 11 . 1 1 164 164 GLY N N 164 103.160 103.160 104.211 -1.051 18935 8846 1 11 . 1 1 164 164 GLY C C 164 174.240 174.240 173.757 0.483 18935 8847 1 11 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.600 -0.298 18935 8848 1 11 . 1 1 164 164 GLY H H 164 7.625 7.625 7.994 -0.369 18935 8849 1 11 . 1 1 165 165 PHE N N 165 117.952 117.952 118.377 -0.425 18935 8850 1 11 . 1 1 165 165 PHE C C 165 174.556 174.556 174.796 -0.240 18935 8851 1 11 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.639 -0.174 18935 8852 1 11 . 1 1 165 165 PHE CB C 165 40.762 40.762 42.197 -1.435 18935 8853 1 11 . 1 1 165 165 PHE H H 165 7.283 7.283 8.168 -0.885 18935 8854 1 11 . 1 1 166 166 THR N N 166 118.178 118.178 114.636 3.542 18935 8855 1 11 . 1 1 166 166 THR C C 166 175.306 175.306 173.942 1.364 18935 8856 1 11 . 1 1 166 166 THR CA C 166 63.466 63.466 60.491 2.975 18935 8857 1 11 . 1 1 166 166 THR CB C 166 68.721 68.721 70.646 -1.925 18935 8858 1 11 . 1 1 166 166 THR H H 166 9.678 9.678 8.567 1.111 18935 8859 1 11 . 1 1 167 167 TYR N N 167 128.239 128.239 124.185 4.054 18935 8860 1 11 . 1 1 167 167 TYR C C 167 173.297 173.297 175.342 -2.045 18935 8861 1 11 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.701 0.711 18935 8862 1 11 . 1 1 167 167 TYR CB C 167 36.722 36.722 38.948 -2.226 18935 8863 1 11 . 1 1 167 167 TYR H H 167 9.264 9.264 8.676 0.588 18935 8864 1 11 . 1 1 168 168 ARG N N 168 126.789 126.789 126.024 0.765 18935 8865 1 11 . 1 1 168 168 ARG C C 168 175.297 175.297 174.929 0.368 18935 8866 1 11 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.493 -1.728 18935 8867 1 11 . 1 1 168 168 ARG CB C 168 31.326 31.326 33.082 -1.756 18935 8868 1 11 . 1 1 168 168 ARG H H 168 7.030 7.030 8.455 -1.425 18935 8869 1 11 . 1 1 169 169 ILE N N 169 119.221 119.221 116.522 2.699 18935 8870 1 11 . 1 1 169 169 ILE C C 169 174.522 174.522 174.757 -0.235 18935 8871 1 11 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.228 3.051 18935 8872 1 11 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.297 -4.650 18935 8873 1 11 . 1 1 169 169 ILE H H 169 8.349 8.349 8.340 0.009 18935 8874 1 11 . 1 1 171 171 LYS N N 171 111.335 111.335 116.762 -5.427 18935 8875 1 11 . 1 1 171 171 LYS C C 171 176.638 176.638 177.757 -1.119 18935 8876 1 11 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.012 -1.474 18935 8877 1 11 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.720 0.247 18935 8878 1 11 . 1 1 171 171 LYS H H 171 8.198 8.198 8.556 -0.358 18935 8879 1 11 . 1 1 172 172 LYS N N 172 116.411 116.411 115.450 0.961 18935 8880 1 11 . 1 1 172 172 LYS C C 172 175.331 175.331 176.795 -1.464 18935 8881 1 11 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.538 -1.537 18935 8882 1 11 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.457 -1.639 18935 8883 1 11 . 1 1 172 172 LYS H H 172 7.843 7.843 7.608 0.235 18935 8884 1 11 . 1 1 173 173 ARG N N 173 120.490 120.490 117.562 2.928 18935 8885 1 11 . 1 1 173 173 ARG C C 173 172.830 172.830 175.141 -2.311 18935 8886 1 11 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.352 0.823 18935 8887 1 11 . 1 1 173 173 ARG CB C 173 28.829 28.829 28.985 -0.156 18935 8888 1 11 . 1 1 173 173 ARG H H 173 6.917 6.917 8.002 -1.085 18935 8889 1 12 . 1 1 2 2 LEU N N 2 119.937 119.937 115.846 4.091 18935 8890 1 12 . 1 1 2 2 LEU C C 2 175.307 175.307 174.806 0.501 18935 8891 1 12 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.948 0.344 18935 8892 1 12 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.361 -1.677 18935 8893 1 12 . 1 1 2 2 LEU H H 2 9.251 9.251 7.829 1.422 18935 8894 1 12 . 1 1 3 3 THR N N 3 111.335 111.335 109.302 2.033 18935 8895 1 12 . 1 1 3 3 THR C C 3 175.854 175.854 175.495 0.359 18935 8896 1 12 . 1 1 3 3 THR CA C 3 60.540 60.540 60.220 0.320 18935 8897 1 12 . 1 1 3 3 THR CB C 3 70.782 70.782 70.433 0.349 18935 8898 1 12 . 1 1 3 3 THR H H 3 8.677 8.677 8.145 0.532 18935 8899 1 12 . 1 1 4 4 LEU N N 4 120.988 120.988 123.649 -2.661 18935 8900 1 12 . 1 1 4 4 LEU C C 4 178.391 178.391 178.325 0.066 18935 8901 1 12 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.508 -0.444 18935 8902 1 12 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.222 -2.961 18935 8903 1 12 . 1 1 4 4 LEU H H 4 7.746 7.746 7.830 -0.084 18935 8904 1 12 . 1 1 5 5 ILE N N 5 114.236 114.236 113.750 0.486 18935 8905 1 12 . 1 1 5 5 ILE C C 5 178.339 178.339 177.809 0.530 18935 8906 1 12 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.445 -0.863 18935 8907 1 12 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.082 -0.283 18935 8908 1 12 . 1 1 5 5 ILE H H 5 7.821 7.821 7.806 0.015 18935 8909 1 12 . 1 1 6 6 GLN N N 6 120.399 120.399 121.032 -0.633 18935 8910 1 12 . 1 1 6 6 GLN C C 6 178.783 178.783 178.408 0.375 18935 8911 1 12 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.159 -0.939 18935 8912 1 12 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.038 0.077 18935 8913 1 12 . 1 1 6 6 GLN H H 6 7.810 7.810 7.757 0.053 18935 8914 1 12 . 1 1 7 7 GLY N N 7 106.277 106.277 105.655 0.622 18935 8915 1 12 . 1 1 7 7 GLY C C 7 174.554 174.554 176.062 -1.508 18935 8916 1 12 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.020 -0.087 18935 8917 1 12 . 1 1 7 7 GLY H H 7 8.733 8.733 8.306 0.427 18935 8918 1 12 . 1 1 8 8 LYS N N 8 119.991 119.991 121.400 -1.409 18935 8919 1 12 . 1 1 8 8 LYS C C 8 179.433 179.433 177.926 1.507 18935 8920 1 12 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.198 1.694 18935 8921 1 12 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.306 -0.974 18935 8922 1 12 . 1 1 8 8 LYS H H 8 8.688 8.688 7.137 1.551 18935 8923 1 12 . 1 1 9 9 LYS N N 9 119.175 119.175 120.425 -1.250 18935 8924 1 12 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.658 -0.276 18935 8925 1 12 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.263 -0.828 18935 8926 1 12 . 1 1 9 9 LYS H H 9 8.015 8.015 7.963 0.052 18935 8927 1 12 . 1 1 10 10 ILE N N 10 120.308 120.308 116.048 4.260 18935 8928 1 12 . 1 1 10 10 ILE C C 10 177.766 177.766 177.354 0.412 18935 8929 1 12 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.663 0.013 18935 8930 1 12 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.559 -1.246 18935 8931 1 12 . 1 1 10 10 ILE H H 10 7.967 7.967 8.212 -0.245 18935 8932 1 12 . 1 1 11 11 VAL N N 11 119.130 119.130 121.261 -2.131 18935 8933 1 12 . 1 1 11 11 VAL C C 11 176.606 176.606 178.061 -1.455 18935 8934 1 12 . 1 1 11 11 VAL CA C 11 67.640 67.640 65.931 1.709 18935 8935 1 12 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.511 -0.301 18935 8936 1 12 . 1 1 11 11 VAL H H 11 8.128 8.128 7.652 0.476 18935 8937 1 12 . 1 1 12 12 ASN N N 12 115.822 115.822 118.408 -2.586 18935 8938 1 12 . 1 1 12 12 ASN C C 12 177.375 177.375 176.539 0.836 18935 8939 1 12 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.728 -0.758 18935 8940 1 12 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.796 -1.233 18935 8941 1 12 . 1 1 12 12 ASN H H 12 8.203 8.203 8.039 0.164 18935 8942 1 12 . 1 1 13 13 HIS N N 13 117.659 117.659 117.390 0.269 18935 8943 1 12 . 1 1 13 13 HIS C C 13 177.287 177.287 178.093 -0.806 18935 8944 1 12 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.651 1.036 18935 8945 1 12 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.436 -0.415 18935 8946 1 12 . 1 1 13 13 HIS H H 13 7.861 7.861 7.533 0.328 18935 8947 1 12 . 1 1 14 14 LEU N N 14 115.595 115.595 119.609 -4.014 18935 8948 1 12 . 1 1 14 14 LEU C C 14 179.092 179.092 178.485 0.607 18935 8949 1 12 . 1 1 14 14 LEU CA C 14 56.641 56.641 57.664 -1.024 18935 8950 1 12 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.736 -0.716 18935 8951 1 12 . 1 1 14 14 LEU H H 14 8.376 8.376 8.974 -0.598 18935 8952 1 12 . 1 1 15 15 ARG N N 15 115.006 115.006 116.072 -1.066 18935 8953 1 12 . 1 1 15 15 ARG C C 15 176.265 176.265 177.311 -1.046 18935 8954 1 12 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.347 1.537 18935 8955 1 12 . 1 1 15 15 ARG CB C 15 29.072 29.072 30.031 -0.959 18935 8956 1 12 . 1 1 15 15 ARG H H 15 8.074 8.074 8.489 -0.415 18935 8957 1 12 . 1 1 16 16 SER N N 16 107.778 107.778 114.304 -6.526 18935 8958 1 12 . 1 1 16 16 SER C C 16 176.009 176.009 174.943 1.066 18935 8959 1 12 . 1 1 16 16 SER CA C 16 57.244 57.244 59.039 -1.795 18935 8960 1 12 . 1 1 16 16 SER CB C 16 63.525 63.525 64.899 -1.374 18935 8961 1 12 . 1 1 16 16 SER H H 16 7.136 7.136 8.008 -0.872 18935 8962 1 12 . 1 1 17 17 ARG N N 17 121.532 121.532 121.152 0.380 18935 8963 1 12 . 1 1 17 17 ARG C C 17 174.482 174.482 175.641 -1.159 18935 8964 1 12 . 1 1 17 17 ARG CA C 17 56.322 56.322 54.953 1.369 18935 8965 1 12 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.963 0.867 18935 8966 1 12 . 1 1 17 17 ARG H H 17 7.913 7.913 7.677 0.236 18935 8967 1 12 . 1 1 18 18 LEU N N 18 121.305 121.305 119.492 1.813 18935 8968 1 12 . 1 1 18 18 LEU C C 18 176.283 176.283 175.928 0.355 18935 8969 1 12 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.153 -0.455 18935 8970 1 12 . 1 1 18 18 LEU CB C 18 43.055 43.055 42.996 0.059 18935 8971 1 12 . 1 1 18 18 LEU H H 18 8.812 8.812 7.470 1.342 18935 8972 1 12 . 1 1 19 19 ALA N N 19 125.293 125.293 120.147 5.146 18935 8973 1 12 . 1 1 19 19 ALA C C 19 173.780 173.780 175.284 -1.504 18935 8974 1 12 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.857 -1.055 18935 8975 1 12 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.961 0.892 18935 8976 1 12 . 1 1 19 19 ALA H H 19 8.790 8.790 7.811 0.979 18935 8977 1 12 . 1 1 20 20 PHE N N 20 113.117 113.117 115.271 -2.154 18935 8978 1 12 . 1 1 20 20 PHE C C 20 172.708 172.708 172.864 -0.156 18935 8979 1 12 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.489 -0.891 18935 8980 1 12 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.381 -0.656 18935 8981 1 12 . 1 1 20 20 PHE H H 20 8.925 8.925 8.730 0.195 18935 8982 1 12 . 1 1 21 21 GLU N N 21 121.532 121.532 122.777 -1.245 18935 8983 1 12 . 1 1 21 21 GLU C C 21 174.830 174.830 175.163 -0.333 18935 8984 1 12 . 1 1 21 21 GLU CA C 21 54.963 54.963 54.441 0.522 18935 8985 1 12 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.717 -2.374 18935 8986 1 12 . 1 1 21 21 GLU H H 21 7.972 7.972 8.986 -1.014 18935 8987 1 12 . 1 1 22 22 TYR N N 22 125.339 125.339 129.524 -4.185 18935 8988 1 12 . 1 1 22 22 TYR C C 22 174.864 174.864 175.548 -0.684 18935 8989 1 12 . 1 1 22 22 TYR CA C 22 55.288 55.288 55.526 -0.238 18935 8990 1 12 . 1 1 22 22 TYR CB C 22 39.859 39.859 39.364 0.495 18935 8991 1 12 . 1 1 22 22 TYR H H 22 9.016 9.016 8.718 0.298 18935 8992 1 12 . 1 1 23 23 ASN N N 23 127.024 127.024 127.506 -0.482 18935 8993 1 12 . 1 1 23 23 ASN C C 23 175.410 175.410 175.167 0.243 18935 8994 1 12 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.344 -1.290 18935 8995 1 12 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.695 -1.434 18935 8996 1 12 . 1 1 23 23 ASN H H 23 9.181 9.181 9.598 -0.417 18935 8997 1 12 . 1 1 24 24 GLY N N 24 102.755 102.755 103.245 -0.490 18935 8998 1 12 . 1 1 24 24 GLY C C 24 173.626 173.626 174.557 -0.931 18935 8999 1 12 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.091 -0.156 18935 9000 1 12 . 1 1 24 24 GLY H H 24 8.666 8.666 8.623 0.043 18935 9001 1 12 . 1 1 25 25 GLN N N 25 118.722 118.722 120.313 -1.591 18935 9002 1 12 . 1 1 25 25 GLN C C 25 173.657 173.657 175.063 -1.406 18935 9003 1 12 . 1 1 25 25 GLN CA C 25 53.233 53.233 55.112 -1.879 18935 9004 1 12 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.039 0.766 18935 9005 1 12 . 1 1 25 25 GLN H H 25 7.708 7.708 8.143 -0.435 18935 9006 1 12 . 1 1 26 26 LEU N N 26 123.526 123.526 122.281 1.245 18935 9007 1 12 . 1 1 26 26 LEU C C 26 175.842 175.842 176.528 -0.686 18935 9008 1 12 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.886 0.100 18935 9009 1 12 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.545 -2.738 18935 9010 1 12 . 1 1 26 26 LEU H H 26 8.543 8.543 8.315 0.228 18935 9011 1 12 . 1 1 27 27 ILE N N 27 129.462 129.462 124.843 4.619 18935 9012 1 12 . 1 1 27 27 ILE C C 27 175.085 175.085 174.136 0.949 18935 9013 1 12 . 1 1 27 27 ILE CA C 27 58.973 58.973 59.751 -0.778 18935 9014 1 12 . 1 1 27 27 ILE CB C 27 35.552 35.552 40.385 -4.833 18935 9015 1 12 . 1 1 27 27 ILE H H 27 8.989 8.989 8.900 0.089 18935 9016 1 12 . 1 1 28 28 LYS N N 28 125.157 125.157 126.307 -1.150 18935 9017 1 12 . 1 1 28 28 LYS C C 28 176.725 176.725 175.637 1.088 18935 9018 1 12 . 1 1 28 28 LYS CA C 28 56.810 56.810 56.306 0.504 18935 9019 1 12 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.100 -1.283 18935 9020 1 12 . 1 1 28 28 LYS H H 28 8.311 8.311 8.356 -0.045 18935 9021 1 12 . 1 1 29 29 ILE N N 29 125.565 125.565 120.344 5.221 18935 9022 1 12 . 1 1 29 29 ILE C C 29 175.685 175.685 174.900 0.785 18935 9023 1 12 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.883 0.521 18935 9024 1 12 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.228 -3.197 18935 9025 1 12 . 1 1 29 29 ILE H H 29 8.209 8.209 7.820 0.389 18935 9026 1 12 . 1 1 30 30 LEU N N 30 127.831 127.831 119.127 8.704 18935 9027 1 12 . 1 1 30 30 LEU C C 30 178.794 178.794 178.065 0.729 18935 9028 1 12 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.586 0.857 18935 9029 1 12 . 1 1 30 30 LEU CB C 30 40.836 40.836 43.720 -2.884 18935 9030 1 12 . 1 1 30 30 LEU H H 30 9.027 9.027 8.435 0.592 18935 9031 1 12 . 1 1 31 31 SER N N 31 116.864 116.864 118.100 -1.236 18935 9032 1 12 . 1 1 31 31 SER C C 31 177.464 177.464 176.687 0.777 18935 9033 1 12 . 1 1 31 31 SER CA C 31 61.180 61.180 61.295 -0.115 18935 9034 1 12 . 1 1 31 31 SER CB C 31 62.105 62.105 62.578 -0.473 18935 9035 1 12 . 1 1 31 31 SER H H 31 8.887 8.887 8.912 -0.025 18935 9036 1 12 . 1 1 32 32 LYS N N 32 114.825 114.825 121.329 -6.504 18935 9037 1 12 . 1 1 32 32 LYS C C 32 176.243 176.243 177.455 -1.212 18935 9038 1 12 . 1 1 32 32 LYS CA C 32 57.292 57.292 57.938 -0.646 18935 9039 1 12 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.171 -1.905 18935 9040 1 12 . 1 1 32 32 LYS H H 32 8.290 8.290 8.378 -0.088 18935 9041 1 12 . 1 1 33 33 ASN N N 33 117.564 117.564 116.271 1.293 18935 9042 1 12 . 1 1 33 33 ASN C C 33 172.253 172.253 173.864 -1.611 18935 9043 1 12 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.347 -1.256 18935 9044 1 12 . 1 1 33 33 ASN CB C 33 38.339 38.339 39.512 -1.173 18935 9045 1 12 . 1 1 33 33 ASN H H 33 8.051 8.051 7.970 0.081 18935 9046 1 12 . 1 1 34 34 ILE N N 34 118.949 118.949 120.305 -1.356 18935 9047 1 12 . 1 1 34 34 ILE C C 34 175.343 175.343 174.857 0.486 18935 9048 1 12 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.035 0.518 18935 9049 1 12 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.608 -2.740 18935 9050 1 12 . 1 1 34 34 ILE H H 34 7.670 7.670 7.700 -0.030 18935 9051 1 12 . 1 1 35 35 VAL N N 35 128.355 128.355 127.042 1.313 18935 9052 1 12 . 1 1 35 35 VAL C C 35 175.543 175.543 174.440 1.103 18935 9053 1 12 . 1 1 35 35 VAL CA C 35 60.014 60.014 59.907 0.107 18935 9054 1 12 . 1 1 35 35 VAL CB C 35 34.231 34.231 34.724 -0.493 18935 9055 1 12 . 1 1 35 35 VAL H H 35 9.698 9.698 9.350 0.348 18935 9056 1 12 . 1 1 36 36 ALA N N 36 129.553 129.553 132.243 -2.690 18935 9057 1 12 . 1 1 36 36 ALA C C 36 177.015 177.015 176.671 0.344 18935 9058 1 12 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.809 0.587 18935 9059 1 12 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.111 -0.489 18935 9060 1 12 . 1 1 36 36 ALA H H 36 8.917 8.917 8.572 0.345 18935 9061 1 12 . 1 1 37 37 VAL N N 37 115.006 115.006 120.536 -5.530 18935 9062 1 12 . 1 1 37 37 VAL C C 37 174.649 174.649 175.038 -0.389 18935 9063 1 12 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.394 -0.073 18935 9064 1 12 . 1 1 37 37 VAL CB C 37 32.386 32.386 34.338 -1.952 18935 9065 1 12 . 1 1 37 37 VAL H H 37 8.214 8.214 7.583 0.631 18935 9066 1 12 . 1 1 38 38 GLY N N 38 109.387 109.387 106.833 2.554 18935 9067 1 12 . 1 1 38 38 GLY C C 38 174.152 174.152 175.811 -1.659 18935 9068 1 12 . 1 1 38 38 GLY CA C 38 45.497 45.497 44.918 0.579 18935 9069 1 12 . 1 1 38 38 GLY H H 38 8.677 8.677 7.813 0.864 18935 9070 1 12 . 1 1 39 39 SER N N 39 116.776 116.776 118.657 -1.881 18935 9071 1 12 . 1 1 39 39 SER C C 39 175.129 175.129 177.065 -1.936 18935 9072 1 12 . 1 1 39 39 SER CA C 39 60.036 60.036 61.744 -1.708 18935 9073 1 12 . 1 1 39 39 SER CB C 39 61.522 61.522 63.113 -1.591 18935 9074 1 12 . 1 1 39 39 SER H H 39 9.705 9.705 8.831 0.874 18935 9075 1 12 . 1 1 40 40 LEU N N 40 113.696 113.696 122.191 -8.495 18935 9076 1 12 . 1 1 40 40 LEU C C 40 180.558 180.558 178.147 2.411 18935 9077 1 12 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.562 0.811 18935 9078 1 12 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.856 0.021 18935 9079 1 12 . 1 1 40 40 LEU H H 40 7.311 7.311 8.097 -0.786 18935 9080 1 12 . 1 1 41 41 ARG N N 41 121.162 121.162 117.510 3.652 18935 9081 1 12 . 1 1 41 41 ARG C C 41 176.964 176.964 177.097 -0.133 18935 9082 1 12 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.796 1.655 18935 9083 1 12 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.196 -1.991 18935 9084 1 12 . 1 1 41 41 ARG H H 41 6.999 6.999 7.686 -0.687 18935 9085 1 12 . 1 1 42 42 ARG N N 42 111.109 111.109 118.044 -6.935 18935 9086 1 12 . 1 1 42 42 ARG C C 42 172.564 172.564 175.216 -2.652 18935 9087 1 12 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.517 0.863 18935 9088 1 12 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.639 -2.290 18935 9089 1 12 . 1 1 42 42 ARG H H 42 7.041 7.041 7.588 -0.547 18935 9090 1 12 . 1 1 43 43 GLU N N 43 111.924 111.924 116.633 -4.709 18935 9091 1 12 . 1 1 43 43 GLU C C 43 176.202 176.202 175.491 0.711 18935 9092 1 12 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.220 -0.766 18935 9093 1 12 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.345 -2.044 18935 9094 1 12 . 1 1 43 43 GLU H H 43 7.757 7.757 7.893 -0.136 18935 9095 1 12 . 1 1 44 44 GLU N N 44 117.861 117.861 119.705 -1.844 18935 9096 1 12 . 1 1 44 44 GLU C C 44 175.197 175.197 175.783 -0.586 18935 9097 1 12 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.145 -0.018 18935 9098 1 12 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.951 -2.392 18935 9099 1 12 . 1 1 44 44 GLU H H 44 7.461 7.461 7.920 -0.459 18935 9100 1 12 . 1 1 45 45 LYS N N 45 115.051 115.051 116.114 -1.063 18935 9101 1 12 . 1 1 45 45 LYS C C 45 177.733 177.733 175.023 2.710 18935 9102 1 12 . 1 1 45 45 LYS CA C 45 59.055 59.055 56.856 2.199 18935 9103 1 12 . 1 1 45 45 LYS CB C 45 32.027 32.027 34.295 -2.268 18935 9104 1 12 . 1 1 45 45 LYS H H 45 8.123 8.123 8.624 -0.501 18935 9105 1 12 . 1 1 46 46 MET N N 46 114.009 114.009 120.624 -6.615 18935 9106 1 12 . 1 1 46 46 MET C C 46 174.067 174.067 174.152 -0.085 18935 9107 1 12 . 1 1 46 46 MET CA C 46 52.477 52.477 54.925 -2.448 18935 9108 1 12 . 1 1 46 46 MET CB C 46 33.974 33.974 34.112 -0.138 18935 9109 1 12 . 1 1 46 46 MET H H 46 7.767 7.767 7.471 0.296 18935 9110 1 12 . 1 1 47 47 LEU N N 47 120.263 120.263 124.674 -4.411 18935 9111 1 12 . 1 1 47 47 LEU C C 47 177.669 177.669 177.345 0.324 18935 9112 1 12 . 1 1 47 47 LEU CA C 47 52.201 52.201 54.188 -1.987 18935 9113 1 12 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.926 -1.018 18935 9114 1 12 . 1 1 47 47 LEU H H 47 9.481 9.481 8.499 0.982 18935 9115 1 12 . 1 1 48 48 ASN N N 48 118.632 118.632 117.171 1.461 18935 9116 1 12 . 1 1 48 48 ASN C C 48 174.715 174.715 174.244 0.471 18935 9117 1 12 . 1 1 48 48 ASN CA C 48 55.501 55.501 52.984 2.517 18935 9118 1 12 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.360 -1.532 18935 9119 1 12 . 1 1 48 48 ASN H H 48 9.388 9.388 8.778 0.610 18935 9120 1 12 . 1 1 49 49 ASP N N 49 115.867 115.867 118.829 -2.962 18935 9121 1 12 . 1 1 49 49 ASP C C 49 174.111 174.111 174.286 -0.175 18935 9122 1 12 . 1 1 49 49 ASP CA C 49 51.201 51.201 53.665 -2.464 18935 9123 1 12 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.518 -3.441 18935 9124 1 12 . 1 1 49 49 ASP H H 49 7.670 7.670 7.662 0.008 18935 9125 1 12 . 1 1 50 50 VAL N N 50 119.185 119.185 121.246 -2.061 18935 9126 1 12 . 1 1 50 50 VAL C C 50 172.333 172.333 173.993 -1.660 18935 9127 1 12 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.486 0.429 18935 9128 1 12 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.787 -0.822 18935 9129 1 12 . 1 1 50 50 VAL H H 50 8.339 8.339 7.997 0.342 18935 9130 1 12 . 1 1 51 51 ASP N N 51 124.704 124.704 126.671 -1.967 18935 9131 1 12 . 1 1 51 51 ASP C C 51 173.725 173.725 175.171 -1.446 18935 9132 1 12 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.651 -0.623 18935 9133 1 12 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.652 0.177 18935 9134 1 12 . 1 1 51 51 ASP H H 51 8.984 8.984 8.373 0.611 18935 9135 1 12 . 1 1 52 52 LEU N N 52 120.943 120.943 123.196 -2.253 18935 9136 1 12 . 1 1 52 52 LEU C C 52 173.045 173.045 173.886 -0.841 18935 9137 1 12 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.633 -1.762 18935 9138 1 12 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.694 -2.441 18935 9139 1 12 . 1 1 52 52 LEU H H 52 9.081 9.081 8.582 0.499 18935 9140 1 12 . 1 1 53 53 LEU N N 53 123.027 123.027 127.420 -4.393 18935 9141 1 12 . 1 1 53 53 LEU C C 53 173.750 173.750 174.590 -0.840 18935 9142 1 12 . 1 1 53 53 LEU CA C 53 52.333 52.333 52.834 -0.501 18935 9143 1 12 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.981 -0.973 18935 9144 1 12 . 1 1 53 53 LEU H H 53 9.146 9.146 9.258 -0.112 18935 9145 1 12 . 1 1 54 54 ILE N N 54 126.562 126.562 127.105 -0.543 18935 9146 1 12 . 1 1 54 54 ILE C C 54 175.132 175.132 175.265 -0.133 18935 9147 1 12 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.953 -1.355 18935 9148 1 12 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.807 -1.246 18935 9149 1 12 . 1 1 54 54 ILE H H 54 9.440 9.440 9.326 0.114 18935 9150 1 12 . 1 1 55 55 ILE N N 55 126.879 126.879 126.876 0.003 18935 9151 1 12 . 1 1 55 55 ILE C C 55 175.655 175.655 175.436 0.219 18935 9152 1 12 . 1 1 55 55 ILE CA C 55 57.561 57.561 59.814 -2.253 18935 9153 1 12 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.830 -5.524 18935 9154 1 12 . 1 1 55 55 ILE H H 55 9.381 9.381 8.088 1.293 18935 9155 1 12 . 1 1 56 56 VAL N N 56 128.936 128.936 122.513 6.423 18935 9156 1 12 . 1 1 56 56 VAL C C 56 176.389 176.389 174.803 1.586 18935 9157 1 12 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.233 0.397 18935 9158 1 12 . 1 1 56 56 VAL CB C 56 32.784 32.784 34.204 -1.420 18935 9159 1 12 . 1 1 56 56 VAL H H 56 9.227 9.227 8.556 0.671 18935 9160 1 12 . 1 1 58 58 GLU N N 58 112.423 112.423 118.220 -5.797 18935 9161 1 12 . 1 1 58 58 GLU C C 58 175.946 175.946 176.401 -0.455 18935 9162 1 12 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.253 -0.953 18935 9163 1 12 . 1 1 58 58 GLU CB C 58 32.097 32.097 30.894 1.203 18935 9164 1 12 . 1 1 58 58 GLU H H 58 6.685 6.685 7.959 -1.274 18935 9165 1 12 . 1 1 59 59 LYS N N 59 125.293 125.293 120.592 4.701 18935 9166 1 12 . 1 1 59 59 LYS C C 59 179.248 179.248 175.736 3.512 18935 9167 1 12 . 1 1 59 59 LYS CA C 59 59.774 59.774 56.912 2.862 18935 9168 1 12 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.170 -1.093 18935 9169 1 12 . 1 1 59 59 LYS H H 59 9.108 9.108 8.778 0.330 18935 9170 1 12 . 1 1 60 60 LYS N N 60 117.408 117.408 118.312 -0.904 18935 9171 1 12 . 1 1 60 60 LYS C C 60 177.198 177.198 177.175 0.023 18935 9172 1 12 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.742 1.471 18935 9173 1 12 . 1 1 60 60 LYS CB C 60 30.583 30.583 33.028 -2.445 18935 9174 1 12 . 1 1 60 60 LYS H H 60 9.102 9.102 7.569 1.533 18935 9175 1 12 . 1 1 61 61 LEU N N 61 114.779 114.779 121.613 -6.834 18935 9176 1 12 . 1 1 61 61 LEU C C 61 178.790 178.790 178.580 0.210 18935 9177 1 12 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.772 -2.748 18935 9178 1 12 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.586 -0.722 18935 9179 1 12 . 1 1 61 61 LEU H H 61 7.455 7.455 8.441 -0.986 18935 9180 1 12 . 1 1 62 62 LEU N N 62 119.629 119.629 119.082 0.547 18935 9181 1 12 . 1 1 62 62 LEU C C 62 177.762 177.762 178.122 -0.360 18935 9182 1 12 . 1 1 62 62 LEU CA C 62 58.198 58.198 58.105 0.093 18935 9183 1 12 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.829 -1.098 18935 9184 1 12 . 1 1 62 62 LEU H H 62 7.714 7.714 7.639 0.075 18935 9185 1 12 . 1 1 63 63 LYS N N 63 112.921 112.921 116.056 -3.135 18935 9186 1 12 . 1 1 63 63 LYS C C 63 175.386 175.386 177.583 -2.197 18935 9187 1 12 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.966 -0.610 18935 9188 1 12 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.059 -1.096 18935 9189 1 12 . 1 1 63 63 LYS H H 63 7.751 7.751 7.994 -0.243 18935 9190 1 12 . 1 1 64 64 HIS N N 64 112.468 112.468 115.934 -3.466 18935 9191 1 12 . 1 1 64 64 HIS C C 64 176.081 176.081 176.399 -0.318 18935 9192 1 12 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.775 -2.006 18935 9193 1 12 . 1 1 64 64 HIS CB C 64 32.370 32.370 30.408 1.962 18935 9194 1 12 . 1 1 64 64 HIS H H 64 7.697 7.697 7.444 0.253 18935 9195 1 12 . 1 1 65 65 VAL N N 65 117.499 117.499 118.648 -1.149 18935 9196 1 12 . 1 1 65 65 VAL C C 65 174.301 174.301 176.776 -2.475 18935 9197 1 12 . 1 1 65 65 VAL CA C 65 66.330 66.330 64.109 2.221 18935 9198 1 12 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.129 -1.769 18935 9199 1 12 . 1 1 65 65 VAL H H 65 6.917 6.917 7.125 -0.208 18935 9200 1 12 . 1 1 66 66 LEU N N 66 113.873 113.873 119.119 -5.246 18935 9201 1 12 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.779 0.071 18935 9202 1 12 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.760 -3.702 18935 9203 1 12 . 1 1 66 66 LEU H H 66 9.102 9.102 7.306 1.796 18935 9204 1 12 . 1 1 68 68 ASN N N 68 110.792 110.792 116.894 -6.102 18935 9205 1 12 . 1 1 68 68 ASN C C 68 174.877 174.877 173.300 1.577 18935 9206 1 12 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.270 -1.455 18935 9207 1 12 . 1 1 68 68 ASN CB C 68 40.311 40.311 40.418 -0.107 18935 9208 1 12 . 1 1 68 68 ASN H H 68 7.234 7.234 8.273 -1.039 18935 9209 1 12 . 1 1 69 69 ILE N N 69 122.348 122.348 125.229 -2.881 18935 9210 1 12 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.096 -0.184 18935 9211 1 12 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.643 -2.605 18935 9212 1 12 . 1 1 69 69 ILE H H 69 7.428 7.428 8.595 -1.167 18935 9213 1 12 . 1 1 70 70 ARG N N 70 125.701 125.701 126.069 -0.368 18935 9214 1 12 . 1 1 70 70 ARG C C 70 174.596 174.596 173.659 0.937 18935 9215 1 12 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.654 -1.492 18935 9216 1 12 . 1 1 70 70 ARG CB C 70 32.453 32.453 32.474 -0.021 18935 9217 1 12 . 1 1 70 70 ARG H H 70 9.083 9.083 8.751 0.332 18935 9218 1 12 . 1 1 71 71 ILE N N 71 118.496 118.496 118.562 -0.066 18935 9219 1 12 . 1 1 71 71 ILE C C 71 175.625 175.625 176.239 -0.614 18935 9220 1 12 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.644 0.132 18935 9221 1 12 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.496 -2.529 18935 9222 1 12 . 1 1 71 71 ILE H H 71 7.864 7.864 8.306 -0.442 18935 9223 1 12 . 1 1 72 72 LYS N N 72 127.423 127.423 124.020 3.403 18935 9224 1 12 . 1 1 72 72 LYS C C 72 177.659 177.659 177.103 0.556 18935 9225 1 12 . 1 1 72 72 LYS CA C 72 57.428 57.428 56.394 1.034 18935 9226 1 12 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.592 -1.218 18935 9227 1 12 . 1 1 72 72 LYS H H 72 8.720 8.720 8.858 -0.138 18935 9228 1 12 . 1 1 73 73 GLY N N 73 112.604 112.604 113.111 -0.507 18935 9229 1 12 . 1 1 73 73 GLY C C 73 173.729 173.729 173.583 0.146 18935 9230 1 12 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.307 0.524 18935 9231 1 12 . 1 1 73 73 GLY H H 73 8.930 8.930 8.961 -0.031 18935 9232 1 12 . 1 1 74 74 LEU N N 74 119.538 119.538 119.531 0.007 18935 9233 1 12 . 1 1 74 74 LEU C C 74 175.802 175.802 175.041 0.761 18935 9234 1 12 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.528 0.133 18935 9235 1 12 . 1 1 74 74 LEU CB C 74 44.053 44.053 45.432 -1.379 18935 9236 1 12 . 1 1 74 74 LEU H H 74 7.547 7.547 7.787 -0.240 18935 9237 1 12 . 1 1 75 75 SER N N 75 118.994 118.994 117.584 1.410 18935 9238 1 12 . 1 1 75 75 SER C C 75 173.111 173.111 173.175 -0.064 18935 9239 1 12 . 1 1 75 75 SER CA C 75 57.696 57.696 57.902 -0.206 18935 9240 1 12 . 1 1 75 75 SER CB C 75 63.073 63.073 63.449 -0.376 18935 9241 1 12 . 1 1 75 75 SER H H 75 9.076 9.076 8.667 0.409 18935 9242 1 12 . 1 1 76 76 PHE N N 76 117.802 117.802 121.373 -3.571 18935 9243 1 12 . 1 1 76 76 PHE C C 76 173.564 173.564 174.512 -0.948 18935 9244 1 12 . 1 1 76 76 PHE CA C 76 55.409 55.409 55.874 -0.465 18935 9245 1 12 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.052 -0.209 18935 9246 1 12 . 1 1 76 76 PHE H H 76 8.119 8.119 7.933 0.186 18935 9247 1 12 . 1 1 77 77 SER N N 77 113.918 113.918 117.525 -3.607 18935 9248 1 12 . 1 1 77 77 SER C C 77 173.194 173.194 173.230 -0.036 18935 9249 1 12 . 1 1 77 77 SER CA C 77 55.999 55.999 57.487 -1.488 18935 9250 1 12 . 1 1 77 77 SER CB C 77 65.218 65.218 65.577 -0.359 18935 9251 1 12 . 1 1 77 77 SER H H 77 8.989 8.989 8.406 0.583 18935 9252 1 12 . 1 1 78 78 VAL N N 78 123.662 123.662 125.915 -2.253 18935 9253 1 12 . 1 1 78 78 VAL C C 78 176.057 176.057 175.781 0.276 18935 9254 1 12 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.624 -0.533 18935 9255 1 12 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.627 0.667 18935 9256 1 12 . 1 1 78 78 VAL H H 78 8.995 8.995 8.743 0.252 18935 9257 1 12 . 1 1 79 79 LYS N N 79 129.417 129.417 129.565 -0.148 18935 9258 1 12 . 1 1 79 79 LYS C C 79 176.436 176.436 174.650 1.786 18935 9259 1 12 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.205 3.447 18935 9260 1 12 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.061 -3.588 18935 9261 1 12 . 1 1 79 79 LYS H H 79 9.425 9.425 8.715 0.710 18935 9262 1 12 . 1 1 80 80 VAL N N 80 108.616 108.616 121.987 -13.371 18935 9263 1 12 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.241 -2.144 18935 9264 1 12 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.319 0.763 18935 9265 1 12 . 1 1 80 80 VAL H H 80 7.380 7.380 8.466 -1.086 18935 9266 1 12 . 1 1 81 81 CYS N N 81 123.254 123.254 126.896 -3.642 18935 9267 1 12 . 1 1 81 81 CYS C C 81 172.053 172.053 173.884 -1.831 18935 9268 1 12 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.732 2.007 18935 9269 1 12 . 1 1 81 81 CYS CB C 81 27.332 27.332 30.378 -3.046 18935 9270 1 12 . 1 1 81 81 CYS H H 81 9.759 9.759 8.563 1.196 18935 9271 1 12 . 1 1 82 82 GLY N N 82 118.450 118.450 113.718 4.732 18935 9272 1 12 . 1 1 82 82 GLY C C 82 171.814 171.814 174.910 -3.096 18935 9273 1 12 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.576 -2.223 18935 9274 1 12 . 1 1 82 82 GLY H H 82 8.537 8.537 8.456 0.081 18935 9275 1 12 . 1 1 83 83 GLU N N 83 113.964 113.964 121.970 -8.006 18935 9276 1 12 . 1 1 83 83 GLU C C 83 179.320 179.320 177.322 1.998 18935 9277 1 12 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.105 0.570 18935 9278 1 12 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.316 -0.409 18935 9279 1 12 . 1 1 83 83 GLU H H 83 8.473 8.473 8.801 -0.328 18935 9280 1 12 . 1 1 84 84 ARG N N 84 117.544 117.544 117.429 0.115 18935 9281 1 12 . 1 1 84 84 ARG C C 84 177.252 177.252 175.636 1.616 18935 9282 1 12 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.261 -0.757 18935 9283 1 12 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.238 0.308 18935 9284 1 12 . 1 1 84 84 ARG H H 84 9.760 9.760 8.351 1.409 18935 9285 1 12 . 1 1 85 85 LYS N N 85 124.160 124.160 120.495 3.665 18935 9286 1 12 . 1 1 85 85 LYS C C 85 173.379 173.379 175.624 -2.245 18935 9287 1 12 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.763 -1.531 18935 9288 1 12 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.180 0.032 18935 9289 1 12 . 1 1 85 85 LYS H H 85 8.494 8.494 7.711 0.783 18935 9290 1 12 . 1 1 86 86 CYS N N 86 126.472 126.472 118.809 7.663 18935 9291 1 12 . 1 1 86 86 CYS C C 86 171.935 171.935 173.006 -1.071 18935 9292 1 12 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.702 -1.824 18935 9293 1 12 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.431 -0.127 18935 9294 1 12 . 1 1 86 86 CYS H H 86 9.221 9.221 8.213 1.008 18935 9295 1 12 . 1 1 87 87 VAL N N 87 126.426 126.426 123.416 3.010 18935 9296 1 12 . 1 1 87 87 VAL C C 87 173.760 173.760 173.908 -0.148 18935 9297 1 12 . 1 1 87 87 VAL CA C 87 61.333 61.333 60.603 0.730 18935 9298 1 12 . 1 1 87 87 VAL CB C 87 33.338 33.338 34.153 -0.815 18935 9299 1 12 . 1 1 87 87 VAL H H 87 8.623 8.623 8.793 -0.170 18935 9300 1 12 . 1 1 88 88 LEU N N 88 125.701 125.701 126.993 -1.292 18935 9301 1 12 . 1 1 88 88 LEU C C 88 175.424 175.424 175.318 0.106 18935 9302 1 12 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.064 -0.979 18935 9303 1 12 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.160 -1.616 18935 9304 1 12 . 1 1 88 88 LEU H H 88 9.592 9.592 8.796 0.796 18935 9305 1 12 . 1 1 89 89 PHE N N 89 118.314 118.314 122.847 -4.533 18935 9306 1 12 . 1 1 89 89 PHE C C 89 177.068 177.068 176.107 0.961 18935 9307 1 12 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.536 -0.661 18935 9308 1 12 . 1 1 89 89 PHE CB C 89 38.837 38.837 38.814 0.023 18935 9309 1 12 . 1 1 89 89 PHE H H 89 8.979 8.979 8.617 0.362 18935 9310 1 12 . 1 1 90 90 ILE N N 90 119.039 119.039 119.887 -0.848 18935 9311 1 12 . 1 1 90 90 ILE C C 90 173.692 173.692 175.334 -1.642 18935 9312 1 12 . 1 1 90 90 ILE CA C 90 58.672 58.672 60.474 -1.802 18935 9313 1 12 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.097 1.086 18935 9314 1 12 . 1 1 90 90 ILE H H 90 9.447 9.447 8.120 1.327 18935 9315 1 12 . 1 1 91 91 GLU N N 91 122.801 122.801 125.158 -2.357 18935 9316 1 12 . 1 1 91 91 GLU C C 91 175.565 175.565 175.224 0.341 18935 9317 1 12 . 1 1 91 91 GLU CA C 91 54.465 54.465 54.967 -0.502 18935 9318 1 12 . 1 1 91 91 GLU CB C 91 29.662 29.662 31.666 -2.004 18935 9319 1 12 . 1 1 91 91 GLU H H 91 8.360 8.360 8.661 -0.301 18935 9320 1 12 . 1 1 92 92 TRP N N 92 126.018 126.018 119.796 6.222 18935 9321 1 12 . 1 1 92 92 TRP C C 92 175.070 175.070 175.166 -0.096 18935 9322 1 12 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.699 -0.509 18935 9323 1 12 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.192 -0.610 18935 9324 1 12 . 1 1 92 92 TRP H H 92 9.425 9.425 8.563 0.862 18935 9325 1 12 . 1 1 93 93 GLU N N 93 126.381 126.381 120.893 5.488 18935 9326 1 12 . 1 1 93 93 GLU C C 93 175.637 175.637 175.634 0.003 18935 9327 1 12 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.858 -1.089 18935 9328 1 12 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.003 -2.059 18935 9329 1 12 . 1 1 93 93 GLU H H 93 8.914 8.914 9.197 -0.283 18935 9330 1 12 . 1 1 94 94 LYS N N 94 107.891 107.891 111.895 -4.004 18935 9331 1 12 . 1 1 94 94 LYS C C 94 175.359 175.359 175.567 -0.208 18935 9332 1 12 . 1 1 94 94 LYS CA C 94 57.429 57.429 56.864 0.565 18935 9333 1 12 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.627 -1.985 18935 9334 1 12 . 1 1 94 94 LYS H H 94 8.634 8.634 8.613 0.021 18935 9335 1 12 . 1 1 95 95 LYS N N 95 120.490 120.490 118.988 1.502 18935 9336 1 12 . 1 1 95 95 LYS C C 95 174.369 174.369 174.282 0.087 18935 9337 1 12 . 1 1 95 95 LYS CA C 95 54.353 54.353 55.183 -0.830 18935 9338 1 12 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.977 -1.514 18935 9339 1 12 . 1 1 95 95 LYS H H 95 7.924 7.924 7.634 0.290 18935 9340 1 12 . 1 1 96 96 THR N N 96 115.278 115.278 113.061 2.217 18935 9341 1 12 . 1 1 96 96 THR C C 96 174.317 174.317 173.249 1.068 18935 9342 1 12 . 1 1 96 96 THR CA C 96 61.203 61.203 60.298 0.904 18935 9343 1 12 . 1 1 96 96 THR CB C 96 69.348 69.348 70.255 -0.907 18935 9344 1 12 . 1 1 96 96 THR H H 96 7.967 7.967 7.771 0.196 18935 9345 1 12 . 1 1 97 97 TYR N N 97 123.254 123.254 124.780 -1.526 18935 9346 1 12 . 1 1 97 97 TYR C C 97 173.320 173.320 174.656 -1.336 18935 9347 1 12 . 1 1 97 97 TYR CA C 97 55.884 55.884 55.824 0.060 18935 9348 1 12 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.599 -0.463 18935 9349 1 12 . 1 1 97 97 TYR H H 97 9.232 9.232 9.041 0.191 18935 9350 1 12 . 1 1 98 98 GLN N N 98 122.574 122.574 118.027 4.547 18935 9351 1 12 . 1 1 98 98 GLN C C 98 172.781 172.781 174.352 -1.571 18935 9352 1 12 . 1 1 98 98 GLN CA C 98 55.171 55.171 54.994 0.177 18935 9353 1 12 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.412 -3.013 18935 9354 1 12 . 1 1 98 98 GLN H H 98 9.000 9.000 8.913 0.087 18935 9355 1 12 . 1 1 99 99 LEU N N 99 130.218 130.218 124.791 5.427 18935 9356 1 12 . 1 1 99 99 LEU C C 99 172.806 172.806 174.306 -1.500 18935 9357 1 12 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.554 -1.504 18935 9358 1 12 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.221 -0.469 18935 9359 1 12 . 1 1 99 99 LEU H H 99 9.246 9.246 8.982 0.264 18935 9360 1 12 . 1 1 100 100 ASP N N 100 124.931 124.931 126.973 -2.042 18935 9361 1 12 . 1 1 100 100 ASP C C 100 172.626 172.626 174.384 -1.758 18935 9362 1 12 . 1 1 100 100 ASP CA C 100 50.430 50.430 52.895 -2.465 18935 9363 1 12 . 1 1 100 100 ASP CB C 100 37.328 37.328 42.109 -4.781 18935 9364 1 12 . 1 1 100 100 ASP H H 100 9.253 9.253 8.664 0.589 18935 9365 1 12 . 1 1 101 101 LEU N N 101 119.402 119.402 119.805 -0.403 18935 9366 1 12 . 1 1 101 101 LEU C C 101 173.869 173.869 174.404 -0.535 18935 9367 1 12 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.886 -1.231 18935 9368 1 12 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.405 0.761 18935 9369 1 12 . 1 1 101 101 LEU H H 101 8.726 8.726 7.456 1.270 18935 9370 1 12 . 1 1 102 102 PHE N N 102 117.952 117.952 119.642 -1.690 18935 9371 1 12 . 1 1 102 102 PHE C C 102 175.853 175.853 175.345 0.508 18935 9372 1 12 . 1 1 102 102 PHE CA C 102 53.282 53.282 56.162 -2.880 18935 9373 1 12 . 1 1 102 102 PHE CB C 102 41.824 41.824 42.287 -0.463 18935 9374 1 12 . 1 1 102 102 PHE H H 102 8.236 8.236 8.972 -0.736 18935 9375 1 12 . 1 1 103 103 THR N N 103 106.853 106.853 117.690 -10.837 18935 9376 1 12 . 1 1 103 103 THR C C 103 175.154 175.154 173.834 1.320 18935 9377 1 12 . 1 1 103 103 THR CA C 103 57.685 57.685 60.405 -2.720 18935 9378 1 12 . 1 1 103 103 THR CB C 103 71.037 71.037 69.527 1.510 18935 9379 1 12 . 1 1 103 103 THR H H 103 7.917 7.917 8.551 -0.634 18935 9380 1 12 . 1 1 104 104 ALA N N 104 122.348 122.348 128.757 -6.409 18935 9381 1 12 . 1 1 104 104 ALA C C 104 175.947 175.947 174.929 1.018 18935 9382 1 12 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.294 -0.487 18935 9383 1 12 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.286 0.142 18935 9384 1 12 . 1 1 104 104 ALA H H 104 8.930 8.930 8.687 0.243 18935 9385 1 12 . 1 1 105 105 LEU N N 105 119.855 119.855 118.759 1.096 18935 9386 1 12 . 1 1 105 105 LEU C C 105 179.628 179.628 178.954 0.674 18935 9387 1 12 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.208 -1.085 18935 9388 1 12 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.492 -2.158 18935 9389 1 12 . 1 1 105 105 LEU H H 105 8.316 8.316 8.439 -0.123 18935 9390 1 12 . 1 1 106 106 ALA N N 106 123.662 123.662 124.317 -0.655 18935 9391 1 12 . 1 1 106 106 ALA C C 106 181.056 181.056 177.768 3.288 18935 9392 1 12 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.106 1.243 18935 9393 1 12 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.570 -1.254 18935 9394 1 12 . 1 1 106 106 ALA H H 106 8.306 8.306 8.225 0.081 18935 9395 1 12 . 1 1 107 107 GLU N N 107 114.825 114.825 113.821 1.004 18935 9396 1 12 . 1 1 107 107 GLU C C 107 177.854 177.854 176.931 0.923 18935 9397 1 12 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.983 0.403 18935 9398 1 12 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.914 -1.070 18935 9399 1 12 . 1 1 107 107 GLU H H 107 9.754 9.754 8.609 1.145 18935 9400 1 12 . 1 1 108 108 GLU N N 108 115.097 115.097 118.874 -3.777 18935 9401 1 12 . 1 1 108 108 GLU C C 108 178.001 178.001 177.659 0.342 18935 9402 1 12 . 1 1 108 108 GLU CA C 108 54.926 54.926 55.843 -0.917 18935 9403 1 12 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.009 0.992 18935 9404 1 12 . 1 1 108 108 GLU H H 108 7.859 7.859 7.620 0.239 18935 9405 1 12 . 1 1 109 109 LYS N N 109 118.360 118.360 121.438 -3.078 18935 9406 1 12 . 1 1 109 109 LYS C C 109 172.691 172.691 176.174 -3.483 18935 9407 1 12 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.229 0.673 18935 9408 1 12 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.738 -0.198 18935 9409 1 12 . 1 1 109 109 LYS H H 109 7.660 7.660 7.278 0.382 18935 9410 1 12 . 1 1 111 111 TYR N N 111 114.054 114.054 118.730 -4.676 18935 9411 1 12 . 1 1 111 111 TYR C C 111 179.764 179.764 177.917 1.847 18935 9412 1 12 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.946 -1.948 18935 9413 1 12 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.337 -1.381 18935 9414 1 12 . 1 1 111 111 TYR H H 111 6.583 6.583 8.332 -1.749 18935 9415 1 12 . 1 1 112 112 ALA N N 112 124.749 124.749 122.542 2.207 18935 9416 1 12 . 1 1 112 112 ALA C C 112 179.430 179.430 179.589 -0.159 18935 9417 1 12 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.566 0.403 18935 9418 1 12 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.919 -0.107 18935 9419 1 12 . 1 1 112 112 ALA H H 112 8.753 8.753 8.751 0.002 18935 9420 1 12 . 1 1 113 113 ILE N N 113 119.130 119.130 119.924 -0.794 18935 9421 1 12 . 1 1 113 113 ILE C C 113 178.646 178.646 178.555 0.091 18935 9422 1 12 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.326 2.075 18935 9423 1 12 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.499 0.738 18935 9424 1 12 . 1 1 113 113 ILE H H 113 8.946 8.946 8.531 0.415 18935 9425 1 12 . 1 1 114 114 PHE N N 114 121.758 121.758 121.029 0.729 18935 9426 1 12 . 1 1 114 114 PHE C C 114 177.954 177.954 177.135 0.819 18935 9427 1 12 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.322 -1.545 18935 9428 1 12 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.380 0.684 18935 9429 1 12 . 1 1 114 114 PHE H H 114 7.940 7.940 8.311 -0.371 18935 9430 1 12 . 1 1 115 115 HIS N N 115 116.547 116.547 118.783 -2.236 18935 9431 1 12 . 1 1 115 115 HIS C C 115 176.161 176.161 176.755 -0.594 18935 9432 1 12 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.335 -0.216 18935 9433 1 12 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.660 1.407 18935 9434 1 12 . 1 1 115 115 HIS H H 115 7.767 7.767 7.768 -0.001 18935 9435 1 12 . 1 1 116 116 PHE N N 116 109.387 109.387 114.398 -5.011 18935 9436 1 12 . 1 1 116 116 PHE C C 116 177.282 177.282 177.135 0.147 18935 9437 1 12 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.060 1.374 18935 9438 1 12 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.186 -1.931 18935 9439 1 12 . 1 1 116 116 PHE H H 116 8.989 8.989 8.222 0.767 18935 9440 1 12 . 1 1 117 117 THR N N 117 116.864 116.864 111.900 4.964 18935 9441 1 12 . 1 1 117 117 THR C C 117 172.889 172.889 175.484 -2.595 18935 9442 1 12 . 1 1 117 117 THR CA C 117 66.997 66.997 64.315 2.682 18935 9443 1 12 . 1 1 117 117 THR CB C 117 67.948 67.948 69.542 -1.594 18935 9444 1 12 . 1 1 117 117 THR H H 117 7.988 7.988 8.074 -0.086 18935 9445 1 12 . 1 1 118 118 GLY N N 118 103.320 103.320 110.123 -6.803 18935 9446 1 12 . 1 1 118 118 GLY C C 118 176.912 176.912 171.327 5.585 18935 9447 1 12 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.804 1.378 18935 9448 1 12 . 1 1 118 118 GLY H H 118 6.550 6.550 7.293 -0.743 18935 9449 1 12 . 1 1 120 120 VAL N N 120 120.671 120.671 126.707 -6.036 18935 9450 1 12 . 1 1 120 120 VAL C C 120 176.283 176.283 177.260 -0.977 18935 9451 1 12 . 1 1 120 120 VAL CA C 120 66.940 66.940 65.747 1.193 18935 9452 1 12 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.849 -1.997 18935 9453 1 12 . 1 1 120 120 VAL H H 120 8.408 8.408 8.499 -0.091 18935 9454 1 12 . 1 1 121 121 SER N N 121 111.789 111.789 114.948 -3.159 18935 9455 1 12 . 1 1 121 121 SER C C 121 175.658 175.658 176.544 -0.886 18935 9456 1 12 . 1 1 121 121 SER CA C 121 60.814 60.814 61.498 -0.684 18935 9457 1 12 . 1 1 121 121 SER CB C 121 60.253 60.253 62.292 -2.039 18935 9458 1 12 . 1 1 121 121 SER H H 121 8.290 8.290 8.308 -0.018 18935 9459 1 12 . 1 1 122 122 TYR N N 122 123.254 123.254 122.954 0.300 18935 9460 1 12 . 1 1 122 122 TYR C C 122 174.611 174.611 177.124 -2.513 18935 9461 1 12 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.811 -2.265 18935 9462 1 12 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.379 -0.240 18935 9463 1 12 . 1 1 122 122 TYR H H 122 6.303 6.303 7.392 -1.089 18935 9464 1 12 . 1 1 123 123 LEU N N 123 114.825 114.825 120.314 -5.489 18935 9465 1 12 . 1 1 123 123 LEU C C 123 178.891 178.891 179.165 -0.274 18935 9466 1 12 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.967 -1.188 18935 9467 1 12 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.932 -0.294 18935 9468 1 12 . 1 1 123 123 LEU H H 123 6.965 6.965 7.701 -0.736 18935 9469 1 12 . 1 1 124 124 ILE N N 124 114.915 114.915 118.843 -3.928 18935 9470 1 12 . 1 1 124 124 ILE C C 124 177.187 177.187 177.858 -0.671 18935 9471 1 12 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.686 -1.255 18935 9472 1 12 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.484 -0.929 18935 9473 1 12 . 1 1 124 124 ILE H H 124 7.531 7.531 8.126 -0.595 18935 9474 1 12 . 1 1 125 125 ARG N N 125 115.278 115.278 120.087 -4.809 18935 9475 1 12 . 1 1 125 125 ARG C C 125 178.473 178.473 178.561 -0.088 18935 9476 1 12 . 1 1 125 125 ARG CA C 125 58.459 58.459 59.103 -0.644 18935 9477 1 12 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.450 -2.371 18935 9478 1 12 . 1 1 125 125 ARG H H 125 6.809 6.809 7.532 -0.723 18935 9479 1 12 . 1 1 126 126 ILE N N 126 124.160 124.160 118.908 5.252 18935 9480 1 12 . 1 1 126 126 ILE C C 126 178.172 178.172 177.846 0.326 18935 9481 1 12 . 1 1 126 126 ILE CA C 126 60.927 60.927 64.220 -3.293 18935 9482 1 12 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.330 -2.864 18935 9483 1 12 . 1 1 126 126 ILE H H 126 7.408 7.408 7.434 -0.026 18935 9484 1 12 . 1 1 127 127 ARG N N 127 117.136 117.136 120.275 -3.139 18935 9485 1 12 . 1 1 127 127 ARG C C 127 179.227 179.227 178.563 0.664 18935 9486 1 12 . 1 1 127 127 ARG CA C 127 60.216 60.216 58.957 1.259 18935 9487 1 12 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.797 -2.008 18935 9488 1 12 . 1 1 127 127 ARG H H 127 8.230 8.230 7.691 0.539 18935 9489 1 12 . 1 1 128 128 ALA N N 128 121.305 121.305 119.036 2.269 18935 9490 1 12 . 1 1 128 128 ALA C C 128 179.933 179.933 178.577 1.356 18935 9491 1 12 . 1 1 128 128 ALA CA C 128 54.706 54.706 54.540 0.166 18935 9492 1 12 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.479 -0.141 18935 9493 1 12 . 1 1 128 128 ALA H H 128 8.666 8.666 8.594 0.072 18935 9494 1 12 . 1 1 129 129 ALA N N 129 120.943 120.943 120.937 0.006 18935 9495 1 12 . 1 1 129 129 ALA C C 129 181.336 181.336 179.569 1.767 18935 9496 1 12 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.009 0.699 18935 9497 1 12 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.686 -1.827 18935 9498 1 12 . 1 1 129 129 ALA H H 129 7.837 7.837 7.339 0.498 18935 9499 1 12 . 1 1 130 130 LEU N N 130 117.726 117.726 119.786 -2.060 18935 9500 1 12 . 1 1 130 130 LEU C C 130 179.432 179.432 179.205 0.227 18935 9501 1 12 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.928 -0.752 18935 9502 1 12 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.795 -1.229 18935 9503 1 12 . 1 1 130 130 LEU H H 130 8.114 8.114 7.848 0.266 18935 9504 1 12 . 1 1 131 131 LYS N N 131 124.115 124.115 120.464 3.651 18935 9505 1 12 . 1 1 131 131 LYS C C 131 181.452 181.452 179.507 1.945 18935 9506 1 12 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.919 -0.033 18935 9507 1 12 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.873 0.325 18935 9508 1 12 . 1 1 131 131 LYS H H 131 8.849 8.849 7.958 0.891 18935 9509 1 12 . 1 1 132 132 LYS N N 132 119.447 119.447 118.742 0.705 18935 9510 1 12 . 1 1 132 132 LYS C C 132 177.607 177.607 178.048 -0.441 18935 9511 1 12 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.657 -0.705 18935 9512 1 12 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.728 -0.303 18935 9513 1 12 . 1 1 132 132 LYS H H 132 7.778 7.778 7.708 0.070 18935 9514 1 12 . 1 1 133 133 LYS N N 133 116.638 116.638 116.204 0.434 18935 9515 1 12 . 1 1 133 133 LYS C C 133 174.681 174.681 176.055 -1.374 18935 9516 1 12 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.813 -0.735 18935 9517 1 12 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.264 -0.624 18935 9518 1 12 . 1 1 133 133 LYS H H 133 7.617 7.617 7.383 0.234 18935 9519 1 12 . 1 1 134 134 ASN N N 134 110.792 110.792 116.297 -5.505 18935 9520 1 12 . 1 1 134 134 ASN C C 134 174.034 174.034 173.291 0.743 18935 9521 1 12 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.100 0.515 18935 9522 1 12 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.162 -1.110 18935 9523 1 12 . 1 1 134 134 ASN H H 134 8.123 8.123 8.391 -0.268 18935 9524 1 12 . 1 1 135 135 TYR N N 135 115.867 115.867 117.311 -1.444 18935 9525 1 12 . 1 1 135 135 TYR C C 135 175.122 175.122 174.065 1.057 18935 9526 1 12 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.118 0.634 18935 9527 1 12 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.117 -1.201 18935 9528 1 12 . 1 1 135 135 TYR H H 135 8.133 8.133 8.121 0.012 18935 9529 1 12 . 1 1 136 136 LYS N N 136 119.870 119.870 122.924 -3.054 18935 9530 1 12 . 1 1 136 136 LYS C C 136 174.324 174.324 174.362 -0.038 18935 9531 1 12 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.851 0.330 18935 9532 1 12 . 1 1 136 136 LYS CB C 136 34.073 34.073 35.805 -1.732 18935 9533 1 12 . 1 1 136 136 LYS H H 136 9.234 9.234 9.062 0.172 18935 9534 1 12 . 1 1 137 137 LEU N N 137 129.708 129.708 127.855 1.853 18935 9535 1 12 . 1 1 137 137 LEU C C 137 173.798 173.798 175.151 -1.353 18935 9536 1 12 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.377 -1.543 18935 9537 1 12 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.569 1.414 18935 9538 1 12 . 1 1 137 137 LEU H H 137 8.959 8.959 8.813 0.146 18935 9539 1 12 . 1 1 140 140 TYR N N 140 120.580 120.580 114.276 6.304 18935 9540 1 12 . 1 1 140 140 TYR C C 140 174.705 174.705 175.136 -0.431 18935 9541 1 12 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.174 -0.722 18935 9542 1 12 . 1 1 140 140 TYR CB C 140 38.301 38.301 40.365 -2.064 18935 9543 1 12 . 1 1 140 140 TYR H H 140 8.962 8.962 7.235 1.727 18935 9544 1 12 . 1 1 141 141 GLY N N 141 104.986 104.986 105.688 -0.702 18935 9545 1 12 . 1 1 141 141 GLY C C 141 181.854 181.854 171.826 10.028 18935 9546 1 12 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.978 -0.856 18935 9547 1 12 . 1 1 141 141 GLY H H 141 7.555 7.555 7.612 -0.057 18935 9548 1 12 . 1 1 142 142 LEU N N 142 118.269 118.269 121.193 -2.924 18935 9549 1 12 . 1 1 142 142 LEU C C 142 174.067 174.067 175.451 -1.384 18935 9550 1 12 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.225 -0.723 18935 9551 1 12 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.896 0.646 18935 9552 1 12 . 1 1 142 142 LEU H H 142 7.794 7.794 8.241 -0.447 18935 9553 1 12 . 1 1 143 143 PHE N N 143 122.076 122.076 124.868 -2.792 18935 9554 1 12 . 1 1 143 143 PHE C C 143 175.199 175.199 175.296 -0.097 18935 9555 1 12 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.480 -1.448 18935 9556 1 12 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.891 2.179 18935 9557 1 12 . 1 1 143 143 PHE H H 143 9.522 9.522 9.611 -0.089 18935 9558 1 12 . 1 1 144 144 LYS N N 144 121.305 121.305 124.731 -3.426 18935 9559 1 12 . 1 1 144 144 LYS C C 144 176.917 176.917 176.738 0.179 18935 9560 1 12 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.629 0.727 18935 9561 1 12 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.653 0.027 18935 9562 1 12 . 1 1 144 144 LYS H H 144 9.076 9.076 9.273 -0.197 18935 9563 1 12 . 1 1 145 145 ASN N N 145 126.834 126.834 126.478 0.356 18935 9564 1 12 . 1 1 145 145 ASN C C 145 175.070 175.070 174.512 0.558 18935 9565 1 12 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.194 0.570 18935 9566 1 12 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.544 -1.114 18935 9567 1 12 . 1 1 145 145 ASN H H 145 9.618 9.618 9.295 0.323 18935 9568 1 12 . 1 1 146 146 GLN N N 146 110.112 110.112 110.207 -0.095 18935 9569 1 12 . 1 1 146 146 GLN C C 146 175.198 175.198 174.971 0.227 18935 9570 1 12 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.529 -0.633 18935 9571 1 12 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.560 -1.192 18935 9572 1 12 . 1 1 146 146 GLN H H 146 9.140 9.140 8.675 0.465 18935 9573 1 12 . 1 1 147 147 THR N N 147 116.003 116.003 116.419 -0.416 18935 9574 1 12 . 1 1 147 147 THR C C 147 173.224 173.224 173.281 -0.057 18935 9575 1 12 . 1 1 147 147 THR CA C 147 61.450 61.450 61.477 -0.027 18935 9576 1 12 . 1 1 147 147 THR CB C 147 70.285 70.285 70.276 0.009 18935 9577 1 12 . 1 1 147 147 THR H H 147 8.069 8.069 7.782 0.287 18935 9578 1 12 . 1 1 148 148 LEU N N 148 129.281 129.281 129.528 -0.247 18935 9579 1 12 . 1 1 148 148 LEU C C 148 176.703 176.703 175.522 1.181 18935 9580 1 12 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.364 0.102 18935 9581 1 12 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.809 -1.084 18935 9582 1 12 . 1 1 148 148 LEU H H 148 8.831 8.831 8.830 0.001 18935 9583 1 12 . 1 1 149 149 VAL N N 149 130.189 130.189 126.940 3.249 18935 9584 1 12 . 1 1 149 149 VAL C C 149 175.012 175.012 173.931 1.081 18935 9585 1 12 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.842 0.427 18935 9586 1 12 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.342 -3.886 18935 9587 1 12 . 1 1 149 149 VAL H H 149 9.243 9.243 8.727 0.516 18935 9588 1 12 . 1 1 151 151 LEU N N 151 123.481 123.481 115.791 7.690 18935 9589 1 12 . 1 1 151 151 LEU C C 151 177.679 177.679 177.006 0.673 18935 9590 1 12 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.352 0.645 18935 9591 1 12 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.036 1.583 18935 9592 1 12 . 1 1 151 151 LEU H H 151 8.080 8.080 8.261 -0.181 18935 9593 1 12 . 1 1 152 152 LYS N N 152 126.381 126.381 121.813 4.568 18935 9594 1 12 . 1 1 152 152 LYS C C 152 175.115 175.115 174.937 0.178 18935 9595 1 12 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.085 -1.489 18935 9596 1 12 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.980 -2.915 18935 9597 1 12 . 1 1 152 152 LYS H H 152 9.112 9.112 8.908 0.204 18935 9598 1 12 . 1 1 153 153 ILE N N 153 113.737 113.737 114.435 -0.698 18935 9599 1 12 . 1 1 153 153 ILE C C 153 175.748 175.748 173.730 2.018 18935 9600 1 12 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.351 -0.962 18935 9601 1 12 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.766 1.038 18935 9602 1 12 . 1 1 153 153 ILE H H 153 7.304 7.304 7.446 -0.142 18935 9603 1 12 . 1 1 154 154 THR N N 154 110.656 110.656 112.657 -2.001 18935 9604 1 12 . 1 1 154 154 THR C C 154 174.864 174.864 173.472 1.392 18935 9605 1 12 . 1 1 154 154 THR CA C 154 62.141 62.141 61.807 0.334 18935 9606 1 12 . 1 1 154 154 THR CB C 154 70.413 70.413 69.886 0.527 18935 9607 1 12 . 1 1 154 154 THR H H 154 9.382 9.382 8.402 0.980 18935 9608 1 12 . 1 1 155 155 THR N N 155 110.746 110.746 116.188 -5.442 18935 9609 1 12 . 1 1 155 155 THR C C 155 174.718 174.718 175.123 -0.405 18935 9610 1 12 . 1 1 155 155 THR CA C 155 58.785 58.785 60.846 -2.061 18935 9611 1 12 . 1 1 155 155 THR CB C 155 72.277 72.277 70.482 1.795 18935 9612 1 12 . 1 1 155 155 THR H H 155 7.746 7.746 7.594 0.152 18935 9613 1 12 . 1 1 156 156 GLU N N 156 122.302 122.302 123.326 -1.024 18935 9614 1 12 . 1 1 156 156 GLU C C 156 177.289 177.289 177.841 -0.552 18935 9615 1 12 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.648 -1.824 18935 9616 1 12 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.121 -0.740 18935 9617 1 12 . 1 1 156 156 GLU H H 156 9.490 9.490 9.063 0.427 18935 9618 1 12 . 1 1 157 157 LYS N N 157 118.905 118.905 116.192 2.713 18935 9619 1 12 . 1 1 157 157 LYS C C 157 178.241 178.241 178.728 -0.487 18935 9620 1 12 . 1 1 157 157 LYS CA C 157 59.765 59.765 57.300 2.465 18935 9621 1 12 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.542 -0.264 18935 9622 1 12 . 1 1 157 157 LYS H H 157 8.329 8.329 8.448 -0.119 18935 9623 1 12 . 1 1 158 158 GLU N N 158 116.230 116.230 120.856 -4.626 18935 9624 1 12 . 1 1 158 158 GLU C C 158 178.988 178.988 178.332 0.656 18935 9625 1 12 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.464 -0.208 18935 9626 1 12 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.624 -0.566 18935 9627 1 12 . 1 1 158 158 GLU H H 158 7.611 7.611 7.465 0.146 18935 9628 1 12 . 1 1 159 159 LEU N N 159 118.978 118.978 121.593 -2.615 18935 9629 1 12 . 1 1 159 159 LEU C C 159 176.347 176.347 178.324 -1.977 18935 9630 1 12 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.367 -5.128 18935 9631 1 12 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.784 -2.241 18935 9632 1 12 . 1 1 159 159 LEU H H 159 7.704 7.704 8.303 -0.599 18935 9633 1 12 . 1 1 160 160 ILE N N 160 117.227 117.227 114.303 2.924 18935 9634 1 12 . 1 1 160 160 ILE C C 160 177.219 177.219 177.315 -0.096 18935 9635 1 12 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.220 0.395 18935 9636 1 12 . 1 1 160 160 ILE CB C 160 37.557 37.557 36.990 0.567 18935 9637 1 12 . 1 1 160 160 ILE H H 160 7.886 7.886 7.408 0.478 18935 9638 1 12 . 1 1 161 161 LYS N N 161 115.912 115.912 119.337 -3.425 18935 9639 1 12 . 1 1 161 161 LYS C C 161 180.990 180.990 178.759 2.231 18935 9640 1 12 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.618 0.013 18935 9641 1 12 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.964 -1.216 18935 9642 1 12 . 1 1 161 161 LYS H H 161 7.536 7.536 7.572 -0.036 18935 9643 1 12 . 1 1 162 162 GLU N N 162 120.852 120.852 120.661 0.191 18935 9644 1 12 . 1 1 162 162 GLU C C 162 178.793 178.793 177.854 0.939 18935 9645 1 12 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.582 -0.600 18935 9646 1 12 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.514 -1.722 18935 9647 1 12 . 1 1 162 162 GLU H H 162 8.392 8.392 7.973 0.419 18935 9648 1 12 . 1 1 163 163 LEU N N 163 115.912 115.912 117.426 -1.514 18935 9649 1 12 . 1 1 163 163 LEU C C 163 176.370 176.370 178.142 -1.772 18935 9650 1 12 . 1 1 163 163 LEU CA C 163 55.094 55.094 56.422 -1.328 18935 9651 1 12 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.881 -1.707 18935 9652 1 12 . 1 1 163 163 LEU H H 163 8.031 8.031 7.942 0.089 18935 9653 1 12 . 1 1 164 164 GLY N N 164 103.160 103.160 103.646 -0.486 18935 9654 1 12 . 1 1 164 164 GLY C C 164 174.240 174.240 174.037 0.203 18935 9655 1 12 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.503 -0.201 18935 9656 1 12 . 1 1 164 164 GLY H H 164 7.625 7.625 7.947 -0.322 18935 9657 1 12 . 1 1 165 165 PHE N N 165 117.952 117.952 119.415 -1.463 18935 9658 1 12 . 1 1 165 165 PHE C C 165 174.556 174.556 174.905 -0.349 18935 9659 1 12 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.639 -0.174 18935 9660 1 12 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.509 -0.747 18935 9661 1 12 . 1 1 165 165 PHE H H 165 7.283 7.283 7.895 -0.612 18935 9662 1 12 . 1 1 166 166 THR N N 166 118.178 118.178 112.632 5.546 18935 9663 1 12 . 1 1 166 166 THR C C 166 175.306 175.306 174.075 1.231 18935 9664 1 12 . 1 1 166 166 THR CA C 166 63.466 63.466 61.041 2.425 18935 9665 1 12 . 1 1 166 166 THR CB C 166 68.721 68.721 70.412 -1.691 18935 9666 1 12 . 1 1 166 166 THR H H 166 9.678 9.678 8.531 1.147 18935 9667 1 12 . 1 1 167 167 TYR N N 167 128.239 128.239 122.282 5.957 18935 9668 1 12 . 1 1 167 167 TYR C C 167 173.297 173.297 175.440 -2.143 18935 9669 1 12 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.013 1.399 18935 9670 1 12 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.178 -2.455 18935 9671 1 12 . 1 1 167 167 TYR H H 167 9.264 9.264 8.580 0.684 18935 9672 1 12 . 1 1 168 168 ARG N N 168 126.789 126.789 126.728 0.061 18935 9673 1 12 . 1 1 168 168 ARG C C 168 175.297 175.297 174.390 0.907 18935 9674 1 12 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.023 -1.258 18935 9675 1 12 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.752 -1.426 18935 9676 1 12 . 1 1 168 168 ARG H H 168 7.030 7.030 8.497 -1.467 18935 9677 1 12 . 1 1 169 169 ILE N N 169 119.221 119.221 115.390 3.831 18935 9678 1 12 . 1 1 169 169 ILE C C 169 174.522 174.522 175.103 -0.581 18935 9679 1 12 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.149 3.130 18935 9680 1 12 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.762 -5.115 18935 9681 1 12 . 1 1 169 169 ILE H H 169 8.349 8.349 8.195 0.154 18935 9682 1 12 . 1 1 171 171 LYS N N 171 111.335 111.335 116.631 -5.296 18935 9683 1 12 . 1 1 171 171 LYS C C 171 176.638 176.638 177.593 -0.955 18935 9684 1 12 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.922 -1.384 18935 9685 1 12 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.598 0.369 18935 9686 1 12 . 1 1 171 171 LYS H H 171 8.198 8.198 8.614 -0.416 18935 9687 1 12 . 1 1 172 172 LYS N N 172 116.411 116.411 117.320 -0.909 18935 9688 1 12 . 1 1 172 172 LYS C C 172 175.331 175.331 176.498 -1.167 18935 9689 1 12 . 1 1 172 172 LYS CA C 172 54.001 54.001 54.691 -0.690 18935 9690 1 12 . 1 1 172 172 LYS CB C 172 31.818 31.818 32.316 -0.499 18935 9691 1 12 . 1 1 172 172 LYS H H 172 7.843 7.843 7.387 0.456 18935 9692 1 12 . 1 1 173 173 ARG N N 173 120.490 120.490 119.302 1.188 18935 9693 1 12 . 1 1 173 173 ARG C C 173 172.830 172.830 176.010 -3.180 18935 9694 1 12 . 1 1 173 173 ARG CA C 173 57.175 57.175 55.825 1.350 18935 9695 1 12 . 1 1 173 173 ARG CB C 173 28.829 28.829 29.593 -0.763 18935 9696 1 12 . 1 1 173 173 ARG H H 173 6.917 6.917 7.660 -0.743 18935 9697 1 13 . 1 1 2 2 LEU N N 2 119.937 119.937 118.148 1.789 18935 9698 1 13 . 1 1 2 2 LEU C C 2 175.307 175.307 175.591 -0.284 18935 9699 1 13 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.921 0.371 18935 9700 1 13 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.882 -2.197 18935 9701 1 13 . 1 1 2 2 LEU H H 2 9.251 9.251 8.629 0.622 18935 9702 1 13 . 1 1 3 3 THR N N 3 111.335 111.335 111.418 -0.083 18935 9703 1 13 . 1 1 3 3 THR C C 3 175.854 175.854 175.600 0.254 18935 9704 1 13 . 1 1 3 3 THR CA C 3 60.540 60.540 60.485 0.055 18935 9705 1 13 . 1 1 3 3 THR CB C 3 70.782 70.782 70.474 0.308 18935 9706 1 13 . 1 1 3 3 THR H H 3 8.677 8.677 8.032 0.645 18935 9707 1 13 . 1 1 4 4 LEU N N 4 120.988 120.988 122.646 -1.658 18935 9708 1 13 . 1 1 4 4 LEU C C 4 178.391 178.391 178.306 0.085 18935 9709 1 13 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.991 0.073 18935 9710 1 13 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.109 -2.848 18935 9711 1 13 . 1 1 4 4 LEU H H 4 7.746 7.746 7.922 -0.176 18935 9712 1 13 . 1 1 5 5 ILE N N 5 114.236 114.236 114.222 0.014 18935 9713 1 13 . 1 1 5 5 ILE C C 5 178.339 178.339 177.887 0.452 18935 9714 1 13 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.448 -0.866 18935 9715 1 13 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.062 -0.263 18935 9716 1 13 . 1 1 5 5 ILE H H 5 7.821 7.821 7.934 -0.113 18935 9717 1 13 . 1 1 6 6 GLN N N 6 120.399 120.399 120.544 -0.145 18935 9718 1 13 . 1 1 6 6 GLN C C 6 178.783 178.783 178.625 0.158 18935 9719 1 13 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.184 -0.964 18935 9720 1 13 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.095 0.020 18935 9721 1 13 . 1 1 6 6 GLN H H 6 7.810 7.810 7.934 -0.124 18935 9722 1 13 . 1 1 7 7 GLY N N 7 106.277 106.277 105.782 0.495 18935 9723 1 13 . 1 1 7 7 GLY C C 7 174.554 174.554 175.916 -1.362 18935 9724 1 13 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.152 -0.218 18935 9725 1 13 . 1 1 7 7 GLY H H 7 8.733 8.733 8.108 0.625 18935 9726 1 13 . 1 1 8 8 LYS N N 8 119.991 119.991 120.810 -0.819 18935 9727 1 13 . 1 1 8 8 LYS C C 8 179.433 179.433 178.026 1.407 18935 9728 1 13 . 1 1 8 8 LYS CA C 8 59.892 59.892 57.904 1.988 18935 9729 1 13 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.211 -0.879 18935 9730 1 13 . 1 1 8 8 LYS H H 8 8.688 8.688 7.135 1.553 18935 9731 1 13 . 1 1 9 9 LYS N N 9 119.175 119.175 120.939 -1.764 18935 9732 1 13 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.916 -0.534 18935 9733 1 13 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.517 -1.082 18935 9734 1 13 . 1 1 9 9 LYS H H 9 8.015 8.015 7.818 0.197 18935 9735 1 13 . 1 1 10 10 ILE N N 10 120.308 120.308 116.321 3.987 18935 9736 1 13 . 1 1 10 10 ILE C C 10 177.766 177.766 177.449 0.317 18935 9737 1 13 . 1 1 10 10 ILE CA C 10 64.676 64.676 65.034 -0.358 18935 9738 1 13 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.510 -1.197 18935 9739 1 13 . 1 1 10 10 ILE H H 10 7.967 7.967 8.385 -0.418 18935 9740 1 13 . 1 1 11 11 VAL N N 11 119.130 119.130 119.890 -0.760 18935 9741 1 13 . 1 1 11 11 VAL C C 11 176.606 176.606 178.247 -1.641 18935 9742 1 13 . 1 1 11 11 VAL CA C 11 67.640 67.640 65.938 1.702 18935 9743 1 13 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.515 -0.306 18935 9744 1 13 . 1 1 11 11 VAL H H 11 8.128 8.128 7.689 0.439 18935 9745 1 13 . 1 1 12 12 ASN N N 12 115.822 115.822 117.471 -1.649 18935 9746 1 13 . 1 1 12 12 ASN C C 12 177.375 177.375 177.287 0.088 18935 9747 1 13 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.291 -0.321 18935 9748 1 13 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.765 -1.202 18935 9749 1 13 . 1 1 12 12 ASN H H 12 8.203 8.203 7.715 0.488 18935 9750 1 13 . 1 1 13 13 HIS N N 13 117.659 117.659 116.919 0.740 18935 9751 1 13 . 1 1 13 13 HIS C C 13 177.287 177.287 176.562 0.725 18935 9752 1 13 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.479 1.208 18935 9753 1 13 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.014 0.007 18935 9754 1 13 . 1 1 13 13 HIS H H 13 7.861 7.861 7.950 -0.089 18935 9755 1 13 . 1 1 14 14 LEU N N 14 115.595 115.595 120.542 -4.947 18935 9756 1 13 . 1 1 14 14 LEU C C 14 179.092 179.092 177.808 1.284 18935 9757 1 13 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.581 0.060 18935 9758 1 13 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.359 -1.339 18935 9759 1 13 . 1 1 14 14 LEU H H 14 8.376 8.376 8.310 0.066 18935 9760 1 13 . 1 1 15 15 ARG N N 15 115.006 115.006 117.898 -2.892 18935 9761 1 13 . 1 1 15 15 ARG C C 15 176.265 176.265 178.316 -2.051 18935 9762 1 13 . 1 1 15 15 ARG CA C 15 59.884 59.884 56.912 2.972 18935 9763 1 13 . 1 1 15 15 ARG CB C 15 29.072 29.072 30.077 -1.005 18935 9764 1 13 . 1 1 15 15 ARG H H 15 8.074 8.074 8.005 0.069 18935 9765 1 13 . 1 1 16 16 SER N N 16 107.778 107.778 113.962 -6.184 18935 9766 1 13 . 1 1 16 16 SER C C 16 176.009 176.009 175.532 0.477 18935 9767 1 13 . 1 1 16 16 SER CA C 16 57.244 57.244 60.465 -3.221 18935 9768 1 13 . 1 1 16 16 SER CB C 16 63.525 63.525 63.837 -0.312 18935 9769 1 13 . 1 1 16 16 SER H H 16 7.136 7.136 8.243 -1.107 18935 9770 1 13 . 1 1 17 17 ARG N N 17 121.532 121.532 121.104 0.428 18935 9771 1 13 . 1 1 17 17 ARG C C 17 174.482 174.482 175.215 -0.733 18935 9772 1 13 . 1 1 17 17 ARG CA C 17 56.322 56.322 56.077 0.245 18935 9773 1 13 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.413 1.417 18935 9774 1 13 . 1 1 17 17 ARG H H 17 7.913 7.913 8.077 -0.164 18935 9775 1 13 . 1 1 18 18 LEU N N 18 121.305 121.305 119.620 1.685 18935 9776 1 13 . 1 1 18 18 LEU C C 18 176.283 176.283 175.350 0.933 18935 9777 1 13 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.661 -0.963 18935 9778 1 13 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.172 -0.117 18935 9779 1 13 . 1 1 18 18 LEU H H 18 8.812 8.812 7.542 1.270 18935 9780 1 13 . 1 1 19 19 ALA N N 19 125.293 125.293 124.291 1.002 18935 9781 1 13 . 1 1 19 19 ALA C C 19 173.780 173.780 175.028 -1.248 18935 9782 1 13 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.553 -0.751 18935 9783 1 13 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.138 0.715 18935 9784 1 13 . 1 1 19 19 ALA H H 19 8.790 8.790 8.047 0.743 18935 9785 1 13 . 1 1 20 20 PHE N N 20 113.117 113.117 115.570 -2.453 18935 9786 1 13 . 1 1 20 20 PHE C C 20 172.708 172.708 173.274 -0.566 18935 9787 1 13 . 1 1 20 20 PHE CA C 20 55.598 55.598 55.888 -0.290 18935 9788 1 13 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.738 -0.013 18935 9789 1 13 . 1 1 20 20 PHE H H 20 8.925 8.925 8.871 0.054 18935 9790 1 13 . 1 1 21 21 GLU N N 21 121.532 121.532 119.737 1.795 18935 9791 1 13 . 1 1 21 21 GLU C C 21 174.830 174.830 175.192 -0.362 18935 9792 1 13 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.727 -0.764 18935 9793 1 13 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.772 -2.429 18935 9794 1 13 . 1 1 21 21 GLU H H 21 7.972 7.972 9.061 -1.089 18935 9795 1 13 . 1 1 22 22 TYR N N 22 125.339 125.339 120.281 5.058 18935 9796 1 13 . 1 1 22 22 TYR C C 22 174.864 174.864 174.448 0.416 18935 9797 1 13 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.189 -2.901 18935 9798 1 13 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.208 -0.349 18935 9799 1 13 . 1 1 22 22 TYR H H 22 9.016 9.016 8.412 0.604 18935 9800 1 13 . 1 1 23 23 ASN N N 23 127.024 127.024 125.863 1.161 18935 9801 1 13 . 1 1 23 23 ASN C C 23 175.410 175.410 175.212 0.198 18935 9802 1 13 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.904 -0.850 18935 9803 1 13 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.769 -1.508 18935 9804 1 13 . 1 1 23 23 ASN H H 23 9.181 9.181 9.182 -0.001 18935 9805 1 13 . 1 1 24 24 GLY N N 24 102.755 102.755 103.100 -0.345 18935 9806 1 13 . 1 1 24 24 GLY C C 24 173.626 173.626 174.191 -0.565 18935 9807 1 13 . 1 1 24 24 GLY CA C 24 44.935 44.935 44.964 -0.029 18935 9808 1 13 . 1 1 24 24 GLY H H 24 8.666 8.666 8.241 0.425 18935 9809 1 13 . 1 1 25 25 GLN N N 25 118.722 118.722 120.755 -2.033 18935 9810 1 13 . 1 1 25 25 GLN C C 25 173.657 173.657 174.960 -1.303 18935 9811 1 13 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.601 -1.368 18935 9812 1 13 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.602 0.203 18935 9813 1 13 . 1 1 25 25 GLN H H 25 7.708 7.708 8.031 -0.323 18935 9814 1 13 . 1 1 26 26 LEU N N 26 123.526 123.526 120.806 2.720 18935 9815 1 13 . 1 1 26 26 LEU C C 26 175.842 175.842 176.204 -0.362 18935 9816 1 13 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.800 0.186 18935 9817 1 13 . 1 1 26 26 LEU CB C 26 40.807 40.807 44.041 -3.234 18935 9818 1 13 . 1 1 26 26 LEU H H 26 8.543 8.543 8.335 0.208 18935 9819 1 13 . 1 1 27 27 ILE N N 27 129.462 129.462 124.132 5.330 18935 9820 1 13 . 1 1 27 27 ILE C C 27 175.085 175.085 174.050 1.035 18935 9821 1 13 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.330 0.643 18935 9822 1 13 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.590 -3.038 18935 9823 1 13 . 1 1 27 27 ILE H H 27 8.989 8.989 9.114 -0.125 18935 9824 1 13 . 1 1 28 28 LYS N N 28 125.157 125.157 126.784 -1.627 18935 9825 1 13 . 1 1 28 28 LYS C C 28 176.725 176.725 175.551 1.174 18935 9826 1 13 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.416 1.394 18935 9827 1 13 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.416 -1.599 18935 9828 1 13 . 1 1 28 28 LYS H H 28 8.311 8.311 8.237 0.074 18935 9829 1 13 . 1 1 29 29 ILE N N 29 125.565 125.565 117.064 8.501 18935 9830 1 13 . 1 1 29 29 ILE C C 29 175.685 175.685 174.568 1.117 18935 9831 1 13 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.761 0.644 18935 9832 1 13 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.327 -3.296 18935 9833 1 13 . 1 1 29 29 ILE H H 29 8.209 8.209 7.946 0.263 18935 9834 1 13 . 1 1 30 30 LEU N N 30 127.831 127.831 122.666 5.165 18935 9835 1 13 . 1 1 30 30 LEU C C 30 178.794 178.794 178.060 0.734 18935 9836 1 13 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.400 1.043 18935 9837 1 13 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.020 -4.184 18935 9838 1 13 . 1 1 30 30 LEU H H 30 9.027 9.027 8.246 0.781 18935 9839 1 13 . 1 1 31 31 SER N N 31 116.864 116.864 120.333 -3.469 18935 9840 1 13 . 1 1 31 31 SER C C 31 177.464 177.464 176.393 1.071 18935 9841 1 13 . 1 1 31 31 SER CA C 31 61.180 61.180 61.758 -0.578 18935 9842 1 13 . 1 1 31 31 SER CB C 31 62.105 62.105 62.691 -0.586 18935 9843 1 13 . 1 1 31 31 SER H H 31 8.887 8.887 8.718 0.169 18935 9844 1 13 . 1 1 32 32 LYS N N 32 114.825 114.825 119.989 -5.164 18935 9845 1 13 . 1 1 32 32 LYS C C 32 176.243 176.243 177.001 -0.758 18935 9846 1 13 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.462 -1.170 18935 9847 1 13 . 1 1 32 32 LYS CB C 32 30.266 30.266 31.954 -1.688 18935 9848 1 13 . 1 1 32 32 LYS H H 32 8.290 8.290 8.206 0.084 18935 9849 1 13 . 1 1 33 33 ASN N N 33 117.564 117.564 117.623 -0.059 18935 9850 1 13 . 1 1 33 33 ASN C C 33 172.253 172.253 174.003 -1.750 18935 9851 1 13 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.797 -1.706 18935 9852 1 13 . 1 1 33 33 ASN CB C 33 38.339 38.339 38.975 -0.636 18935 9853 1 13 . 1 1 33 33 ASN H H 33 8.051 8.051 7.874 0.177 18935 9854 1 13 . 1 1 34 34 ILE N N 34 118.949 118.949 119.540 -0.591 18935 9855 1 13 . 1 1 34 34 ILE C C 34 175.343 175.343 174.789 0.554 18935 9856 1 13 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.382 0.172 18935 9857 1 13 . 1 1 34 34 ILE CB C 34 38.867 38.867 42.334 -3.467 18935 9858 1 13 . 1 1 34 34 ILE H H 34 7.670 7.670 7.506 0.164 18935 9859 1 13 . 1 1 35 35 VAL N N 35 128.355 128.355 125.582 2.773 18935 9860 1 13 . 1 1 35 35 VAL C C 35 175.543 175.543 174.660 0.883 18935 9861 1 13 . 1 1 35 35 VAL CA C 35 60.014 60.014 59.728 0.285 18935 9862 1 13 . 1 1 35 35 VAL CB C 35 34.231 34.231 34.970 -0.739 18935 9863 1 13 . 1 1 35 35 VAL H H 35 9.698 9.698 9.297 0.401 18935 9864 1 13 . 1 1 36 36 ALA N N 36 129.553 129.553 131.681 -2.128 18935 9865 1 13 . 1 1 36 36 ALA C C 36 177.015 177.015 176.768 0.247 18935 9866 1 13 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.473 0.923 18935 9867 1 13 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.050 -0.428 18935 9868 1 13 . 1 1 36 36 ALA H H 36 8.917 8.917 8.575 0.342 18935 9869 1 13 . 1 1 37 37 VAL N N 37 115.006 115.006 117.548 -2.542 18935 9870 1 13 . 1 1 37 37 VAL C C 37 174.649 174.649 176.220 -1.571 18935 9871 1 13 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.697 -0.376 18935 9872 1 13 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.358 -0.973 18935 9873 1 13 . 1 1 37 37 VAL H H 37 8.214 8.214 7.802 0.412 18935 9874 1 13 . 1 1 38 38 GLY N N 38 109.387 109.387 107.687 1.700 18935 9875 1 13 . 1 1 38 38 GLY C C 38 174.152 174.152 175.607 -1.455 18935 9876 1 13 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.852 -0.355 18935 9877 1 13 . 1 1 38 38 GLY H H 38 8.677 8.677 7.940 0.737 18935 9878 1 13 . 1 1 39 39 SER N N 39 116.776 116.776 119.298 -2.522 18935 9879 1 13 . 1 1 39 39 SER C C 39 175.129 175.129 176.747 -1.618 18935 9880 1 13 . 1 1 39 39 SER CA C 39 60.036 60.036 61.825 -1.789 18935 9881 1 13 . 1 1 39 39 SER CB C 39 61.522 61.522 62.832 -1.310 18935 9882 1 13 . 1 1 39 39 SER H H 39 9.705 9.705 8.465 1.240 18935 9883 1 13 . 1 1 40 40 LEU N N 40 113.696 113.696 119.479 -5.783 18935 9884 1 13 . 1 1 40 40 LEU C C 40 180.558 180.558 178.290 2.268 18935 9885 1 13 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.067 1.306 18935 9886 1 13 . 1 1 40 40 LEU CB C 40 41.877 41.877 40.937 0.940 18935 9887 1 13 . 1 1 40 40 LEU H H 40 7.311 7.311 7.785 -0.474 18935 9888 1 13 . 1 1 41 41 ARG N N 41 121.162 121.162 116.651 4.511 18935 9889 1 13 . 1 1 41 41 ARG C C 41 176.964 176.964 177.326 -0.362 18935 9890 1 13 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.339 2.112 18935 9891 1 13 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.743 -2.538 18935 9892 1 13 . 1 1 41 41 ARG H H 41 6.999 6.999 7.805 -0.806 18935 9893 1 13 . 1 1 42 42 ARG N N 42 111.109 111.109 118.473 -7.364 18935 9894 1 13 . 1 1 42 42 ARG C C 42 172.564 172.564 175.927 -3.363 18935 9895 1 13 . 1 1 42 42 ARG CA C 42 56.380 56.380 56.721 -0.341 18935 9896 1 13 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.557 -2.208 18935 9897 1 13 . 1 1 42 42 ARG H H 42 7.041 7.041 7.766 -0.725 18935 9898 1 13 . 1 1 43 43 GLU N N 43 111.924 111.924 115.762 -3.838 18935 9899 1 13 . 1 1 43 43 GLU C C 43 176.202 176.202 175.290 0.912 18935 9900 1 13 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.529 -1.075 18935 9901 1 13 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.566 -2.264 18935 9902 1 13 . 1 1 43 43 GLU H H 43 7.757 7.757 7.988 -0.231 18935 9903 1 13 . 1 1 44 44 GLU N N 44 117.861 117.861 118.132 -0.271 18935 9904 1 13 . 1 1 44 44 GLU C C 44 175.197 175.197 176.553 -1.356 18935 9905 1 13 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.323 -0.195 18935 9906 1 13 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.438 -1.879 18935 9907 1 13 . 1 1 44 44 GLU H H 44 7.461 7.461 7.732 -0.271 18935 9908 1 13 . 1 1 45 45 LYS N N 45 115.051 115.051 118.948 -3.897 18935 9909 1 13 . 1 1 45 45 LYS C C 45 177.733 177.733 176.536 1.197 18935 9910 1 13 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.143 1.912 18935 9911 1 13 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.612 -1.585 18935 9912 1 13 . 1 1 45 45 LYS H H 45 8.123 8.123 8.542 -0.419 18935 9913 1 13 . 1 1 46 46 MET N N 46 114.009 114.009 118.676 -4.667 18935 9914 1 13 . 1 1 46 46 MET C C 46 174.067 174.067 174.516 -0.449 18935 9915 1 13 . 1 1 46 46 MET CA C 46 52.477 52.477 54.764 -2.287 18935 9916 1 13 . 1 1 46 46 MET CB C 46 33.974 33.974 34.622 -0.648 18935 9917 1 13 . 1 1 46 46 MET H H 46 7.767 7.767 7.564 0.203 18935 9918 1 13 . 1 1 47 47 LEU N N 47 120.263 120.263 123.140 -2.877 18935 9919 1 13 . 1 1 47 47 LEU C C 47 177.669 177.669 175.482 2.187 18935 9920 1 13 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.013 -0.812 18935 9921 1 13 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.401 -0.493 18935 9922 1 13 . 1 1 47 47 LEU H H 47 9.481 9.481 8.330 1.151 18935 9923 1 13 . 1 1 48 48 ASN N N 48 118.632 118.632 118.033 0.599 18935 9924 1 13 . 1 1 48 48 ASN C C 48 174.715 174.715 174.204 0.511 18935 9925 1 13 . 1 1 48 48 ASN CA C 48 55.501 55.501 54.278 1.223 18935 9926 1 13 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.313 -1.485 18935 9927 1 13 . 1 1 48 48 ASN H H 48 9.388 9.388 9.021 0.367 18935 9928 1 13 . 1 1 49 49 ASP N N 49 115.867 115.867 117.058 -1.191 18935 9929 1 13 . 1 1 49 49 ASP C C 49 174.111 174.111 174.497 -0.386 18935 9930 1 13 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.538 -1.337 18935 9931 1 13 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.887 -3.810 18935 9932 1 13 . 1 1 49 49 ASP H H 49 7.670 7.670 7.858 -0.188 18935 9933 1 13 . 1 1 50 50 VAL N N 50 119.185 119.185 119.155 0.030 18935 9934 1 13 . 1 1 50 50 VAL C C 50 172.333 172.333 174.508 -2.175 18935 9935 1 13 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.859 0.056 18935 9936 1 13 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.369 -1.404 18935 9937 1 13 . 1 1 50 50 VAL H H 50 8.339 8.339 7.945 0.394 18935 9938 1 13 . 1 1 51 51 ASP N N 51 124.704 124.704 127.085 -2.381 18935 9939 1 13 . 1 1 51 51 ASP C C 51 173.725 173.725 175.223 -1.498 18935 9940 1 13 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.610 -0.582 18935 9941 1 13 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.342 0.487 18935 9942 1 13 . 1 1 51 51 ASP H H 51 8.984 8.984 8.544 0.440 18935 9943 1 13 . 1 1 52 52 LEU N N 52 120.943 120.943 122.679 -1.736 18935 9944 1 13 . 1 1 52 52 LEU C C 52 173.045 173.045 174.447 -1.402 18935 9945 1 13 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.838 -0.967 18935 9946 1 13 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.114 -1.861 18935 9947 1 13 . 1 1 52 52 LEU H H 52 9.081 9.081 8.464 0.617 18935 9948 1 13 . 1 1 53 53 LEU N N 53 123.027 123.027 124.529 -1.502 18935 9949 1 13 . 1 1 53 53 LEU C C 53 173.750 173.750 175.215 -1.465 18935 9950 1 13 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.595 -1.262 18935 9951 1 13 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.108 -0.100 18935 9952 1 13 . 1 1 53 53 LEU H H 53 9.146 9.146 9.066 0.080 18935 9953 1 13 . 1 1 54 54 ILE N N 54 126.562 126.562 126.172 0.390 18935 9954 1 13 . 1 1 54 54 ILE C C 54 175.132 175.132 175.232 -0.100 18935 9955 1 13 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.971 -1.373 18935 9956 1 13 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.814 -1.253 18935 9957 1 13 . 1 1 54 54 ILE H H 54 9.440 9.440 9.173 0.267 18935 9958 1 13 . 1 1 55 55 ILE N N 55 126.879 126.879 128.699 -1.820 18935 9959 1 13 . 1 1 55 55 ILE C C 55 175.655 175.655 175.810 -0.155 18935 9960 1 13 . 1 1 55 55 ILE CA C 55 57.561 57.561 59.401 -1.840 18935 9961 1 13 . 1 1 55 55 ILE CB C 55 34.306 34.306 40.303 -5.997 18935 9962 1 13 . 1 1 55 55 ILE H H 55 9.381 9.381 7.948 1.433 18935 9963 1 13 . 1 1 56 56 VAL N N 56 128.936 128.936 125.660 3.276 18935 9964 1 13 . 1 1 56 56 VAL C C 56 176.389 176.389 174.593 1.796 18935 9965 1 13 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.998 -0.368 18935 9966 1 13 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.785 -1.000 18935 9967 1 13 . 1 1 56 56 VAL H H 56 9.227 9.227 8.761 0.466 18935 9968 1 13 . 1 1 58 58 GLU N N 58 112.423 112.423 117.649 -5.226 18935 9969 1 13 . 1 1 58 58 GLU C C 58 175.946 175.946 175.900 0.046 18935 9970 1 13 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.102 -0.802 18935 9971 1 13 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.884 0.213 18935 9972 1 13 . 1 1 58 58 GLU H H 58 6.685 6.685 7.863 -1.178 18935 9973 1 13 . 1 1 59 59 LYS N N 59 125.293 125.293 120.182 5.111 18935 9974 1 13 . 1 1 59 59 LYS C C 59 179.248 179.248 175.786 3.462 18935 9975 1 13 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.224 2.550 18935 9976 1 13 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.662 -1.585 18935 9977 1 13 . 1 1 59 59 LYS H H 59 9.108 9.108 8.625 0.483 18935 9978 1 13 . 1 1 60 60 LYS N N 60 117.408 117.408 118.361 -0.953 18935 9979 1 13 . 1 1 60 60 LYS C C 60 177.198 177.198 177.294 -0.096 18935 9980 1 13 . 1 1 60 60 LYS CA C 60 58.213 58.213 57.374 0.839 18935 9981 1 13 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.729 -2.146 18935 9982 1 13 . 1 1 60 60 LYS H H 60 9.102 9.102 7.486 1.616 18935 9983 1 13 . 1 1 61 61 LEU N N 61 114.779 114.779 121.426 -6.647 18935 9984 1 13 . 1 1 61 61 LEU C C 61 178.790 178.790 178.822 -0.032 18935 9985 1 13 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.246 -2.222 18935 9986 1 13 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.320 -0.456 18935 9987 1 13 . 1 1 61 61 LEU H H 61 7.455 7.455 8.091 -0.636 18935 9988 1 13 . 1 1 62 62 LEU N N 62 119.629 119.629 118.086 1.543 18935 9989 1 13 . 1 1 62 62 LEU C C 62 177.762 177.762 177.219 0.543 18935 9990 1 13 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.646 0.552 18935 9991 1 13 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.978 -1.248 18935 9992 1 13 . 1 1 62 62 LEU H H 62 7.714 7.714 7.488 0.226 18935 9993 1 13 . 1 1 63 63 LYS N N 63 112.921 112.921 115.145 -2.224 18935 9994 1 13 . 1 1 63 63 LYS C C 63 175.386 175.386 178.050 -2.664 18935 9995 1 13 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.121 0.235 18935 9996 1 13 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.618 -1.655 18935 9997 1 13 . 1 1 63 63 LYS H H 63 7.751 7.751 8.198 -0.447 18935 9998 1 13 . 1 1 64 64 HIS N N 64 112.468 112.468 117.506 -5.038 18935 9999 1 13 . 1 1 64 64 HIS C C 64 176.081 176.081 175.991 0.090 18935 10000 1 13 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.594 -1.825 18935 10001 1 13 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.187 1.183 18935 10002 1 13 . 1 1 64 64 HIS H H 64 7.697 7.697 7.709 -0.012 18935 10003 1 13 . 1 1 65 65 VAL N N 65 117.499 117.499 118.137 -0.638 18935 10004 1 13 . 1 1 65 65 VAL C C 65 174.301 174.301 176.608 -2.307 18935 10005 1 13 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.204 3.126 18935 10006 1 13 . 1 1 65 65 VAL CB C 65 29.360 29.360 30.966 -1.606 18935 10007 1 13 . 1 1 65 65 VAL H H 65 6.917 6.917 7.216 -0.299 18935 10008 1 13 . 1 1 66 66 LEU N N 66 113.873 113.873 118.689 -4.816 18935 10009 1 13 . 1 1 66 66 LEU CA C 66 57.850 57.850 58.034 -0.184 18935 10010 1 13 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.954 -3.896 18935 10011 1 13 . 1 1 66 66 LEU H H 66 9.102 9.102 7.892 1.210 18935 10012 1 13 . 1 1 68 68 ASN N N 68 110.792 110.792 115.559 -4.767 18935 10013 1 13 . 1 1 68 68 ASN C C 68 174.877 174.877 173.315 1.562 18935 10014 1 13 . 1 1 68 68 ASN CA C 68 50.815 50.815 53.116 -2.301 18935 10015 1 13 . 1 1 68 68 ASN CB C 68 40.311 40.311 42.048 -1.737 18935 10016 1 13 . 1 1 68 68 ASN H H 68 7.234 7.234 8.339 -1.105 18935 10017 1 13 . 1 1 69 69 ILE N N 69 122.348 122.348 124.226 -1.878 18935 10018 1 13 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.080 -0.168 18935 10019 1 13 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.456 -2.418 18935 10020 1 13 . 1 1 69 69 ILE H H 69 7.428 7.428 8.577 -1.149 18935 10021 1 13 . 1 1 70 70 ARG N N 70 125.701 125.701 125.836 -0.135 18935 10022 1 13 . 1 1 70 70 ARG C C 70 174.596 174.596 173.466 1.130 18935 10023 1 13 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.636 -1.475 18935 10024 1 13 . 1 1 70 70 ARG CB C 70 32.453 32.453 32.279 0.174 18935 10025 1 13 . 1 1 70 70 ARG H H 70 9.083 9.083 8.967 0.116 18935 10026 1 13 . 1 1 71 71 ILE N N 71 118.496 118.496 119.034 -0.538 18935 10027 1 13 . 1 1 71 71 ILE C C 71 175.625 175.625 175.979 -0.354 18935 10028 1 13 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.761 0.015 18935 10029 1 13 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.928 -2.961 18935 10030 1 13 . 1 1 71 71 ILE H H 71 7.864 7.864 8.180 -0.316 18935 10031 1 13 . 1 1 72 72 LYS N N 72 127.423 127.423 126.857 0.566 18935 10032 1 13 . 1 1 72 72 LYS C C 72 177.659 177.659 177.238 0.421 18935 10033 1 13 . 1 1 72 72 LYS CA C 72 57.428 57.428 57.143 0.285 18935 10034 1 13 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.144 -0.770 18935 10035 1 13 . 1 1 72 72 LYS H H 72 8.720 8.720 8.905 -0.185 18935 10036 1 13 . 1 1 73 73 GLY N N 73 112.604 112.604 112.883 -0.279 18935 10037 1 13 . 1 1 73 73 GLY C C 73 173.729 173.729 173.624 0.105 18935 10038 1 13 . 1 1 73 73 GLY CA C 73 45.831 45.831 44.967 0.864 18935 10039 1 13 . 1 1 73 73 GLY H H 73 8.930 8.930 8.927 0.003 18935 10040 1 13 . 1 1 74 74 LEU N N 74 119.538 119.538 120.039 -0.501 18935 10041 1 13 . 1 1 74 74 LEU C C 74 175.802 175.802 174.880 0.922 18935 10042 1 13 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.457 0.204 18935 10043 1 13 . 1 1 74 74 LEU CB C 74 44.053 44.053 45.308 -1.255 18935 10044 1 13 . 1 1 74 74 LEU H H 74 7.547 7.547 7.565 -0.018 18935 10045 1 13 . 1 1 75 75 SER N N 75 118.994 118.994 117.219 1.775 18935 10046 1 13 . 1 1 75 75 SER C C 75 173.111 173.111 173.118 -0.007 18935 10047 1 13 . 1 1 75 75 SER CA C 75 57.696 57.696 57.710 -0.014 18935 10048 1 13 . 1 1 75 75 SER CB C 75 63.073 63.073 63.286 -0.213 18935 10049 1 13 . 1 1 75 75 SER H H 75 9.076 9.076 8.534 0.542 18935 10050 1 13 . 1 1 76 76 PHE N N 76 117.802 117.802 120.399 -2.597 18935 10051 1 13 . 1 1 76 76 PHE C C 76 173.564 173.564 175.224 -1.660 18935 10052 1 13 . 1 1 76 76 PHE CA C 76 55.409 55.409 55.913 -0.503 18935 10053 1 13 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.172 -0.329 18935 10054 1 13 . 1 1 76 76 PHE H H 76 8.119 8.119 7.959 0.160 18935 10055 1 13 . 1 1 77 77 SER N N 77 113.918 113.918 118.412 -4.494 18935 10056 1 13 . 1 1 77 77 SER C C 77 173.194 173.194 174.469 -1.275 18935 10057 1 13 . 1 1 77 77 SER CA C 77 55.999 55.999 57.926 -1.927 18935 10058 1 13 . 1 1 77 77 SER CB C 77 65.218 65.218 64.189 1.030 18935 10059 1 13 . 1 1 77 77 SER H H 77 8.989 8.989 8.692 0.297 18935 10060 1 13 . 1 1 78 78 VAL N N 78 123.662 123.662 125.211 -1.549 18935 10061 1 13 . 1 1 78 78 VAL C C 78 176.057 176.057 176.207 -0.150 18935 10062 1 13 . 1 1 78 78 VAL CA C 78 62.091 62.091 63.806 -1.715 18935 10063 1 13 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.597 0.697 18935 10064 1 13 . 1 1 78 78 VAL H H 78 8.995 8.995 8.418 0.577 18935 10065 1 13 . 1 1 79 79 LYS N N 79 129.417 129.417 129.584 -0.167 18935 10066 1 13 . 1 1 79 79 LYS C C 79 176.436 176.436 174.608 1.828 18935 10067 1 13 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.374 3.278 18935 10068 1 13 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.118 -3.645 18935 10069 1 13 . 1 1 79 79 LYS H H 79 9.425 9.425 9.017 0.408 18935 10070 1 13 . 1 1 80 80 VAL N N 80 108.616 108.616 124.723 -16.107 18935 10071 1 13 . 1 1 80 80 VAL CA C 80 59.097 59.097 62.630 -3.533 18935 10072 1 13 . 1 1 80 80 VAL CB C 80 34.082 34.082 32.639 1.443 18935 10073 1 13 . 1 1 80 80 VAL H H 80 7.380 7.380 8.545 -1.165 18935 10074 1 13 . 1 1 81 81 CYS N N 81 123.254 123.254 127.339 -4.085 18935 10075 1 13 . 1 1 81 81 CYS C C 81 172.053 172.053 173.785 -1.732 18935 10076 1 13 . 1 1 81 81 CYS CA C 81 59.739 59.739 58.399 1.340 18935 10077 1 13 . 1 1 81 81 CYS CB C 81 27.332 27.332 30.673 -3.341 18935 10078 1 13 . 1 1 81 81 CYS H H 81 9.759 9.759 8.460 1.299 18935 10079 1 13 . 1 1 82 82 GLY N N 82 118.450 118.450 114.450 4.000 18935 10080 1 13 . 1 1 82 82 GLY C C 82 171.814 171.814 174.788 -2.974 18935 10081 1 13 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.436 -2.083 18935 10082 1 13 . 1 1 82 82 GLY H H 82 8.537 8.537 8.552 -0.015 18935 10083 1 13 . 1 1 83 83 GLU N N 83 113.964 113.964 121.219 -7.255 18935 10084 1 13 . 1 1 83 83 GLU C C 83 179.320 179.320 177.256 2.064 18935 10085 1 13 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.679 -0.004 18935 10086 1 13 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.094 -0.187 18935 10087 1 13 . 1 1 83 83 GLU H H 83 8.473 8.473 8.715 -0.242 18935 10088 1 13 . 1 1 84 84 ARG N N 84 117.544 117.544 117.989 -0.445 18935 10089 1 13 . 1 1 84 84 ARG C C 84 177.252 177.252 175.608 1.644 18935 10090 1 13 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.437 -0.933 18935 10091 1 13 . 1 1 84 84 ARG CB C 84 31.546 31.546 30.602 0.944 18935 10092 1 13 . 1 1 84 84 ARG H H 84 9.760 9.760 8.296 1.464 18935 10093 1 13 . 1 1 85 85 LYS N N 85 124.160 124.160 119.790 4.370 18935 10094 1 13 . 1 1 85 85 LYS C C 85 173.379 173.379 175.777 -2.398 18935 10095 1 13 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.171 -0.939 18935 10096 1 13 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.587 -0.375 18935 10097 1 13 . 1 1 85 85 LYS H H 85 8.494 8.494 7.661 0.833 18935 10098 1 13 . 1 1 86 86 CYS N N 86 126.472 126.472 118.848 7.624 18935 10099 1 13 . 1 1 86 86 CYS C C 86 171.935 171.935 172.757 -0.822 18935 10100 1 13 . 1 1 86 86 CYS CA C 86 55.878 55.878 58.267 -2.389 18935 10101 1 13 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.675 -0.371 18935 10102 1 13 . 1 1 86 86 CYS H H 86 9.221 9.221 8.333 0.888 18935 10103 1 13 . 1 1 87 87 VAL N N 87 126.426 126.426 123.543 2.883 18935 10104 1 13 . 1 1 87 87 VAL C C 87 173.760 173.760 174.017 -0.257 18935 10105 1 13 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.168 0.165 18935 10106 1 13 . 1 1 87 87 VAL CB C 87 33.338 33.338 34.299 -0.961 18935 10107 1 13 . 1 1 87 87 VAL H H 87 8.623 8.623 9.189 -0.566 18935 10108 1 13 . 1 1 88 88 LEU N N 88 125.701 125.701 125.928 -0.227 18935 10109 1 13 . 1 1 88 88 LEU C C 88 175.424 175.424 175.113 0.311 18935 10110 1 13 . 1 1 88 88 LEU CA C 88 52.085 52.085 54.080 -1.995 18935 10111 1 13 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.459 -1.915 18935 10112 1 13 . 1 1 88 88 LEU H H 88 9.592 9.592 8.893 0.699 18935 10113 1 13 . 1 1 89 89 PHE N N 89 118.314 118.314 123.103 -4.789 18935 10114 1 13 . 1 1 89 89 PHE C C 89 177.068 177.068 176.180 0.888 18935 10115 1 13 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.785 -0.909 18935 10116 1 13 . 1 1 89 89 PHE CB C 89 38.837 38.837 38.594 0.243 18935 10117 1 13 . 1 1 89 89 PHE H H 89 8.979 8.979 8.969 0.010 18935 10118 1 13 . 1 1 90 90 ILE N N 90 119.039 119.039 118.918 0.121 18935 10119 1 13 . 1 1 90 90 ILE C C 90 173.692 173.692 174.801 -1.109 18935 10120 1 13 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.706 -1.034 18935 10121 1 13 . 1 1 90 90 ILE CB C 90 40.183 40.183 40.156 0.027 18935 10122 1 13 . 1 1 90 90 ILE H H 90 9.447 9.447 8.426 1.021 18935 10123 1 13 . 1 1 91 91 GLU N N 91 122.801 122.801 125.491 -2.690 18935 10124 1 13 . 1 1 91 91 GLU C C 91 175.565 175.565 174.699 0.866 18935 10125 1 13 . 1 1 91 91 GLU CA C 91 54.465 54.465 54.889 -0.424 18935 10126 1 13 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.350 -3.688 18935 10127 1 13 . 1 1 91 91 GLU H H 91 8.360 8.360 8.458 -0.098 18935 10128 1 13 . 1 1 92 92 TRP N N 92 126.018 126.018 124.083 1.935 18935 10129 1 13 . 1 1 92 92 TRP C C 92 175.070 175.070 175.276 -0.206 18935 10130 1 13 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.657 -0.467 18935 10131 1 13 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.940 -1.358 18935 10132 1 13 . 1 1 92 92 TRP H H 92 9.425 9.425 8.557 0.868 18935 10133 1 13 . 1 1 93 93 GLU N N 93 126.381 126.381 119.641 6.740 18935 10134 1 13 . 1 1 93 93 GLU C C 93 175.637 175.637 175.867 -0.230 18935 10135 1 13 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.686 -0.917 18935 10136 1 13 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.625 -2.681 18935 10137 1 13 . 1 1 93 93 GLU H H 93 8.914 8.914 9.043 -0.129 18935 10138 1 13 . 1 1 94 94 LYS N N 94 107.891 107.891 112.682 -4.791 18935 10139 1 13 . 1 1 94 94 LYS C C 94 175.359 175.359 175.314 0.045 18935 10140 1 13 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.057 0.372 18935 10141 1 13 . 1 1 94 94 LYS CB C 94 28.642 28.642 31.038 -2.396 18935 10142 1 13 . 1 1 94 94 LYS H H 94 8.634 8.634 8.431 0.203 18935 10143 1 13 . 1 1 95 95 LYS N N 95 120.490 120.490 118.599 1.891 18935 10144 1 13 . 1 1 95 95 LYS C C 95 174.369 174.369 174.209 0.160 18935 10145 1 13 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.676 -0.323 18935 10146 1 13 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.671 -1.208 18935 10147 1 13 . 1 1 95 95 LYS H H 95 7.924 7.924 7.639 0.285 18935 10148 1 13 . 1 1 96 96 THR N N 96 115.278 115.278 113.790 1.488 18935 10149 1 13 . 1 1 96 96 THR C C 96 174.317 174.317 173.308 1.009 18935 10150 1 13 . 1 1 96 96 THR CA C 96 61.203 61.203 60.569 0.634 18935 10151 1 13 . 1 1 96 96 THR CB C 96 69.348 69.348 69.677 -0.329 18935 10152 1 13 . 1 1 96 96 THR H H 96 7.967 7.967 7.786 0.181 18935 10153 1 13 . 1 1 97 97 TYR N N 97 123.254 123.254 125.080 -1.826 18935 10154 1 13 . 1 1 97 97 TYR C C 97 173.320 173.320 174.989 -1.669 18935 10155 1 13 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.288 -0.404 18935 10156 1 13 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.356 -0.220 18935 10157 1 13 . 1 1 97 97 TYR H H 97 9.232 9.232 8.883 0.349 18935 10158 1 13 . 1 1 98 98 GLN N N 98 122.574 122.574 118.590 3.984 18935 10159 1 13 . 1 1 98 98 GLN C C 98 172.781 172.781 174.477 -1.696 18935 10160 1 13 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.042 0.129 18935 10161 1 13 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.421 -3.022 18935 10162 1 13 . 1 1 98 98 GLN H H 98 9.000 9.000 8.898 0.102 18935 10163 1 13 . 1 1 99 99 LEU N N 99 130.218 130.218 124.618 5.600 18935 10164 1 13 . 1 1 99 99 LEU C C 99 172.806 172.806 174.354 -1.548 18935 10165 1 13 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.646 -1.596 18935 10166 1 13 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.488 -0.736 18935 10167 1 13 . 1 1 99 99 LEU H H 99 9.246 9.246 9.152 0.094 18935 10168 1 13 . 1 1 100 100 ASP N N 100 124.931 124.931 126.571 -1.640 18935 10169 1 13 . 1 1 100 100 ASP C C 100 172.626 172.626 174.445 -1.819 18935 10170 1 13 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.090 -2.660 18935 10171 1 13 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.008 -5.680 18935 10172 1 13 . 1 1 100 100 ASP H H 100 9.253 9.253 8.645 0.608 18935 10173 1 13 . 1 1 101 101 LEU N N 101 119.402 119.402 119.551 -0.149 18935 10174 1 13 . 1 1 101 101 LEU C C 101 173.869 173.869 174.458 -0.589 18935 10175 1 13 . 1 1 101 101 LEU CA C 101 51.655 51.655 51.955 -0.300 18935 10176 1 13 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.267 0.899 18935 10177 1 13 . 1 1 101 101 LEU H H 101 8.726 8.726 7.747 0.979 18935 10178 1 13 . 1 1 102 102 PHE N N 102 117.952 117.952 116.699 1.253 18935 10179 1 13 . 1 1 102 102 PHE C C 102 175.853 175.853 175.553 0.300 18935 10180 1 13 . 1 1 102 102 PHE CA C 102 53.282 53.282 56.353 -3.071 18935 10181 1 13 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.891 0.933 18935 10182 1 13 . 1 1 102 102 PHE H H 102 8.236 8.236 8.713 -0.477 18935 10183 1 13 . 1 1 103 103 THR N N 103 106.853 106.853 117.555 -10.702 18935 10184 1 13 . 1 1 103 103 THR C C 103 175.154 175.154 174.271 0.883 18935 10185 1 13 . 1 1 103 103 THR CA C 103 57.685 57.685 60.667 -2.982 18935 10186 1 13 . 1 1 103 103 THR CB C 103 71.037 71.037 69.621 1.416 18935 10187 1 13 . 1 1 103 103 THR H H 103 7.917 7.917 8.557 -0.640 18935 10188 1 13 . 1 1 104 104 ALA N N 104 122.348 122.348 129.093 -6.745 18935 10189 1 13 . 1 1 104 104 ALA C C 104 175.947 175.947 174.817 1.130 18935 10190 1 13 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.224 -0.417 18935 10191 1 13 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.500 -0.072 18935 10192 1 13 . 1 1 104 104 ALA H H 104 8.930 8.930 8.943 -0.013 18935 10193 1 13 . 1 1 105 105 LEU N N 105 119.855 119.855 119.764 0.091 18935 10194 1 13 . 1 1 105 105 LEU C C 105 179.628 179.628 178.796 0.832 18935 10195 1 13 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.358 -1.235 18935 10196 1 13 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.255 -1.921 18935 10197 1 13 . 1 1 105 105 LEU H H 105 8.316 8.316 9.007 -0.691 18935 10198 1 13 . 1 1 106 106 ALA N N 106 123.662 123.662 124.049 -0.387 18935 10199 1 13 . 1 1 106 106 ALA C C 106 181.056 181.056 177.827 3.229 18935 10200 1 13 . 1 1 106 106 ALA CA C 106 56.349 56.349 54.904 1.445 18935 10201 1 13 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.580 -1.265 18935 10202 1 13 . 1 1 106 106 ALA H H 106 8.306 8.306 8.246 0.060 18935 10203 1 13 . 1 1 107 107 GLU N N 107 114.825 114.825 114.439 0.386 18935 10204 1 13 . 1 1 107 107 GLU C C 107 177.854 177.854 176.815 1.039 18935 10205 1 13 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.797 0.589 18935 10206 1 13 . 1 1 107 107 GLU CB C 107 27.844 27.844 29.241 -1.397 18935 10207 1 13 . 1 1 107 107 GLU H H 107 9.754 9.754 8.608 1.146 18935 10208 1 13 . 1 1 108 108 GLU N N 108 115.097 115.097 117.597 -2.500 18935 10209 1 13 . 1 1 108 108 GLU C C 108 178.001 178.001 177.111 0.890 18935 10210 1 13 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.018 -1.092 18935 10211 1 13 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.347 0.654 18935 10212 1 13 . 1 1 108 108 GLU H H 108 7.859 7.859 7.706 0.153 18935 10213 1 13 . 1 1 109 109 LYS N N 109 118.360 118.360 121.849 -3.489 18935 10214 1 13 . 1 1 109 109 LYS C C 109 172.691 172.691 176.934 -4.243 18935 10215 1 13 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.059 0.843 18935 10216 1 13 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.288 0.253 18935 10217 1 13 . 1 1 109 109 LYS H H 109 7.660 7.660 7.436 0.224 18935 10218 1 13 . 1 1 111 111 TYR N N 111 114.054 114.054 118.347 -4.293 18935 10219 1 13 . 1 1 111 111 TYR C C 111 179.764 179.764 177.958 1.806 18935 10220 1 13 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.837 -1.839 18935 10221 1 13 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.358 -1.402 18935 10222 1 13 . 1 1 111 111 TYR H H 111 6.583 6.583 8.497 -1.914 18935 10223 1 13 . 1 1 112 112 ALA N N 112 124.749 124.749 121.716 3.033 18935 10224 1 13 . 1 1 112 112 ALA C C 112 179.430 179.430 179.267 0.163 18935 10225 1 13 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.463 0.506 18935 10226 1 13 . 1 1 112 112 ALA CB C 112 18.812 18.812 19.096 -0.284 18935 10227 1 13 . 1 1 112 112 ALA H H 112 8.753 8.753 8.294 0.459 18935 10228 1 13 . 1 1 113 113 ILE N N 113 119.130 119.130 120.078 -0.948 18935 10229 1 13 . 1 1 113 113 ILE C C 113 178.646 178.646 178.437 0.209 18935 10230 1 13 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.791 2.610 18935 10231 1 13 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.463 0.774 18935 10232 1 13 . 1 1 113 113 ILE H H 113 8.946 8.946 8.734 0.212 18935 10233 1 13 . 1 1 114 114 PHE N N 114 121.758 121.758 120.966 0.792 18935 10234 1 13 . 1 1 114 114 PHE C C 114 177.954 177.954 177.321 0.633 18935 10235 1 13 . 1 1 114 114 PHE CA C 114 59.777 59.777 60.934 -1.157 18935 10236 1 13 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.331 0.733 18935 10237 1 13 . 1 1 114 114 PHE H H 114 7.940 7.940 8.605 -0.665 18935 10238 1 13 . 1 1 115 115 HIS N N 115 116.547 116.547 118.825 -2.278 18935 10239 1 13 . 1 1 115 115 HIS C C 115 176.161 176.161 176.604 -0.443 18935 10240 1 13 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.546 -0.427 18935 10241 1 13 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.718 1.349 18935 10242 1 13 . 1 1 115 115 HIS H H 115 7.767 7.767 7.837 -0.070 18935 10243 1 13 . 1 1 116 116 PHE N N 116 109.387 109.387 112.985 -3.598 18935 10244 1 13 . 1 1 116 116 PHE C C 116 177.282 177.282 176.584 0.698 18935 10245 1 13 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.103 1.331 18935 10246 1 13 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.759 -2.504 18935 10247 1 13 . 1 1 116 116 PHE H H 116 8.989 8.989 8.113 0.876 18935 10248 1 13 . 1 1 117 117 THR N N 117 116.864 116.864 115.444 1.420 18935 10249 1 13 . 1 1 117 117 THR C C 117 172.889 172.889 174.761 -1.872 18935 10250 1 13 . 1 1 117 117 THR CA C 117 66.997 66.997 64.972 2.025 18935 10251 1 13 . 1 1 117 117 THR CB C 117 67.948 67.948 69.467 -1.519 18935 10252 1 13 . 1 1 117 117 THR H H 117 7.988 7.988 7.850 0.138 18935 10253 1 13 . 1 1 118 118 GLY N N 118 103.320 103.320 108.798 -5.478 18935 10254 1 13 . 1 1 118 118 GLY C C 118 176.912 176.912 171.575 5.337 18935 10255 1 13 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.555 1.627 18935 10256 1 13 . 1 1 118 118 GLY H H 118 6.550 6.550 7.406 -0.856 18935 10257 1 13 . 1 1 120 120 VAL N N 120 120.671 120.671 126.545 -5.874 18935 10258 1 13 . 1 1 120 120 VAL C C 120 176.283 176.283 177.011 -0.728 18935 10259 1 13 . 1 1 120 120 VAL CA C 120 66.940 66.940 66.204 0.736 18935 10260 1 13 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.665 -1.813 18935 10261 1 13 . 1 1 120 120 VAL H H 120 8.408 8.408 8.454 -0.046 18935 10262 1 13 . 1 1 121 121 SER N N 121 111.789 111.789 114.352 -2.563 18935 10263 1 13 . 1 1 121 121 SER C C 121 175.658 175.658 176.682 -1.024 18935 10264 1 13 . 1 1 121 121 SER CA C 121 60.814 60.814 61.708 -0.894 18935 10265 1 13 . 1 1 121 121 SER CB C 121 60.253 60.253 62.103 -1.850 18935 10266 1 13 . 1 1 121 121 SER H H 121 8.290 8.290 8.376 -0.086 18935 10267 1 13 . 1 1 122 122 TYR N N 122 123.254 123.254 123.305 -0.051 18935 10268 1 13 . 1 1 122 122 TYR C C 122 174.611 174.611 177.425 -2.814 18935 10269 1 13 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.898 -2.352 18935 10270 1 13 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.328 -0.189 18935 10271 1 13 . 1 1 122 122 TYR H H 122 6.303 6.303 7.417 -1.114 18935 10272 1 13 . 1 1 123 123 LEU N N 123 114.825 114.825 119.950 -5.125 18935 10273 1 13 . 1 1 123 123 LEU C C 123 178.891 178.891 179.166 -0.275 18935 10274 1 13 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.974 -1.195 18935 10275 1 13 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.704 -0.066 18935 10276 1 13 . 1 1 123 123 LEU H H 123 6.965 6.965 7.488 -0.523 18935 10277 1 13 . 1 1 124 124 ILE N N 124 114.915 114.915 118.481 -3.566 18935 10278 1 13 . 1 1 124 124 ILE C C 124 177.187 177.187 177.784 -0.597 18935 10279 1 13 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.441 -1.010 18935 10280 1 13 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.377 -0.822 18935 10281 1 13 . 1 1 124 124 ILE H H 124 7.531 7.531 7.872 -0.341 18935 10282 1 13 . 1 1 125 125 ARG N N 125 115.278 115.278 119.781 -4.503 18935 10283 1 13 . 1 1 125 125 ARG C C 125 178.473 178.473 178.559 -0.086 18935 10284 1 13 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.662 -0.203 18935 10285 1 13 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.237 -2.158 18935 10286 1 13 . 1 1 125 125 ARG H H 125 6.809 6.809 7.485 -0.676 18935 10287 1 13 . 1 1 126 126 ILE N N 126 124.160 124.160 119.186 4.974 18935 10288 1 13 . 1 1 126 126 ILE C C 126 178.172 178.172 177.655 0.517 18935 10289 1 13 . 1 1 126 126 ILE CA C 126 60.927 60.927 63.376 -2.449 18935 10290 1 13 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.270 -2.804 18935 10291 1 13 . 1 1 126 126 ILE H H 126 7.408 7.408 7.523 -0.115 18935 10292 1 13 . 1 1 127 127 ARG N N 127 117.136 117.136 120.621 -3.485 18935 10293 1 13 . 1 1 127 127 ARG C C 127 179.227 179.227 178.508 0.719 18935 10294 1 13 . 1 1 127 127 ARG CA C 127 60.216 60.216 60.009 0.207 18935 10295 1 13 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.657 -1.868 18935 10296 1 13 . 1 1 127 127 ARG H H 127 8.230 8.230 7.839 0.391 18935 10297 1 13 . 1 1 128 128 ALA N N 128 121.305 121.305 121.089 0.216 18935 10298 1 13 . 1 1 128 128 ALA C C 128 179.933 179.933 179.024 0.909 18935 10299 1 13 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.248 -0.542 18935 10300 1 13 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.206 0.132 18935 10301 1 13 . 1 1 128 128 ALA H H 128 8.666 8.666 7.796 0.870 18935 10302 1 13 . 1 1 129 129 ALA N N 129 120.943 120.943 121.700 -0.757 18935 10303 1 13 . 1 1 129 129 ALA C C 129 181.336 181.336 179.911 1.425 18935 10304 1 13 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.932 -0.224 18935 10305 1 13 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.226 -1.366 18935 10306 1 13 . 1 1 129 129 ALA H H 129 7.837 7.837 7.634 0.203 18935 10307 1 13 . 1 1 130 130 LEU N N 130 117.726 117.726 117.743 -0.017 18935 10308 1 13 . 1 1 130 130 LEU C C 130 179.432 179.432 179.626 -0.194 18935 10309 1 13 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.453 -0.277 18935 10310 1 13 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.899 -1.333 18935 10311 1 13 . 1 1 130 130 LEU H H 130 8.114 8.114 8.272 -0.158 18935 10312 1 13 . 1 1 131 131 LYS N N 131 124.115 124.115 121.319 2.796 18935 10313 1 13 . 1 1 131 131 LYS C C 131 181.452 181.452 179.622 1.830 18935 10314 1 13 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.957 -0.071 18935 10315 1 13 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.917 0.281 18935 10316 1 13 . 1 1 131 131 LYS H H 131 8.849 8.849 8.174 0.675 18935 10317 1 13 . 1 1 132 132 LYS N N 132 119.447 119.447 118.353 1.094 18935 10318 1 13 . 1 1 132 132 LYS C C 132 177.607 177.607 178.060 -0.453 18935 10319 1 13 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.634 -0.682 18935 10320 1 13 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.863 -0.438 18935 10321 1 13 . 1 1 132 132 LYS H H 132 7.778 7.778 8.163 -0.385 18935 10322 1 13 . 1 1 133 133 LYS N N 133 116.638 116.638 115.773 0.865 18935 10323 1 13 . 1 1 133 133 LYS C C 133 174.681 174.681 175.680 -0.999 18935 10324 1 13 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.463 -0.385 18935 10325 1 13 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.745 -1.105 18935 10326 1 13 . 1 1 133 133 LYS H H 133 7.617 7.617 7.681 -0.064 18935 10327 1 13 . 1 1 134 134 ASN N N 134 110.792 110.792 116.467 -5.675 18935 10328 1 13 . 1 1 134 134 ASN C C 134 174.034 174.034 173.348 0.686 18935 10329 1 13 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.024 0.591 18935 10330 1 13 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.175 -1.123 18935 10331 1 13 . 1 1 134 134 ASN H H 134 8.123 8.123 8.420 -0.297 18935 10332 1 13 . 1 1 135 135 TYR N N 135 115.867 115.867 116.601 -0.734 18935 10333 1 13 . 1 1 135 135 TYR C C 135 175.122 175.122 174.079 1.043 18935 10334 1 13 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.172 -0.420 18935 10335 1 13 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.604 -1.688 18935 10336 1 13 . 1 1 135 135 TYR H H 135 8.133 8.133 7.869 0.264 18935 10337 1 13 . 1 1 136 136 LYS N N 136 119.870 119.870 123.168 -3.298 18935 10338 1 13 . 1 1 136 136 LYS C C 136 174.324 174.324 174.292 0.032 18935 10339 1 13 . 1 1 136 136 LYS CA C 136 55.181 55.181 55.035 0.146 18935 10340 1 13 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.309 -2.236 18935 10341 1 13 . 1 1 136 136 LYS H H 136 9.234 9.234 8.770 0.464 18935 10342 1 13 . 1 1 137 137 LEU N N 137 129.708 129.708 128.633 1.075 18935 10343 1 13 . 1 1 137 137 LEU C C 137 173.798 173.798 174.787 -0.989 18935 10344 1 13 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.386 -1.552 18935 10345 1 13 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.775 1.208 18935 10346 1 13 . 1 1 137 137 LEU H H 137 8.959 8.959 8.812 0.147 18935 10347 1 13 . 1 1 140 140 TYR N N 140 120.580 120.580 114.340 6.240 18935 10348 1 13 . 1 1 140 140 TYR C C 140 174.705 174.705 176.415 -1.710 18935 10349 1 13 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.057 -1.605 18935 10350 1 13 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.688 -0.387 18935 10351 1 13 . 1 1 140 140 TYR H H 140 8.962 8.962 7.326 1.636 18935 10352 1 13 . 1 1 141 141 GLY N N 141 104.986 104.986 106.421 -1.435 18935 10353 1 13 . 1 1 141 141 GLY C C 141 181.854 181.854 172.592 9.262 18935 10354 1 13 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.590 -0.468 18935 10355 1 13 . 1 1 141 141 GLY H H 141 7.555 7.555 7.748 -0.193 18935 10356 1 13 . 1 1 142 142 LEU N N 142 118.269 118.269 121.452 -3.183 18935 10357 1 13 . 1 1 142 142 LEU C C 142 174.067 174.067 176.178 -2.111 18935 10358 1 13 . 1 1 142 142 LEU CA C 142 52.502 52.502 54.005 -1.503 18935 10359 1 13 . 1 1 142 142 LEU CB C 142 44.542 44.542 42.796 1.746 18935 10360 1 13 . 1 1 142 142 LEU H H 142 7.794 7.794 8.384 -0.590 18935 10361 1 13 . 1 1 143 143 PHE N N 143 122.076 122.076 126.011 -3.935 18935 10362 1 13 . 1 1 143 143 PHE C C 143 175.199 175.199 175.136 0.063 18935 10363 1 13 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.779 -1.748 18935 10364 1 13 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.679 2.391 18935 10365 1 13 . 1 1 143 143 PHE H H 143 9.522 9.522 9.774 -0.252 18935 10366 1 13 . 1 1 144 144 LYS N N 144 121.305 121.305 125.909 -4.604 18935 10367 1 13 . 1 1 144 144 LYS C C 144 176.917 176.917 176.658 0.259 18935 10368 1 13 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.533 0.823 18935 10369 1 13 . 1 1 144 144 LYS CB C 144 33.679 33.679 32.681 0.998 18935 10370 1 13 . 1 1 144 144 LYS H H 144 9.076 9.076 8.839 0.237 18935 10371 1 13 . 1 1 145 145 ASN N N 145 126.834 126.834 124.802 2.032 18935 10372 1 13 . 1 1 145 145 ASN C C 145 175.070 175.070 174.850 0.220 18935 10373 1 13 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.013 0.751 18935 10374 1 13 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.829 -1.399 18935 10375 1 13 . 1 1 145 145 ASN H H 145 9.618 9.618 9.240 0.378 18935 10376 1 13 . 1 1 146 146 GLN N N 146 110.112 110.112 110.923 -0.811 18935 10377 1 13 . 1 1 146 146 GLN C C 146 175.198 175.198 175.308 -0.110 18935 10378 1 13 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.649 -0.753 18935 10379 1 13 . 1 1 146 146 GLN CB C 146 26.368 26.368 28.188 -1.819 18935 10380 1 13 . 1 1 146 146 GLN H H 146 9.140 9.140 8.842 0.298 18935 10381 1 13 . 1 1 147 147 THR N N 147 116.003 116.003 116.762 -0.759 18935 10382 1 13 . 1 1 147 147 THR C C 147 173.224 173.224 173.338 -0.114 18935 10383 1 13 . 1 1 147 147 THR CA C 147 61.450 61.450 62.469 -1.020 18935 10384 1 13 . 1 1 147 147 THR CB C 147 70.285 70.285 69.613 0.672 18935 10385 1 13 . 1 1 147 147 THR H H 147 8.069 8.069 7.589 0.480 18935 10386 1 13 . 1 1 148 148 LEU N N 148 129.281 129.281 129.485 -0.204 18935 10387 1 13 . 1 1 148 148 LEU C C 148 176.703 176.703 175.410 1.293 18935 10388 1 13 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.370 0.096 18935 10389 1 13 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.511 -0.787 18935 10390 1 13 . 1 1 148 148 LEU H H 148 8.831 8.831 8.722 0.109 18935 10391 1 13 . 1 1 149 149 VAL N N 149 130.189 130.189 128.085 2.104 18935 10392 1 13 . 1 1 149 149 VAL C C 149 175.012 175.012 173.695 1.317 18935 10393 1 13 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.942 0.327 18935 10394 1 13 . 1 1 149 149 VAL CB C 149 31.456 31.456 34.657 -3.200 18935 10395 1 13 . 1 1 149 149 VAL H H 149 9.243 9.243 8.197 1.046 18935 10396 1 13 . 1 1 151 151 LEU N N 151 123.481 123.481 117.177 6.304 18935 10397 1 13 . 1 1 151 151 LEU C C 151 177.679 177.679 177.068 0.611 18935 10398 1 13 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.795 -0.798 18935 10399 1 13 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.724 0.895 18935 10400 1 13 . 1 1 151 151 LEU H H 151 8.080 8.080 8.131 -0.051 18935 10401 1 13 . 1 1 152 152 LYS N N 152 126.381 126.381 122.336 4.045 18935 10402 1 13 . 1 1 152 152 LYS C C 152 175.115 175.115 175.324 -0.209 18935 10403 1 13 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.206 -1.610 18935 10404 1 13 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.952 -2.887 18935 10405 1 13 . 1 1 152 152 LYS H H 152 9.112 9.112 8.647 0.465 18935 10406 1 13 . 1 1 153 153 ILE N N 153 113.737 113.737 116.306 -2.569 18935 10407 1 13 . 1 1 153 153 ILE C C 153 175.748 175.748 173.397 2.351 18935 10408 1 13 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.597 -1.208 18935 10409 1 13 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.990 0.813 18935 10410 1 13 . 1 1 153 153 ILE H H 153 7.304 7.304 7.531 -0.227 18935 10411 1 13 . 1 1 154 154 THR N N 154 110.656 110.656 113.559 -2.903 18935 10412 1 13 . 1 1 154 154 THR C C 154 174.864 174.864 173.609 1.255 18935 10413 1 13 . 1 1 154 154 THR CA C 154 62.141 62.141 62.066 0.075 18935 10414 1 13 . 1 1 154 154 THR CB C 154 70.413 70.413 70.983 -0.570 18935 10415 1 13 . 1 1 154 154 THR H H 154 9.382 9.382 9.556 -0.174 18935 10416 1 13 . 1 1 155 155 THR N N 155 110.746 110.746 117.720 -6.974 18935 10417 1 13 . 1 1 155 155 THR C C 155 174.718 174.718 175.199 -0.481 18935 10418 1 13 . 1 1 155 155 THR CA C 155 58.785 58.785 60.939 -2.154 18935 10419 1 13 . 1 1 155 155 THR CB C 155 72.277 72.277 71.786 0.491 18935 10420 1 13 . 1 1 155 155 THR H H 155 7.746 7.746 8.369 -0.623 18935 10421 1 13 . 1 1 156 156 GLU N N 156 122.302 122.302 124.000 -1.698 18935 10422 1 13 . 1 1 156 156 GLU C C 156 177.289 177.289 178.360 -1.071 18935 10423 1 13 . 1 1 156 156 GLU CA C 156 58.824 58.824 61.082 -2.258 18935 10424 1 13 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.223 -0.842 18935 10425 1 13 . 1 1 156 156 GLU H H 156 9.490 9.490 9.050 0.440 18935 10426 1 13 . 1 1 157 157 LYS N N 157 118.905 118.905 118.058 0.847 18935 10427 1 13 . 1 1 157 157 LYS C C 157 178.241 178.241 179.042 -0.801 18935 10428 1 13 . 1 1 157 157 LYS CA C 157 59.765 59.765 59.108 0.657 18935 10429 1 13 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.674 -0.396 18935 10430 1 13 . 1 1 157 157 LYS H H 157 8.329 8.329 8.635 -0.306 18935 10431 1 13 . 1 1 158 158 GLU N N 158 116.230 116.230 119.907 -3.677 18935 10432 1 13 . 1 1 158 158 GLU C C 158 178.988 178.988 178.696 0.292 18935 10433 1 13 . 1 1 158 158 GLU CA C 158 58.256 58.256 59.700 -1.444 18935 10434 1 13 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.421 -0.363 18935 10435 1 13 . 1 1 158 158 GLU H H 158 7.611 7.611 8.244 -0.633 18935 10436 1 13 . 1 1 159 159 LEU N N 159 118.978 118.978 120.953 -1.975 18935 10437 1 13 . 1 1 159 159 LEU C C 159 176.347 176.347 178.528 -2.181 18935 10438 1 13 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.248 -5.009 18935 10439 1 13 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.924 -2.381 18935 10440 1 13 . 1 1 159 159 LEU H H 159 7.704 7.704 8.280 -0.576 18935 10441 1 13 . 1 1 160 160 ILE N N 160 117.227 117.227 114.725 2.502 18935 10442 1 13 . 1 1 160 160 ILE C C 160 177.219 177.219 177.511 -0.292 18935 10443 1 13 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.832 0.783 18935 10444 1 13 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.106 0.451 18935 10445 1 13 . 1 1 160 160 ILE H H 160 7.886 7.886 7.477 0.409 18935 10446 1 13 . 1 1 161 161 LYS N N 161 115.912 115.912 119.085 -3.173 18935 10447 1 13 . 1 1 161 161 LYS C C 161 180.990 180.990 178.920 2.070 18935 10448 1 13 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.280 0.351 18935 10449 1 13 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.860 -1.112 18935 10450 1 13 . 1 1 161 161 LYS H H 161 7.536 7.536 7.638 -0.102 18935 10451 1 13 . 1 1 162 162 GLU N N 162 120.852 120.852 119.403 1.449 18935 10452 1 13 . 1 1 162 162 GLU C C 162 178.793 178.793 177.776 1.017 18935 10453 1 13 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.321 -0.339 18935 10454 1 13 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.626 -1.834 18935 10455 1 13 . 1 1 162 162 GLU H H 162 8.392 8.392 7.962 0.430 18935 10456 1 13 . 1 1 163 163 LEU N N 163 115.912 115.912 116.635 -0.723 18935 10457 1 13 . 1 1 163 163 LEU C C 163 176.370 176.370 177.129 -0.759 18935 10458 1 13 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.416 -0.322 18935 10459 1 13 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.799 -1.625 18935 10460 1 13 . 1 1 163 163 LEU H H 163 8.031 8.031 7.734 0.297 18935 10461 1 13 . 1 1 164 164 GLY N N 164 103.160 103.160 105.810 -2.650 18935 10462 1 13 . 1 1 164 164 GLY C C 164 174.240 174.240 173.933 0.307 18935 10463 1 13 . 1 1 164 164 GLY CA C 164 44.302 44.302 45.078 -0.776 18935 10464 1 13 . 1 1 164 164 GLY H H 164 7.625 7.625 7.886 -0.261 18935 10465 1 13 . 1 1 165 165 PHE N N 165 117.952 117.952 118.653 -0.701 18935 10466 1 13 . 1 1 165 165 PHE C C 165 174.556 174.556 175.396 -0.840 18935 10467 1 13 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.425 -0.960 18935 10468 1 13 . 1 1 165 165 PHE CB C 165 40.762 40.762 42.012 -1.250 18935 10469 1 13 . 1 1 165 165 PHE H H 165 7.283 7.283 7.808 -0.525 18935 10470 1 13 . 1 1 166 166 THR N N 166 118.178 118.178 114.000 4.178 18935 10471 1 13 . 1 1 166 166 THR C C 166 175.306 175.306 173.988 1.318 18935 10472 1 13 . 1 1 166 166 THR CA C 166 63.466 63.466 61.342 2.124 18935 10473 1 13 . 1 1 166 166 THR CB C 166 68.721 68.721 70.221 -1.500 18935 10474 1 13 . 1 1 166 166 THR H H 166 9.678 9.678 8.945 0.733 18935 10475 1 13 . 1 1 167 167 TYR N N 167 128.239 128.239 123.826 4.413 18935 10476 1 13 . 1 1 167 167 TYR C C 167 173.297 173.297 175.372 -2.075 18935 10477 1 13 . 1 1 167 167 TYR CA C 167 60.412 60.412 58.650 1.762 18935 10478 1 13 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.151 -2.429 18935 10479 1 13 . 1 1 167 167 TYR H H 167 9.264 9.264 8.489 0.775 18935 10480 1 13 . 1 1 168 168 ARG N N 168 126.789 126.789 127.124 -0.335 18935 10481 1 13 . 1 1 168 168 ARG C C 168 175.297 175.297 174.638 0.659 18935 10482 1 13 . 1 1 168 168 ARG CA C 168 52.765 52.765 53.901 -1.137 18935 10483 1 13 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.889 -1.563 18935 10484 1 13 . 1 1 168 168 ARG H H 168 7.030 7.030 8.639 -1.609 18935 10485 1 13 . 1 1 169 169 ILE N N 169 119.221 119.221 115.655 3.566 18935 10486 1 13 . 1 1 169 169 ILE C C 169 174.522 174.522 175.035 -0.513 18935 10487 1 13 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.149 3.130 18935 10488 1 13 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.834 -5.187 18935 10489 1 13 . 1 1 169 169 ILE H H 169 8.349 8.349 8.322 0.027 18935 10490 1 13 . 1 1 171 171 LYS N N 171 111.335 111.335 116.911 -5.576 18935 10491 1 13 . 1 1 171 171 LYS C C 171 176.638 176.638 177.832 -1.194 18935 10492 1 13 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.986 -1.448 18935 10493 1 13 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.764 0.203 18935 10494 1 13 . 1 1 171 171 LYS H H 171 8.198 8.198 8.434 -0.236 18935 10495 1 13 . 1 1 172 172 LYS N N 172 116.411 116.411 116.669 -0.258 18935 10496 1 13 . 1 1 172 172 LYS C C 172 175.331 175.331 175.687 -0.356 18935 10497 1 13 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.598 -1.597 18935 10498 1 13 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.509 -1.691 18935 10499 1 13 . 1 1 172 172 LYS H H 172 7.843 7.843 7.463 0.380 18935 10500 1 13 . 1 1 173 173 ARG N N 173 120.490 120.490 117.736 2.754 18935 10501 1 13 . 1 1 173 173 ARG C C 173 172.830 172.830 174.972 -2.142 18935 10502 1 13 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.515 0.660 18935 10503 1 13 . 1 1 173 173 ARG CB C 173 28.829 28.829 28.706 0.123 18935 10504 1 13 . 1 1 173 173 ARG H H 173 6.917 6.917 7.682 -0.765 18935 10505 1 14 . 1 1 2 2 LEU N N 2 119.937 119.937 114.295 5.642 18935 10506 1 14 . 1 1 2 2 LEU C C 2 175.307 175.307 175.293 0.014 18935 10507 1 14 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.796 0.496 18935 10508 1 14 . 1 1 2 2 LEU CB C 2 42.684 42.684 45.585 -2.901 18935 10509 1 14 . 1 1 2 2 LEU H H 2 9.251 9.251 9.086 0.165 18935 10510 1 14 . 1 1 3 3 THR N N 3 111.335 111.335 112.039 -0.704 18935 10511 1 14 . 1 1 3 3 THR C C 3 175.854 175.854 176.142 -0.288 18935 10512 1 14 . 1 1 3 3 THR CA C 3 60.540 60.540 60.706 -0.166 18935 10513 1 14 . 1 1 3 3 THR CB C 3 70.782 70.782 70.450 0.332 18935 10514 1 14 . 1 1 3 3 THR H H 3 8.677 8.677 7.988 0.689 18935 10515 1 14 . 1 1 4 4 LEU N N 4 120.988 120.988 122.807 -1.819 18935 10516 1 14 . 1 1 4 4 LEU C C 4 178.391 178.391 177.576 0.815 18935 10517 1 14 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.645 0.419 18935 10518 1 14 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.203 -2.942 18935 10519 1 14 . 1 1 4 4 LEU H H 4 7.746 7.746 8.219 -0.473 18935 10520 1 14 . 1 1 5 5 ILE N N 5 114.236 114.236 111.672 2.564 18935 10521 1 14 . 1 1 5 5 ILE C C 5 178.339 178.339 177.202 1.137 18935 10522 1 14 . 1 1 5 5 ILE CA C 5 63.582 63.582 62.184 1.398 18935 10523 1 14 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.628 -0.829 18935 10524 1 14 . 1 1 5 5 ILE H H 5 7.821 7.821 7.725 0.096 18935 10525 1 14 . 1 1 6 6 GLN N N 6 120.399 120.399 121.039 -0.640 18935 10526 1 14 . 1 1 6 6 GLN C C 6 178.783 178.783 178.096 0.687 18935 10527 1 14 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.773 -0.553 18935 10528 1 14 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.618 -0.503 18935 10529 1 14 . 1 1 6 6 GLN H H 6 7.810 7.810 7.997 -0.187 18935 10530 1 14 . 1 1 7 7 GLY N N 7 106.277 106.277 108.034 -1.757 18935 10531 1 14 . 1 1 7 7 GLY C C 7 174.554 174.554 175.830 -1.276 18935 10532 1 14 . 1 1 7 7 GLY CA C 7 46.934 46.934 46.606 0.328 18935 10533 1 14 . 1 1 7 7 GLY H H 7 8.733 8.733 7.760 0.973 18935 10534 1 14 . 1 1 8 8 LYS N N 8 119.991 119.991 121.618 -1.627 18935 10535 1 14 . 1 1 8 8 LYS C C 8 179.433 179.433 178.707 0.726 18935 10536 1 14 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.572 1.320 18935 10537 1 14 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.117 -0.785 18935 10538 1 14 . 1 1 8 8 LYS H H 8 8.688 8.688 7.580 1.108 18935 10539 1 14 . 1 1 9 9 LYS N N 9 119.175 119.175 118.443 0.732 18935 10540 1 14 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.373 0.009 18935 10541 1 14 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.564 -1.129 18935 10542 1 14 . 1 1 9 9 LYS H H 9 8.015 8.015 7.527 0.488 18935 10543 1 14 . 1 1 10 10 ILE N N 10 120.308 120.308 117.430 2.878 18935 10544 1 14 . 1 1 10 10 ILE C C 10 177.766 177.766 177.748 0.018 18935 10545 1 14 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.645 0.031 18935 10546 1 14 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.555 -1.242 18935 10547 1 14 . 1 1 10 10 ILE H H 10 7.967 7.967 7.619 0.348 18935 10548 1 14 . 1 1 11 11 VAL N N 11 119.130 119.130 120.431 -1.301 18935 10549 1 14 . 1 1 11 11 VAL C C 11 176.606 176.606 178.063 -1.457 18935 10550 1 14 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.737 0.903 18935 10551 1 14 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.515 -0.306 18935 10552 1 14 . 1 1 11 11 VAL H H 11 8.128 8.128 8.516 -0.388 18935 10553 1 14 . 1 1 12 12 ASN N N 12 115.822 115.822 116.371 -0.549 18935 10554 1 14 . 1 1 12 12 ASN C C 12 177.375 177.375 176.582 0.793 18935 10555 1 14 . 1 1 12 12 ASN CA C 12 55.970 55.970 55.933 0.037 18935 10556 1 14 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.345 -0.782 18935 10557 1 14 . 1 1 12 12 ASN H H 12 8.203 8.203 7.752 0.451 18935 10558 1 14 . 1 1 13 13 HIS N N 13 117.659 117.659 116.146 1.513 18935 10559 1 14 . 1 1 13 13 HIS C C 13 177.287 177.287 177.212 0.075 18935 10560 1 14 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.507 1.180 18935 10561 1 14 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.593 -0.572 18935 10562 1 14 . 1 1 13 13 HIS H H 13 7.861 7.861 7.993 -0.132 18935 10563 1 14 . 1 1 14 14 LEU N N 14 115.595 115.595 120.470 -4.875 18935 10564 1 14 . 1 1 14 14 LEU C C 14 179.092 179.092 177.518 1.574 18935 10565 1 14 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.836 -0.195 18935 10566 1 14 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.320 -1.300 18935 10567 1 14 . 1 1 14 14 LEU H H 14 8.376 8.376 8.368 0.008 18935 10568 1 14 . 1 1 15 15 ARG N N 15 115.006 115.006 118.498 -3.492 18935 10569 1 14 . 1 1 15 15 ARG C C 15 176.265 176.265 176.989 -0.724 18935 10570 1 14 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.079 1.805 18935 10571 1 14 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.958 -0.886 18935 10572 1 14 . 1 1 15 15 ARG H H 15 8.074 8.074 7.941 0.133 18935 10573 1 14 . 1 1 16 16 SER N N 16 107.778 107.778 113.786 -6.008 18935 10574 1 14 . 1 1 16 16 SER C C 16 176.009 176.009 175.372 0.637 18935 10575 1 14 . 1 1 16 16 SER CA C 16 57.244 57.244 60.775 -3.531 18935 10576 1 14 . 1 1 16 16 SER CB C 16 63.525 63.525 63.541 -0.016 18935 10577 1 14 . 1 1 16 16 SER H H 16 7.136 7.136 8.155 -1.019 18935 10578 1 14 . 1 1 17 17 ARG N N 17 121.532 121.532 122.576 -1.044 18935 10579 1 14 . 1 1 17 17 ARG C C 17 174.482 174.482 175.340 -0.858 18935 10580 1 14 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.218 1.104 18935 10581 1 14 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.197 1.633 18935 10582 1 14 . 1 1 17 17 ARG H H 17 7.913 7.913 7.673 0.240 18935 10583 1 14 . 1 1 18 18 LEU N N 18 121.305 121.305 120.248 1.057 18935 10584 1 14 . 1 1 18 18 LEU C C 18 176.283 176.283 175.315 0.968 18935 10585 1 14 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.675 -0.977 18935 10586 1 14 . 1 1 18 18 LEU CB C 18 43.055 43.055 42.720 0.335 18935 10587 1 14 . 1 1 18 18 LEU H H 18 8.812 8.812 7.529 1.283 18935 10588 1 14 . 1 1 19 19 ALA N N 19 125.293 125.293 124.401 0.892 18935 10589 1 14 . 1 1 19 19 ALA C C 19 173.780 173.780 175.199 -1.419 18935 10590 1 14 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.442 -0.640 18935 10591 1 14 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.518 0.335 18935 10592 1 14 . 1 1 19 19 ALA H H 19 8.790 8.790 8.020 0.770 18935 10593 1 14 . 1 1 20 20 PHE N N 20 113.117 113.117 116.350 -3.233 18935 10594 1 14 . 1 1 20 20 PHE C C 20 172.708 172.708 172.851 -0.143 18935 10595 1 14 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.434 -0.836 18935 10596 1 14 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.722 0.003 18935 10597 1 14 . 1 1 20 20 PHE H H 20 8.925 8.925 8.942 -0.017 18935 10598 1 14 . 1 1 21 21 GLU N N 21 121.532 121.532 119.688 1.844 18935 10599 1 14 . 1 1 21 21 GLU C C 21 174.830 174.830 175.226 -0.396 18935 10600 1 14 . 1 1 21 21 GLU CA C 21 54.963 54.963 54.832 0.131 18935 10601 1 14 . 1 1 21 21 GLU CB C 21 30.343 30.343 33.580 -3.237 18935 10602 1 14 . 1 1 21 21 GLU H H 21 7.972 7.972 9.060 -1.088 18935 10603 1 14 . 1 1 22 22 TYR N N 22 125.339 125.339 122.051 3.288 18935 10604 1 14 . 1 1 22 22 TYR C C 22 174.864 174.864 174.323 0.541 18935 10605 1 14 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.064 -2.776 18935 10606 1 14 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.261 -0.402 18935 10607 1 14 . 1 1 22 22 TYR H H 22 9.016 9.016 8.555 0.461 18935 10608 1 14 . 1 1 23 23 ASN N N 23 127.024 127.024 125.214 1.810 18935 10609 1 14 . 1 1 23 23 ASN C C 23 175.410 175.410 175.197 0.213 18935 10610 1 14 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.057 -1.003 18935 10611 1 14 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.562 -1.301 18935 10612 1 14 . 1 1 23 23 ASN H H 23 9.181 9.181 9.150 0.031 18935 10613 1 14 . 1 1 24 24 GLY N N 24 102.755 102.755 101.593 1.162 18935 10614 1 14 . 1 1 24 24 GLY C C 24 173.626 173.626 174.044 -0.418 18935 10615 1 14 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.018 -0.083 18935 10616 1 14 . 1 1 24 24 GLY H H 24 8.666 8.666 8.132 0.534 18935 10617 1 14 . 1 1 25 25 GLN N N 25 118.722 118.722 121.241 -2.519 18935 10618 1 14 . 1 1 25 25 GLN C C 25 173.657 173.657 175.186 -1.529 18935 10619 1 14 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.420 -1.187 18935 10620 1 14 . 1 1 25 25 GLN CB C 25 30.805 30.805 29.191 1.614 18935 10621 1 14 . 1 1 25 25 GLN H H 25 7.708 7.708 8.035 -0.327 18935 10622 1 14 . 1 1 26 26 LEU N N 26 123.526 123.526 125.354 -1.828 18935 10623 1 14 . 1 1 26 26 LEU C C 26 175.842 175.842 176.471 -0.629 18935 10624 1 14 . 1 1 26 26 LEU CA C 26 53.986 53.986 54.796 -0.810 18935 10625 1 14 . 1 1 26 26 LEU CB C 26 40.807 40.807 42.449 -1.642 18935 10626 1 14 . 1 1 26 26 LEU H H 26 8.543 8.543 8.620 -0.077 18935 10627 1 14 . 1 1 27 27 ILE N N 27 129.462 129.462 125.198 4.264 18935 10628 1 14 . 1 1 27 27 ILE C C 27 175.085 175.085 174.231 0.854 18935 10629 1 14 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.331 0.642 18935 10630 1 14 . 1 1 27 27 ILE CB C 27 35.552 35.552 37.722 -2.170 18935 10631 1 14 . 1 1 27 27 ILE H H 27 8.989 8.989 9.018 -0.029 18935 10632 1 14 . 1 1 28 28 LYS N N 28 125.157 125.157 127.234 -2.077 18935 10633 1 14 . 1 1 28 28 LYS C C 28 176.725 176.725 175.362 1.363 18935 10634 1 14 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.599 1.211 18935 10635 1 14 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.322 -1.505 18935 10636 1 14 . 1 1 28 28 LYS H H 28 8.311 8.311 8.303 0.008 18935 10637 1 14 . 1 1 29 29 ILE N N 29 125.565 125.565 117.063 8.502 18935 10638 1 14 . 1 1 29 29 ILE C C 29 175.685 175.685 174.389 1.296 18935 10639 1 14 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.572 0.833 18935 10640 1 14 . 1 1 29 29 ILE CB C 29 37.031 37.031 39.920 -2.889 18935 10641 1 14 . 1 1 29 29 ILE H H 29 8.209 8.209 7.947 0.262 18935 10642 1 14 . 1 1 30 30 LEU N N 30 127.831 127.831 121.379 6.452 18935 10643 1 14 . 1 1 30 30 LEU C C 30 178.794 178.794 178.141 0.653 18935 10644 1 14 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.150 1.293 18935 10645 1 14 . 1 1 30 30 LEU CB C 30 40.836 40.836 44.975 -4.139 18935 10646 1 14 . 1 1 30 30 LEU H H 30 9.027 9.027 8.334 0.693 18935 10647 1 14 . 1 1 31 31 SER N N 31 116.864 116.864 119.139 -2.275 18935 10648 1 14 . 1 1 31 31 SER C C 31 177.464 177.464 176.486 0.978 18935 10649 1 14 . 1 1 31 31 SER CA C 31 61.180 61.180 61.770 -0.590 18935 10650 1 14 . 1 1 31 31 SER CB C 31 62.105 62.105 63.084 -0.979 18935 10651 1 14 . 1 1 31 31 SER H H 31 8.887 8.887 8.695 0.192 18935 10652 1 14 . 1 1 32 32 LYS N N 32 114.825 114.825 121.597 -6.772 18935 10653 1 14 . 1 1 32 32 LYS C C 32 176.243 176.243 178.393 -2.150 18935 10654 1 14 . 1 1 32 32 LYS CA C 32 57.292 57.292 58.712 -1.420 18935 10655 1 14 . 1 1 32 32 LYS CB C 32 30.266 30.266 32.213 -1.947 18935 10656 1 14 . 1 1 32 32 LYS H H 32 8.290 8.290 8.263 0.027 18935 10657 1 14 . 1 1 33 33 ASN N N 33 117.564 117.564 117.071 0.493 18935 10658 1 14 . 1 1 33 33 ASN C C 33 172.253 172.253 173.916 -1.663 18935 10659 1 14 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.690 -1.599 18935 10660 1 14 . 1 1 33 33 ASN CB C 33 38.339 38.339 38.469 -0.130 18935 10661 1 14 . 1 1 33 33 ASN H H 33 8.051 8.051 8.013 0.038 18935 10662 1 14 . 1 1 34 34 ILE N N 34 118.949 118.949 119.080 -0.131 18935 10663 1 14 . 1 1 34 34 ILE C C 34 175.343 175.343 174.428 0.915 18935 10664 1 14 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.406 0.147 18935 10665 1 14 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.950 -3.083 18935 10666 1 14 . 1 1 34 34 ILE H H 34 7.670 7.670 7.178 0.492 18935 10667 1 14 . 1 1 35 35 VAL N N 35 128.355 128.355 125.856 2.499 18935 10668 1 14 . 1 1 35 35 VAL C C 35 175.543 175.543 174.449 1.094 18935 10669 1 14 . 1 1 35 35 VAL CA C 35 60.014 60.014 59.892 0.122 18935 10670 1 14 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.956 -1.725 18935 10671 1 14 . 1 1 35 35 VAL H H 35 9.698 9.698 8.871 0.827 18935 10672 1 14 . 1 1 36 36 ALA N N 36 129.553 129.553 129.706 -0.153 18935 10673 1 14 . 1 1 36 36 ALA C C 36 177.015 177.015 176.699 0.316 18935 10674 1 14 . 1 1 36 36 ALA CA C 36 52.396 52.396 50.904 1.492 18935 10675 1 14 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.378 -0.756 18935 10676 1 14 . 1 1 36 36 ALA H H 36 8.917 8.917 8.484 0.433 18935 10677 1 14 . 1 1 37 37 VAL N N 37 115.006 115.006 121.739 -6.733 18935 10678 1 14 . 1 1 37 37 VAL C C 37 174.649 174.649 176.317 -1.668 18935 10679 1 14 . 1 1 37 37 VAL CA C 37 59.321 59.321 60.075 -0.754 18935 10680 1 14 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.088 -0.702 18935 10681 1 14 . 1 1 37 37 VAL H H 37 8.214 8.214 7.713 0.501 18935 10682 1 14 . 1 1 38 38 GLY N N 38 109.387 109.387 107.089 2.298 18935 10683 1 14 . 1 1 38 38 GLY C C 38 174.152 174.152 175.960 -1.808 18935 10684 1 14 . 1 1 38 38 GLY CA C 38 45.497 45.497 46.538 -1.041 18935 10685 1 14 . 1 1 38 38 GLY H H 38 8.677 8.677 7.860 0.817 18935 10686 1 14 . 1 1 39 39 SER N N 39 116.776 116.776 119.966 -3.190 18935 10687 1 14 . 1 1 39 39 SER C C 39 175.129 175.129 176.783 -1.654 18935 10688 1 14 . 1 1 39 39 SER CA C 39 60.036 60.036 62.248 -2.212 18935 10689 1 14 . 1 1 39 39 SER CB C 39 61.522 61.522 63.088 -1.566 18935 10690 1 14 . 1 1 39 39 SER H H 39 9.705 9.705 8.183 1.522 18935 10691 1 14 . 1 1 40 40 LEU N N 40 113.696 113.696 118.938 -5.242 18935 10692 1 14 . 1 1 40 40 LEU C C 40 180.558 180.558 178.329 2.229 18935 10693 1 14 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.074 1.299 18935 10694 1 14 . 1 1 40 40 LEU CB C 40 41.877 41.877 40.921 0.956 18935 10695 1 14 . 1 1 40 40 LEU H H 40 7.311 7.311 7.778 -0.467 18935 10696 1 14 . 1 1 41 41 ARG N N 41 121.162 121.162 117.688 3.474 18935 10697 1 14 . 1 1 41 41 ARG C C 41 176.964 176.964 177.779 -0.815 18935 10698 1 14 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.907 1.544 18935 10699 1 14 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.294 -2.089 18935 10700 1 14 . 1 1 41 41 ARG H H 41 6.999 6.999 7.631 -0.632 18935 10701 1 14 . 1 1 42 42 ARG N N 42 111.109 111.109 117.991 -6.882 18935 10702 1 14 . 1 1 42 42 ARG C C 42 172.564 172.564 176.201 -3.637 18935 10703 1 14 . 1 1 42 42 ARG CA C 42 56.380 56.380 56.359 0.021 18935 10704 1 14 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.419 -2.070 18935 10705 1 14 . 1 1 42 42 ARG H H 42 7.041 7.041 7.873 -0.832 18935 10706 1 14 . 1 1 43 43 GLU N N 43 111.924 111.924 115.132 -3.208 18935 10707 1 14 . 1 1 43 43 GLU C C 43 176.202 176.202 174.978 1.224 18935 10708 1 14 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.378 -0.924 18935 10709 1 14 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.107 -1.806 18935 10710 1 14 . 1 1 43 43 GLU H H 43 7.757 7.757 7.978 -0.221 18935 10711 1 14 . 1 1 44 44 GLU N N 44 117.861 117.861 118.252 -0.391 18935 10712 1 14 . 1 1 44 44 GLU C C 44 175.197 175.197 176.514 -1.317 18935 10713 1 14 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.186 -0.058 18935 10714 1 14 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.515 -1.956 18935 10715 1 14 . 1 1 44 44 GLU H H 44 7.461 7.461 7.594 -0.133 18935 10716 1 14 . 1 1 45 45 LYS N N 45 115.051 115.051 118.838 -3.787 18935 10717 1 14 . 1 1 45 45 LYS C C 45 177.733 177.733 176.486 1.247 18935 10718 1 14 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.345 1.710 18935 10719 1 14 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.735 -1.708 18935 10720 1 14 . 1 1 45 45 LYS H H 45 8.123 8.123 8.464 -0.341 18935 10721 1 14 . 1 1 46 46 MET N N 46 114.009 114.009 118.603 -4.594 18935 10722 1 14 . 1 1 46 46 MET C C 46 174.067 174.067 174.557 -0.490 18935 10723 1 14 . 1 1 46 46 MET CA C 46 52.477 52.477 54.528 -2.051 18935 10724 1 14 . 1 1 46 46 MET CB C 46 33.974 33.974 35.466 -1.492 18935 10725 1 14 . 1 1 46 46 MET H H 46 7.767 7.767 7.594 0.173 18935 10726 1 14 . 1 1 47 47 LEU N N 47 120.263 120.263 121.283 -1.020 18935 10727 1 14 . 1 1 47 47 LEU C C 47 177.669 177.669 174.822 2.847 18935 10728 1 14 . 1 1 47 47 LEU CA C 47 52.201 52.201 52.953 -0.752 18935 10729 1 14 . 1 1 47 47 LEU CB C 47 42.908 42.908 44.023 -1.115 18935 10730 1 14 . 1 1 47 47 LEU H H 47 9.481 9.481 9.166 0.315 18935 10731 1 14 . 1 1 48 48 ASN N N 48 118.632 118.632 117.979 0.653 18935 10732 1 14 . 1 1 48 48 ASN C C 48 174.715 174.715 174.424 0.291 18935 10733 1 14 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.965 1.536 18935 10734 1 14 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.486 -1.658 18935 10735 1 14 . 1 1 48 48 ASN H H 48 9.388 9.388 8.978 0.410 18935 10736 1 14 . 1 1 49 49 ASP N N 49 115.867 115.867 117.259 -1.392 18935 10737 1 14 . 1 1 49 49 ASP C C 49 174.111 174.111 174.418 -0.307 18935 10738 1 14 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.848 -1.647 18935 10739 1 14 . 1 1 49 49 ASP CB C 49 40.077 40.077 44.700 -4.623 18935 10740 1 14 . 1 1 49 49 ASP H H 49 7.670 7.670 8.030 -0.360 18935 10741 1 14 . 1 1 50 50 VAL N N 50 119.185 119.185 118.804 0.381 18935 10742 1 14 . 1 1 50 50 VAL C C 50 172.333 172.333 174.242 -1.909 18935 10743 1 14 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.489 0.426 18935 10744 1 14 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.556 -1.591 18935 10745 1 14 . 1 1 50 50 VAL H H 50 8.339 8.339 7.848 0.491 18935 10746 1 14 . 1 1 51 51 ASP N N 51 124.704 124.704 125.136 -0.432 18935 10747 1 14 . 1 1 51 51 ASP C C 51 173.725 173.725 175.153 -1.428 18935 10748 1 14 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.386 -0.358 18935 10749 1 14 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.234 0.595 18935 10750 1 14 . 1 1 51 51 ASP H H 51 8.984 8.984 8.663 0.321 18935 10751 1 14 . 1 1 52 52 LEU N N 52 120.943 120.943 123.735 -2.792 18935 10752 1 14 . 1 1 52 52 LEU C C 52 173.045 173.045 174.505 -1.460 18935 10753 1 14 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.388 -1.517 18935 10754 1 14 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.384 -2.131 18935 10755 1 14 . 1 1 52 52 LEU H H 52 9.081 9.081 8.682 0.399 18935 10756 1 14 . 1 1 53 53 LEU N N 53 123.027 123.027 126.447 -3.420 18935 10757 1 14 . 1 1 53 53 LEU C C 53 173.750 173.750 175.454 -1.704 18935 10758 1 14 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.672 -1.339 18935 10759 1 14 . 1 1 53 53 LEU CB C 53 45.008 45.008 44.772 0.236 18935 10760 1 14 . 1 1 53 53 LEU H H 53 9.146 9.146 8.802 0.344 18935 10761 1 14 . 1 1 54 54 ILE N N 54 126.562 126.562 124.392 2.170 18935 10762 1 14 . 1 1 54 54 ILE C C 54 175.132 175.132 176.274 -1.142 18935 10763 1 14 . 1 1 54 54 ILE CA C 54 58.598 58.598 60.366 -1.768 18935 10764 1 14 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.221 -0.660 18935 10765 1 14 . 1 1 54 54 ILE H H 54 9.440 9.440 8.414 1.026 18935 10766 1 14 . 1 1 55 55 ILE N N 55 126.879 126.879 118.806 8.073 18935 10767 1 14 . 1 1 55 55 ILE C C 55 175.655 175.655 174.455 1.200 18935 10768 1 14 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.590 -3.030 18935 10769 1 14 . 1 1 55 55 ILE CB C 55 34.306 34.306 42.398 -8.092 18935 10770 1 14 . 1 1 55 55 ILE H H 55 9.381 9.381 7.774 1.607 18935 10771 1 14 . 1 1 56 56 VAL N N 56 128.936 128.936 121.500 7.436 18935 10772 1 14 . 1 1 56 56 VAL C C 56 176.389 176.389 173.796 2.593 18935 10773 1 14 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.565 0.065 18935 10774 1 14 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.295 -0.511 18935 10775 1 14 . 1 1 56 56 VAL H H 56 9.227 9.227 8.530 0.697 18935 10776 1 14 . 1 1 58 58 GLU N N 58 112.423 112.423 117.699 -5.276 18935 10777 1 14 . 1 1 58 58 GLU C C 58 175.946 175.946 178.020 -2.074 18935 10778 1 14 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.847 -1.547 18935 10779 1 14 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.202 0.895 18935 10780 1 14 . 1 1 58 58 GLU H H 58 6.685 6.685 8.426 -1.741 18935 10781 1 14 . 1 1 59 59 LYS N N 59 125.293 125.293 122.181 3.112 18935 10782 1 14 . 1 1 59 59 LYS C C 59 179.248 179.248 178.599 0.649 18935 10783 1 14 . 1 1 59 59 LYS CA C 59 59.774 59.774 59.285 0.489 18935 10784 1 14 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.364 -1.287 18935 10785 1 14 . 1 1 59 59 LYS H H 59 9.108 9.108 8.589 0.519 18935 10786 1 14 . 1 1 60 60 LYS N N 60 117.408 117.408 120.314 -2.906 18935 10787 1 14 . 1 1 60 60 LYS C C 60 177.198 177.198 179.064 -1.866 18935 10788 1 14 . 1 1 60 60 LYS CA C 60 58.213 58.213 58.787 -0.574 18935 10789 1 14 . 1 1 60 60 LYS CB C 60 30.583 30.583 31.519 -0.936 18935 10790 1 14 . 1 1 60 60 LYS H H 60 9.102 9.102 7.986 1.116 18935 10791 1 14 . 1 1 61 61 LEU N N 61 114.779 114.779 118.326 -3.547 18935 10792 1 14 . 1 1 61 61 LEU C C 61 178.790 178.790 178.662 0.128 18935 10793 1 14 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.622 -2.598 18935 10794 1 14 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.181 -0.317 18935 10795 1 14 . 1 1 61 61 LEU H H 61 7.455 7.455 8.039 -0.584 18935 10796 1 14 . 1 1 62 62 LEU N N 62 119.629 119.629 118.152 1.477 18935 10797 1 14 . 1 1 62 62 LEU C C 62 177.762 177.762 177.680 0.082 18935 10798 1 14 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.902 0.296 18935 10799 1 14 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.966 -1.235 18935 10800 1 14 . 1 1 62 62 LEU H H 62 7.714 7.714 7.447 0.267 18935 10801 1 14 . 1 1 63 63 LYS N N 63 112.921 112.921 116.050 -3.129 18935 10802 1 14 . 1 1 63 63 LYS C C 63 175.386 175.386 177.778 -2.392 18935 10803 1 14 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.490 -0.134 18935 10804 1 14 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.650 -1.687 18935 10805 1 14 . 1 1 63 63 LYS H H 63 7.751 7.751 7.983 -0.232 18935 10806 1 14 . 1 1 64 64 HIS N N 64 112.468 112.468 117.207 -4.739 18935 10807 1 14 . 1 1 64 64 HIS C C 64 176.081 176.081 176.422 -0.341 18935 10808 1 14 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.683 -1.914 18935 10809 1 14 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.469 0.901 18935 10810 1 14 . 1 1 64 64 HIS H H 64 7.697 7.697 7.858 -0.161 18935 10811 1 14 . 1 1 65 65 VAL N N 65 117.499 117.499 116.766 0.733 18935 10812 1 14 . 1 1 65 65 VAL C C 65 174.301 174.301 176.469 -2.168 18935 10813 1 14 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.280 3.050 18935 10814 1 14 . 1 1 65 65 VAL CB C 65 29.360 29.360 30.994 -1.634 18935 10815 1 14 . 1 1 65 65 VAL H H 65 6.917 6.917 7.152 -0.235 18935 10816 1 14 . 1 1 66 66 LEU N N 66 113.873 113.873 119.520 -5.647 18935 10817 1 14 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.314 0.536 18935 10818 1 14 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.329 -3.271 18935 10819 1 14 . 1 1 66 66 LEU H H 66 9.102 9.102 8.150 0.952 18935 10820 1 14 . 1 1 68 68 ASN N N 68 110.792 110.792 116.849 -6.057 18935 10821 1 14 . 1 1 68 68 ASN C C 68 174.877 174.877 173.468 1.409 18935 10822 1 14 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.481 -1.666 18935 10823 1 14 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.243 -0.932 18935 10824 1 14 . 1 1 68 68 ASN H H 68 7.234 7.234 8.374 -1.140 18935 10825 1 14 . 1 1 69 69 ILE N N 69 122.348 122.348 124.641 -2.293 18935 10826 1 14 . 1 1 69 69 ILE CA C 69 59.912 59.912 59.963 -0.051 18935 10827 1 14 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.855 -2.817 18935 10828 1 14 . 1 1 69 69 ILE H H 69 7.428 7.428 8.797 -1.369 18935 10829 1 14 . 1 1 70 70 ARG N N 70 125.701 125.701 126.137 -0.436 18935 10830 1 14 . 1 1 70 70 ARG C C 70 174.596 174.596 173.788 0.808 18935 10831 1 14 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.788 -1.627 18935 10832 1 14 . 1 1 70 70 ARG CB C 70 32.453 32.453 33.296 -0.843 18935 10833 1 14 . 1 1 70 70 ARG H H 70 9.083 9.083 9.066 0.017 18935 10834 1 14 . 1 1 71 71 ILE N N 71 118.496 118.496 121.047 -2.551 18935 10835 1 14 . 1 1 71 71 ILE C C 71 175.625 175.625 176.364 -0.739 18935 10836 1 14 . 1 1 71 71 ILE CA C 71 59.776 59.776 60.186 -0.410 18935 10837 1 14 . 1 1 71 71 ILE CB C 71 37.967 37.967 39.475 -1.508 18935 10838 1 14 . 1 1 71 71 ILE H H 71 7.864 7.864 8.578 -0.714 18935 10839 1 14 . 1 1 72 72 LYS N N 72 127.423 127.423 129.242 -1.819 18935 10840 1 14 . 1 1 72 72 LYS C C 72 177.659 177.659 176.863 0.796 18935 10841 1 14 . 1 1 72 72 LYS CA C 72 57.428 57.428 56.799 0.629 18935 10842 1 14 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.200 -0.826 18935 10843 1 14 . 1 1 72 72 LYS H H 72 8.720 8.720 8.183 0.537 18935 10844 1 14 . 1 1 73 73 GLY N N 73 112.604 112.604 112.410 0.194 18935 10845 1 14 . 1 1 73 73 GLY C C 73 173.729 173.729 174.314 -0.585 18935 10846 1 14 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.028 0.803 18935 10847 1 14 . 1 1 73 73 GLY H H 73 8.930 8.930 8.675 0.255 18935 10848 1 14 . 1 1 74 74 LEU N N 74 119.538 119.538 121.013 -1.475 18935 10849 1 14 . 1 1 74 74 LEU C C 74 175.802 175.802 176.274 -0.472 18935 10850 1 14 . 1 1 74 74 LEU CA C 74 53.661 53.661 54.203 -0.542 18935 10851 1 14 . 1 1 74 74 LEU CB C 74 44.053 44.053 43.856 0.197 18935 10852 1 14 . 1 1 74 74 LEU H H 74 7.547 7.547 7.593 -0.046 18935 10853 1 14 . 1 1 75 75 SER N N 75 118.994 118.994 115.955 3.039 18935 10854 1 14 . 1 1 75 75 SER C C 75 173.111 173.111 172.789 0.322 18935 10855 1 14 . 1 1 75 75 SER CA C 75 57.696 57.696 57.710 -0.014 18935 10856 1 14 . 1 1 75 75 SER CB C 75 63.073 63.073 63.222 -0.149 18935 10857 1 14 . 1 1 75 75 SER H H 75 9.076 9.076 8.668 0.408 18935 10858 1 14 . 1 1 76 76 PHE N N 76 117.802 117.802 120.505 -2.703 18935 10859 1 14 . 1 1 76 76 PHE C C 76 173.564 173.564 173.944 -0.380 18935 10860 1 14 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.495 -1.086 18935 10861 1 14 . 1 1 76 76 PHE CB C 76 41.843 41.843 41.800 0.043 18935 10862 1 14 . 1 1 76 76 PHE H H 76 8.119 8.119 7.874 0.245 18935 10863 1 14 . 1 1 77 77 SER N N 77 113.918 113.918 117.442 -3.524 18935 10864 1 14 . 1 1 77 77 SER C C 77 173.194 173.194 173.657 -0.463 18935 10865 1 14 . 1 1 77 77 SER CA C 77 55.999 55.999 57.141 -1.141 18935 10866 1 14 . 1 1 77 77 SER CB C 77 65.218 65.218 65.095 0.123 18935 10867 1 14 . 1 1 77 77 SER H H 77 8.989 8.989 8.829 0.160 18935 10868 1 14 . 1 1 78 78 VAL N N 78 123.662 123.662 127.699 -4.037 18935 10869 1 14 . 1 1 78 78 VAL C C 78 176.057 176.057 175.997 0.060 18935 10870 1 14 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.985 -0.894 18935 10871 1 14 . 1 1 78 78 VAL CB C 78 32.294 32.294 32.166 0.128 18935 10872 1 14 . 1 1 78 78 VAL H H 78 8.995 8.995 8.915 0.080 18935 10873 1 14 . 1 1 79 79 LYS N N 79 129.417 129.417 128.340 1.077 18935 10874 1 14 . 1 1 79 79 LYS C C 79 176.436 176.436 174.550 1.886 18935 10875 1 14 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.283 3.369 18935 10876 1 14 . 1 1 79 79 LYS CB C 79 32.473 32.473 37.049 -4.576 18935 10877 1 14 . 1 1 79 79 LYS H H 79 9.425 9.425 8.924 0.501 18935 10878 1 14 . 1 1 80 80 VAL N N 80 108.616 108.616 121.238 -12.622 18935 10879 1 14 . 1 1 80 80 VAL CA C 80 59.097 59.097 60.894 -1.797 18935 10880 1 14 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.200 0.882 18935 10881 1 14 . 1 1 80 80 VAL H H 80 7.380 7.380 8.526 -1.146 18935 10882 1 14 . 1 1 81 81 CYS N N 81 123.254 123.254 128.174 -4.920 18935 10883 1 14 . 1 1 81 81 CYS C C 81 172.053 172.053 174.300 -2.247 18935 10884 1 14 . 1 1 81 81 CYS CA C 81 59.739 59.739 58.256 1.483 18935 10885 1 14 . 1 1 81 81 CYS CB C 81 27.332 27.332 29.581 -2.249 18935 10886 1 14 . 1 1 81 81 CYS H H 81 9.759 9.759 8.305 1.454 18935 10887 1 14 . 1 1 82 82 GLY N N 82 118.450 118.450 115.499 2.951 18935 10888 1 14 . 1 1 82 82 GLY C C 82 171.814 171.814 174.444 -2.630 18935 10889 1 14 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.563 -2.210 18935 10890 1 14 . 1 1 82 82 GLY H H 82 8.537 8.537 8.701 -0.164 18935 10891 1 14 . 1 1 83 83 GLU N N 83 113.964 113.964 120.134 -6.170 18935 10892 1 14 . 1 1 83 83 GLU C C 83 179.320 179.320 177.593 1.727 18935 10893 1 14 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.265 0.410 18935 10894 1 14 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.924 -0.017 18935 10895 1 14 . 1 1 83 83 GLU H H 83 8.473 8.473 8.538 -0.065 18935 10896 1 14 . 1 1 84 84 ARG N N 84 117.544 117.544 117.854 -0.310 18935 10897 1 14 . 1 1 84 84 ARG C C 84 177.252 177.252 176.372 0.880 18935 10898 1 14 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.541 -1.037 18935 10899 1 14 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.225 0.321 18935 10900 1 14 . 1 1 84 84 ARG H H 84 9.760 9.760 8.107 1.653 18935 10901 1 14 . 1 1 85 85 LYS N N 85 124.160 124.160 120.138 4.022 18935 10902 1 14 . 1 1 85 85 LYS C C 85 173.379 173.379 175.539 -2.160 18935 10903 1 14 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.271 -1.039 18935 10904 1 14 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.225 -0.013 18935 10905 1 14 . 1 1 85 85 LYS H H 85 8.494 8.494 7.917 0.577 18935 10906 1 14 . 1 1 86 86 CYS N N 86 126.472 126.472 119.229 7.243 18935 10907 1 14 . 1 1 86 86 CYS C C 86 171.935 171.935 172.369 -0.434 18935 10908 1 14 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.584 -1.706 18935 10909 1 14 . 1 1 86 86 CYS CB C 86 30.304 30.304 29.629 0.675 18935 10910 1 14 . 1 1 86 86 CYS H H 86 9.221 9.221 8.686 0.535 18935 10911 1 14 . 1 1 87 87 VAL N N 87 126.426 126.426 127.050 -0.624 18935 10912 1 14 . 1 1 87 87 VAL C C 87 173.760 173.760 172.819 0.941 18935 10913 1 14 . 1 1 87 87 VAL CA C 87 61.333 61.333 59.785 1.548 18935 10914 1 14 . 1 1 87 87 VAL CB C 87 33.338 33.338 35.868 -2.530 18935 10915 1 14 . 1 1 87 87 VAL H H 87 8.623 8.623 8.897 -0.274 18935 10916 1 14 . 1 1 88 88 LEU N N 88 125.701 125.701 127.644 -1.943 18935 10917 1 14 . 1 1 88 88 LEU C C 88 175.424 175.424 175.183 0.241 18935 10918 1 14 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.636 -1.551 18935 10919 1 14 . 1 1 88 88 LEU CB C 88 44.544 44.544 45.893 -1.349 18935 10920 1 14 . 1 1 88 88 LEU H H 88 9.592 9.592 9.002 0.590 18935 10921 1 14 . 1 1 89 89 PHE N N 89 118.314 118.314 122.795 -4.481 18935 10922 1 14 . 1 1 89 89 PHE C C 89 177.068 177.068 175.929 1.139 18935 10923 1 14 . 1 1 89 89 PHE CA C 89 55.875 55.875 57.120 -1.245 18935 10924 1 14 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.556 -0.719 18935 10925 1 14 . 1 1 89 89 PHE H H 89 8.979 8.979 8.779 0.200 18935 10926 1 14 . 1 1 90 90 ILE N N 90 119.039 119.039 118.635 0.404 18935 10927 1 14 . 1 1 90 90 ILE C C 90 173.692 173.692 175.113 -1.421 18935 10928 1 14 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.589 -0.917 18935 10929 1 14 . 1 1 90 90 ILE CB C 90 40.183 40.183 40.516 -0.333 18935 10930 1 14 . 1 1 90 90 ILE H H 90 9.447 9.447 8.525 0.922 18935 10931 1 14 . 1 1 91 91 GLU N N 91 122.801 122.801 124.370 -1.569 18935 10932 1 14 . 1 1 91 91 GLU C C 91 175.565 175.565 175.403 0.162 18935 10933 1 14 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.127 -0.662 18935 10934 1 14 . 1 1 91 91 GLU CB C 91 29.662 29.662 31.634 -1.972 18935 10935 1 14 . 1 1 91 91 GLU H H 91 8.360 8.360 8.468 -0.108 18935 10936 1 14 . 1 1 92 92 TRP N N 92 126.018 126.018 120.915 5.103 18935 10937 1 14 . 1 1 92 92 TRP C C 92 175.070 175.070 175.313 -0.243 18935 10938 1 14 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.752 -0.562 18935 10939 1 14 . 1 1 92 92 TRP CB C 92 30.582 30.582 30.862 -0.280 18935 10940 1 14 . 1 1 92 92 TRP H H 92 9.425 9.425 8.567 0.858 18935 10941 1 14 . 1 1 93 93 GLU N N 93 126.381 126.381 120.628 5.753 18935 10942 1 14 . 1 1 93 93 GLU C C 93 175.637 175.637 175.677 -0.040 18935 10943 1 14 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.837 -1.068 18935 10944 1 14 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.198 -2.254 18935 10945 1 14 . 1 1 93 93 GLU H H 93 8.914 8.914 9.215 -0.301 18935 10946 1 14 . 1 1 94 94 LYS N N 94 107.891 107.891 112.521 -4.630 18935 10947 1 14 . 1 1 94 94 LYS C C 94 175.359 175.359 175.503 -0.144 18935 10948 1 14 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.050 0.379 18935 10949 1 14 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.985 -2.343 18935 10950 1 14 . 1 1 94 94 LYS H H 94 8.634 8.634 8.558 0.076 18935 10951 1 14 . 1 1 95 95 LYS N N 95 120.490 120.490 118.836 1.654 18935 10952 1 14 . 1 1 95 95 LYS C C 95 174.369 174.369 174.034 0.335 18935 10953 1 14 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.831 -0.478 18935 10954 1 14 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.605 -1.142 18935 10955 1 14 . 1 1 95 95 LYS H H 95 7.924 7.924 7.707 0.217 18935 10956 1 14 . 1 1 96 96 THR N N 96 115.278 115.278 114.130 1.148 18935 10957 1 14 . 1 1 96 96 THR C C 96 174.317 174.317 173.355 0.962 18935 10958 1 14 . 1 1 96 96 THR CA C 96 61.203 61.203 60.387 0.816 18935 10959 1 14 . 1 1 96 96 THR CB C 96 69.348 69.348 69.078 0.270 18935 10960 1 14 . 1 1 96 96 THR H H 96 7.967 7.967 7.858 0.109 18935 10961 1 14 . 1 1 97 97 TYR N N 97 123.254 123.254 125.976 -2.722 18935 10962 1 14 . 1 1 97 97 TYR C C 97 173.320 173.320 174.859 -1.539 18935 10963 1 14 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.206 -0.322 18935 10964 1 14 . 1 1 97 97 TYR CB C 97 41.136 41.136 40.535 0.601 18935 10965 1 14 . 1 1 97 97 TYR H H 97 9.232 9.232 8.795 0.437 18935 10966 1 14 . 1 1 98 98 GLN N N 98 122.574 122.574 118.893 3.681 18935 10967 1 14 . 1 1 98 98 GLN C C 98 172.781 172.781 174.248 -1.467 18935 10968 1 14 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.129 0.042 18935 10969 1 14 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.104 -2.705 18935 10970 1 14 . 1 1 98 98 GLN H H 98 9.000 9.000 8.882 0.118 18935 10971 1 14 . 1 1 99 99 LEU N N 99 130.218 130.218 125.207 5.011 18935 10972 1 14 . 1 1 99 99 LEU C C 99 172.806 172.806 174.479 -1.673 18935 10973 1 14 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.096 -1.046 18935 10974 1 14 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.929 -1.177 18935 10975 1 14 . 1 1 99 99 LEU H H 99 9.246 9.246 8.981 0.265 18935 10976 1 14 . 1 1 100 100 ASP N N 100 124.931 124.931 125.680 -0.749 18935 10977 1 14 . 1 1 100 100 ASP C C 100 172.626 172.626 173.960 -1.334 18935 10978 1 14 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.591 -3.161 18935 10979 1 14 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.890 -6.562 18935 10980 1 14 . 1 1 100 100 ASP H H 100 9.253 9.253 8.419 0.834 18935 10981 1 14 . 1 1 101 101 LEU N N 101 119.402 119.402 123.544 -4.142 18935 10982 1 14 . 1 1 101 101 LEU C C 101 173.869 173.869 174.706 -0.837 18935 10983 1 14 . 1 1 101 101 LEU CA C 101 51.655 51.655 53.129 -1.474 18935 10984 1 14 . 1 1 101 101 LEU CB C 101 44.166 44.166 45.413 -1.247 18935 10985 1 14 . 1 1 101 101 LEU H H 101 8.726 8.726 7.567 1.159 18935 10986 1 14 . 1 1 102 102 PHE N N 102 117.952 117.952 117.871 0.081 18935 10987 1 14 . 1 1 102 102 PHE C C 102 175.853 175.853 175.113 0.740 18935 10988 1 14 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.870 -2.588 18935 10989 1 14 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.099 1.725 18935 10990 1 14 . 1 1 102 102 PHE H H 102 8.236 8.236 8.333 -0.097 18935 10991 1 14 . 1 1 103 103 THR N N 103 106.853 106.853 119.997 -13.144 18935 10992 1 14 . 1 1 103 103 THR C C 103 175.154 175.154 173.911 1.243 18935 10993 1 14 . 1 1 103 103 THR CA C 103 57.685 57.685 62.364 -4.679 18935 10994 1 14 . 1 1 103 103 THR CB C 103 71.037 71.037 68.851 2.186 18935 10995 1 14 . 1 1 103 103 THR H H 103 7.917 7.917 8.496 -0.579 18935 10996 1 14 . 1 1 104 104 ALA N N 104 122.348 122.348 128.010 -5.662 18935 10997 1 14 . 1 1 104 104 ALA C C 104 175.947 175.947 175.108 0.839 18935 10998 1 14 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.328 -0.521 18935 10999 1 14 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.449 -0.021 18935 11000 1 14 . 1 1 104 104 ALA H H 104 8.930 8.930 7.745 1.185 18935 11001 1 14 . 1 1 105 105 LEU N N 105 119.855 119.855 119.108 0.747 18935 11002 1 14 . 1 1 105 105 LEU C C 105 179.628 179.628 178.910 0.718 18935 11003 1 14 . 1 1 105 105 LEU CA C 105 53.123 53.123 53.687 -0.564 18935 11004 1 14 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.442 -2.108 18935 11005 1 14 . 1 1 105 105 LEU H H 105 8.316 8.316 9.278 -0.962 18935 11006 1 14 . 1 1 106 106 ALA N N 106 123.662 123.662 124.181 -0.519 18935 11007 1 14 . 1 1 106 106 ALA C C 106 181.056 181.056 178.904 2.152 18935 11008 1 14 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.048 1.301 18935 11009 1 14 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.513 -1.198 18935 11010 1 14 . 1 1 106 106 ALA H H 106 8.306 8.306 8.514 -0.208 18935 11011 1 14 . 1 1 107 107 GLU N N 107 114.825 114.825 115.697 -0.872 18935 11012 1 14 . 1 1 107 107 GLU C C 107 177.854 177.854 176.789 1.065 18935 11013 1 14 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.910 0.476 18935 11014 1 14 . 1 1 107 107 GLU CB C 107 27.844 27.844 29.031 -1.187 18935 11015 1 14 . 1 1 107 107 GLU H H 107 9.754 9.754 8.741 1.013 18935 11016 1 14 . 1 1 108 108 GLU N N 108 115.097 115.097 116.941 -1.844 18935 11017 1 14 . 1 1 108 108 GLU C C 108 178.001 178.001 177.150 0.851 18935 11018 1 14 . 1 1 108 108 GLU CA C 108 54.926 54.926 55.882 -0.956 18935 11019 1 14 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.386 0.615 18935 11020 1 14 . 1 1 108 108 GLU H H 108 7.859 7.859 7.715 0.144 18935 11021 1 14 . 1 1 109 109 LYS N N 109 118.360 118.360 122.017 -3.657 18935 11022 1 14 . 1 1 109 109 LYS C C 109 172.691 172.691 176.472 -3.781 18935 11023 1 14 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.852 1.050 18935 11024 1 14 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.694 -0.153 18935 11025 1 14 . 1 1 109 109 LYS H H 109 7.660 7.660 7.311 0.349 18935 11026 1 14 . 1 1 111 111 TYR N N 111 114.054 114.054 117.283 -3.229 18935 11027 1 14 . 1 1 111 111 TYR C C 111 179.764 179.764 176.761 3.003 18935 11028 1 14 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.446 -1.448 18935 11029 1 14 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.356 -1.400 18935 11030 1 14 . 1 1 111 111 TYR H H 111 6.583 6.583 8.418 -1.835 18935 11031 1 14 . 1 1 112 112 ALA N N 112 124.749 124.749 120.697 4.052 18935 11032 1 14 . 1 1 112 112 ALA C C 112 179.430 179.430 179.437 -0.007 18935 11033 1 14 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.277 0.692 18935 11034 1 14 . 1 1 112 112 ALA CB C 112 18.812 18.812 19.469 -0.657 18935 11035 1 14 . 1 1 112 112 ALA H H 112 8.753 8.753 8.031 0.722 18935 11036 1 14 . 1 1 113 113 ILE N N 113 119.130 119.130 119.537 -0.407 18935 11037 1 14 . 1 1 113 113 ILE C C 113 178.646 178.646 177.780 0.866 18935 11038 1 14 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.074 3.327 18935 11039 1 14 . 1 1 113 113 ILE CB C 113 37.237 37.237 37.064 0.173 18935 11040 1 14 . 1 1 113 113 ILE H H 113 8.946 8.946 8.095 0.851 18935 11041 1 14 . 1 1 114 114 PHE N N 114 121.758 121.758 117.243 4.515 18935 11042 1 14 . 1 1 114 114 PHE C C 114 177.954 177.954 174.851 3.103 18935 11043 1 14 . 1 1 114 114 PHE CA C 114 59.777 59.777 59.022 0.756 18935 11044 1 14 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.358 0.706 18935 11045 1 14 . 1 1 114 114 PHE H H 114 7.940 7.940 8.041 -0.101 18935 11046 1 14 . 1 1 115 115 HIS N N 115 116.547 116.547 118.036 -1.489 18935 11047 1 14 . 1 1 115 115 HIS C C 115 176.161 176.161 175.150 1.011 18935 11048 1 14 . 1 1 115 115 HIS CA C 115 59.119 59.119 57.656 1.463 18935 11049 1 14 . 1 1 115 115 HIS CB C 115 31.067 31.067 31.712 -0.645 18935 11050 1 14 . 1 1 115 115 HIS H H 115 7.767 7.767 7.609 0.158 18935 11051 1 14 . 1 1 116 116 PHE N N 116 109.387 109.387 116.184 -6.797 18935 11052 1 14 . 1 1 116 116 PHE C C 116 177.282 177.282 176.746 0.536 18935 11053 1 14 . 1 1 116 116 PHE CA C 116 61.434 61.434 58.308 3.126 18935 11054 1 14 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.334 -2.079 18935 11055 1 14 . 1 1 116 116 PHE H H 116 8.989 8.989 8.233 0.756 18935 11056 1 14 . 1 1 117 117 THR N N 117 116.864 116.864 116.353 0.511 18935 11057 1 14 . 1 1 117 117 THR C C 117 172.889 172.889 175.384 -2.495 18935 11058 1 14 . 1 1 117 117 THR CA C 117 66.997 66.997 65.955 1.042 18935 11059 1 14 . 1 1 117 117 THR CB C 117 67.948 67.948 68.871 -0.923 18935 11060 1 14 . 1 1 117 117 THR H H 117 7.988 7.988 7.881 0.107 18935 11061 1 14 . 1 1 118 118 GLY N N 118 103.320 103.320 108.492 -5.172 18935 11062 1 14 . 1 1 118 118 GLY C C 118 176.912 176.912 171.941 4.971 18935 11063 1 14 . 1 1 118 118 GLY CA C 118 44.182 44.182 45.452 -1.270 18935 11064 1 14 . 1 1 118 118 GLY H H 118 6.550 6.550 7.424 -0.874 18935 11065 1 14 . 1 1 120 120 VAL N N 120 120.671 120.671 125.151 -4.480 18935 11066 1 14 . 1 1 120 120 VAL C C 120 176.283 176.283 176.586 -0.303 18935 11067 1 14 . 1 1 120 120 VAL CA C 120 66.940 66.940 64.991 1.949 18935 11068 1 14 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.680 -1.828 18935 11069 1 14 . 1 1 120 120 VAL H H 120 8.408 8.408 7.867 0.541 18935 11070 1 14 . 1 1 121 121 SER N N 121 111.789 111.789 115.478 -3.689 18935 11071 1 14 . 1 1 121 121 SER C C 121 175.658 175.658 176.725 -1.067 18935 11072 1 14 . 1 1 121 121 SER CA C 121 60.814 60.814 62.009 -1.195 18935 11073 1 14 . 1 1 121 121 SER CB C 121 60.253 60.253 62.647 -2.394 18935 11074 1 14 . 1 1 121 121 SER H H 121 8.290 8.290 8.131 0.159 18935 11075 1 14 . 1 1 122 122 TYR N N 122 123.254 123.254 120.643 2.611 18935 11076 1 14 . 1 1 122 122 TYR C C 122 174.611 174.611 177.524 -2.913 18935 11077 1 14 . 1 1 122 122 TYR CA C 122 58.546 58.546 61.542 -2.996 18935 11078 1 14 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.643 -0.504 18935 11079 1 14 . 1 1 122 122 TYR H H 122 6.303 6.303 7.931 -1.629 18935 11080 1 14 . 1 1 123 123 LEU N N 123 114.825 114.825 120.057 -5.232 18935 11081 1 14 . 1 1 123 123 LEU C C 123 178.891 178.891 178.922 -0.031 18935 11082 1 14 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.489 -0.710 18935 11083 1 14 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.494 0.144 18935 11084 1 14 . 1 1 123 123 LEU H H 123 6.965 6.965 7.610 -0.645 18935 11085 1 14 . 1 1 124 124 ILE N N 124 114.915 114.915 118.502 -3.587 18935 11086 1 14 . 1 1 124 124 ILE C C 124 177.187 177.187 177.728 -0.541 18935 11087 1 14 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.483 -1.052 18935 11088 1 14 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.119 -0.564 18935 11089 1 14 . 1 1 124 124 ILE H H 124 7.531 7.531 7.898 -0.367 18935 11090 1 14 . 1 1 125 125 ARG N N 125 115.278 115.278 117.579 -2.301 18935 11091 1 14 . 1 1 125 125 ARG C C 125 178.473 178.473 178.944 -0.471 18935 11092 1 14 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.806 -0.347 18935 11093 1 14 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.344 -2.265 18935 11094 1 14 . 1 1 125 125 ARG H H 125 6.809 6.809 7.546 -0.737 18935 11095 1 14 . 1 1 126 126 ILE N N 126 124.160 124.160 120.545 3.615 18935 11096 1 14 . 1 1 126 126 ILE C C 126 178.172 178.172 177.422 0.750 18935 11097 1 14 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.721 -1.794 18935 11098 1 14 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.745 -3.279 18935 11099 1 14 . 1 1 126 126 ILE H H 126 7.408 7.408 7.552 -0.144 18935 11100 1 14 . 1 1 127 127 ARG N N 127 117.136 117.136 120.974 -3.838 18935 11101 1 14 . 1 1 127 127 ARG C C 127 179.227 179.227 178.559 0.668 18935 11102 1 14 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.854 0.362 18935 11103 1 14 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.804 -2.015 18935 11104 1 14 . 1 1 127 127 ARG H H 127 8.230 8.230 8.301 -0.071 18935 11105 1 14 . 1 1 128 128 ALA N N 128 121.305 121.305 120.383 0.922 18935 11106 1 14 . 1 1 128 128 ALA C C 128 179.933 179.933 178.972 0.961 18935 11107 1 14 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.146 -0.440 18935 11108 1 14 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.250 0.088 18935 11109 1 14 . 1 1 128 128 ALA H H 128 8.666 8.666 8.033 0.633 18935 11110 1 14 . 1 1 129 129 ALA N N 129 120.943 120.943 122.157 -1.214 18935 11111 1 14 . 1 1 129 129 ALA C C 129 181.336 181.336 179.896 1.440 18935 11112 1 14 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.926 -0.218 18935 11113 1 14 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.280 -1.420 18935 11114 1 14 . 1 1 129 129 ALA H H 129 7.837 7.837 7.440 0.397 18935 11115 1 14 . 1 1 130 130 LEU N N 130 117.726 117.726 118.432 -0.706 18935 11116 1 14 . 1 1 130 130 LEU C C 130 179.432 179.432 179.857 -0.425 18935 11117 1 14 . 1 1 130 130 LEU CA C 130 57.176 57.176 58.187 -1.011 18935 11118 1 14 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.670 -1.104 18935 11119 1 14 . 1 1 130 130 LEU H H 130 8.114 8.114 8.424 -0.310 18935 11120 1 14 . 1 1 131 131 LYS N N 131 124.115 124.115 121.194 2.921 18935 11121 1 14 . 1 1 131 131 LYS C C 131 181.452 181.452 179.538 1.914 18935 11122 1 14 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.843 0.043 18935 11123 1 14 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.896 0.302 18935 11124 1 14 . 1 1 131 131 LYS H H 131 8.849 8.849 7.920 0.929 18935 11125 1 14 . 1 1 132 132 LYS N N 132 119.447 119.447 118.325 1.122 18935 11126 1 14 . 1 1 132 132 LYS C C 132 177.607 177.607 177.964 -0.357 18935 11127 1 14 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.371 -0.419 18935 11128 1 14 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.773 -0.348 18935 11129 1 14 . 1 1 132 132 LYS H H 132 7.778 7.778 8.240 -0.462 18935 11130 1 14 . 1 1 133 133 LYS N N 133 116.638 116.638 115.528 1.110 18935 11131 1 14 . 1 1 133 133 LYS C C 133 174.681 174.681 175.803 -1.122 18935 11132 1 14 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.667 -0.589 18935 11133 1 14 . 1 1 133 133 LYS CB C 133 31.640 31.640 33.381 -1.741 18935 11134 1 14 . 1 1 133 133 LYS H H 133 7.617 7.617 7.877 -0.260 18935 11135 1 14 . 1 1 134 134 ASN N N 134 110.792 110.792 116.562 -5.770 18935 11136 1 14 . 1 1 134 134 ASN C C 134 174.034 174.034 173.375 0.659 18935 11137 1 14 . 1 1 134 134 ASN CA C 134 54.615 54.615 53.917 0.698 18935 11138 1 14 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.072 -1.020 18935 11139 1 14 . 1 1 134 134 ASN H H 134 8.123 8.123 8.349 -0.226 18935 11140 1 14 . 1 1 135 135 TYR N N 135 115.867 115.867 116.909 -1.042 18935 11141 1 14 . 1 1 135 135 TYR C C 135 175.122 175.122 174.026 1.096 18935 11142 1 14 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.461 -0.709 18935 11143 1 14 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.390 -1.474 18935 11144 1 14 . 1 1 135 135 TYR H H 135 8.133 8.133 7.717 0.416 18935 11145 1 14 . 1 1 136 136 LYS N N 136 119.870 119.870 121.080 -1.210 18935 11146 1 14 . 1 1 136 136 LYS C C 136 174.324 174.324 174.581 -0.257 18935 11147 1 14 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.943 0.238 18935 11148 1 14 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.738 -2.665 18935 11149 1 14 . 1 1 136 136 LYS H H 136 9.234 9.234 8.721 0.513 18935 11150 1 14 . 1 1 137 137 LEU N N 137 129.708 129.708 126.406 3.302 18935 11151 1 14 . 1 1 137 137 LEU C C 137 173.798 173.798 174.891 -1.093 18935 11152 1 14 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.362 -1.528 18935 11153 1 14 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.871 1.112 18935 11154 1 14 . 1 1 137 137 LEU H H 137 8.959 8.959 8.788 0.171 18935 11155 1 14 . 1 1 140 140 TYR N N 140 120.580 120.580 113.581 6.999 18935 11156 1 14 . 1 1 140 140 TYR C C 140 174.705 174.705 175.372 -0.667 18935 11157 1 14 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.779 -1.327 18935 11158 1 14 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.687 -0.386 18935 11159 1 14 . 1 1 140 140 TYR H H 140 8.962 8.962 7.415 1.547 18935 11160 1 14 . 1 1 141 141 GLY N N 141 104.986 104.986 104.763 0.223 18935 11161 1 14 . 1 1 141 141 GLY C C 141 181.854 181.854 172.082 9.772 18935 11162 1 14 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.665 -0.543 18935 11163 1 14 . 1 1 141 141 GLY H H 141 7.555 7.555 7.474 0.081 18935 11164 1 14 . 1 1 142 142 LEU N N 142 118.269 118.269 121.253 -2.984 18935 11165 1 14 . 1 1 142 142 LEU C C 142 174.067 174.067 176.216 -2.149 18935 11166 1 14 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.624 -1.122 18935 11167 1 14 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.093 1.449 18935 11168 1 14 . 1 1 142 142 LEU H H 142 7.794 7.794 8.322 -0.528 18935 11169 1 14 . 1 1 143 143 PHE N N 143 122.076 122.076 124.862 -2.786 18935 11170 1 14 . 1 1 143 143 PHE C C 143 175.199 175.199 175.268 -0.069 18935 11171 1 14 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.472 -1.440 18935 11172 1 14 . 1 1 143 143 PHE CB C 143 42.070 42.070 40.060 2.010 18935 11173 1 14 . 1 1 143 143 PHE H H 143 9.522 9.522 9.111 0.411 18935 11174 1 14 . 1 1 144 144 LYS N N 144 121.305 121.305 122.894 -1.589 18935 11175 1 14 . 1 1 144 144 LYS C C 144 176.917 176.917 176.319 0.598 18935 11176 1 14 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.360 0.996 18935 11177 1 14 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.888 -0.209 18935 11178 1 14 . 1 1 144 144 LYS H H 144 9.076 9.076 8.998 0.078 18935 11179 1 14 . 1 1 145 145 ASN N N 145 126.834 126.834 124.916 1.918 18935 11180 1 14 . 1 1 145 145 ASN C C 145 175.070 175.070 174.945 0.125 18935 11181 1 14 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.055 0.709 18935 11182 1 14 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.699 -1.269 18935 11183 1 14 . 1 1 145 145 ASN H H 145 9.618 9.618 9.359 0.259 18935 11184 1 14 . 1 1 146 146 GLN N N 146 110.112 110.112 111.458 -1.346 18935 11185 1 14 . 1 1 146 146 GLN C C 146 175.198 175.198 174.776 0.422 18935 11186 1 14 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.335 -0.439 18935 11187 1 14 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.790 -1.421 18935 11188 1 14 . 1 1 146 146 GLN H H 146 9.140 9.140 8.800 0.340 18935 11189 1 14 . 1 1 147 147 THR N N 147 116.003 116.003 115.120 0.883 18935 11190 1 14 . 1 1 147 147 THR C C 147 173.224 173.224 173.304 -0.080 18935 11191 1 14 . 1 1 147 147 THR CA C 147 61.450 61.450 60.951 0.499 18935 11192 1 14 . 1 1 147 147 THR CB C 147 70.285 70.285 70.337 -0.051 18935 11193 1 14 . 1 1 147 147 THR H H 147 8.069 8.069 7.580 0.489 18935 11194 1 14 . 1 1 148 148 LEU N N 148 129.281 129.281 130.133 -0.852 18935 11195 1 14 . 1 1 148 148 LEU C C 148 176.703 176.703 175.453 1.250 18935 11196 1 14 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.576 -0.110 18935 11197 1 14 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.841 -1.116 18935 11198 1 14 . 1 1 148 148 LEU H H 148 8.831 8.831 8.894 -0.063 18935 11199 1 14 . 1 1 149 149 VAL N N 149 130.189 130.189 126.903 3.286 18935 11200 1 14 . 1 1 149 149 VAL C C 149 175.012 175.012 173.889 1.123 18935 11201 1 14 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.742 0.527 18935 11202 1 14 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.243 -3.787 18935 11203 1 14 . 1 1 149 149 VAL H H 149 9.243 9.243 8.565 0.678 18935 11204 1 14 . 1 1 151 151 LEU N N 151 123.481 123.481 115.228 8.253 18935 11205 1 14 . 1 1 151 151 LEU C C 151 177.679 177.679 176.910 0.769 18935 11206 1 14 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.382 -0.385 18935 11207 1 14 . 1 1 151 151 LEU CB C 151 43.619 43.619 43.124 0.495 18935 11208 1 14 . 1 1 151 151 LEU H H 151 8.080 8.080 7.943 0.137 18935 11209 1 14 . 1 1 152 152 LYS N N 152 126.381 126.381 122.947 3.434 18935 11210 1 14 . 1 1 152 152 LYS C C 152 175.115 175.115 175.286 -0.171 18935 11211 1 14 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.134 -1.538 18935 11212 1 14 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.930 -2.865 18935 11213 1 14 . 1 1 152 152 LYS H H 152 9.112 9.112 8.837 0.275 18935 11214 1 14 . 1 1 153 153 ILE N N 153 113.737 113.737 116.066 -2.329 18935 11215 1 14 . 1 1 153 153 ILE C C 153 175.748 175.748 173.868 1.880 18935 11216 1 14 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.397 -1.008 18935 11217 1 14 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.776 1.027 18935 11218 1 14 . 1 1 153 153 ILE H H 153 7.304 7.304 7.617 -0.313 18935 11219 1 14 . 1 1 154 154 THR N N 154 110.656 110.656 114.376 -3.720 18935 11220 1 14 . 1 1 154 154 THR C C 154 174.864 174.864 173.541 1.323 18935 11221 1 14 . 1 1 154 154 THR CA C 154 62.141 62.141 61.247 0.894 18935 11222 1 14 . 1 1 154 154 THR CB C 154 70.413 70.413 69.761 0.652 18935 11223 1 14 . 1 1 154 154 THR H H 154 9.382 9.382 8.330 1.052 18935 11224 1 14 . 1 1 155 155 THR N N 155 110.746 110.746 115.296 -4.550 18935 11225 1 14 . 1 1 155 155 THR C C 155 174.718 174.718 174.679 0.039 18935 11226 1 14 . 1 1 155 155 THR CA C 155 58.785 58.785 60.903 -2.118 18935 11227 1 14 . 1 1 155 155 THR CB C 155 72.277 72.277 71.332 0.945 18935 11228 1 14 . 1 1 155 155 THR H H 155 7.746 7.746 7.620 0.126 18935 11229 1 14 . 1 1 156 156 GLU N N 156 122.302 122.302 124.834 -2.532 18935 11230 1 14 . 1 1 156 156 GLU C C 156 177.289 177.289 178.150 -0.861 18935 11231 1 14 . 1 1 156 156 GLU CA C 156 58.824 58.824 61.002 -2.178 18935 11232 1 14 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.158 -0.777 18935 11233 1 14 . 1 1 156 156 GLU H H 156 9.490 9.490 9.027 0.463 18935 11234 1 14 . 1 1 157 157 LYS N N 157 118.905 118.905 119.150 -0.245 18935 11235 1 14 . 1 1 157 157 LYS C C 157 178.241 178.241 179.353 -1.112 18935 11236 1 14 . 1 1 157 157 LYS CA C 157 59.765 59.765 59.289 0.476 18935 11237 1 14 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.655 -0.378 18935 11238 1 14 . 1 1 157 157 LYS H H 157 8.329 8.329 8.395 -0.066 18935 11239 1 14 . 1 1 158 158 GLU N N 158 116.230 116.230 119.272 -3.042 18935 11240 1 14 . 1 1 158 158 GLU C C 158 178.988 178.988 178.642 0.346 18935 11241 1 14 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.703 -0.447 18935 11242 1 14 . 1 1 158 158 GLU CB C 158 29.058 29.058 28.957 0.101 18935 11243 1 14 . 1 1 158 158 GLU H H 158 7.611 7.611 8.077 -0.466 18935 11244 1 14 . 1 1 159 159 LEU N N 159 118.978 118.978 121.683 -2.705 18935 11245 1 14 . 1 1 159 159 LEU C C 159 176.347 176.347 178.349 -2.002 18935 11246 1 14 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.424 -5.185 18935 11247 1 14 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.696 -2.153 18935 11248 1 14 . 1 1 159 159 LEU H H 159 7.704 7.704 8.069 -0.365 18935 11249 1 14 . 1 1 160 160 ILE N N 160 117.227 117.227 116.004 1.223 18935 11250 1 14 . 1 1 160 160 ILE C C 160 177.219 177.219 177.587 -0.368 18935 11251 1 14 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.301 0.314 18935 11252 1 14 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.137 0.420 18935 11253 1 14 . 1 1 160 160 ILE H H 160 7.886 7.886 8.314 -0.428 18935 11254 1 14 . 1 1 161 161 LYS N N 161 115.912 115.912 120.497 -4.585 18935 11255 1 14 . 1 1 161 161 LYS C C 161 180.990 180.990 179.075 1.915 18935 11256 1 14 . 1 1 161 161 LYS CA C 161 58.631 58.631 59.487 -0.856 18935 11257 1 14 . 1 1 161 161 LYS CB C 161 30.748 30.748 32.286 -1.538 18935 11258 1 14 . 1 1 161 161 LYS H H 161 7.536 7.536 7.483 0.053 18935 11259 1 14 . 1 1 162 162 GLU N N 162 120.852 120.852 120.031 0.821 18935 11260 1 14 . 1 1 162 162 GLU C C 162 178.793 178.793 178.515 0.278 18935 11261 1 14 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.891 -0.909 18935 11262 1 14 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.330 -1.538 18935 11263 1 14 . 1 1 162 162 GLU H H 162 8.392 8.392 7.889 0.503 18935 11264 1 14 . 1 1 163 163 LEU N N 163 115.912 115.912 115.831 0.081 18935 11265 1 14 . 1 1 163 163 LEU C C 163 176.370 176.370 177.252 -0.882 18935 11266 1 14 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.955 -0.861 18935 11267 1 14 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.817 -1.643 18935 11268 1 14 . 1 1 163 163 LEU H H 163 8.031 8.031 8.030 0.001 18935 11269 1 14 . 1 1 164 164 GLY N N 164 103.160 103.160 103.452 -0.292 18935 11270 1 14 . 1 1 164 164 GLY C C 164 174.240 174.240 174.024 0.216 18935 11271 1 14 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.562 -0.260 18935 11272 1 14 . 1 1 164 164 GLY H H 164 7.625 7.625 7.614 0.011 18935 11273 1 14 . 1 1 165 165 PHE N N 165 117.952 117.952 119.225 -1.273 18935 11274 1 14 . 1 1 165 165 PHE C C 165 174.556 174.556 174.411 0.145 18935 11275 1 14 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.111 -0.646 18935 11276 1 14 . 1 1 165 165 PHE CB C 165 40.762 40.762 42.303 -1.541 18935 11277 1 14 . 1 1 165 165 PHE H H 165 7.283 7.283 8.617 -1.334 18935 11278 1 14 . 1 1 166 166 THR N N 166 118.178 118.178 113.005 5.173 18935 11279 1 14 . 1 1 166 166 THR C C 166 175.306 175.306 173.712 1.594 18935 11280 1 14 . 1 1 166 166 THR CA C 166 63.466 63.466 60.834 2.632 18935 11281 1 14 . 1 1 166 166 THR CB C 166 68.721 68.721 70.072 -1.351 18935 11282 1 14 . 1 1 166 166 THR H H 166 9.678 9.678 8.383 1.295 18935 11283 1 14 . 1 1 167 167 TYR N N 167 128.239 128.239 124.690 3.549 18935 11284 1 14 . 1 1 167 167 TYR C C 167 173.297 173.297 175.556 -2.259 18935 11285 1 14 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.539 0.873 18935 11286 1 14 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.069 -2.347 18935 11287 1 14 . 1 1 167 167 TYR H H 167 9.264 9.264 8.612 0.652 18935 11288 1 14 . 1 1 168 168 ARG N N 168 126.789 126.789 126.561 0.228 18935 11289 1 14 . 1 1 168 168 ARG C C 168 175.297 175.297 174.412 0.885 18935 11290 1 14 . 1 1 168 168 ARG CA C 168 52.765 52.765 53.978 -1.213 18935 11291 1 14 . 1 1 168 168 ARG CB C 168 31.326 31.326 33.218 -1.893 18935 11292 1 14 . 1 1 168 168 ARG H H 168 7.030 7.030 7.805 -0.775 18935 11293 1 14 . 1 1 169 169 ILE N N 169 119.221 119.221 115.674 3.547 18935 11294 1 14 . 1 1 169 169 ILE C C 169 174.522 174.522 174.642 -0.120 18935 11295 1 14 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.686 2.593 18935 11296 1 14 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.865 -5.218 18935 11297 1 14 . 1 1 169 169 ILE H H 169 8.349 8.349 8.314 0.035 18935 11298 1 14 . 1 1 171 171 LYS N N 171 111.335 111.335 115.258 -3.923 18935 11299 1 14 . 1 1 171 171 LYS C C 171 176.638 176.638 177.168 -0.530 18935 11300 1 14 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.053 -1.516 18935 11301 1 14 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.956 0.011 18935 11302 1 14 . 1 1 171 171 LYS H H 171 8.198 8.198 8.478 -0.280 18935 11303 1 14 . 1 1 172 172 LYS N N 172 116.411 116.411 116.468 -0.057 18935 11304 1 14 . 1 1 172 172 LYS C C 172 175.331 175.331 175.619 -0.288 18935 11305 1 14 . 1 1 172 172 LYS CA C 172 54.001 54.001 54.524 -0.523 18935 11306 1 14 . 1 1 172 172 LYS CB C 172 31.818 31.818 32.656 -0.838 18935 11307 1 14 . 1 1 172 172 LYS H H 172 7.843 7.843 7.708 0.135 18935 11308 1 14 . 1 1 173 173 ARG N N 173 120.490 120.490 117.134 3.356 18935 11309 1 14 . 1 1 173 173 ARG C C 173 172.830 172.830 174.087 -1.257 18935 11310 1 14 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.610 0.565 18935 11311 1 14 . 1 1 173 173 ARG CB C 173 28.829 28.829 28.817 0.012 18935 11312 1 14 . 1 1 173 173 ARG H H 173 6.917 6.917 7.668 -0.751 18935 11313 1 15 . 1 1 2 2 LEU N N 2 119.937 119.937 121.865 -1.928 18935 11314 1 15 . 1 1 2 2 LEU C C 2 175.307 175.307 175.882 -0.575 18935 11315 1 15 . 1 1 2 2 LEU CA C 2 54.292 54.292 54.103 0.189 18935 11316 1 15 . 1 1 2 2 LEU CB C 2 42.684 42.684 43.617 -0.933 18935 11317 1 15 . 1 1 2 2 LEU H H 2 9.251 9.251 7.843 1.408 18935 11318 1 15 . 1 1 3 3 THR N N 3 111.335 111.335 112.511 -1.176 18935 11319 1 15 . 1 1 3 3 THR C C 3 175.854 175.854 175.544 0.310 18935 11320 1 15 . 1 1 3 3 THR CA C 3 60.540 60.540 60.295 0.245 18935 11321 1 15 . 1 1 3 3 THR CB C 3 70.782 70.782 70.376 0.406 18935 11322 1 15 . 1 1 3 3 THR H H 3 8.677 8.677 8.131 0.546 18935 11323 1 15 . 1 1 4 4 LEU N N 4 120.988 120.988 122.483 -1.495 18935 11324 1 15 . 1 1 4 4 LEU C C 4 178.391 178.391 178.468 -0.077 18935 11325 1 15 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.258 0.806 18935 11326 1 15 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.663 -2.402 18935 11327 1 15 . 1 1 4 4 LEU H H 4 7.746 7.746 8.363 -0.617 18935 11328 1 15 . 1 1 5 5 ILE N N 5 114.236 114.236 114.064 0.172 18935 11329 1 15 . 1 1 5 5 ILE C C 5 178.339 178.339 177.605 0.734 18935 11330 1 15 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.293 -0.711 18935 11331 1 15 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.255 -0.456 18935 11332 1 15 . 1 1 5 5 ILE H H 5 7.821 7.821 7.721 0.100 18935 11333 1 15 . 1 1 6 6 GLN N N 6 120.399 120.399 121.028 -0.629 18935 11334 1 15 . 1 1 6 6 GLN C C 6 178.783 178.783 178.435 0.348 18935 11335 1 15 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.910 -0.690 18935 11336 1 15 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.140 -0.025 18935 11337 1 15 . 1 1 6 6 GLN H H 6 7.810 7.810 7.771 0.039 18935 11338 1 15 . 1 1 7 7 GLY N N 7 106.277 106.277 105.546 0.731 18935 11339 1 15 . 1 1 7 7 GLY C C 7 174.554 174.554 176.160 -1.606 18935 11340 1 15 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.051 -0.117 18935 11341 1 15 . 1 1 7 7 GLY H H 7 8.733 8.733 8.107 0.626 18935 11342 1 15 . 1 1 8 8 LYS N N 8 119.991 119.991 120.980 -0.989 18935 11343 1 15 . 1 1 8 8 LYS C C 8 179.433 179.433 177.974 1.459 18935 11344 1 15 . 1 1 8 8 LYS CA C 8 59.892 59.892 57.909 1.983 18935 11345 1 15 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.329 -0.997 18935 11346 1 15 . 1 1 8 8 LYS H H 8 8.688 8.688 7.137 1.551 18935 11347 1 15 . 1 1 9 9 LYS N N 9 119.175 119.175 120.777 -1.602 18935 11348 1 15 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.951 -0.569 18935 11349 1 15 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.474 -1.039 18935 11350 1 15 . 1 1 9 9 LYS H H 9 8.015 8.015 7.895 0.120 18935 11351 1 15 . 1 1 10 10 ILE N N 10 120.308 120.308 116.093 4.215 18935 11352 1 15 . 1 1 10 10 ILE C C 10 177.766 177.766 177.422 0.344 18935 11353 1 15 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.988 -0.312 18935 11354 1 15 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.503 -1.190 18935 11355 1 15 . 1 1 10 10 ILE H H 10 7.967 7.967 8.272 -0.305 18935 11356 1 15 . 1 1 11 11 VAL N N 11 119.130 119.130 119.951 -0.821 18935 11357 1 15 . 1 1 11 11 VAL C C 11 176.606 176.606 177.950 -1.344 18935 11358 1 15 . 1 1 11 11 VAL CA C 11 67.640 67.640 67.039 0.601 18935 11359 1 15 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.081 -0.872 18935 11360 1 15 . 1 1 11 11 VAL H H 11 8.128 8.128 7.617 0.511 18935 11361 1 15 . 1 1 12 12 ASN N N 12 115.822 115.822 117.249 -1.427 18935 11362 1 15 . 1 1 12 12 ASN C C 12 177.375 177.375 176.536 0.839 18935 11363 1 15 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.108 -0.138 18935 11364 1 15 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.611 -1.048 18935 11365 1 15 . 1 1 12 12 ASN H H 12 8.203 8.203 7.859 0.344 18935 11366 1 15 . 1 1 13 13 HIS N N 13 117.659 117.659 115.911 1.748 18935 11367 1 15 . 1 1 13 13 HIS C C 13 177.287 177.287 176.360 0.927 18935 11368 1 15 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.115 1.572 18935 11369 1 15 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.463 -0.442 18935 11370 1 15 . 1 1 13 13 HIS H H 13 7.861 7.861 7.901 -0.040 18935 11371 1 15 . 1 1 14 14 LEU N N 14 115.595 115.595 119.142 -3.547 18935 11372 1 15 . 1 1 14 14 LEU C C 14 179.092 179.092 177.638 1.454 18935 11373 1 15 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.395 0.246 18935 11374 1 15 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.831 -1.811 18935 11375 1 15 . 1 1 14 14 LEU H H 14 8.376 8.376 8.340 0.036 18935 11376 1 15 . 1 1 15 15 ARG N N 15 115.006 115.006 118.016 -3.010 18935 11377 1 15 . 1 1 15 15 ARG C C 15 176.265 176.265 176.984 -0.719 18935 11378 1 15 . 1 1 15 15 ARG CA C 15 59.884 59.884 57.433 2.451 18935 11379 1 15 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.544 -0.471 18935 11380 1 15 . 1 1 15 15 ARG H H 15 8.074 8.074 7.962 0.112 18935 11381 1 15 . 1 1 16 16 SER N N 16 107.778 107.778 111.426 -3.648 18935 11382 1 15 . 1 1 16 16 SER C C 16 176.009 176.009 175.024 0.985 18935 11383 1 15 . 1 1 16 16 SER CA C 16 57.244 57.244 58.283 -1.040 18935 11384 1 15 . 1 1 16 16 SER CB C 16 63.525 63.525 63.238 0.287 18935 11385 1 15 . 1 1 16 16 SER H H 16 7.136 7.136 8.118 -0.982 18935 11386 1 15 . 1 1 17 17 ARG N N 17 121.532 121.532 120.001 1.531 18935 11387 1 15 . 1 1 17 17 ARG C C 17 174.482 174.482 175.813 -1.331 18935 11388 1 15 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.575 0.747 18935 11389 1 15 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.183 0.647 18935 11390 1 15 . 1 1 17 17 ARG H H 17 7.913 7.913 7.498 0.415 18935 11391 1 15 . 1 1 18 18 LEU N N 18 121.305 121.305 120.013 1.292 18935 11392 1 15 . 1 1 18 18 LEU C C 18 176.283 176.283 175.878 0.405 18935 11393 1 15 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.123 -0.425 18935 11394 1 15 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.304 -0.249 18935 11395 1 15 . 1 1 18 18 LEU H H 18 8.812 8.812 7.374 1.438 18935 11396 1 15 . 1 1 19 19 ALA N N 19 125.293 125.293 120.740 4.553 18935 11397 1 15 . 1 1 19 19 ALA C C 19 173.780 173.780 175.031 -1.251 18935 11398 1 15 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.879 -1.077 18935 11399 1 15 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.791 1.062 18935 11400 1 15 . 1 1 19 19 ALA H H 19 8.790 8.790 7.899 0.891 18935 11401 1 15 . 1 1 20 20 PHE N N 20 113.117 113.117 115.421 -2.304 18935 11402 1 15 . 1 1 20 20 PHE C C 20 172.708 172.708 173.016 -0.308 18935 11403 1 15 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.299 -0.701 18935 11404 1 15 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.399 -0.674 18935 11405 1 15 . 1 1 20 20 PHE H H 20 8.925 8.925 8.729 0.196 18935 11406 1 15 . 1 1 21 21 GLU N N 21 121.532 121.532 123.628 -2.096 18935 11407 1 15 . 1 1 21 21 GLU C C 21 174.830 174.830 175.329 -0.499 18935 11408 1 15 . 1 1 21 21 GLU CA C 21 54.963 54.963 54.535 0.429 18935 11409 1 15 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.123 -1.780 18935 11410 1 15 . 1 1 21 21 GLU H H 21 7.972 7.972 8.926 -0.954 18935 11411 1 15 . 1 1 22 22 TYR N N 22 125.339 125.339 129.140 -3.801 18935 11412 1 15 . 1 1 22 22 TYR C C 22 174.864 174.864 175.453 -0.589 18935 11413 1 15 . 1 1 22 22 TYR CA C 22 55.288 55.288 56.732 -1.444 18935 11414 1 15 . 1 1 22 22 TYR CB C 22 39.859 39.859 39.830 0.029 18935 11415 1 15 . 1 1 22 22 TYR H H 22 9.016 9.016 8.284 0.732 18935 11416 1 15 . 1 1 23 23 ASN N N 23 127.024 127.024 127.303 -0.279 18935 11417 1 15 . 1 1 23 23 ASN C C 23 175.410 175.410 174.710 0.700 18935 11418 1 15 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.108 -1.054 18935 11419 1 15 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.479 -1.218 18935 11420 1 15 . 1 1 23 23 ASN H H 23 9.181 9.181 9.521 -0.340 18935 11421 1 15 . 1 1 24 24 GLY N N 24 102.755 102.755 103.603 -0.848 18935 11422 1 15 . 1 1 24 24 GLY C C 24 173.626 173.626 174.266 -0.640 18935 11423 1 15 . 1 1 24 24 GLY CA C 24 44.935 44.935 44.971 -0.036 18935 11424 1 15 . 1 1 24 24 GLY H H 24 8.666 8.666 8.271 0.395 18935 11425 1 15 . 1 1 25 25 GLN N N 25 118.722 118.722 119.806 -1.084 18935 11426 1 15 . 1 1 25 25 GLN C C 25 173.657 173.657 174.926 -1.269 18935 11427 1 15 . 1 1 25 25 GLN CA C 25 53.233 53.233 55.414 -2.181 18935 11428 1 15 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.346 0.459 18935 11429 1 15 . 1 1 25 25 GLN H H 25 7.708 7.708 8.039 -0.331 18935 11430 1 15 . 1 1 26 26 LEU N N 26 123.526 123.526 120.820 2.706 18935 11431 1 15 . 1 1 26 26 LEU C C 26 175.842 175.842 176.348 -0.506 18935 11432 1 15 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.848 0.138 18935 11433 1 15 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.240 -2.433 18935 11434 1 15 . 1 1 26 26 LEU H H 26 8.543 8.543 8.346 0.197 18935 11435 1 15 . 1 1 27 27 ILE N N 27 129.462 129.462 124.573 4.889 18935 11436 1 15 . 1 1 27 27 ILE C C 27 175.085 175.085 174.152 0.933 18935 11437 1 15 . 1 1 27 27 ILE CA C 27 58.973 58.973 59.727 -0.754 18935 11438 1 15 . 1 1 27 27 ILE CB C 27 35.552 35.552 39.910 -4.358 18935 11439 1 15 . 1 1 27 27 ILE H H 27 8.989 8.989 8.859 0.130 18935 11440 1 15 . 1 1 28 28 LYS N N 28 125.157 125.157 127.434 -2.277 18935 11441 1 15 . 1 1 28 28 LYS C C 28 176.725 176.725 175.215 1.510 18935 11442 1 15 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.441 1.369 18935 11443 1 15 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.279 -1.462 18935 11444 1 15 . 1 1 28 28 LYS H H 28 8.311 8.311 8.281 0.030 18935 11445 1 15 . 1 1 29 29 ILE N N 29 125.565 125.565 118.783 6.782 18935 11446 1 15 . 1 1 29 29 ILE C C 29 175.685 175.685 174.203 1.482 18935 11447 1 15 . 1 1 29 29 ILE CA C 29 60.405 60.405 60.178 0.227 18935 11448 1 15 . 1 1 29 29 ILE CB C 29 37.031 37.031 39.741 -2.710 18935 11449 1 15 . 1 1 29 29 ILE H H 29 8.209 8.209 7.695 0.514 18935 11450 1 15 . 1 1 30 30 LEU N N 30 127.831 127.831 121.770 6.061 18935 11451 1 15 . 1 1 30 30 LEU C C 30 178.794 178.794 177.221 1.573 18935 11452 1 15 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.572 0.871 18935 11453 1 15 . 1 1 30 30 LEU CB C 30 40.836 40.836 44.718 -3.882 18935 11454 1 15 . 1 1 30 30 LEU H H 30 9.027 9.027 8.460 0.567 18935 11455 1 15 . 1 1 31 31 SER N N 31 116.864 116.864 115.451 1.413 18935 11456 1 15 . 1 1 31 31 SER C C 31 177.464 177.464 175.471 1.993 18935 11457 1 15 . 1 1 31 31 SER CA C 31 61.180 61.180 60.759 0.421 18935 11458 1 15 . 1 1 31 31 SER CB C 31 62.105 62.105 63.212 -1.107 18935 11459 1 15 . 1 1 31 31 SER H H 31 8.887 8.887 8.448 0.439 18935 11460 1 15 . 1 1 32 32 LYS N N 32 114.825 114.825 118.827 -4.002 18935 11461 1 15 . 1 1 32 32 LYS C C 32 176.243 176.243 175.787 0.456 18935 11462 1 15 . 1 1 32 32 LYS CA C 32 57.292 57.292 57.104 0.188 18935 11463 1 15 . 1 1 32 32 LYS CB C 32 30.266 30.266 30.923 -0.657 18935 11464 1 15 . 1 1 32 32 LYS H H 32 8.290 8.290 8.360 -0.070 18935 11465 1 15 . 1 1 33 33 ASN N N 33 117.564 117.564 113.871 3.693 18935 11466 1 15 . 1 1 33 33 ASN C C 33 172.253 172.253 173.473 -1.220 18935 11467 1 15 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.325 -1.234 18935 11468 1 15 . 1 1 33 33 ASN CB C 33 38.339 38.339 42.020 -3.682 18935 11469 1 15 . 1 1 33 33 ASN H H 33 8.051 8.051 8.158 -0.107 18935 11470 1 15 . 1 1 34 34 ILE N N 34 118.949 118.949 121.012 -2.063 18935 11471 1 15 . 1 1 34 34 ILE C C 34 175.343 175.343 175.289 0.054 18935 11472 1 15 . 1 1 34 34 ILE CA C 34 60.553 60.553 59.205 1.348 18935 11473 1 15 . 1 1 34 34 ILE CB C 34 38.867 38.867 39.106 -0.239 18935 11474 1 15 . 1 1 34 34 ILE H H 34 7.670 7.670 8.030 -0.360 18935 11475 1 15 . 1 1 35 35 VAL N N 35 128.355 128.355 125.295 3.060 18935 11476 1 15 . 1 1 35 35 VAL C C 35 175.543 175.543 174.671 0.872 18935 11477 1 15 . 1 1 35 35 VAL CA C 35 60.014 60.014 59.745 0.269 18935 11478 1 15 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.507 -1.276 18935 11479 1 15 . 1 1 35 35 VAL H H 35 9.698 9.698 9.226 0.472 18935 11480 1 15 . 1 1 36 36 ALA N N 36 129.553 129.553 131.550 -1.997 18935 11481 1 15 . 1 1 36 36 ALA C C 36 177.015 177.015 176.704 0.311 18935 11482 1 15 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.416 0.980 18935 11483 1 15 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.030 -0.408 18935 11484 1 15 . 1 1 36 36 ALA H H 36 8.917 8.917 8.581 0.336 18935 11485 1 15 . 1 1 37 37 VAL N N 37 115.006 115.006 118.468 -3.462 18935 11486 1 15 . 1 1 37 37 VAL C C 37 174.649 174.649 176.333 -1.684 18935 11487 1 15 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.269 0.052 18935 11488 1 15 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.907 -1.521 18935 11489 1 15 . 1 1 37 37 VAL H H 37 8.214 8.214 7.518 0.696 18935 11490 1 15 . 1 1 38 38 GLY N N 38 109.387 109.387 107.971 1.416 18935 11491 1 15 . 1 1 38 38 GLY C C 38 174.152 174.152 175.641 -1.489 18935 11492 1 15 . 1 1 38 38 GLY CA C 38 45.497 45.497 46.120 -0.623 18935 11493 1 15 . 1 1 38 38 GLY H H 38 8.677 8.677 7.881 0.796 18935 11494 1 15 . 1 1 39 39 SER N N 39 116.776 116.776 119.433 -2.657 18935 11495 1 15 . 1 1 39 39 SER C C 39 175.129 175.129 176.556 -1.427 18935 11496 1 15 . 1 1 39 39 SER CA C 39 60.036 60.036 61.430 -1.394 18935 11497 1 15 . 1 1 39 39 SER CB C 39 61.522 61.522 63.109 -1.587 18935 11498 1 15 . 1 1 39 39 SER H H 39 9.705 9.705 8.431 1.274 18935 11499 1 15 . 1 1 40 40 LEU N N 40 113.696 113.696 120.793 -7.097 18935 11500 1 15 . 1 1 40 40 LEU C C 40 180.558 180.558 178.408 2.150 18935 11501 1 15 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.094 1.279 18935 11502 1 15 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.079 0.798 18935 11503 1 15 . 1 1 40 40 LEU H H 40 7.311 7.311 7.578 -0.267 18935 11504 1 15 . 1 1 41 41 ARG N N 41 121.162 121.162 115.542 5.620 18935 11505 1 15 . 1 1 41 41 ARG C C 41 176.964 176.964 177.568 -0.604 18935 11506 1 15 . 1 1 41 41 ARG CA C 41 58.451 58.451 57.278 1.173 18935 11507 1 15 . 1 1 41 41 ARG CB C 41 28.205 28.205 31.037 -2.832 18935 11508 1 15 . 1 1 41 41 ARG H H 41 6.999 6.999 7.762 -0.763 18935 11509 1 15 . 1 1 42 42 ARG N N 42 111.109 111.109 118.086 -6.977 18935 11510 1 15 . 1 1 42 42 ARG C C 42 172.564 172.564 176.475 -3.911 18935 11511 1 15 . 1 1 42 42 ARG CA C 42 56.380 56.380 57.838 -1.458 18935 11512 1 15 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.906 -2.557 18935 11513 1 15 . 1 1 42 42 ARG H H 42 7.041 7.041 7.648 -0.607 18935 11514 1 15 . 1 1 43 43 GLU N N 43 111.924 111.924 114.103 -2.179 18935 11515 1 15 . 1 1 43 43 GLU C C 43 176.202 176.202 175.021 1.181 18935 11516 1 15 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.341 -0.887 18935 11517 1 15 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.083 -1.782 18935 11518 1 15 . 1 1 43 43 GLU H H 43 7.757 7.757 8.097 -0.340 18935 11519 1 15 . 1 1 44 44 GLU N N 44 117.861 117.861 119.027 -1.166 18935 11520 1 15 . 1 1 44 44 GLU C C 44 175.197 175.197 176.483 -1.286 18935 11521 1 15 . 1 1 44 44 GLU CA C 44 56.128 56.128 57.267 -1.139 18935 11522 1 15 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.477 -1.917 18935 11523 1 15 . 1 1 44 44 GLU H H 44 7.461 7.461 7.593 -0.132 18935 11524 1 15 . 1 1 45 45 LYS N N 45 115.051 115.051 118.259 -3.208 18935 11525 1 15 . 1 1 45 45 LYS C C 45 177.733 177.733 176.100 1.633 18935 11526 1 15 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.558 1.497 18935 11527 1 15 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.265 -1.238 18935 11528 1 15 . 1 1 45 45 LYS H H 45 8.123 8.123 8.552 -0.429 18935 11529 1 15 . 1 1 46 46 MET N N 46 114.009 114.009 118.396 -4.387 18935 11530 1 15 . 1 1 46 46 MET C C 46 174.067 174.067 174.331 -0.264 18935 11531 1 15 . 1 1 46 46 MET CA C 46 52.477 52.477 54.837 -2.360 18935 11532 1 15 . 1 1 46 46 MET CB C 46 33.974 33.974 34.965 -0.991 18935 11533 1 15 . 1 1 46 46 MET H H 46 7.767 7.767 7.501 0.266 18935 11534 1 15 . 1 1 47 47 LEU N N 47 120.263 120.263 122.307 -2.044 18935 11535 1 15 . 1 1 47 47 LEU C C 47 177.669 177.669 175.207 2.462 18935 11536 1 15 . 1 1 47 47 LEU CA C 47 52.201 52.201 52.715 -0.514 18935 11537 1 15 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.294 -0.385 18935 11538 1 15 . 1 1 47 47 LEU H H 47 9.481 9.481 8.143 1.338 18935 11539 1 15 . 1 1 48 48 ASN N N 48 118.632 118.632 116.605 2.027 18935 11540 1 15 . 1 1 48 48 ASN C C 48 174.715 174.715 173.737 0.978 18935 11541 1 15 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.152 2.349 18935 11542 1 15 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.231 -1.403 18935 11543 1 15 . 1 1 48 48 ASN H H 48 9.388 9.388 8.765 0.623 18935 11544 1 15 . 1 1 49 49 ASP N N 49 115.867 115.867 113.618 2.249 18935 11545 1 15 . 1 1 49 49 ASP C C 49 174.111 174.111 173.785 0.326 18935 11546 1 15 . 1 1 49 49 ASP CA C 49 51.201 51.201 53.396 -2.195 18935 11547 1 15 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.326 -3.249 18935 11548 1 15 . 1 1 49 49 ASP H H 49 7.670 7.670 7.568 0.102 18935 11549 1 15 . 1 1 50 50 VAL N N 50 119.185 119.185 118.818 0.367 18935 11550 1 15 . 1 1 50 50 VAL C C 50 172.333 172.333 174.296 -1.963 18935 11551 1 15 . 1 1 50 50 VAL CA C 50 61.915 61.915 60.732 1.183 18935 11552 1 15 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.756 -1.791 18935 11553 1 15 . 1 1 50 50 VAL H H 50 8.339 8.339 7.908 0.431 18935 11554 1 15 . 1 1 51 51 ASP N N 51 124.704 124.704 126.413 -1.709 18935 11555 1 15 . 1 1 51 51 ASP C C 51 173.725 173.725 174.986 -1.261 18935 11556 1 15 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.258 -0.230 18935 11557 1 15 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.784 0.045 18935 11558 1 15 . 1 1 51 51 ASP H H 51 8.984 8.984 8.443 0.541 18935 11559 1 15 . 1 1 52 52 LEU N N 52 120.943 120.943 122.121 -1.178 18935 11560 1 15 . 1 1 52 52 LEU C C 52 173.045 173.045 174.230 -1.185 18935 11561 1 15 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.678 -0.807 18935 11562 1 15 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.126 -1.873 18935 11563 1 15 . 1 1 52 52 LEU H H 52 9.081 9.081 8.173 0.908 18935 11564 1 15 . 1 1 53 53 LEU N N 53 123.027 123.027 124.685 -1.658 18935 11565 1 15 . 1 1 53 53 LEU C C 53 173.750 173.750 175.095 -1.345 18935 11566 1 15 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.560 -1.227 18935 11567 1 15 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.456 -0.448 18935 11568 1 15 . 1 1 53 53 LEU H H 53 9.146 9.146 9.093 0.053 18935 11569 1 15 . 1 1 54 54 ILE N N 54 126.562 126.562 125.584 0.978 18935 11570 1 15 . 1 1 54 54 ILE C C 54 175.132 175.132 175.370 -0.238 18935 11571 1 15 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.840 -1.242 18935 11572 1 15 . 1 1 54 54 ILE CB C 54 38.561 38.561 40.146 -1.585 18935 11573 1 15 . 1 1 54 54 ILE H H 54 9.440 9.440 9.190 0.250 18935 11574 1 15 . 1 1 55 55 ILE N N 55 126.879 126.879 127.790 -0.911 18935 11575 1 15 . 1 1 55 55 ILE C C 55 175.655 175.655 175.235 0.420 18935 11576 1 15 . 1 1 55 55 ILE CA C 55 57.561 57.561 59.798 -2.237 18935 11577 1 15 . 1 1 55 55 ILE CB C 55 34.306 34.306 40.464 -6.158 18935 11578 1 15 . 1 1 55 55 ILE H H 55 9.381 9.381 7.983 1.398 18935 11579 1 15 . 1 1 56 56 VAL N N 56 128.936 128.936 123.586 5.350 18935 11580 1 15 . 1 1 56 56 VAL C C 56 176.389 176.389 174.405 1.984 18935 11581 1 15 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.905 -0.275 18935 11582 1 15 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.207 -0.423 18935 11583 1 15 . 1 1 56 56 VAL H H 56 9.227 9.227 8.646 0.581 18935 11584 1 15 . 1 1 58 58 GLU N N 58 112.423 112.423 117.447 -5.024 18935 11585 1 15 . 1 1 58 58 GLU C C 58 175.946 175.946 176.476 -0.530 18935 11586 1 15 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.455 -1.155 18935 11587 1 15 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.379 0.718 18935 11588 1 15 . 1 1 58 58 GLU H H 58 6.685 6.685 8.247 -1.562 18935 11589 1 15 . 1 1 59 59 LYS N N 59 125.293 125.293 119.702 5.591 18935 11590 1 15 . 1 1 59 59 LYS C C 59 179.248 179.248 176.361 2.887 18935 11591 1 15 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.099 2.675 18935 11592 1 15 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.437 -1.360 18935 11593 1 15 . 1 1 59 59 LYS H H 59 9.108 9.108 8.529 0.579 18935 11594 1 15 . 1 1 60 60 LYS N N 60 117.408 117.408 116.800 0.608 18935 11595 1 15 . 1 1 60 60 LYS C C 60 177.198 177.198 177.960 -0.762 18935 11596 1 15 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.658 1.555 18935 11597 1 15 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.794 -2.211 18935 11598 1 15 . 1 1 60 60 LYS H H 60 9.102 9.102 7.578 1.524 18935 11599 1 15 . 1 1 61 61 LEU N N 61 114.779 114.779 121.283 -6.504 18935 11600 1 15 . 1 1 61 61 LEU C C 61 178.790 178.790 178.728 0.062 18935 11601 1 15 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.454 -2.430 18935 11602 1 15 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.443 -0.579 18935 11603 1 15 . 1 1 61 61 LEU H H 61 7.455 7.455 8.360 -0.905 18935 11604 1 15 . 1 1 62 62 LEU N N 62 119.629 119.629 118.439 1.190 18935 11605 1 15 . 1 1 62 62 LEU C C 62 177.762 177.762 177.930 -0.168 18935 11606 1 15 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.941 0.257 18935 11607 1 15 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.865 -1.134 18935 11608 1 15 . 1 1 62 62 LEU H H 62 7.714 7.714 7.510 0.204 18935 11609 1 15 . 1 1 63 63 LYS N N 63 112.921 112.921 116.445 -3.524 18935 11610 1 15 . 1 1 63 63 LYS C C 63 175.386 175.386 177.549 -2.163 18935 11611 1 15 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.202 0.154 18935 11612 1 15 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.439 -1.476 18935 11613 1 15 . 1 1 63 63 LYS H H 63 7.751 7.751 8.206 -0.455 18935 11614 1 15 . 1 1 64 64 HIS N N 64 112.468 112.468 117.288 -4.820 18935 11615 1 15 . 1 1 64 64 HIS C C 64 176.081 176.081 176.500 -0.419 18935 11616 1 15 . 1 1 64 64 HIS CA C 64 55.769 55.769 58.295 -2.526 18935 11617 1 15 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.638 0.732 18935 11618 1 15 . 1 1 64 64 HIS H H 64 7.697 7.697 7.713 -0.016 18935 11619 1 15 . 1 1 65 65 VAL N N 65 117.499 117.499 119.334 -1.835 18935 11620 1 15 . 1 1 65 65 VAL C C 65 174.301 174.301 176.617 -2.316 18935 11621 1 15 . 1 1 65 65 VAL CA C 65 66.330 66.330 64.496 1.834 18935 11622 1 15 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.555 -2.195 18935 11623 1 15 . 1 1 65 65 VAL H H 65 6.917 6.917 7.295 -0.378 18935 11624 1 15 . 1 1 66 66 LEU N N 66 113.873 113.873 118.566 -4.693 18935 11625 1 15 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.107 0.743 18935 11626 1 15 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.104 -3.046 18935 11627 1 15 . 1 1 66 66 LEU H H 66 9.102 9.102 7.880 1.222 18935 11628 1 15 . 1 1 68 68 ASN N N 68 110.792 110.792 116.881 -6.089 18935 11629 1 15 . 1 1 68 68 ASN C C 68 174.877 174.877 173.429 1.448 18935 11630 1 15 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.496 -1.681 18935 11631 1 15 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.091 -0.780 18935 11632 1 15 . 1 1 68 68 ASN H H 68 7.234 7.234 8.295 -1.061 18935 11633 1 15 . 1 1 69 69 ILE N N 69 122.348 122.348 124.861 -2.513 18935 11634 1 15 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.075 -0.163 18935 11635 1 15 . 1 1 69 69 ILE CB C 69 38.038 38.038 41.221 -3.183 18935 11636 1 15 . 1 1 69 69 ILE H H 69 7.428 7.428 8.688 -1.260 18935 11637 1 15 . 1 1 70 70 ARG N N 70 125.701 125.701 126.096 -0.395 18935 11638 1 15 . 1 1 70 70 ARG C C 70 174.596 174.596 173.469 1.127 18935 11639 1 15 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.702 -1.541 18935 11640 1 15 . 1 1 70 70 ARG CB C 70 32.453 32.453 33.212 -0.759 18935 11641 1 15 . 1 1 70 70 ARG H H 70 9.083 9.083 8.917 0.166 18935 11642 1 15 . 1 1 71 71 ILE N N 71 118.496 118.496 118.180 0.316 18935 11643 1 15 . 1 1 71 71 ILE C C 71 175.625 175.625 176.240 -0.615 18935 11644 1 15 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.347 0.429 18935 11645 1 15 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.468 -2.501 18935 11646 1 15 . 1 1 71 71 ILE H H 71 7.864 7.864 7.769 0.095 18935 11647 1 15 . 1 1 72 72 LYS N N 72 127.423 127.423 123.470 3.953 18935 11648 1 15 . 1 1 72 72 LYS C C 72 177.659 177.659 177.070 0.589 18935 11649 1 15 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.819 1.609 18935 11650 1 15 . 1 1 72 72 LYS CB C 72 31.374 31.374 31.563 -0.189 18935 11651 1 15 . 1 1 72 72 LYS H H 72 8.720 8.720 8.715 0.005 18935 11652 1 15 . 1 1 73 73 GLY N N 73 112.604 112.604 113.239 -0.635 18935 11653 1 15 . 1 1 73 73 GLY C C 73 173.729 173.729 173.873 -0.144 18935 11654 1 15 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.787 0.044 18935 11655 1 15 . 1 1 73 73 GLY H H 73 8.930 8.930 8.859 0.071 18935 11656 1 15 . 1 1 74 74 LEU N N 74 119.538 119.538 119.547 -0.009 18935 11657 1 15 . 1 1 74 74 LEU C C 74 175.802 175.802 175.785 0.017 18935 11658 1 15 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.288 0.373 18935 11659 1 15 . 1 1 74 74 LEU CB C 74 44.053 44.053 45.093 -1.040 18935 11660 1 15 . 1 1 74 74 LEU H H 74 7.547 7.547 8.111 -0.564 18935 11661 1 15 . 1 1 75 75 SER N N 75 118.994 118.994 116.988 2.006 18935 11662 1 15 . 1 1 75 75 SER C C 75 173.111 173.111 173.115 -0.004 18935 11663 1 15 . 1 1 75 75 SER CA C 75 57.696 57.696 57.831 -0.135 18935 11664 1 15 . 1 1 75 75 SER CB C 75 63.073 63.073 64.062 -0.989 18935 11665 1 15 . 1 1 75 75 SER H H 75 9.076 9.076 8.876 0.200 18935 11666 1 15 . 1 1 76 76 PHE N N 76 117.802 117.802 121.122 -3.320 18935 11667 1 15 . 1 1 76 76 PHE C C 76 173.564 173.564 174.328 -0.764 18935 11668 1 15 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.601 -1.192 18935 11669 1 15 . 1 1 76 76 PHE CB C 76 41.843 41.843 41.865 -0.022 18935 11670 1 15 . 1 1 76 76 PHE H H 76 8.119 8.119 8.110 0.009 18935 11671 1 15 . 1 1 77 77 SER N N 77 113.918 113.918 118.247 -4.329 18935 11672 1 15 . 1 1 77 77 SER C C 77 173.194 173.194 173.278 -0.084 18935 11673 1 15 . 1 1 77 77 SER CA C 77 55.999 55.999 57.110 -1.111 18935 11674 1 15 . 1 1 77 77 SER CB C 77 65.218 65.218 64.984 0.234 18935 11675 1 15 . 1 1 77 77 SER H H 77 8.989 8.989 8.452 0.537 18935 11676 1 15 . 1 1 78 78 VAL N N 78 123.662 123.662 126.057 -2.395 18935 11677 1 15 . 1 1 78 78 VAL C C 78 176.057 176.057 176.008 0.049 18935 11678 1 15 . 1 1 78 78 VAL CA C 78 62.091 62.091 61.965 0.126 18935 11679 1 15 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.331 0.963 18935 11680 1 15 . 1 1 78 78 VAL H H 78 8.995 8.995 8.778 0.217 18935 11681 1 15 . 1 1 79 79 LYS N N 79 129.417 129.417 129.042 0.375 18935 11682 1 15 . 1 1 79 79 LYS C C 79 176.436 176.436 174.819 1.617 18935 11683 1 15 . 1 1 79 79 LYS CA C 79 57.652 57.652 53.806 3.846 18935 11684 1 15 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.481 -4.008 18935 11685 1 15 . 1 1 79 79 LYS H H 79 9.425 9.425 8.898 0.527 18935 11686 1 15 . 1 1 80 80 VAL N N 80 108.616 108.616 121.724 -13.108 18935 11687 1 15 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.359 -2.262 18935 11688 1 15 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.091 0.991 18935 11689 1 15 . 1 1 80 80 VAL H H 80 7.380 7.380 8.463 -1.083 18935 11690 1 15 . 1 1 81 81 CYS N N 81 123.254 123.254 128.098 -4.844 18935 11691 1 15 . 1 1 81 81 CYS C C 81 172.053 172.053 173.881 -1.828 18935 11692 1 15 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.811 1.928 18935 11693 1 15 . 1 1 81 81 CYS CB C 81 27.332 27.332 29.881 -2.549 18935 11694 1 15 . 1 1 81 81 CYS H H 81 9.759 9.759 8.730 1.029 18935 11695 1 15 . 1 1 82 82 GLY N N 82 118.450 118.450 116.561 1.889 18935 11696 1 15 . 1 1 82 82 GLY C C 82 171.814 171.814 174.789 -2.975 18935 11697 1 15 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.563 -2.210 18935 11698 1 15 . 1 1 82 82 GLY H H 82 8.537 8.537 8.718 -0.181 18935 11699 1 15 . 1 1 83 83 GLU N N 83 113.964 113.964 120.722 -6.758 18935 11700 1 15 . 1 1 83 83 GLU C C 83 179.320 179.320 177.735 1.585 18935 11701 1 15 . 1 1 83 83 GLU CA C 83 57.675 57.675 56.728 0.947 18935 11702 1 15 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.218 -0.311 18935 11703 1 15 . 1 1 83 83 GLU H H 83 8.473 8.473 8.766 -0.293 18935 11704 1 15 . 1 1 84 84 ARG N N 84 117.544 117.544 118.594 -1.050 18935 11705 1 15 . 1 1 84 84 ARG C C 84 177.252 177.252 176.002 1.250 18935 11706 1 15 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.166 -0.662 18935 11707 1 15 . 1 1 84 84 ARG CB C 84 31.546 31.546 30.775 0.771 18935 11708 1 15 . 1 1 84 84 ARG H H 84 9.760 9.760 8.212 1.548 18935 11709 1 15 . 1 1 85 85 LYS N N 85 124.160 124.160 120.956 3.204 18935 11710 1 15 . 1 1 85 85 LYS C C 85 173.379 173.379 175.580 -2.201 18935 11711 1 15 . 1 1 85 85 LYS CA C 85 55.232 55.232 57.075 -1.843 18935 11712 1 15 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.524 -0.312 18935 11713 1 15 . 1 1 85 85 LYS H H 85 8.494 8.494 7.718 0.776 18935 11714 1 15 . 1 1 86 86 CYS N N 86 126.472 126.472 121.078 5.394 18935 11715 1 15 . 1 1 86 86 CYS C C 86 171.935 171.935 173.320 -1.385 18935 11716 1 15 . 1 1 86 86 CYS CA C 86 55.878 55.878 58.067 -2.189 18935 11717 1 15 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.497 -0.193 18935 11718 1 15 . 1 1 86 86 CYS H H 86 9.221 9.221 8.444 0.777 18935 11719 1 15 . 1 1 87 87 VAL N N 87 126.426 126.426 124.867 1.559 18935 11720 1 15 . 1 1 87 87 VAL C C 87 173.760 173.760 174.156 -0.396 18935 11721 1 15 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.376 -0.043 18935 11722 1 15 . 1 1 87 87 VAL CB C 87 33.338 33.338 33.121 0.217 18935 11723 1 15 . 1 1 87 87 VAL H H 87 8.623 8.623 8.868 -0.245 18935 11724 1 15 . 1 1 88 88 LEU N N 88 125.701 125.701 127.877 -2.176 18935 11725 1 15 . 1 1 88 88 LEU C C 88 175.424 175.424 175.305 0.119 18935 11726 1 15 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.079 -0.994 18935 11727 1 15 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.404 -1.860 18935 11728 1 15 . 1 1 88 88 LEU H H 88 9.592 9.592 8.967 0.625 18935 11729 1 15 . 1 1 89 89 PHE N N 89 118.314 118.314 123.225 -4.911 18935 11730 1 15 . 1 1 89 89 PHE C C 89 177.068 177.068 176.030 1.038 18935 11731 1 15 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.576 -0.701 18935 11732 1 15 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.112 -0.275 18935 11733 1 15 . 1 1 89 89 PHE H H 89 8.979 8.979 8.774 0.205 18935 11734 1 15 . 1 1 90 90 ILE N N 90 119.039 119.039 119.793 -0.754 18935 11735 1 15 . 1 1 90 90 ILE C C 90 173.692 173.692 175.223 -1.531 18935 11736 1 15 . 1 1 90 90 ILE CA C 90 58.672 58.672 60.139 -1.467 18935 11737 1 15 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.297 0.886 18935 11738 1 15 . 1 1 90 90 ILE H H 90 9.447 9.447 8.361 1.086 18935 11739 1 15 . 1 1 91 91 GLU N N 91 122.801 122.801 125.533 -2.732 18935 11740 1 15 . 1 1 91 91 GLU C C 91 175.565 175.565 175.297 0.268 18935 11741 1 15 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.224 -0.759 18935 11742 1 15 . 1 1 91 91 GLU CB C 91 29.662 29.662 32.224 -2.562 18935 11743 1 15 . 1 1 91 91 GLU H H 91 8.360 8.360 8.361 -0.001 18935 11744 1 15 . 1 1 92 92 TRP N N 92 126.018 126.018 120.098 5.920 18935 11745 1 15 . 1 1 92 92 TRP C C 92 175.070 175.070 175.180 -0.110 18935 11746 1 15 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.475 -0.285 18935 11747 1 15 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.193 -0.611 18935 11748 1 15 . 1 1 92 92 TRP H H 92 9.425 9.425 8.329 1.096 18935 11749 1 15 . 1 1 93 93 GLU N N 93 126.381 126.381 121.269 5.112 18935 11750 1 15 . 1 1 93 93 GLU C C 93 175.637 175.637 175.742 -0.105 18935 11751 1 15 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.859 -1.090 18935 11752 1 15 . 1 1 93 93 GLU CB C 93 25.944 25.944 27.988 -2.044 18935 11753 1 15 . 1 1 93 93 GLU H H 93 8.914 8.914 9.228 -0.314 18935 11754 1 15 . 1 1 94 94 LYS N N 94 107.891 107.891 111.251 -3.360 18935 11755 1 15 . 1 1 94 94 LYS C C 94 175.359 175.359 175.743 -0.384 18935 11756 1 15 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.104 0.325 18935 11757 1 15 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.934 -2.292 18935 11758 1 15 . 1 1 94 94 LYS H H 94 8.634 8.634 8.496 0.138 18935 11759 1 15 . 1 1 95 95 LYS N N 95 120.490 120.490 118.556 1.934 18935 11760 1 15 . 1 1 95 95 LYS C C 95 174.369 174.369 174.107 0.262 18935 11761 1 15 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.083 0.270 18935 11762 1 15 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.836 -1.373 18935 11763 1 15 . 1 1 95 95 LYS H H 95 7.924 7.924 7.601 0.323 18935 11764 1 15 . 1 1 96 96 THR N N 96 115.278 115.278 112.554 2.724 18935 11765 1 15 . 1 1 96 96 THR C C 96 174.317 174.317 173.353 0.964 18935 11766 1 15 . 1 1 96 96 THR CA C 96 61.203 61.203 60.300 0.903 18935 11767 1 15 . 1 1 96 96 THR CB C 96 69.348 69.348 69.294 0.054 18935 11768 1 15 . 1 1 96 96 THR H H 96 7.967 7.967 7.762 0.205 18935 11769 1 15 . 1 1 97 97 TYR N N 97 123.254 123.254 125.795 -2.541 18935 11770 1 15 . 1 1 97 97 TYR C C 97 173.320 173.320 174.779 -1.459 18935 11771 1 15 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.144 -0.260 18935 11772 1 15 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.719 -0.583 18935 11773 1 15 . 1 1 97 97 TYR H H 97 9.232 9.232 8.996 0.236 18935 11774 1 15 . 1 1 98 98 GLN N N 98 122.574 122.574 118.588 3.986 18935 11775 1 15 . 1 1 98 98 GLN C C 98 172.781 172.781 174.753 -1.972 18935 11776 1 15 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.091 0.080 18935 11777 1 15 . 1 1 98 98 GLN CB C 98 28.399 28.399 29.935 -1.536 18935 11778 1 15 . 1 1 98 98 GLN H H 98 9.000 9.000 8.806 0.194 18935 11779 1 15 . 1 1 99 99 LEU N N 99 130.218 130.218 125.411 4.807 18935 11780 1 15 . 1 1 99 99 LEU C C 99 172.806 172.806 174.229 -1.423 18935 11781 1 15 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.862 -1.812 18935 11782 1 15 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.441 -0.690 18935 11783 1 15 . 1 1 99 99 LEU H H 99 9.246 9.246 9.030 0.216 18935 11784 1 15 . 1 1 100 100 ASP N N 100 124.931 124.931 126.621 -1.690 18935 11785 1 15 . 1 1 100 100 ASP C C 100 172.626 172.626 174.470 -1.844 18935 11786 1 15 . 1 1 100 100 ASP CA C 100 50.430 50.430 52.905 -2.475 18935 11787 1 15 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.510 -6.182 18935 11788 1 15 . 1 1 100 100 ASP H H 100 9.253 9.253 8.307 0.946 18935 11789 1 15 . 1 1 101 101 LEU N N 101 119.402 119.402 120.103 -0.701 18935 11790 1 15 . 1 1 101 101 LEU C C 101 173.869 173.869 174.488 -0.619 18935 11791 1 15 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.608 -0.953 18935 11792 1 15 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.628 0.538 18935 11793 1 15 . 1 1 101 101 LEU H H 101 8.726 8.726 7.775 0.951 18935 11794 1 15 . 1 1 102 102 PHE N N 102 117.952 117.952 118.056 -0.104 18935 11795 1 15 . 1 1 102 102 PHE C C 102 175.853 175.853 175.697 0.156 18935 11796 1 15 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.586 -2.304 18935 11797 1 15 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.737 1.087 18935 11798 1 15 . 1 1 102 102 PHE H H 102 8.236 8.236 8.657 -0.421 18935 11799 1 15 . 1 1 103 103 THR N N 103 106.853 106.853 119.726 -12.873 18935 11800 1 15 . 1 1 103 103 THR C C 103 175.154 175.154 174.062 1.092 18935 11801 1 15 . 1 1 103 103 THR CA C 103 57.685 57.685 60.589 -2.904 18935 11802 1 15 . 1 1 103 103 THR CB C 103 71.037 71.037 68.964 2.073 18935 11803 1 15 . 1 1 103 103 THR H H 103 7.917 7.917 8.264 -0.347 18935 11804 1 15 . 1 1 104 104 ALA N N 104 122.348 122.348 128.821 -6.473 18935 11805 1 15 . 1 1 104 104 ALA C C 104 175.947 175.947 174.634 1.313 18935 11806 1 15 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.514 -0.707 18935 11807 1 15 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.348 0.080 18935 11808 1 15 . 1 1 104 104 ALA H H 104 8.930 8.930 8.681 0.249 18935 11809 1 15 . 1 1 105 105 LEU N N 105 119.855 119.855 118.962 0.893 18935 11810 1 15 . 1 1 105 105 LEU C C 105 179.628 179.628 179.022 0.606 18935 11811 1 15 . 1 1 105 105 LEU CA C 105 53.123 53.123 53.778 -0.655 18935 11812 1 15 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.545 -2.211 18935 11813 1 15 . 1 1 105 105 LEU H H 105 8.316 8.316 8.855 -0.539 18935 11814 1 15 . 1 1 106 106 ALA N N 106 123.662 123.662 124.302 -0.640 18935 11815 1 15 . 1 1 106 106 ALA C C 106 181.056 181.056 177.884 3.172 18935 11816 1 15 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.248 1.101 18935 11817 1 15 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.630 -1.315 18935 11818 1 15 . 1 1 106 106 ALA H H 106 8.306 8.306 8.665 -0.359 18935 11819 1 15 . 1 1 107 107 GLU N N 107 114.825 114.825 114.398 0.427 18935 11820 1 15 . 1 1 107 107 GLU C C 107 177.854 177.854 176.994 0.860 18935 11821 1 15 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.752 0.634 18935 11822 1 15 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.981 -1.137 18935 11823 1 15 . 1 1 107 107 GLU H H 107 9.754 9.754 8.618 1.136 18935 11824 1 15 . 1 1 108 108 GLU N N 108 115.097 115.097 119.593 -4.496 18935 11825 1 15 . 1 1 108 108 GLU C C 108 178.001 178.001 177.801 0.200 18935 11826 1 15 . 1 1 108 108 GLU CA C 108 54.926 54.926 57.047 -2.121 18935 11827 1 15 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.518 0.482 18935 11828 1 15 . 1 1 108 108 GLU H H 108 7.859 7.859 7.752 0.107 18935 11829 1 15 . 1 1 109 109 LYS N N 109 118.360 118.360 121.535 -3.175 18935 11830 1 15 . 1 1 109 109 LYS C C 109 172.691 172.691 175.952 -3.261 18935 11831 1 15 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.789 1.113 18935 11832 1 15 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.971 -0.430 18935 11833 1 15 . 1 1 109 109 LYS H H 109 7.660 7.660 7.541 0.119 18935 11834 1 15 . 1 1 111 111 TYR N N 111 114.054 114.054 118.532 -4.478 18935 11835 1 15 . 1 1 111 111 TYR C C 111 179.764 179.764 178.515 1.249 18935 11836 1 15 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.767 -1.768 18935 11837 1 15 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.331 -1.375 18935 11838 1 15 . 1 1 111 111 TYR H H 111 6.583 6.583 8.331 -1.748 18935 11839 1 15 . 1 1 112 112 ALA N N 112 124.749 124.749 122.958 1.791 18935 11840 1 15 . 1 1 112 112 ALA C C 112 179.430 179.430 179.452 -0.022 18935 11841 1 15 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.390 0.579 18935 11842 1 15 . 1 1 112 112 ALA CB C 112 18.812 18.812 19.014 -0.202 18935 11843 1 15 . 1 1 112 112 ALA H H 112 8.753 8.753 8.572 0.181 18935 11844 1 15 . 1 1 113 113 ILE N N 113 119.130 119.130 120.007 -0.877 18935 11845 1 15 . 1 1 113 113 ILE C C 113 178.646 178.646 177.547 1.099 18935 11846 1 15 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.459 2.942 18935 11847 1 15 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.906 0.331 18935 11848 1 15 . 1 1 113 113 ILE H H 113 8.946 8.946 8.583 0.363 18935 11849 1 15 . 1 1 114 114 PHE N N 114 121.758 121.758 115.885 5.873 18935 11850 1 15 . 1 1 114 114 PHE C C 114 177.954 177.954 174.207 3.747 18935 11851 1 15 . 1 1 114 114 PHE CA C 114 59.777 59.777 58.381 1.396 18935 11852 1 15 . 1 1 114 114 PHE CB C 114 39.064 39.064 37.905 1.159 18935 11853 1 15 . 1 1 114 114 PHE H H 114 7.940 7.940 8.199 -0.259 18935 11854 1 15 . 1 1 115 115 HIS N N 115 116.547 116.547 117.660 -1.113 18935 11855 1 15 . 1 1 115 115 HIS C C 115 176.161 176.161 174.998 1.163 18935 11856 1 15 . 1 1 115 115 HIS CA C 115 59.119 59.119 56.439 2.680 18935 11857 1 15 . 1 1 115 115 HIS CB C 115 31.067 31.067 31.075 -0.008 18935 11858 1 15 . 1 1 115 115 HIS H H 115 7.767 7.767 7.562 0.205 18935 11859 1 15 . 1 1 116 116 PHE N N 116 109.387 109.387 118.800 -9.413 18935 11860 1 15 . 1 1 116 116 PHE C C 116 177.282 177.282 176.482 0.800 18935 11861 1 15 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.217 1.217 18935 11862 1 15 . 1 1 116 116 PHE CB C 116 37.255 37.255 40.030 -2.775 18935 11863 1 15 . 1 1 116 116 PHE H H 116 8.989 8.989 8.121 0.868 18935 11864 1 15 . 1 1 117 117 THR N N 117 116.864 116.864 113.708 3.156 18935 11865 1 15 . 1 1 117 117 THR C C 117 172.889 172.889 174.558 -1.669 18935 11866 1 15 . 1 1 117 117 THR CA C 117 66.997 66.997 64.100 2.897 18935 11867 1 15 . 1 1 117 117 THR CB C 117 67.948 67.948 69.816 -1.868 18935 11868 1 15 . 1 1 117 117 THR H H 117 7.988 7.988 8.193 -0.205 18935 11869 1 15 . 1 1 118 118 GLY N N 118 103.320 103.320 109.327 -6.007 18935 11870 1 15 . 1 1 118 118 GLY C C 118 176.912 176.912 171.797 5.115 18935 11871 1 15 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.703 1.479 18935 11872 1 15 . 1 1 118 118 GLY H H 118 6.550 6.550 7.707 -1.157 18935 11873 1 15 . 1 1 120 120 VAL N N 120 120.671 120.671 126.466 -5.795 18935 11874 1 15 . 1 1 120 120 VAL C C 120 176.283 176.283 177.420 -1.137 18935 11875 1 15 . 1 1 120 120 VAL CA C 120 66.940 66.940 65.980 0.960 18935 11876 1 15 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.943 -2.091 18935 11877 1 15 . 1 1 120 120 VAL H H 120 8.408 8.408 8.633 -0.225 18935 11878 1 15 . 1 1 121 121 SER N N 121 111.789 111.789 114.587 -2.798 18935 11879 1 15 . 1 1 121 121 SER C C 121 175.658 175.658 176.400 -0.742 18935 11880 1 15 . 1 1 121 121 SER CA C 121 60.814 60.814 61.797 -0.983 18935 11881 1 15 . 1 1 121 121 SER CB C 121 60.253 60.253 62.278 -2.025 18935 11882 1 15 . 1 1 121 121 SER H H 121 8.290 8.290 8.286 0.004 18935 11883 1 15 . 1 1 122 122 TYR N N 122 123.254 123.254 122.922 0.332 18935 11884 1 15 . 1 1 122 122 TYR C C 122 174.611 174.611 177.653 -3.042 18935 11885 1 15 . 1 1 122 122 TYR CA C 122 58.546 58.546 61.081 -2.535 18935 11886 1 15 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.056 0.083 18935 11887 1 15 . 1 1 122 122 TYR H H 122 6.303 6.303 7.424 -1.121 18935 11888 1 15 . 1 1 123 123 LEU N N 123 114.825 114.825 118.706 -3.881 18935 11889 1 15 . 1 1 123 123 LEU C C 123 178.891 178.891 179.275 -0.384 18935 11890 1 15 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.961 -1.182 18935 11891 1 15 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.741 -0.103 18935 11892 1 15 . 1 1 123 123 LEU H H 123 6.965 6.965 7.327 -0.362 18935 11893 1 15 . 1 1 124 124 ILE N N 124 114.915 114.915 118.740 -3.825 18935 11894 1 15 . 1 1 124 124 ILE C C 124 177.187 177.187 177.817 -0.630 18935 11895 1 15 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.376 -0.945 18935 11896 1 15 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.362 -0.807 18935 11897 1 15 . 1 1 124 124 ILE H H 124 7.531 7.531 7.633 -0.102 18935 11898 1 15 . 1 1 125 125 ARG N N 125 115.278 115.278 117.736 -2.458 18935 11899 1 15 . 1 1 125 125 ARG C C 125 178.473 178.473 177.479 0.994 18935 11900 1 15 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.494 -0.035 18935 11901 1 15 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.415 -2.336 18935 11902 1 15 . 1 1 125 125 ARG H H 125 6.809 6.809 8.049 -1.240 18935 11903 1 15 . 1 1 126 126 ILE N N 126 124.160 124.160 118.696 5.464 18935 11904 1 15 . 1 1 126 126 ILE C C 126 178.172 178.172 176.937 1.235 18935 11905 1 15 . 1 1 126 126 ILE CA C 126 60.927 60.927 60.854 0.073 18935 11906 1 15 . 1 1 126 126 ILE CB C 126 34.466 34.466 38.058 -3.592 18935 11907 1 15 . 1 1 126 126 ILE H H 126 7.408 7.408 7.155 0.253 18935 11908 1 15 . 1 1 127 127 ARG N N 127 117.136 117.136 121.245 -4.109 18935 11909 1 15 . 1 1 127 127 ARG C C 127 179.227 179.227 178.338 0.889 18935 11910 1 15 . 1 1 127 127 ARG CA C 127 60.216 60.216 60.294 -0.078 18935 11911 1 15 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.692 -1.903 18935 11912 1 15 . 1 1 127 127 ARG H H 127 8.230 8.230 8.087 0.143 18935 11913 1 15 . 1 1 128 128 ALA N N 128 121.305 121.305 121.220 0.085 18935 11914 1 15 . 1 1 128 128 ALA C C 128 179.933 179.933 179.033 0.900 18935 11915 1 15 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.231 -0.525 18935 11916 1 15 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.077 0.261 18935 11917 1 15 . 1 1 128 128 ALA H H 128 8.666 8.666 7.855 0.811 18935 11918 1 15 . 1 1 129 129 ALA N N 129 120.943 120.943 121.291 -0.348 18935 11919 1 15 . 1 1 129 129 ALA C C 129 181.336 181.336 179.502 1.834 18935 11920 1 15 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.902 -0.194 18935 11921 1 15 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.373 -1.513 18935 11922 1 15 . 1 1 129 129 ALA H H 129 7.837 7.837 8.012 -0.175 18935 11923 1 15 . 1 1 130 130 LEU N N 130 117.726 117.726 118.226 -0.500 18935 11924 1 15 . 1 1 130 130 LEU C C 130 179.432 179.432 179.647 -0.215 18935 11925 1 15 . 1 1 130 130 LEU CA C 130 57.176 57.176 58.134 -0.958 18935 11926 1 15 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.955 -1.389 18935 11927 1 15 . 1 1 130 130 LEU H H 130 8.114 8.114 8.106 0.008 18935 11928 1 15 . 1 1 131 131 LYS N N 131 124.115 124.115 121.777 2.338 18935 11929 1 15 . 1 1 131 131 LYS C C 131 181.452 181.452 179.336 2.116 18935 11930 1 15 . 1 1 131 131 LYS CA C 131 58.886 58.886 59.106 -0.220 18935 11931 1 15 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.871 0.327 18935 11932 1 15 . 1 1 131 131 LYS H H 131 8.849 8.849 8.463 0.386 18935 11933 1 15 . 1 1 132 132 LYS N N 132 119.447 119.447 118.056 1.391 18935 11934 1 15 . 1 1 132 132 LYS C C 132 177.607 177.607 177.972 -0.365 18935 11935 1 15 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.432 -0.480 18935 11936 1 15 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.872 -0.448 18935 11937 1 15 . 1 1 132 132 LYS H H 132 7.778 7.778 8.127 -0.349 18935 11938 1 15 . 1 1 133 133 LYS N N 133 116.638 116.638 115.602 1.036 18935 11939 1 15 . 1 1 133 133 LYS C C 133 174.681 174.681 175.641 -0.960 18935 11940 1 15 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.132 -0.054 18935 11941 1 15 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.623 -0.983 18935 11942 1 15 . 1 1 133 133 LYS H H 133 7.617 7.617 7.906 -0.289 18935 11943 1 15 . 1 1 134 134 ASN N N 134 110.792 110.792 117.844 -7.052 18935 11944 1 15 . 1 1 134 134 ASN C C 134 174.034 174.034 173.291 0.743 18935 11945 1 15 . 1 1 134 134 ASN CA C 134 54.615 54.615 53.958 0.657 18935 11946 1 15 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.196 -1.144 18935 11947 1 15 . 1 1 134 134 ASN H H 134 8.123 8.123 8.591 -0.468 18935 11948 1 15 . 1 1 135 135 TYR N N 135 115.867 115.867 117.593 -1.726 18935 11949 1 15 . 1 1 135 135 TYR C C 135 175.122 175.122 174.084 1.038 18935 11950 1 15 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.197 -0.445 18935 11951 1 15 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.559 -1.643 18935 11952 1 15 . 1 1 135 135 TYR H H 135 8.133 8.133 7.689 0.444 18935 11953 1 15 . 1 1 136 136 LYS N N 136 119.870 119.870 120.641 -0.771 18935 11954 1 15 . 1 1 136 136 LYS C C 136 174.324 174.324 174.436 -0.112 18935 11955 1 15 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.957 0.224 18935 11956 1 15 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.705 -2.632 18935 11957 1 15 . 1 1 136 136 LYS H H 136 9.234 9.234 8.867 0.367 18935 11958 1 15 . 1 1 137 137 LEU N N 137 129.708 129.708 126.499 3.209 18935 11959 1 15 . 1 1 137 137 LEU C C 137 173.798 173.798 174.885 -1.087 18935 11960 1 15 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.241 -1.407 18935 11961 1 15 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.824 1.159 18935 11962 1 15 . 1 1 137 137 LEU H H 137 8.959 8.959 8.745 0.214 18935 11963 1 15 . 1 1 140 140 TYR N N 140 120.580 120.580 114.807 5.773 18935 11964 1 15 . 1 1 140 140 TYR C C 140 174.705 174.705 175.830 -1.125 18935 11965 1 15 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.925 -1.473 18935 11966 1 15 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.285 0.016 18935 11967 1 15 . 1 1 140 140 TYR H H 140 8.962 8.962 7.388 1.574 18935 11968 1 15 . 1 1 141 141 GLY N N 141 104.986 104.986 105.946 -0.960 18935 11969 1 15 . 1 1 141 141 GLY C C 141 181.854 181.854 172.365 9.489 18935 11970 1 15 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.464 -0.342 18935 11971 1 15 . 1 1 141 141 GLY H H 141 7.555 7.555 7.471 0.084 18935 11972 1 15 . 1 1 142 142 LEU N N 142 118.269 118.269 120.898 -2.629 18935 11973 1 15 . 1 1 142 142 LEU C C 142 174.067 174.067 176.227 -2.160 18935 11974 1 15 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.511 -1.009 18935 11975 1 15 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.394 1.148 18935 11976 1 15 . 1 1 142 142 LEU H H 142 7.794 7.794 8.425 -0.631 18935 11977 1 15 . 1 1 143 143 PHE N N 143 122.076 122.076 124.946 -2.870 18935 11978 1 15 . 1 1 143 143 PHE C C 143 175.199 175.199 175.154 0.045 18935 11979 1 15 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.730 -1.698 18935 11980 1 15 . 1 1 143 143 PHE CB C 143 42.070 42.070 40.181 1.889 18935 11981 1 15 . 1 1 143 143 PHE H H 143 9.522 9.522 9.522 -0.000 18935 11982 1 15 . 1 1 144 144 LYS N N 144 121.305 121.305 124.523 -3.218 18935 11983 1 15 . 1 1 144 144 LYS C C 144 176.917 176.917 176.500 0.417 18935 11984 1 15 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.862 0.494 18935 11985 1 15 . 1 1 144 144 LYS CB C 144 33.679 33.679 34.043 -0.364 18935 11986 1 15 . 1 1 144 144 LYS H H 144 9.076 9.076 9.104 -0.028 18935 11987 1 15 . 1 1 145 145 ASN N N 145 126.834 126.834 125.008 1.826 18935 11988 1 15 . 1 1 145 145 ASN C C 145 175.070 175.070 175.046 0.024 18935 11989 1 15 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.027 0.737 18935 11990 1 15 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.510 -1.080 18935 11991 1 15 . 1 1 145 145 ASN H H 145 9.618 9.618 9.234 0.384 18935 11992 1 15 . 1 1 146 146 GLN N N 146 110.112 110.112 110.315 -0.203 18935 11993 1 15 . 1 1 146 146 GLN C C 146 175.198 175.198 175.166 0.032 18935 11994 1 15 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.433 -0.537 18935 11995 1 15 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.883 -1.515 18935 11996 1 15 . 1 1 146 146 GLN H H 146 9.140 9.140 8.718 0.422 18935 11997 1 15 . 1 1 147 147 THR N N 147 116.003 116.003 116.396 -0.393 18935 11998 1 15 . 1 1 147 147 THR C C 147 173.224 173.224 173.358 -0.134 18935 11999 1 15 . 1 1 147 147 THR CA C 147 61.450 61.450 62.057 -0.607 18935 12000 1 15 . 1 1 147 147 THR CB C 147 70.285 70.285 70.245 0.040 18935 12001 1 15 . 1 1 147 147 THR H H 147 8.069 8.069 7.702 0.367 18935 12002 1 15 . 1 1 148 148 LEU N N 148 129.281 129.281 129.540 -0.259 18935 12003 1 15 . 1 1 148 148 LEU C C 148 176.703 176.703 175.548 1.155 18935 12004 1 15 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.370 0.097 18935 12005 1 15 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.758 -1.033 18935 12006 1 15 . 1 1 148 148 LEU H H 148 8.831 8.831 8.835 -0.004 18935 12007 1 15 . 1 1 149 149 VAL N N 149 130.189 130.189 127.685 2.504 18935 12008 1 15 . 1 1 149 149 VAL C C 149 175.012 175.012 173.803 1.209 18935 12009 1 15 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.853 0.416 18935 12010 1 15 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.160 -3.704 18935 12011 1 15 . 1 1 149 149 VAL H H 149 9.243 9.243 8.471 0.772 18935 12012 1 15 . 1 1 151 151 LEU N N 151 123.481 123.481 115.231 8.250 18935 12013 1 15 . 1 1 151 151 LEU C C 151 177.679 177.679 177.253 0.426 18935 12014 1 15 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.397 -0.400 18935 12015 1 15 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.710 0.909 18935 12016 1 15 . 1 1 151 151 LEU H H 151 8.080 8.080 7.997 0.083 18935 12017 1 15 . 1 1 152 152 LYS N N 152 126.381 126.381 120.831 5.550 18935 12018 1 15 . 1 1 152 152 LYS C C 152 175.115 175.115 175.199 -0.084 18935 12019 1 15 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.354 -1.758 18935 12020 1 15 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.946 -2.881 18935 12021 1 15 . 1 1 152 152 LYS H H 152 9.112 9.112 8.576 0.536 18935 12022 1 15 . 1 1 153 153 ILE N N 153 113.737 113.737 115.491 -1.754 18935 12023 1 15 . 1 1 153 153 ILE C C 153 175.748 175.748 173.283 2.465 18935 12024 1 15 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.723 -1.334 18935 12025 1 15 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.600 1.203 18935 12026 1 15 . 1 1 153 153 ILE H H 153 7.304 7.304 7.454 -0.150 18935 12027 1 15 . 1 1 154 154 THR N N 154 110.656 110.656 114.053 -3.397 18935 12028 1 15 . 1 1 154 154 THR C C 154 174.864 174.864 174.097 0.767 18935 12029 1 15 . 1 1 154 154 THR CA C 154 62.141 62.141 61.545 0.596 18935 12030 1 15 . 1 1 154 154 THR CB C 154 70.413 70.413 70.508 -0.095 18935 12031 1 15 . 1 1 154 154 THR H H 154 9.382 9.382 9.303 0.079 18935 12032 1 15 . 1 1 155 155 THR N N 155 110.746 110.746 116.953 -6.207 18935 12033 1 15 . 1 1 155 155 THR C C 155 174.718 174.718 174.816 -0.098 18935 12034 1 15 . 1 1 155 155 THR CA C 155 58.785 58.785 60.797 -2.012 18935 12035 1 15 . 1 1 155 155 THR CB C 155 72.277 72.277 71.527 0.750 18935 12036 1 15 . 1 1 155 155 THR H H 155 7.746 7.746 7.949 -0.203 18935 12037 1 15 . 1 1 156 156 GLU N N 156 122.302 122.302 123.603 -1.301 18935 12038 1 15 . 1 1 156 156 GLU C C 156 177.289 177.289 178.217 -0.928 18935 12039 1 15 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.932 -2.108 18935 12040 1 15 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.277 -0.896 18935 12041 1 15 . 1 1 156 156 GLU H H 156 9.490 9.490 9.047 0.443 18935 12042 1 15 . 1 1 157 157 LYS N N 157 118.905 118.905 118.683 0.222 18935 12043 1 15 . 1 1 157 157 LYS C C 157 178.241 178.241 179.108 -0.867 18935 12044 1 15 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.640 1.125 18935 12045 1 15 . 1 1 157 157 LYS CB C 157 31.278 31.278 32.016 -0.738 18935 12046 1 15 . 1 1 157 157 LYS H H 157 8.329 8.329 8.415 -0.086 18935 12047 1 15 . 1 1 158 158 GLU N N 158 116.230 116.230 120.682 -4.452 18935 12048 1 15 . 1 1 158 158 GLU C C 158 178.988 178.988 178.649 0.339 18935 12049 1 15 . 1 1 158 158 GLU CA C 158 58.256 58.256 59.489 -1.232 18935 12050 1 15 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.402 -0.344 18935 12051 1 15 . 1 1 158 158 GLU H H 158 7.611 7.611 8.071 -0.460 18935 12052 1 15 . 1 1 159 159 LEU N N 159 118.978 118.978 120.923 -1.945 18935 12053 1 15 . 1 1 159 159 LEU C C 159 176.347 176.347 178.516 -2.169 18935 12054 1 15 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.272 -5.033 18935 12055 1 15 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.887 -2.344 18935 12056 1 15 . 1 1 159 159 LEU H H 159 7.704 7.704 8.305 -0.601 18935 12057 1 15 . 1 1 160 160 ILE N N 160 117.227 117.227 114.533 2.694 18935 12058 1 15 . 1 1 160 160 ILE C C 160 177.219 177.219 177.395 -0.176 18935 12059 1 15 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.064 0.551 18935 12060 1 15 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.212 0.345 18935 12061 1 15 . 1 1 160 160 ILE H H 160 7.886 7.886 7.539 0.347 18935 12062 1 15 . 1 1 161 161 LYS N N 161 115.912 115.912 119.816 -3.904 18935 12063 1 15 . 1 1 161 161 LYS C C 161 180.990 180.990 179.371 1.619 18935 12064 1 15 . 1 1 161 161 LYS CA C 161 58.631 58.631 57.971 0.660 18935 12065 1 15 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.881 -1.133 18935 12066 1 15 . 1 1 161 161 LYS H H 161 7.536 7.536 7.666 -0.130 18935 12067 1 15 . 1 1 162 162 GLU N N 162 120.852 120.852 120.371 0.481 18935 12068 1 15 . 1 1 162 162 GLU C C 162 178.793 178.793 178.239 0.554 18935 12069 1 15 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.568 -0.586 18935 12070 1 15 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.354 -1.562 18935 12071 1 15 . 1 1 162 162 GLU H H 162 8.392 8.392 8.019 0.373 18935 12072 1 15 . 1 1 163 163 LEU N N 163 115.912 115.912 116.796 -0.884 18935 12073 1 15 . 1 1 163 163 LEU C C 163 176.370 176.370 177.326 -0.956 18935 12074 1 15 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.665 -0.571 18935 12075 1 15 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.772 -1.598 18935 12076 1 15 . 1 1 163 163 LEU H H 163 8.031 8.031 7.838 0.193 18935 12077 1 15 . 1 1 164 164 GLY N N 164 103.160 103.160 105.040 -1.880 18935 12078 1 15 . 1 1 164 164 GLY C C 164 174.240 174.240 173.841 0.399 18935 12079 1 15 . 1 1 164 164 GLY CA C 164 44.302 44.302 45.040 -0.738 18935 12080 1 15 . 1 1 164 164 GLY H H 164 7.625 7.625 7.773 -0.148 18935 12081 1 15 . 1 1 165 165 PHE N N 165 117.952 117.952 117.907 0.045 18935 12082 1 15 . 1 1 165 165 PHE C C 165 174.556 174.556 174.640 -0.084 18935 12083 1 15 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.643 -1.178 18935 12084 1 15 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.713 -0.951 18935 12085 1 15 . 1 1 165 165 PHE H H 165 7.283 7.283 8.290 -1.007 18935 12086 1 15 . 1 1 166 166 THR N N 166 118.178 118.178 113.792 4.386 18935 12087 1 15 . 1 1 166 166 THR C C 166 175.306 175.306 173.404 1.902 18935 12088 1 15 . 1 1 166 166 THR CA C 166 63.466 63.466 59.878 3.588 18935 12089 1 15 . 1 1 166 166 THR CB C 166 68.721 68.721 71.271 -2.550 18935 12090 1 15 . 1 1 166 166 THR H H 166 9.678 9.678 8.802 0.876 18935 12091 1 15 . 1 1 167 167 TYR N N 167 128.239 128.239 124.372 3.867 18935 12092 1 15 . 1 1 167 167 TYR C C 167 173.297 173.297 175.159 -1.862 18935 12093 1 15 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.580 0.832 18935 12094 1 15 . 1 1 167 167 TYR CB C 167 36.722 36.722 38.804 -2.082 18935 12095 1 15 . 1 1 167 167 TYR H H 167 9.264 9.264 8.752 0.512 18935 12096 1 15 . 1 1 168 168 ARG N N 168 126.789 126.789 126.279 0.510 18935 12097 1 15 . 1 1 168 168 ARG C C 168 175.297 175.297 174.681 0.616 18935 12098 1 15 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.117 -1.352 18935 12099 1 15 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.798 -1.472 18935 12100 1 15 . 1 1 168 168 ARG H H 168 7.030 7.030 8.138 -1.108 18935 12101 1 15 . 1 1 169 169 ILE N N 169 119.221 119.221 116.918 2.303 18935 12102 1 15 . 1 1 169 169 ILE C C 169 174.522 174.522 175.070 -0.548 18935 12103 1 15 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.391 2.888 18935 12104 1 15 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.340 -4.693 18935 12105 1 15 . 1 1 169 169 ILE H H 169 8.349 8.349 8.331 0.018 18935 12106 1 15 . 1 1 171 171 LYS N N 171 111.335 111.335 119.314 -7.979 18935 12107 1 15 . 1 1 171 171 LYS C C 171 176.638 176.638 177.791 -1.153 18935 12108 1 15 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.037 -1.499 18935 12109 1 15 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.813 0.154 18935 12110 1 15 . 1 1 171 171 LYS H H 171 8.198 8.198 8.499 -0.301 18935 12111 1 15 . 1 1 172 172 LYS N N 172 116.411 116.411 115.613 0.798 18935 12112 1 15 . 1 1 172 172 LYS C C 172 175.331 175.331 175.729 -0.398 18935 12113 1 15 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.102 -1.101 18935 12114 1 15 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.203 -1.385 18935 12115 1 15 . 1 1 172 172 LYS H H 172 7.843 7.843 7.554 0.289 18935 12116 1 15 . 1 1 173 173 ARG N N 173 120.490 120.490 119.472 1.018 18935 12117 1 15 . 1 1 173 173 ARG C C 173 172.830 172.830 175.214 -2.384 18935 12118 1 15 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.754 0.421 18935 12119 1 15 . 1 1 173 173 ARG CB C 173 28.829 28.829 27.816 1.013 18935 12120 1 15 . 1 1 173 173 ARG H H 173 6.917 6.917 7.818 -0.901 18935 12121 1 16 . 1 1 2 2 LEU N N 2 119.937 119.937 114.415 5.522 18935 12122 1 16 . 1 1 2 2 LEU C C 2 175.307 175.307 174.880 0.427 18935 12123 1 16 . 1 1 2 2 LEU CA C 2 54.292 54.292 54.423 -0.131 18935 12124 1 16 . 1 1 2 2 LEU CB C 2 42.684 42.684 45.050 -2.366 18935 12125 1 16 . 1 1 2 2 LEU H H 2 9.251 9.251 8.590 0.661 18935 12126 1 16 . 1 1 3 3 THR N N 3 111.335 111.335 111.265 0.070 18935 12127 1 16 . 1 1 3 3 THR C C 3 175.854 175.854 175.968 -0.114 18935 12128 1 16 . 1 1 3 3 THR CA C 3 60.540 60.540 60.697 -0.157 18935 12129 1 16 . 1 1 3 3 THR CB C 3 70.782 70.782 71.106 -0.324 18935 12130 1 16 . 1 1 3 3 THR H H 3 8.677 8.677 8.183 0.494 18935 12131 1 16 . 1 1 4 4 LEU N N 4 120.988 120.988 123.105 -2.117 18935 12132 1 16 . 1 1 4 4 LEU C C 4 178.391 178.391 178.375 0.016 18935 12133 1 16 . 1 1 4 4 LEU CA C 4 58.064 58.064 57.851 0.213 18935 12134 1 16 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.656 -2.395 18935 12135 1 16 . 1 1 4 4 LEU H H 4 7.746 7.746 7.931 -0.185 18935 12136 1 16 . 1 1 5 5 ILE N N 5 114.236 114.236 115.140 -0.904 18935 12137 1 16 . 1 1 5 5 ILE C C 5 178.339 178.339 177.738 0.601 18935 12138 1 16 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.534 -0.952 18935 12139 1 16 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.002 -0.203 18935 12140 1 16 . 1 1 5 5 ILE H H 5 7.821 7.821 7.694 0.127 18935 12141 1 16 . 1 1 6 6 GLN N N 6 120.399 120.399 120.581 -0.182 18935 12142 1 16 . 1 1 6 6 GLN C C 6 178.783 178.783 178.464 0.319 18935 12143 1 16 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.944 -0.724 18935 12144 1 16 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.062 0.053 18935 12145 1 16 . 1 1 6 6 GLN H H 6 7.810 7.810 7.694 0.116 18935 12146 1 16 . 1 1 7 7 GLY N N 7 106.277 106.277 106.006 0.271 18935 12147 1 16 . 1 1 7 7 GLY C C 7 174.554 174.554 176.422 -1.868 18935 12148 1 16 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.080 -0.146 18935 12149 1 16 . 1 1 7 7 GLY H H 7 8.733 8.733 8.069 0.664 18935 12150 1 16 . 1 1 8 8 LYS N N 8 119.991 119.991 121.490 -1.499 18935 12151 1 16 . 1 1 8 8 LYS C C 8 179.433 179.433 178.255 1.178 18935 12152 1 16 . 1 1 8 8 LYS CA C 8 59.892 59.892 57.968 1.924 18935 12153 1 16 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.363 -1.031 18935 12154 1 16 . 1 1 8 8 LYS H H 8 8.688 8.688 7.430 1.258 18935 12155 1 16 . 1 1 9 9 LYS N N 9 119.175 119.175 120.736 -1.561 18935 12156 1 16 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.853 -0.471 18935 12157 1 16 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.360 -0.925 18935 12158 1 16 . 1 1 9 9 LYS H H 9 8.015 8.015 7.890 0.125 18935 12159 1 16 . 1 1 10 10 ILE N N 10 120.308 120.308 116.616 3.692 18935 12160 1 16 . 1 1 10 10 ILE C C 10 177.766 177.766 177.433 0.333 18935 12161 1 16 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.924 -0.248 18935 12162 1 16 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.255 -0.942 18935 12163 1 16 . 1 1 10 10 ILE H H 10 7.967 7.967 8.226 -0.259 18935 12164 1 16 . 1 1 11 11 VAL N N 11 119.130 119.130 121.020 -1.890 18935 12165 1 16 . 1 1 11 11 VAL C C 11 176.606 176.606 178.252 -1.646 18935 12166 1 16 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.191 1.449 18935 12167 1 16 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.509 -0.300 18935 12168 1 16 . 1 1 11 11 VAL H H 11 8.128 8.128 7.679 0.449 18935 12169 1 16 . 1 1 12 12 ASN N N 12 115.822 115.822 117.566 -1.744 18935 12170 1 16 . 1 1 12 12 ASN C C 12 177.375 177.375 177.078 0.297 18935 12171 1 16 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.446 -0.476 18935 12172 1 16 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.764 -1.201 18935 12173 1 16 . 1 1 12 12 ASN H H 12 8.203 8.203 7.904 0.299 18935 12174 1 16 . 1 1 13 13 HIS N N 13 117.659 117.659 118.256 -0.597 18935 12175 1 16 . 1 1 13 13 HIS C C 13 177.287 177.287 178.030 -0.743 18935 12176 1 16 . 1 1 13 13 HIS CA C 13 58.687 58.687 58.701 -0.014 18935 12177 1 16 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.565 -0.544 18935 12178 1 16 . 1 1 13 13 HIS H H 13 7.861 7.861 7.782 0.079 18935 12179 1 16 . 1 1 14 14 LEU N N 14 115.595 115.595 120.497 -4.902 18935 12180 1 16 . 1 1 14 14 LEU C C 14 179.092 179.092 178.794 0.298 18935 12181 1 16 . 1 1 14 14 LEU CA C 14 56.641 56.641 58.160 -1.520 18935 12182 1 16 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.416 -0.396 18935 12183 1 16 . 1 1 14 14 LEU H H 14 8.376 8.376 9.071 -0.695 18935 12184 1 16 . 1 1 15 15 ARG N N 15 115.006 115.006 117.272 -2.266 18935 12185 1 16 . 1 1 15 15 ARG C C 15 176.265 176.265 177.592 -1.327 18935 12186 1 16 . 1 1 15 15 ARG CA C 15 59.884 59.884 59.319 0.565 18935 12187 1 16 . 1 1 15 15 ARG CB C 15 29.072 29.072 30.309 -1.237 18935 12188 1 16 . 1 1 15 15 ARG H H 15 8.074 8.074 8.109 -0.035 18935 12189 1 16 . 1 1 16 16 SER N N 16 107.778 107.778 112.089 -4.311 18935 12190 1 16 . 1 1 16 16 SER C C 16 176.009 176.009 175.385 0.624 18935 12191 1 16 . 1 1 16 16 SER CA C 16 57.244 57.244 59.787 -2.543 18935 12192 1 16 . 1 1 16 16 SER CB C 16 63.525 63.525 64.511 -0.986 18935 12193 1 16 . 1 1 16 16 SER H H 16 7.136 7.136 8.036 -0.900 18935 12194 1 16 . 1 1 17 17 ARG N N 17 121.532 121.532 120.672 0.860 18935 12195 1 16 . 1 1 17 17 ARG C C 17 174.482 174.482 176.315 -1.833 18935 12196 1 16 . 1 1 17 17 ARG CA C 17 56.322 56.322 54.544 1.778 18935 12197 1 16 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.344 1.486 18935 12198 1 16 . 1 1 17 17 ARG H H 17 7.913 7.913 7.646 0.267 18935 12199 1 16 . 1 1 18 18 LEU N N 18 121.305 121.305 120.646 0.659 18935 12200 1 16 . 1 1 18 18 LEU C C 18 176.283 176.283 175.450 0.833 18935 12201 1 16 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.583 -0.885 18935 12202 1 16 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.035 0.020 18935 12203 1 16 . 1 1 18 18 LEU H H 18 8.812 8.812 7.692 1.120 18935 12204 1 16 . 1 1 19 19 ALA N N 19 125.293 125.293 122.450 2.843 18935 12205 1 16 . 1 1 19 19 ALA C C 19 173.780 173.780 175.074 -1.294 18935 12206 1 16 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.644 -0.842 18935 12207 1 16 . 1 1 19 19 ALA CB C 19 22.853 22.853 21.985 0.868 18935 12208 1 16 . 1 1 19 19 ALA H H 19 8.790 8.790 7.955 0.835 18935 12209 1 16 . 1 1 20 20 PHE N N 20 113.117 113.117 115.695 -2.578 18935 12210 1 16 . 1 1 20 20 PHE C C 20 172.708 172.708 173.419 -0.711 18935 12211 1 16 . 1 1 20 20 PHE CA C 20 55.598 55.598 55.647 -0.049 18935 12212 1 16 . 1 1 20 20 PHE CB C 20 41.725 41.725 42.120 -0.395 18935 12213 1 16 . 1 1 20 20 PHE H H 20 8.925 8.925 8.884 0.041 18935 12214 1 16 . 1 1 21 21 GLU N N 21 121.532 121.532 119.783 1.749 18935 12215 1 16 . 1 1 21 21 GLU C C 21 174.830 174.830 174.969 -0.139 18935 12216 1 16 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.007 -0.044 18935 12217 1 16 . 1 1 21 21 GLU CB C 21 30.343 30.343 33.688 -3.345 18935 12218 1 16 . 1 1 21 21 GLU H H 21 7.972 7.972 9.134 -1.162 18935 12219 1 16 . 1 1 22 22 TYR N N 22 125.339 125.339 119.262 6.077 18935 12220 1 16 . 1 1 22 22 TYR C C 22 174.864 174.864 174.782 0.082 18935 12221 1 16 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.316 -3.028 18935 12222 1 16 . 1 1 22 22 TYR CB C 22 39.859 39.859 39.593 0.266 18935 12223 1 16 . 1 1 22 22 TYR H H 22 9.016 9.016 8.573 0.443 18935 12224 1 16 . 1 1 23 23 ASN N N 23 127.024 127.024 126.179 0.845 18935 12225 1 16 . 1 1 23 23 ASN C C 23 175.410 175.410 175.079 0.331 18935 12226 1 16 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.160 -1.107 18935 12227 1 16 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.902 -1.641 18935 12228 1 16 . 1 1 23 23 ASN H H 23 9.181 9.181 9.184 -0.003 18935 12229 1 16 . 1 1 24 24 GLY N N 24 102.755 102.755 103.904 -1.149 18935 12230 1 16 . 1 1 24 24 GLY C C 24 173.626 173.626 174.210 -0.584 18935 12231 1 16 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.042 -0.107 18935 12232 1 16 . 1 1 24 24 GLY H H 24 8.666 8.666 8.382 0.284 18935 12233 1 16 . 1 1 25 25 GLN N N 25 118.722 118.722 121.111 -2.389 18935 12234 1 16 . 1 1 25 25 GLN C C 25 173.657 173.657 175.373 -1.716 18935 12235 1 16 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.578 -1.345 18935 12236 1 16 . 1 1 25 25 GLN CB C 25 30.805 30.805 29.541 1.264 18935 12237 1 16 . 1 1 25 25 GLN H H 25 7.708 7.708 8.244 -0.536 18935 12238 1 16 . 1 1 26 26 LEU N N 26 123.526 123.526 126.222 -2.696 18935 12239 1 16 . 1 1 26 26 LEU C C 26 175.842 175.842 176.533 -0.691 18935 12240 1 16 . 1 1 26 26 LEU CA C 26 53.986 53.986 55.142 -1.155 18935 12241 1 16 . 1 1 26 26 LEU CB C 26 40.807 40.807 42.388 -1.581 18935 12242 1 16 . 1 1 26 26 LEU H H 26 8.543 8.543 8.654 -0.111 18935 12243 1 16 . 1 1 27 27 ILE N N 27 129.462 129.462 124.562 4.900 18935 12244 1 16 . 1 1 27 27 ILE C C 27 175.085 175.085 174.148 0.937 18935 12245 1 16 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.334 0.639 18935 12246 1 16 . 1 1 27 27 ILE CB C 27 35.552 35.552 37.992 -2.440 18935 12247 1 16 . 1 1 27 27 ILE H H 27 8.989 8.989 9.020 -0.031 18935 12248 1 16 . 1 1 28 28 LYS N N 28 125.157 125.157 127.077 -1.920 18935 12249 1 16 . 1 1 28 28 LYS C C 28 176.725 176.725 175.454 1.271 18935 12250 1 16 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.610 1.200 18935 12251 1 16 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.438 -1.621 18935 12252 1 16 . 1 1 28 28 LYS H H 28 8.311 8.311 8.236 0.075 18935 12253 1 16 . 1 1 29 29 ILE N N 29 125.565 125.565 114.920 10.645 18935 12254 1 16 . 1 1 29 29 ILE C C 29 175.685 175.685 173.502 2.183 18935 12255 1 16 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.793 0.612 18935 12256 1 16 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.722 -3.691 18935 12257 1 16 . 1 1 29 29 ILE H H 29 8.209 8.209 7.833 0.376 18935 12258 1 16 . 1 1 30 30 LEU N N 30 127.831 127.831 119.648 8.183 18935 12259 1 16 . 1 1 30 30 LEU C C 30 178.794 178.794 177.739 1.055 18935 12260 1 16 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.335 1.108 18935 12261 1 16 . 1 1 30 30 LEU CB C 30 40.836 40.836 44.907 -4.071 18935 12262 1 16 . 1 1 30 30 LEU H H 30 9.027 9.027 8.253 0.774 18935 12263 1 16 . 1 1 31 31 SER N N 31 116.864 116.864 115.241 1.623 18935 12264 1 16 . 1 1 31 31 SER C C 31 177.464 177.464 175.798 1.666 18935 12265 1 16 . 1 1 31 31 SER CA C 31 61.180 61.180 61.806 -0.626 18935 12266 1 16 . 1 1 31 31 SER CB C 31 62.105 62.105 63.056 -0.951 18935 12267 1 16 . 1 1 31 31 SER H H 31 8.887 8.887 8.546 0.341 18935 12268 1 16 . 1 1 32 32 LYS N N 32 114.825 114.825 118.825 -4.000 18935 12269 1 16 . 1 1 32 32 LYS C C 32 176.243 176.243 175.813 0.430 18935 12270 1 16 . 1 1 32 32 LYS CA C 32 57.292 57.292 57.040 0.252 18935 12271 1 16 . 1 1 32 32 LYS CB C 32 30.266 30.266 30.794 -0.528 18935 12272 1 16 . 1 1 32 32 LYS H H 32 8.290 8.290 8.300 -0.010 18935 12273 1 16 . 1 1 33 33 ASN N N 33 117.564 117.564 114.710 2.854 18935 12274 1 16 . 1 1 33 33 ASN C C 33 172.253 172.253 173.796 -1.543 18935 12275 1 16 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.246 -1.155 18935 12276 1 16 . 1 1 33 33 ASN CB C 33 38.339 38.339 41.908 -3.570 18935 12277 1 16 . 1 1 33 33 ASN H H 33 8.051 8.051 8.172 -0.121 18935 12278 1 16 . 1 1 34 34 ILE N N 34 118.949 118.949 121.377 -2.428 18935 12279 1 16 . 1 1 34 34 ILE C C 34 175.343 175.343 173.905 1.438 18935 12280 1 16 . 1 1 34 34 ILE CA C 34 60.553 60.553 61.146 -0.593 18935 12281 1 16 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.928 -3.061 18935 12282 1 16 . 1 1 34 34 ILE H H 34 7.670 7.670 8.204 -0.534 18935 12283 1 16 . 1 1 35 35 VAL N N 35 128.355 128.355 126.889 1.466 18935 12284 1 16 . 1 1 35 35 VAL C C 35 175.543 175.543 174.206 1.337 18935 12285 1 16 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.657 -0.643 18935 12286 1 16 . 1 1 35 35 VAL CB C 35 34.231 34.231 34.929 -0.698 18935 12287 1 16 . 1 1 35 35 VAL H H 35 9.698 9.698 9.169 0.529 18935 12288 1 16 . 1 1 36 36 ALA N N 36 129.553 129.553 132.604 -3.051 18935 12289 1 16 . 1 1 36 36 ALA C C 36 177.015 177.015 176.727 0.288 18935 12290 1 16 . 1 1 36 36 ALA CA C 36 52.396 52.396 50.884 1.512 18935 12291 1 16 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.599 -0.977 18935 12292 1 16 . 1 1 36 36 ALA H H 36 8.917 8.917 8.624 0.293 18935 12293 1 16 . 1 1 37 37 VAL N N 37 115.006 115.006 121.501 -6.495 18935 12294 1 16 . 1 1 37 37 VAL C C 37 174.649 174.649 175.258 -0.609 18935 12295 1 16 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.462 -0.141 18935 12296 1 16 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.600 -1.214 18935 12297 1 16 . 1 1 37 37 VAL H H 37 8.214 8.214 7.542 0.672 18935 12298 1 16 . 1 1 38 38 GLY N N 38 109.387 109.387 107.650 1.737 18935 12299 1 16 . 1 1 38 38 GLY C C 38 174.152 174.152 176.152 -2.000 18935 12300 1 16 . 1 1 38 38 GLY CA C 38 45.497 45.497 44.973 0.524 18935 12301 1 16 . 1 1 38 38 GLY H H 38 8.677 8.677 8.159 0.518 18935 12302 1 16 . 1 1 39 39 SER N N 39 116.776 116.776 117.914 -1.138 18935 12303 1 16 . 1 1 39 39 SER C C 39 175.129 175.129 176.844 -1.715 18935 12304 1 16 . 1 1 39 39 SER CA C 39 60.036 60.036 62.227 -2.191 18935 12305 1 16 . 1 1 39 39 SER CB C 39 61.522 61.522 63.432 -1.910 18935 12306 1 16 . 1 1 39 39 SER H H 39 9.705 9.705 8.780 0.925 18935 12307 1 16 . 1 1 40 40 LEU N N 40 113.696 113.696 115.683 -1.987 18935 12308 1 16 . 1 1 40 40 LEU C C 40 180.558 180.558 177.907 2.651 18935 12309 1 16 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.120 1.254 18935 12310 1 16 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.239 0.638 18935 12311 1 16 . 1 1 40 40 LEU H H 40 7.311 7.311 8.156 -0.845 18935 12312 1 16 . 1 1 41 41 ARG N N 41 121.162 121.162 116.548 4.614 18935 12313 1 16 . 1 1 41 41 ARG C C 41 176.964 176.964 176.928 0.036 18935 12314 1 16 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.740 1.711 18935 12315 1 16 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.400 -2.195 18935 12316 1 16 . 1 1 41 41 ARG H H 41 6.999 6.999 7.625 -0.626 18935 12317 1 16 . 1 1 42 42 ARG N N 42 111.109 111.109 117.331 -6.222 18935 12318 1 16 . 1 1 42 42 ARG C C 42 172.564 172.564 175.423 -2.859 18935 12319 1 16 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.824 0.556 18935 12320 1 16 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.834 -2.485 18935 12321 1 16 . 1 1 42 42 ARG H H 42 7.041 7.041 7.594 -0.553 18935 12322 1 16 . 1 1 43 43 GLU N N 43 111.924 111.924 114.957 -3.033 18935 12323 1 16 . 1 1 43 43 GLU C C 43 176.202 176.202 175.462 0.740 18935 12324 1 16 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.507 -1.053 18935 12325 1 16 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.072 -1.771 18935 12326 1 16 . 1 1 43 43 GLU H H 43 7.757 7.757 7.966 -0.209 18935 12327 1 16 . 1 1 44 44 GLU N N 44 117.861 117.861 117.799 0.062 18935 12328 1 16 . 1 1 44 44 GLU C C 44 175.197 175.197 176.857 -1.660 18935 12329 1 16 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.119 0.009 18935 12330 1 16 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.952 -2.393 18935 12331 1 16 . 1 1 44 44 GLU H H 44 7.461 7.461 7.798 -0.337 18935 12332 1 16 . 1 1 45 45 LYS N N 45 115.051 115.051 118.712 -3.661 18935 12333 1 16 . 1 1 45 45 LYS C C 45 177.733 177.733 176.050 1.683 18935 12334 1 16 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.721 1.333 18935 12335 1 16 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.353 -1.326 18935 12336 1 16 . 1 1 45 45 LYS H H 45 8.123 8.123 8.599 -0.476 18935 12337 1 16 . 1 1 46 46 MET N N 46 114.009 114.009 120.018 -6.009 18935 12338 1 16 . 1 1 46 46 MET C C 46 174.067 174.067 174.454 -0.387 18935 12339 1 16 . 1 1 46 46 MET CA C 46 52.477 52.477 54.576 -2.099 18935 12340 1 16 . 1 1 46 46 MET CB C 46 33.974 33.974 33.789 0.185 18935 12341 1 16 . 1 1 46 46 MET H H 46 7.767 7.767 7.474 0.293 18935 12342 1 16 . 1 1 47 47 LEU N N 47 120.263 120.263 124.780 -4.517 18935 12343 1 16 . 1 1 47 47 LEU C C 47 177.669 177.669 176.631 1.038 18935 12344 1 16 . 1 1 47 47 LEU CA C 47 52.201 52.201 54.132 -1.931 18935 12345 1 16 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.071 -0.163 18935 12346 1 16 . 1 1 47 47 LEU H H 47 9.481 9.481 8.350 1.131 18935 12347 1 16 . 1 1 48 48 ASN N N 48 118.632 118.632 118.207 0.425 18935 12348 1 16 . 1 1 48 48 ASN C C 48 174.715 174.715 174.220 0.495 18935 12349 1 16 . 1 1 48 48 ASN CA C 48 55.501 55.501 54.221 1.280 18935 12350 1 16 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.642 -1.814 18935 12351 1 16 . 1 1 48 48 ASN H H 48 9.388 9.388 9.156 0.232 18935 12352 1 16 . 1 1 49 49 ASP N N 49 115.867 115.867 114.767 1.100 18935 12353 1 16 . 1 1 49 49 ASP C C 49 174.111 174.111 174.049 0.062 18935 12354 1 16 . 1 1 49 49 ASP CA C 49 51.201 51.201 53.114 -1.913 18935 12355 1 16 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.632 -3.555 18935 12356 1 16 . 1 1 49 49 ASP H H 49 7.670 7.670 7.569 0.101 18935 12357 1 16 . 1 1 50 50 VAL N N 50 119.185 119.185 118.543 0.642 18935 12358 1 16 . 1 1 50 50 VAL C C 50 172.333 172.333 174.490 -2.157 18935 12359 1 16 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.273 0.643 18935 12360 1 16 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.241 -1.276 18935 12361 1 16 . 1 1 50 50 VAL H H 50 8.339 8.339 7.960 0.379 18935 12362 1 16 . 1 1 51 51 ASP N N 51 124.704 124.704 126.052 -1.348 18935 12363 1 16 . 1 1 51 51 ASP C C 51 173.725 173.725 175.192 -1.467 18935 12364 1 16 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.403 -0.375 18935 12365 1 16 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.801 0.028 18935 12366 1 16 . 1 1 51 51 ASP H H 51 8.984 8.984 8.123 0.861 18935 12367 1 16 . 1 1 52 52 LEU N N 52 120.943 120.943 121.792 -0.849 18935 12368 1 16 . 1 1 52 52 LEU C C 52 173.045 173.045 174.603 -1.558 18935 12369 1 16 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.739 -0.869 18935 12370 1 16 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.004 -1.751 18935 12371 1 16 . 1 1 52 52 LEU H H 52 9.081 9.081 8.670 0.411 18935 12372 1 16 . 1 1 53 53 LEU N N 53 123.027 123.027 124.919 -1.892 18935 12373 1 16 . 1 1 53 53 LEU C C 53 173.750 173.750 175.115 -1.365 18935 12374 1 16 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.548 -1.215 18935 12375 1 16 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.616 -0.608 18935 12376 1 16 . 1 1 53 53 LEU H H 53 9.146 9.146 9.158 -0.012 18935 12377 1 16 . 1 1 54 54 ILE N N 54 126.562 126.562 127.566 -1.004 18935 12378 1 16 . 1 1 54 54 ILE C C 54 175.132 175.132 175.092 0.040 18935 12379 1 16 . 1 1 54 54 ILE CA C 54 58.598 58.598 60.204 -1.606 18935 12380 1 16 . 1 1 54 54 ILE CB C 54 38.561 38.561 40.130 -1.569 18935 12381 1 16 . 1 1 54 54 ILE H H 54 9.440 9.440 9.076 0.364 18935 12382 1 16 . 1 1 55 55 ILE N N 55 126.879 126.879 128.456 -1.577 18935 12383 1 16 . 1 1 55 55 ILE C C 55 175.655 175.655 175.276 0.379 18935 12384 1 16 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.433 -2.872 18935 12385 1 16 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.790 -5.484 18935 12386 1 16 . 1 1 55 55 ILE H H 55 9.381 9.381 8.637 0.744 18935 12387 1 16 . 1 1 56 56 VAL N N 56 128.936 128.936 124.846 4.090 18935 12388 1 16 . 1 1 56 56 VAL C C 56 176.389 176.389 174.646 1.743 18935 12389 1 16 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.543 0.087 18935 12390 1 16 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.025 -0.241 18935 12391 1 16 . 1 1 56 56 VAL H H 56 9.227 9.227 8.839 0.388 18935 12392 1 16 . 1 1 58 58 GLU N N 58 112.423 112.423 119.337 -6.914 18935 12393 1 16 . 1 1 58 58 GLU C C 58 175.946 175.946 176.634 -0.688 18935 12394 1 16 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.383 -1.083 18935 12395 1 16 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.167 0.930 18935 12396 1 16 . 1 1 58 58 GLU H H 58 6.685 6.685 7.959 -1.274 18935 12397 1 16 . 1 1 59 59 LYS N N 59 125.293 125.293 121.225 4.068 18935 12398 1 16 . 1 1 59 59 LYS C C 59 179.248 179.248 176.105 3.143 18935 12399 1 16 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.499 2.275 18935 12400 1 16 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.309 -1.232 18935 12401 1 16 . 1 1 59 59 LYS H H 59 9.108 9.108 8.620 0.488 18935 12402 1 16 . 1 1 60 60 LYS N N 60 117.408 117.408 118.811 -1.403 18935 12403 1 16 . 1 1 60 60 LYS C C 60 177.198 177.198 177.695 -0.497 18935 12404 1 16 . 1 1 60 60 LYS CA C 60 58.213 58.213 57.018 1.195 18935 12405 1 16 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.944 -2.361 18935 12406 1 16 . 1 1 60 60 LYS H H 60 9.102 9.102 7.620 1.482 18935 12407 1 16 . 1 1 61 61 LEU N N 61 114.779 114.779 121.475 -6.696 18935 12408 1 16 . 1 1 61 61 LEU C C 61 178.790 178.790 178.682 0.108 18935 12409 1 16 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.644 -2.620 18935 12410 1 16 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.524 -0.660 18935 12411 1 16 . 1 1 61 61 LEU H H 61 7.455 7.455 8.394 -0.939 18935 12412 1 16 . 1 1 62 62 LEU N N 62 119.629 119.629 117.864 1.765 18935 12413 1 16 . 1 1 62 62 LEU C C 62 177.762 177.762 177.239 0.523 18935 12414 1 16 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.693 0.505 18935 12415 1 16 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.856 -1.125 18935 12416 1 16 . 1 1 62 62 LEU H H 62 7.714 7.714 7.550 0.164 18935 12417 1 16 . 1 1 63 63 LYS N N 63 112.921 112.921 114.557 -1.636 18935 12418 1 16 . 1 1 63 63 LYS C C 63 175.386 175.386 177.704 -2.318 18935 12419 1 16 . 1 1 63 63 LYS CA C 63 57.356 57.356 56.429 0.927 18935 12420 1 16 . 1 1 63 63 LYS CB C 63 30.963 30.963 33.029 -2.066 18935 12421 1 16 . 1 1 63 63 LYS H H 63 7.751 7.751 8.151 -0.400 18935 12422 1 16 . 1 1 64 64 HIS N N 64 112.468 112.468 117.667 -5.199 18935 12423 1 16 . 1 1 64 64 HIS C C 64 176.081 176.081 176.762 -0.681 18935 12424 1 16 . 1 1 64 64 HIS CA C 64 55.769 55.769 59.033 -3.264 18935 12425 1 16 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.220 1.150 18935 12426 1 16 . 1 1 64 64 HIS H H 64 7.697 7.697 7.668 0.029 18935 12427 1 16 . 1 1 65 65 VAL N N 65 117.499 117.499 118.652 -1.153 18935 12428 1 16 . 1 1 65 65 VAL C C 65 174.301 174.301 177.105 -2.804 18935 12429 1 16 . 1 1 65 65 VAL CA C 65 66.330 66.330 64.476 1.854 18935 12430 1 16 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.082 -1.722 18935 12431 1 16 . 1 1 65 65 VAL H H 65 6.917 6.917 7.209 -0.292 18935 12432 1 16 . 1 1 66 66 LEU N N 66 113.873 113.873 118.467 -4.594 18935 12433 1 16 . 1 1 66 66 LEU CA C 66 57.850 57.850 58.145 -0.296 18935 12434 1 16 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.519 -3.461 18935 12435 1 16 . 1 1 66 66 LEU H H 66 9.102 9.102 7.829 1.273 18935 12436 1 16 . 1 1 68 68 ASN N N 68 110.792 110.792 115.819 -5.027 18935 12437 1 16 . 1 1 68 68 ASN C C 68 174.877 174.877 173.413 1.464 18935 12438 1 16 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.405 -1.590 18935 12439 1 16 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.714 -1.403 18935 12440 1 16 . 1 1 68 68 ASN H H 68 7.234 7.234 8.305 -1.071 18935 12441 1 16 . 1 1 69 69 ILE N N 69 122.348 122.348 124.678 -2.330 18935 12442 1 16 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.102 -0.191 18935 12443 1 16 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.589 -2.550 18935 12444 1 16 . 1 1 69 69 ILE H H 69 7.428 7.428 8.658 -1.230 18935 12445 1 16 . 1 1 70 70 ARG N N 70 125.701 125.701 127.422 -1.721 18935 12446 1 16 . 1 1 70 70 ARG C C 70 174.596 174.596 173.222 1.374 18935 12447 1 16 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.414 -1.253 18935 12448 1 16 . 1 1 70 70 ARG CB C 70 32.453 32.453 33.597 -1.144 18935 12449 1 16 . 1 1 70 70 ARG H H 70 9.083 9.083 9.015 0.068 18935 12450 1 16 . 1 1 71 71 ILE N N 71 118.496 118.496 120.413 -1.917 18935 12451 1 16 . 1 1 71 71 ILE C C 71 175.625 175.625 174.511 1.114 18935 12452 1 16 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.554 0.222 18935 12453 1 16 . 1 1 71 71 ILE CB C 71 37.967 37.967 41.243 -3.276 18935 12454 1 16 . 1 1 71 71 ILE H H 71 7.864 7.864 7.855 0.009 18935 12455 1 16 . 1 1 72 72 LYS N N 72 127.423 127.423 129.450 -2.027 18935 12456 1 16 . 1 1 72 72 LYS C C 72 177.659 177.659 177.129 0.530 18935 12457 1 16 . 1 1 72 72 LYS CA C 72 57.428 57.428 57.313 0.115 18935 12458 1 16 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.803 -1.429 18935 12459 1 16 . 1 1 72 72 LYS H H 72 8.720 8.720 8.967 -0.247 18935 12460 1 16 . 1 1 73 73 GLY N N 73 112.604 112.604 111.517 1.087 18935 12461 1 16 . 1 1 73 73 GLY C C 73 173.729 173.729 174.037 -0.308 18935 12462 1 16 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.249 0.582 18935 12463 1 16 . 1 1 73 73 GLY H H 73 8.930 8.930 8.793 0.137 18935 12464 1 16 . 1 1 74 74 LEU N N 74 119.538 119.538 120.295 -0.757 18935 12465 1 16 . 1 1 74 74 LEU C C 74 175.802 175.802 175.651 0.151 18935 12466 1 16 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.685 -0.024 18935 12467 1 16 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.540 -0.487 18935 12468 1 16 . 1 1 74 74 LEU H H 74 7.547 7.547 7.760 -0.213 18935 12469 1 16 . 1 1 75 75 SER N N 75 118.994 118.994 115.806 3.188 18935 12470 1 16 . 1 1 75 75 SER C C 75 173.111 173.111 172.900 0.211 18935 12471 1 16 . 1 1 75 75 SER CA C 75 57.696 57.696 57.919 -0.223 18935 12472 1 16 . 1 1 75 75 SER CB C 75 63.073 63.073 63.230 -0.157 18935 12473 1 16 . 1 1 75 75 SER H H 75 9.076 9.076 8.625 0.451 18935 12474 1 16 . 1 1 76 76 PHE N N 76 117.802 117.802 121.089 -3.287 18935 12475 1 16 . 1 1 76 76 PHE C C 76 173.564 173.564 174.784 -1.220 18935 12476 1 16 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.211 -0.802 18935 12477 1 16 . 1 1 76 76 PHE CB C 76 41.843 41.843 43.020 -1.177 18935 12478 1 16 . 1 1 76 76 PHE H H 76 8.119 8.119 7.628 0.491 18935 12479 1 16 . 1 1 77 77 SER N N 77 113.918 113.918 117.404 -3.486 18935 12480 1 16 . 1 1 77 77 SER C C 77 173.194 173.194 173.459 -0.265 18935 12481 1 16 . 1 1 77 77 SER CA C 77 55.999 55.999 57.202 -1.203 18935 12482 1 16 . 1 1 77 77 SER CB C 77 65.218 65.218 65.281 -0.063 18935 12483 1 16 . 1 1 77 77 SER H H 77 8.989 8.989 8.713 0.276 18935 12484 1 16 . 1 1 78 78 VAL N N 78 123.662 123.662 126.181 -2.519 18935 12485 1 16 . 1 1 78 78 VAL C C 78 176.057 176.057 176.076 -0.019 18935 12486 1 16 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.613 -0.522 18935 12487 1 16 . 1 1 78 78 VAL CB C 78 32.294 32.294 32.412 -0.118 18935 12488 1 16 . 1 1 78 78 VAL H H 78 8.995 8.995 8.857 0.138 18935 12489 1 16 . 1 1 79 79 LYS N N 79 129.417 129.417 128.633 0.784 18935 12490 1 16 . 1 1 79 79 LYS C C 79 176.436 176.436 174.689 1.747 18935 12491 1 16 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.448 3.204 18935 12492 1 16 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.652 -4.179 18935 12493 1 16 . 1 1 79 79 LYS H H 79 9.425 9.425 9.041 0.384 18935 12494 1 16 . 1 1 80 80 VAL N N 80 108.616 108.616 122.392 -13.776 18935 12495 1 16 . 1 1 80 80 VAL CA C 80 59.097 59.097 62.305 -3.208 18935 12496 1 16 . 1 1 80 80 VAL CB C 80 34.082 34.082 32.934 1.148 18935 12497 1 16 . 1 1 80 80 VAL H H 80 7.380 7.380 8.500 -1.120 18935 12498 1 16 . 1 1 81 81 CYS N N 81 123.254 123.254 128.912 -5.658 18935 12499 1 16 . 1 1 81 81 CYS C C 81 172.053 172.053 174.647 -2.594 18935 12500 1 16 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.813 1.926 18935 12501 1 16 . 1 1 81 81 CYS CB C 81 27.332 27.332 29.494 -2.163 18935 12502 1 16 . 1 1 81 81 CYS H H 81 9.759 9.759 8.670 1.089 18935 12503 1 16 . 1 1 82 82 GLY N N 82 118.450 118.450 115.870 2.580 18935 12504 1 16 . 1 1 82 82 GLY C C 82 171.814 171.814 174.812 -2.998 18935 12505 1 16 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.743 -2.390 18935 12506 1 16 . 1 1 82 82 GLY H H 82 8.537 8.537 8.909 -0.372 18935 12507 1 16 . 1 1 83 83 GLU N N 83 113.964 113.964 121.611 -7.647 18935 12508 1 16 . 1 1 83 83 GLU C C 83 179.320 179.320 177.655 1.665 18935 12509 1 16 . 1 1 83 83 GLU CA C 83 57.675 57.675 58.224 -0.549 18935 12510 1 16 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.742 0.165 18935 12511 1 16 . 1 1 83 83 GLU H H 83 8.473 8.473 8.720 -0.247 18935 12512 1 16 . 1 1 84 84 ARG N N 84 117.544 117.544 117.286 0.258 18935 12513 1 16 . 1 1 84 84 ARG C C 84 177.252 177.252 176.110 1.142 18935 12514 1 16 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.523 -1.019 18935 12515 1 16 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.011 0.535 18935 12516 1 16 . 1 1 84 84 ARG H H 84 9.760 9.760 8.188 1.572 18935 12517 1 16 . 1 1 85 85 LYS N N 85 124.160 124.160 121.916 2.244 18935 12518 1 16 . 1 1 85 85 LYS C C 85 173.379 173.379 175.514 -2.135 18935 12519 1 16 . 1 1 85 85 LYS CA C 85 55.232 55.232 57.288 -2.056 18935 12520 1 16 . 1 1 85 85 LYS CB C 85 34.212 34.212 33.926 0.286 18935 12521 1 16 . 1 1 85 85 LYS H H 85 8.494 8.494 8.287 0.207 18935 12522 1 16 . 1 1 86 86 CYS N N 86 126.472 126.472 118.227 8.245 18935 12523 1 16 . 1 1 86 86 CYS C C 86 171.935 171.935 173.227 -1.292 18935 12524 1 16 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.888 -2.010 18935 12525 1 16 . 1 1 86 86 CYS CB C 86 30.304 30.304 28.397 1.907 18935 12526 1 16 . 1 1 86 86 CYS H H 86 9.221 9.221 8.380 0.841 18935 12527 1 16 . 1 1 87 87 VAL N N 87 126.426 126.426 124.804 1.622 18935 12528 1 16 . 1 1 87 87 VAL C C 87 173.760 173.760 173.820 -0.060 18935 12529 1 16 . 1 1 87 87 VAL CA C 87 61.333 61.333 60.504 0.829 18935 12530 1 16 . 1 1 87 87 VAL CB C 87 33.338 33.338 34.868 -1.530 18935 12531 1 16 . 1 1 87 87 VAL H H 87 8.623 8.623 8.968 -0.345 18935 12532 1 16 . 1 1 88 88 LEU N N 88 125.701 125.701 126.746 -1.045 18935 12533 1 16 . 1 1 88 88 LEU C C 88 175.424 175.424 175.285 0.139 18935 12534 1 16 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.574 -1.489 18935 12535 1 16 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.854 -2.310 18935 12536 1 16 . 1 1 88 88 LEU H H 88 9.592 9.592 9.128 0.464 18935 12537 1 16 . 1 1 89 89 PHE N N 89 118.314 118.314 122.678 -4.364 18935 12538 1 16 . 1 1 89 89 PHE C C 89 177.068 177.068 175.941 1.127 18935 12539 1 16 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.603 -0.728 18935 12540 1 16 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.278 -0.441 18935 12541 1 16 . 1 1 89 89 PHE H H 89 8.979 8.979 8.960 0.019 18935 12542 1 16 . 1 1 90 90 ILE N N 90 119.039 119.039 119.767 -0.728 18935 12543 1 16 . 1 1 90 90 ILE C C 90 173.692 173.692 175.342 -1.650 18935 12544 1 16 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.904 -1.232 18935 12545 1 16 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.565 0.618 18935 12546 1 16 . 1 1 90 90 ILE H H 90 9.447 9.447 8.522 0.925 18935 12547 1 16 . 1 1 91 91 GLU N N 91 122.801 122.801 125.883 -3.082 18935 12548 1 16 . 1 1 91 91 GLU C C 91 175.565 175.565 175.356 0.209 18935 12549 1 16 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.203 -0.738 18935 12550 1 16 . 1 1 91 91 GLU CB C 91 29.662 29.662 31.625 -1.963 18935 12551 1 16 . 1 1 91 91 GLU H H 91 8.360 8.360 8.641 -0.281 18935 12552 1 16 . 1 1 92 92 TRP N N 92 126.018 126.018 120.757 5.261 18935 12553 1 16 . 1 1 92 92 TRP C C 92 175.070 175.070 175.064 0.006 18935 12554 1 16 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.397 -0.207 18935 12555 1 16 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.209 -0.627 18935 12556 1 16 . 1 1 92 92 TRP H H 92 9.425 9.425 8.304 1.121 18935 12557 1 16 . 1 1 93 93 GLU N N 93 126.381 126.381 120.857 5.524 18935 12558 1 16 . 1 1 93 93 GLU C C 93 175.637 175.637 175.722 -0.085 18935 12559 1 16 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.755 -0.986 18935 12560 1 16 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.101 -2.157 18935 12561 1 16 . 1 1 93 93 GLU H H 93 8.914 8.914 9.219 -0.305 18935 12562 1 16 . 1 1 94 94 LYS N N 94 107.891 107.891 112.375 -4.484 18935 12563 1 16 . 1 1 94 94 LYS C C 94 175.359 175.359 175.645 -0.286 18935 12564 1 16 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.094 0.335 18935 12565 1 16 . 1 1 94 94 LYS CB C 94 28.642 28.642 31.056 -2.414 18935 12566 1 16 . 1 1 94 94 LYS H H 94 8.634 8.634 8.489 0.145 18935 12567 1 16 . 1 1 95 95 LYS N N 95 120.490 120.490 118.961 1.529 18935 12568 1 16 . 1 1 95 95 LYS C C 95 174.369 174.369 174.309 0.060 18935 12569 1 16 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.882 -0.529 18935 12570 1 16 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.305 -0.842 18935 12571 1 16 . 1 1 95 95 LYS H H 95 7.924 7.924 7.606 0.318 18935 12572 1 16 . 1 1 96 96 THR N N 96 115.278 115.278 114.053 1.225 18935 12573 1 16 . 1 1 96 96 THR C C 96 174.317 174.317 173.324 0.993 18935 12574 1 16 . 1 1 96 96 THR CA C 96 61.203 61.203 60.734 0.469 18935 12575 1 16 . 1 1 96 96 THR CB C 96 69.348 69.348 69.696 -0.348 18935 12576 1 16 . 1 1 96 96 THR H H 96 7.967 7.967 7.762 0.205 18935 12577 1 16 . 1 1 97 97 TYR N N 97 123.254 123.254 125.891 -2.637 18935 12578 1 16 . 1 1 97 97 TYR C C 97 173.320 173.320 174.638 -1.318 18935 12579 1 16 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.174 -0.290 18935 12580 1 16 . 1 1 97 97 TYR CB C 97 41.136 41.136 40.920 0.216 18935 12581 1 16 . 1 1 97 97 TYR H H 97 9.232 9.232 9.020 0.212 18935 12582 1 16 . 1 1 98 98 GLN N N 98 122.574 122.574 119.013 3.561 18935 12583 1 16 . 1 1 98 98 GLN C C 98 172.781 172.781 174.269 -1.488 18935 12584 1 16 . 1 1 98 98 GLN CA C 98 55.171 55.171 54.895 0.276 18935 12585 1 16 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.123 -2.724 18935 12586 1 16 . 1 1 98 98 GLN H H 98 9.000 9.000 8.791 0.209 18935 12587 1 16 . 1 1 99 99 LEU N N 99 130.218 130.218 125.381 4.837 18935 12588 1 16 . 1 1 99 99 LEU C C 99 172.806 172.806 174.165 -1.359 18935 12589 1 16 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.352 -1.302 18935 12590 1 16 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.568 -0.816 18935 12591 1 16 . 1 1 99 99 LEU H H 99 9.246 9.246 9.097 0.149 18935 12592 1 16 . 1 1 100 100 ASP N N 100 124.931 124.931 127.230 -2.299 18935 12593 1 16 . 1 1 100 100 ASP C C 100 172.626 172.626 174.696 -2.070 18935 12594 1 16 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.335 -2.905 18935 12595 1 16 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.175 -5.847 18935 12596 1 16 . 1 1 100 100 ASP H H 100 9.253 9.253 8.442 0.811 18935 12597 1 16 . 1 1 101 101 LEU N N 101 119.402 119.402 119.888 -0.486 18935 12598 1 16 . 1 1 101 101 LEU C C 101 173.869 173.869 174.288 -0.419 18935 12599 1 16 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.930 -1.275 18935 12600 1 16 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.778 0.388 18935 12601 1 16 . 1 1 101 101 LEU H H 101 8.726 8.726 7.626 1.100 18935 12602 1 16 . 1 1 102 102 PHE N N 102 117.952 117.952 117.816 0.136 18935 12603 1 16 . 1 1 102 102 PHE C C 102 175.853 175.853 175.173 0.680 18935 12604 1 16 . 1 1 102 102 PHE CA C 102 53.282 53.282 56.791 -3.509 18935 12605 1 16 . 1 1 102 102 PHE CB C 102 41.824 41.824 41.909 -0.085 18935 12606 1 16 . 1 1 102 102 PHE H H 102 8.236 8.236 9.027 -0.791 18935 12607 1 16 . 1 1 103 103 THR N N 103 106.853 106.853 119.017 -12.164 18935 12608 1 16 . 1 1 103 103 THR C C 103 175.154 175.154 174.343 0.811 18935 12609 1 16 . 1 1 103 103 THR CA C 103 57.685 57.685 60.505 -2.820 18935 12610 1 16 . 1 1 103 103 THR CB C 103 71.037 71.037 69.570 1.467 18935 12611 1 16 . 1 1 103 103 THR H H 103 7.917 7.917 8.668 -0.751 18935 12612 1 16 . 1 1 104 104 ALA N N 104 122.348 122.348 127.975 -5.627 18935 12613 1 16 . 1 1 104 104 ALA C C 104 175.947 175.947 174.730 1.217 18935 12614 1 16 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.620 -0.813 18935 12615 1 16 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.172 0.256 18935 12616 1 16 . 1 1 104 104 ALA H H 104 8.930 8.930 8.793 0.137 18935 12617 1 16 . 1 1 105 105 LEU N N 105 119.855 119.855 119.183 0.672 18935 12618 1 16 . 1 1 105 105 LEU C C 105 179.628 179.628 179.067 0.561 18935 12619 1 16 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.380 -1.258 18935 12620 1 16 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.175 -1.841 18935 12621 1 16 . 1 1 105 105 LEU H H 105 8.316 8.316 9.423 -1.107 18935 12622 1 16 . 1 1 106 106 ALA N N 106 123.662 123.662 124.202 -0.540 18935 12623 1 16 . 1 1 106 106 ALA C C 106 181.056 181.056 177.814 3.242 18935 12624 1 16 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.088 1.261 18935 12625 1 16 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.642 -1.327 18935 12626 1 16 . 1 1 106 106 ALA H H 106 8.306 8.306 8.469 -0.163 18935 12627 1 16 . 1 1 107 107 GLU N N 107 114.825 114.825 114.643 0.182 18935 12628 1 16 . 1 1 107 107 GLU C C 107 177.854 177.854 176.960 0.894 18935 12629 1 16 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.776 0.610 18935 12630 1 16 . 1 1 107 107 GLU CB C 107 27.844 27.844 29.071 -1.227 18935 12631 1 16 . 1 1 107 107 GLU H H 107 9.754 9.754 8.645 1.109 18935 12632 1 16 . 1 1 108 108 GLU N N 108 115.097 115.097 119.175 -4.078 18935 12633 1 16 . 1 1 108 108 GLU C C 108 178.001 178.001 177.769 0.232 18935 12634 1 16 . 1 1 108 108 GLU CA C 108 54.926 54.926 57.044 -2.118 18935 12635 1 16 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.778 0.223 18935 12636 1 16 . 1 1 108 108 GLU H H 108 7.859 7.859 7.720 0.139 18935 12637 1 16 . 1 1 109 109 LYS N N 109 118.360 118.360 121.599 -3.239 18935 12638 1 16 . 1 1 109 109 LYS C C 109 172.691 172.691 175.945 -3.254 18935 12639 1 16 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.502 1.400 18935 12640 1 16 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.878 -0.337 18935 12641 1 16 . 1 1 109 109 LYS H H 109 7.660 7.660 7.550 0.110 18935 12642 1 16 . 1 1 111 111 TYR N N 111 114.054 114.054 118.222 -4.168 18935 12643 1 16 . 1 1 111 111 TYR C C 111 179.764 179.764 178.141 1.623 18935 12644 1 16 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.812 -1.814 18935 12645 1 16 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.352 -1.396 18935 12646 1 16 . 1 1 111 111 TYR H H 111 6.583 6.583 8.399 -1.816 18935 12647 1 16 . 1 1 112 112 ALA N N 112 124.749 124.749 123.184 1.565 18935 12648 1 16 . 1 1 112 112 ALA C C 112 179.430 179.430 179.199 0.231 18935 12649 1 16 . 1 1 112 112 ALA CA C 112 54.969 54.969 53.998 0.971 18935 12650 1 16 . 1 1 112 112 ALA CB C 112 18.812 18.812 19.109 -0.297 18935 12651 1 16 . 1 1 112 112 ALA H H 112 8.753 8.753 8.576 0.177 18935 12652 1 16 . 1 1 113 113 ILE N N 113 119.130 119.130 119.757 -0.627 18935 12653 1 16 . 1 1 113 113 ILE C C 113 178.646 178.646 177.875 0.771 18935 12654 1 16 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.143 3.258 18935 12655 1 16 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.461 0.776 18935 12656 1 16 . 1 1 113 113 ILE H H 113 8.946 8.946 8.345 0.601 18935 12657 1 16 . 1 1 114 114 PHE N N 114 121.758 121.758 119.692 2.066 18935 12658 1 16 . 1 1 114 114 PHE C C 114 177.954 177.954 177.271 0.683 18935 12659 1 16 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.531 -1.754 18935 12660 1 16 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.928 0.136 18935 12661 1 16 . 1 1 114 114 PHE H H 114 7.940 7.940 8.103 -0.163 18935 12662 1 16 . 1 1 115 115 HIS N N 115 116.547 116.547 117.359 -0.812 18935 12663 1 16 . 1 1 115 115 HIS C C 115 176.161 176.161 176.384 -0.223 18935 12664 1 16 . 1 1 115 115 HIS CA C 115 59.119 59.119 58.573 0.546 18935 12665 1 16 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.711 1.356 18935 12666 1 16 . 1 1 115 115 HIS H H 115 7.767 7.767 7.701 0.066 18935 12667 1 16 . 1 1 116 116 PHE N N 116 109.387 109.387 116.878 -7.491 18935 12668 1 16 . 1 1 116 116 PHE C C 116 177.282 177.282 176.264 1.018 18935 12669 1 16 . 1 1 116 116 PHE CA C 116 61.434 61.434 60.019 1.415 18935 12670 1 16 . 1 1 116 116 PHE CB C 116 37.255 37.255 40.029 -2.774 18935 12671 1 16 . 1 1 116 116 PHE H H 116 8.989 8.989 7.728 1.261 18935 12672 1 16 . 1 1 117 117 THR N N 117 116.864 116.864 113.660 3.204 18935 12673 1 16 . 1 1 117 117 THR C C 117 172.889 172.889 174.239 -1.350 18935 12674 1 16 . 1 1 117 117 THR CA C 117 66.997 66.997 62.309 4.688 18935 12675 1 16 . 1 1 117 117 THR CB C 117 67.948 67.948 69.539 -1.591 18935 12676 1 16 . 1 1 117 117 THR H H 117 7.988 7.988 7.628 0.360 18935 12677 1 16 . 1 1 118 118 GLY N N 118 103.320 103.320 109.467 -6.147 18935 12678 1 16 . 1 1 118 118 GLY C C 118 176.912 176.912 171.532 5.380 18935 12679 1 16 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.374 1.808 18935 12680 1 16 . 1 1 118 118 GLY H H 118 6.550 6.550 7.195 -0.645 18935 12681 1 16 . 1 1 120 120 VAL N N 120 120.671 120.671 127.342 -6.671 18935 12682 1 16 . 1 1 120 120 VAL C C 120 176.283 176.283 177.279 -0.996 18935 12683 1 16 . 1 1 120 120 VAL CA C 120 66.940 66.940 66.630 0.310 18935 12684 1 16 . 1 1 120 120 VAL CB C 120 29.852 29.852 32.010 -2.158 18935 12685 1 16 . 1 1 120 120 VAL H H 120 8.408 8.408 8.579 -0.171 18935 12686 1 16 . 1 1 121 121 SER N N 121 111.789 111.789 114.985 -3.196 18935 12687 1 16 . 1 1 121 121 SER C C 121 175.658 175.658 176.642 -0.984 18935 12688 1 16 . 1 1 121 121 SER CA C 121 60.814 60.814 61.635 -0.821 18935 12689 1 16 . 1 1 121 121 SER CB C 121 60.253 60.253 61.890 -1.637 18935 12690 1 16 . 1 1 121 121 SER H H 121 8.290 8.290 8.305 -0.015 18935 12691 1 16 . 1 1 122 122 TYR N N 122 123.254 123.254 123.750 -0.496 18935 12692 1 16 . 1 1 122 122 TYR C C 122 174.611 174.611 178.119 -3.508 18935 12693 1 16 . 1 1 122 122 TYR CA C 122 58.546 58.546 61.201 -2.655 18935 12694 1 16 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.147 -0.007 18935 12695 1 16 . 1 1 122 122 TYR H H 122 6.303 6.303 8.119 -1.816 18935 12696 1 16 . 1 1 123 123 LEU N N 123 114.825 114.825 119.794 -4.969 18935 12697 1 16 . 1 1 123 123 LEU C C 123 178.891 178.891 179.311 -0.420 18935 12698 1 16 . 1 1 123 123 LEU CA C 123 56.779 56.779 58.228 -1.449 18935 12699 1 16 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.889 -0.251 18935 12700 1 16 . 1 1 123 123 LEU H H 123 6.965 6.965 8.211 -1.246 18935 12701 1 16 . 1 1 124 124 ILE N N 124 114.915 114.915 118.714 -3.799 18935 12702 1 16 . 1 1 124 124 ILE C C 124 177.187 177.187 177.844 -0.657 18935 12703 1 16 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.427 -0.996 18935 12704 1 16 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.482 -0.927 18935 12705 1 16 . 1 1 124 124 ILE H H 124 7.531 7.531 8.261 -0.730 18935 12706 1 16 . 1 1 125 125 ARG N N 125 115.278 115.278 119.750 -4.472 18935 12707 1 16 . 1 1 125 125 ARG C C 125 178.473 178.473 178.763 -0.290 18935 12708 1 16 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.728 -0.269 18935 12709 1 16 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.369 -2.290 18935 12710 1 16 . 1 1 125 125 ARG H H 125 6.809 6.809 7.897 -1.088 18935 12711 1 16 . 1 1 126 126 ILE N N 126 124.160 124.160 119.025 5.135 18935 12712 1 16 . 1 1 126 126 ILE C C 126 178.172 178.172 177.504 0.668 18935 12713 1 16 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.615 -1.688 18935 12714 1 16 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.162 -2.696 18935 12715 1 16 . 1 1 126 126 ILE H H 126 7.408 7.408 7.803 -0.395 18935 12716 1 16 . 1 1 127 127 ARG N N 127 117.136 117.136 120.709 -3.573 18935 12717 1 16 . 1 1 127 127 ARG C C 127 179.227 179.227 178.434 0.793 18935 12718 1 16 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.491 0.725 18935 12719 1 16 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.349 -1.560 18935 12720 1 16 . 1 1 127 127 ARG H H 127 8.230 8.230 7.769 0.461 18935 12721 1 16 . 1 1 128 128 ALA N N 128 121.305 121.305 121.033 0.272 18935 12722 1 16 . 1 1 128 128 ALA C C 128 179.933 179.933 178.985 0.948 18935 12723 1 16 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.328 -0.622 18935 12724 1 16 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.151 0.187 18935 12725 1 16 . 1 1 128 128 ALA H H 128 8.666 8.666 7.799 0.867 18935 12726 1 16 . 1 1 129 129 ALA N N 129 120.943 120.943 121.691 -0.748 18935 12727 1 16 . 1 1 129 129 ALA C C 129 181.336 181.336 179.757 1.579 18935 12728 1 16 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.927 -0.219 18935 12729 1 16 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.273 -1.413 18935 12730 1 16 . 1 1 129 129 ALA H H 129 7.837 7.837 7.471 0.366 18935 12731 1 16 . 1 1 130 130 LEU N N 130 117.726 117.726 118.060 -0.334 18935 12732 1 16 . 1 1 130 130 LEU C C 130 179.432 179.432 179.789 -0.357 18935 12733 1 16 . 1 1 130 130 LEU CA C 130 57.176 57.176 58.135 -0.959 18935 12734 1 16 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.833 -1.266 18935 12735 1 16 . 1 1 130 130 LEU H H 130 8.114 8.114 8.293 -0.179 18935 12736 1 16 . 1 1 131 131 LYS N N 131 124.115 124.115 121.333 2.782 18935 12737 1 16 . 1 1 131 131 LYS C C 131 181.452 181.452 179.546 1.906 18935 12738 1 16 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.910 -0.024 18935 12739 1 16 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.917 0.281 18935 12740 1 16 . 1 1 131 131 LYS H H 131 8.849 8.849 8.189 0.660 18935 12741 1 16 . 1 1 132 132 LYS N N 132 119.447 119.447 118.412 1.035 18935 12742 1 16 . 1 1 132 132 LYS C C 132 177.607 177.607 177.725 -0.118 18935 12743 1 16 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.519 -0.567 18935 12744 1 16 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.820 -0.395 18935 12745 1 16 . 1 1 132 132 LYS H H 132 7.778 7.778 8.251 -0.473 18935 12746 1 16 . 1 1 133 133 LYS N N 133 116.638 116.638 114.986 1.652 18935 12747 1 16 . 1 1 133 133 LYS C C 133 174.681 174.681 175.931 -1.250 18935 12748 1 16 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.327 -0.249 18935 12749 1 16 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.681 -1.042 18935 12750 1 16 . 1 1 133 133 LYS H H 133 7.617 7.617 7.788 -0.171 18935 12751 1 16 . 1 1 134 134 ASN N N 134 110.792 110.792 117.498 -6.706 18935 12752 1 16 . 1 1 134 134 ASN C C 134 174.034 174.034 173.340 0.694 18935 12753 1 16 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.259 0.356 18935 12754 1 16 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.023 -0.971 18935 12755 1 16 . 1 1 134 134 ASN H H 134 8.123 8.123 8.491 -0.368 18935 12756 1 16 . 1 1 135 135 TYR N N 135 115.867 115.867 117.436 -1.569 18935 12757 1 16 . 1 1 135 135 TYR C C 135 175.122 175.122 173.786 1.336 18935 12758 1 16 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.802 -0.050 18935 12759 1 16 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.155 -1.239 18935 12760 1 16 . 1 1 135 135 TYR H H 135 8.133 8.133 7.718 0.415 18935 12761 1 16 . 1 1 136 136 LYS N N 136 119.870 119.870 121.883 -2.013 18935 12762 1 16 . 1 1 136 136 LYS C C 136 174.324 174.324 173.976 0.348 18935 12763 1 16 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.743 0.438 18935 12764 1 16 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.717 -2.644 18935 12765 1 16 . 1 1 136 136 LYS H H 136 9.234 9.234 8.837 0.397 18935 12766 1 16 . 1 1 137 137 LEU N N 137 129.708 129.708 127.290 2.418 18935 12767 1 16 . 1 1 137 137 LEU C C 137 173.798 173.798 174.618 -0.820 18935 12768 1 16 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.281 -1.446 18935 12769 1 16 . 1 1 137 137 LEU CB C 137 44.983 44.983 44.108 0.876 18935 12770 1 16 . 1 1 137 137 LEU H H 137 8.959 8.959 8.664 0.295 18935 12771 1 16 . 1 1 140 140 TYR N N 140 120.580 120.580 113.646 6.934 18935 12772 1 16 . 1 1 140 140 TYR C C 140 174.705 174.705 175.947 -1.242 18935 12773 1 16 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.012 -1.560 18935 12774 1 16 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.799 -0.498 18935 12775 1 16 . 1 1 140 140 TYR H H 140 8.962 8.962 7.486 1.476 18935 12776 1 16 . 1 1 141 141 GLY N N 141 104.986 104.986 104.036 0.950 18935 12777 1 16 . 1 1 141 141 GLY C C 141 181.854 181.854 171.954 9.900 18935 12778 1 16 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.630 -0.508 18935 12779 1 16 . 1 1 141 141 GLY H H 141 7.555 7.555 7.443 0.112 18935 12780 1 16 . 1 1 142 142 LEU N N 142 118.269 118.269 121.199 -2.930 18935 12781 1 16 . 1 1 142 142 LEU C C 142 174.067 174.067 175.400 -1.333 18935 12782 1 16 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.200 -0.698 18935 12783 1 16 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.420 1.122 18935 12784 1 16 . 1 1 142 142 LEU H H 142 7.794 7.794 8.391 -0.597 18935 12785 1 16 . 1 1 143 143 PHE N N 143 122.076 122.076 125.169 -3.093 18935 12786 1 16 . 1 1 143 143 PHE C C 143 175.199 175.199 175.150 0.049 18935 12787 1 16 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.482 -1.450 18935 12788 1 16 . 1 1 143 143 PHE CB C 143 42.070 42.070 40.814 1.256 18935 12789 1 16 . 1 1 143 143 PHE H H 143 9.522 9.522 9.618 -0.096 18935 12790 1 16 . 1 1 144 144 LYS N N 144 121.305 121.305 124.799 -3.494 18935 12791 1 16 . 1 1 144 144 LYS C C 144 176.917 176.917 175.839 1.078 18935 12792 1 16 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.302 1.054 18935 12793 1 16 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.275 0.404 18935 12794 1 16 . 1 1 144 144 LYS H H 144 9.076 9.076 9.115 -0.039 18935 12795 1 16 . 1 1 145 145 ASN N N 145 126.834 126.834 123.410 3.424 18935 12796 1 16 . 1 1 145 145 ASN C C 145 175.070 175.070 175.770 -0.700 18935 12797 1 16 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.424 0.340 18935 12798 1 16 . 1 1 145 145 ASN CB C 145 36.430 36.430 38.346 -1.916 18935 12799 1 16 . 1 1 145 145 ASN H H 145 9.618 9.618 9.340 0.278 18935 12800 1 16 . 1 1 146 146 GLN N N 146 110.112 110.112 112.715 -2.603 18935 12801 1 16 . 1 1 146 146 GLN C C 146 175.198 175.198 175.059 0.139 18935 12802 1 16 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.774 -0.878 18935 12803 1 16 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.656 -1.288 18935 12804 1 16 . 1 1 146 146 GLN H H 146 9.140 9.140 8.905 0.235 18935 12805 1 16 . 1 1 147 147 THR N N 147 116.003 116.003 116.472 -0.469 18935 12806 1 16 . 1 1 147 147 THR C C 147 173.224 173.224 173.491 -0.267 18935 12807 1 16 . 1 1 147 147 THR CA C 147 61.450 61.450 61.155 0.295 18935 12808 1 16 . 1 1 147 147 THR CB C 147 70.285 70.285 69.259 1.026 18935 12809 1 16 . 1 1 147 147 THR H H 147 8.069 8.069 7.596 0.473 18935 12810 1 16 . 1 1 148 148 LEU N N 148 129.281 129.281 130.720 -1.439 18935 12811 1 16 . 1 1 148 148 LEU C C 148 176.703 176.703 175.488 1.215 18935 12812 1 16 . 1 1 148 148 LEU CA C 148 55.466 55.466 54.884 0.582 18935 12813 1 16 . 1 1 148 148 LEU CB C 148 41.725 41.725 43.105 -1.380 18935 12814 1 16 . 1 1 148 148 LEU H H 148 8.831 8.831 8.908 -0.077 18935 12815 1 16 . 1 1 149 149 VAL N N 149 130.189 130.189 126.996 3.193 18935 12816 1 16 . 1 1 149 149 VAL C C 149 175.012 175.012 173.990 1.022 18935 12817 1 16 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.809 0.460 18935 12818 1 16 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.023 -3.567 18935 12819 1 16 . 1 1 149 149 VAL H H 149 9.243 9.243 8.942 0.301 18935 12820 1 16 . 1 1 151 151 LEU N N 151 123.481 123.481 115.387 8.094 18935 12821 1 16 . 1 1 151 151 LEU C C 151 177.679 177.679 176.854 0.825 18935 12822 1 16 . 1 1 151 151 LEU CA C 151 53.997 53.997 52.692 1.305 18935 12823 1 16 . 1 1 151 151 LEU CB C 151 43.619 43.619 43.051 0.568 18935 12824 1 16 . 1 1 151 151 LEU H H 151 8.080 8.080 8.053 0.027 18935 12825 1 16 . 1 1 152 152 LYS N N 152 126.381 126.381 120.510 5.871 18935 12826 1 16 . 1 1 152 152 LYS C C 152 175.115 175.115 175.140 -0.025 18935 12827 1 16 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.318 -1.722 18935 12828 1 16 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.262 -3.197 18935 12829 1 16 . 1 1 152 152 LYS H H 152 9.112 9.112 8.619 0.493 18935 12830 1 16 . 1 1 153 153 ILE N N 153 113.737 113.737 116.198 -2.461 18935 12831 1 16 . 1 1 153 153 ILE C C 153 175.748 175.748 173.523 2.225 18935 12832 1 16 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.638 -1.249 18935 12833 1 16 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.685 1.118 18935 12834 1 16 . 1 1 153 153 ILE H H 153 7.304 7.304 7.554 -0.250 18935 12835 1 16 . 1 1 154 154 THR N N 154 110.656 110.656 113.661 -3.005 18935 12836 1 16 . 1 1 154 154 THR C C 154 174.864 174.864 173.785 1.079 18935 12837 1 16 . 1 1 154 154 THR CA C 154 62.141 62.141 61.799 0.342 18935 12838 1 16 . 1 1 154 154 THR CB C 154 70.413 70.413 71.010 -0.597 18935 12839 1 16 . 1 1 154 154 THR H H 154 9.382 9.382 8.564 0.818 18935 12840 1 16 . 1 1 155 155 THR N N 155 110.746 110.746 118.073 -7.327 18935 12841 1 16 . 1 1 155 155 THR C C 155 174.718 174.718 174.720 -0.002 18935 12842 1 16 . 1 1 155 155 THR CA C 155 58.785 58.785 61.163 -2.378 18935 12843 1 16 . 1 1 155 155 THR CB C 155 72.277 72.277 70.882 1.395 18935 12844 1 16 . 1 1 155 155 THR H H 155 7.746 7.746 7.502 0.244 18935 12845 1 16 . 1 1 156 156 GLU N N 156 122.302 122.302 124.042 -1.740 18935 12846 1 16 . 1 1 156 156 GLU C C 156 177.289 177.289 178.031 -0.742 18935 12847 1 16 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.708 -1.884 18935 12848 1 16 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.117 -0.736 18935 12849 1 16 . 1 1 156 156 GLU H H 156 9.490 9.490 9.087 0.403 18935 12850 1 16 . 1 1 157 157 LYS N N 157 118.905 118.905 117.140 1.765 18935 12851 1 16 . 1 1 157 157 LYS C C 157 178.241 178.241 178.864 -0.623 18935 12852 1 16 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.560 1.205 18935 12853 1 16 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.777 -0.499 18935 12854 1 16 . 1 1 157 157 LYS H H 157 8.329 8.329 8.487 -0.158 18935 12855 1 16 . 1 1 158 158 GLU N N 158 116.230 116.230 120.968 -4.738 18935 12856 1 16 . 1 1 158 158 GLU C C 158 178.988 178.988 178.620 0.368 18935 12857 1 16 . 1 1 158 158 GLU CA C 158 58.256 58.256 59.376 -1.119 18935 12858 1 16 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.426 -0.368 18935 12859 1 16 . 1 1 158 158 GLU H H 158 7.611 7.611 7.772 -0.161 18935 12860 1 16 . 1 1 159 159 LEU N N 159 118.978 118.978 120.794 -1.816 18935 12861 1 16 . 1 1 159 159 LEU C C 159 176.347 176.347 178.020 -1.673 18935 12862 1 16 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.574 -5.335 18935 12863 1 16 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.873 -2.330 18935 12864 1 16 . 1 1 159 159 LEU H H 159 7.704 7.704 8.264 -0.560 18935 12865 1 16 . 1 1 160 160 ILE N N 160 117.227 117.227 114.689 2.538 18935 12866 1 16 . 1 1 160 160 ILE C C 160 177.219 177.219 177.656 -0.437 18935 12867 1 16 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.966 0.649 18935 12868 1 16 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.057 0.500 18935 12869 1 16 . 1 1 160 160 ILE H H 160 7.886 7.886 7.416 0.470 18935 12870 1 16 . 1 1 161 161 LYS N N 161 115.912 115.912 120.180 -4.268 18935 12871 1 16 . 1 1 161 161 LYS C C 161 180.990 180.990 179.195 1.795 18935 12872 1 16 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.462 0.169 18935 12873 1 16 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.689 -0.941 18935 12874 1 16 . 1 1 161 161 LYS H H 161 7.536 7.536 7.604 -0.068 18935 12875 1 16 . 1 1 162 162 GLU N N 162 120.852 120.852 119.354 1.498 18935 12876 1 16 . 1 1 162 162 GLU C C 162 178.793 178.793 178.383 0.410 18935 12877 1 16 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.796 -0.814 18935 12878 1 16 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.799 -2.006 18935 12879 1 16 . 1 1 162 162 GLU H H 162 8.392 8.392 8.041 0.351 18935 12880 1 16 . 1 1 163 163 LEU N N 163 115.912 115.912 116.787 -0.875 18935 12881 1 16 . 1 1 163 163 LEU C C 163 176.370 176.370 176.614 -0.244 18935 12882 1 16 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.468 -0.374 18935 12883 1 16 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.889 -1.714 18935 12884 1 16 . 1 1 163 163 LEU H H 163 8.031 8.031 7.870 0.161 18935 12885 1 16 . 1 1 164 164 GLY N N 164 103.160 103.160 105.127 -1.967 18935 12886 1 16 . 1 1 164 164 GLY C C 164 174.240 174.240 173.703 0.537 18935 12887 1 16 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.900 -0.598 18935 12888 1 16 . 1 1 164 164 GLY H H 164 7.625 7.625 7.788 -0.163 18935 12889 1 16 . 1 1 165 165 PHE N N 165 117.952 117.952 117.986 -0.034 18935 12890 1 16 . 1 1 165 165 PHE C C 165 174.556 174.556 174.438 0.118 18935 12891 1 16 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.939 -1.474 18935 12892 1 16 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.753 -0.991 18935 12893 1 16 . 1 1 165 165 PHE H H 165 7.283 7.283 8.259 -0.976 18935 12894 1 16 . 1 1 166 166 THR N N 166 118.178 118.178 113.753 4.425 18935 12895 1 16 . 1 1 166 166 THR C C 166 175.306 175.306 173.653 1.653 18935 12896 1 16 . 1 1 166 166 THR CA C 166 63.466 63.466 59.606 3.860 18935 12897 1 16 . 1 1 166 166 THR CB C 166 68.721 68.721 71.007 -2.286 18935 12898 1 16 . 1 1 166 166 THR H H 166 9.678 9.678 8.411 1.267 18935 12899 1 16 . 1 1 167 167 TYR N N 167 128.239 128.239 121.880 6.359 18935 12900 1 16 . 1 1 167 167 TYR C C 167 173.297 173.297 174.998 -1.701 18935 12901 1 16 . 1 1 167 167 TYR CA C 167 60.412 60.412 58.572 1.840 18935 12902 1 16 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.774 -3.052 18935 12903 1 16 . 1 1 167 167 TYR H H 167 9.264 9.264 8.617 0.647 18935 12904 1 16 . 1 1 168 168 ARG N N 168 126.789 126.789 124.959 1.830 18935 12905 1 16 . 1 1 168 168 ARG C C 168 175.297 175.297 174.585 0.712 18935 12906 1 16 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.052 -1.287 18935 12907 1 16 . 1 1 168 168 ARG CB C 168 31.326 31.326 33.502 -2.176 18935 12908 1 16 . 1 1 168 168 ARG H H 168 7.030 7.030 8.444 -1.414 18935 12909 1 16 . 1 1 169 169 ILE N N 169 119.221 119.221 117.362 1.859 18935 12910 1 16 . 1 1 169 169 ILE C C 169 174.522 174.522 175.100 -0.578 18935 12911 1 16 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.392 2.887 18935 12912 1 16 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.856 -5.209 18935 12913 1 16 . 1 1 169 169 ILE H H 169 8.349 8.349 8.467 -0.118 18935 12914 1 16 . 1 1 171 171 LYS N N 171 111.335 111.335 117.606 -6.271 18935 12915 1 16 . 1 1 171 171 LYS C C 171 176.638 176.638 178.117 -1.479 18935 12916 1 16 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.123 -1.585 18935 12917 1 16 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.679 0.288 18935 12918 1 16 . 1 1 171 171 LYS H H 171 8.198 8.198 8.514 -0.316 18935 12919 1 16 . 1 1 172 172 LYS N N 172 116.411 116.411 117.189 -0.778 18935 12920 1 16 . 1 1 172 172 LYS C C 172 175.331 175.331 176.270 -0.939 18935 12921 1 16 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.575 -1.574 18935 12922 1 16 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.526 -1.708 18935 12923 1 16 . 1 1 172 172 LYS H H 172 7.843 7.843 7.411 0.432 18935 12924 1 16 . 1 1 173 173 ARG N N 173 120.490 120.490 118.769 1.721 18935 12925 1 16 . 1 1 173 173 ARG C C 173 172.830 172.830 174.486 -1.656 18935 12926 1 16 . 1 1 173 173 ARG CA C 173 57.175 57.175 57.158 0.017 18935 12927 1 16 . 1 1 173 173 ARG CB C 173 28.829 28.829 28.489 0.340 18935 12928 1 16 . 1 1 173 173 ARG H H 173 6.917 6.917 7.837 -0.920 18935 12929 1 17 . 1 1 2 2 LEU N N 2 119.937 119.937 116.590 3.347 18935 12930 1 17 . 1 1 2 2 LEU C C 2 175.307 175.307 175.507 -0.200 18935 12931 1 17 . 1 1 2 2 LEU CA C 2 54.292 54.292 54.009 0.283 18935 12932 1 17 . 1 1 2 2 LEU CB C 2 42.684 42.684 43.429 -0.745 18935 12933 1 17 . 1 1 2 2 LEU H H 2 9.251 9.251 8.666 0.585 18935 12934 1 17 . 1 1 3 3 THR N N 3 111.335 111.335 109.229 2.106 18935 12935 1 17 . 1 1 3 3 THR C C 3 175.854 175.854 175.468 0.386 18935 12936 1 17 . 1 1 3 3 THR CA C 3 60.540 60.540 60.138 0.403 18935 12937 1 17 . 1 1 3 3 THR CB C 3 70.782 70.782 70.529 0.253 18935 12938 1 17 . 1 1 3 3 THR H H 3 8.677 8.677 8.124 0.553 18935 12939 1 17 . 1 1 4 4 LEU N N 4 120.988 120.988 122.630 -1.642 18935 12940 1 17 . 1 1 4 4 LEU C C 4 178.391 178.391 178.015 0.376 18935 12941 1 17 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.094 -0.031 18935 12942 1 17 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.095 -2.834 18935 12943 1 17 . 1 1 4 4 LEU H H 4 7.746 7.746 8.731 -0.985 18935 12944 1 17 . 1 1 5 5 ILE N N 5 114.236 114.236 113.993 0.243 18935 12945 1 17 . 1 1 5 5 ILE C C 5 178.339 178.339 177.626 0.713 18935 12946 1 17 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.300 -0.718 18935 12947 1 17 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.161 -0.362 18935 12948 1 17 . 1 1 5 5 ILE H H 5 7.821 7.821 7.546 0.275 18935 12949 1 17 . 1 1 6 6 GLN N N 6 120.399 120.399 120.756 -0.357 18935 12950 1 17 . 1 1 6 6 GLN C C 6 178.783 178.783 178.368 0.415 18935 12951 1 17 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.738 -0.518 18935 12952 1 17 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.048 0.067 18935 12953 1 17 . 1 1 6 6 GLN H H 6 7.810 7.810 7.880 -0.070 18935 12954 1 17 . 1 1 7 7 GLY N N 7 106.277 106.277 106.004 0.273 18935 12955 1 17 . 1 1 7 7 GLY C C 7 174.554 174.554 176.058 -1.504 18935 12956 1 17 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.130 -0.196 18935 12957 1 17 . 1 1 7 7 GLY H H 7 8.733 8.733 7.985 0.748 18935 12958 1 17 . 1 1 8 8 LYS N N 8 119.991 119.991 121.239 -1.248 18935 12959 1 17 . 1 1 8 8 LYS C C 8 179.433 179.433 178.069 1.364 18935 12960 1 17 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.173 1.719 18935 12961 1 17 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.185 -0.854 18935 12962 1 17 . 1 1 8 8 LYS H H 8 8.688 8.688 7.125 1.563 18935 12963 1 17 . 1 1 9 9 LYS N N 9 119.175 119.175 120.429 -1.254 18935 12964 1 17 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.655 -0.273 18935 12965 1 17 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.181 -0.746 18935 12966 1 17 . 1 1 9 9 LYS H H 9 8.015 8.015 7.724 0.291 18935 12967 1 17 . 1 1 10 10 ILE N N 10 120.308 120.308 116.271 4.037 18935 12968 1 17 . 1 1 10 10 ILE C C 10 177.766 177.766 177.692 0.074 18935 12969 1 17 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.652 0.024 18935 12970 1 17 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.443 -1.130 18935 12971 1 17 . 1 1 10 10 ILE H H 10 7.967 7.967 7.935 0.032 18935 12972 1 17 . 1 1 11 11 VAL N N 11 119.130 119.130 119.813 -0.683 18935 12973 1 17 . 1 1 11 11 VAL C C 11 176.606 176.606 178.067 -1.461 18935 12974 1 17 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.834 0.806 18935 12975 1 17 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.915 -0.706 18935 12976 1 17 . 1 1 11 11 VAL H H 11 8.128 8.128 7.663 0.465 18935 12977 1 17 . 1 1 12 12 ASN N N 12 115.822 115.822 117.110 -1.288 18935 12978 1 17 . 1 1 12 12 ASN C C 12 177.375 177.375 176.964 0.411 18935 12979 1 17 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.642 -0.672 18935 12980 1 17 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.893 -1.330 18935 12981 1 17 . 1 1 12 12 ASN H H 12 8.203 8.203 7.727 0.476 18935 12982 1 17 . 1 1 13 13 HIS N N 13 117.659 117.659 116.703 0.956 18935 12983 1 17 . 1 1 13 13 HIS C C 13 177.287 177.287 176.929 0.358 18935 12984 1 17 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.239 1.448 18935 12985 1 17 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.258 -0.237 18935 12986 1 17 . 1 1 13 13 HIS H H 13 7.861 7.861 8.099 -0.238 18935 12987 1 17 . 1 1 14 14 LEU N N 14 115.595 115.595 118.449 -2.854 18935 12988 1 17 . 1 1 14 14 LEU C C 14 179.092 179.092 177.630 1.462 18935 12989 1 17 . 1 1 14 14 LEU CA C 14 56.641 56.641 55.806 0.835 18935 12990 1 17 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.874 -1.854 18935 12991 1 17 . 1 1 14 14 LEU H H 14 8.376 8.376 8.373 0.003 18935 12992 1 17 . 1 1 15 15 ARG N N 15 115.006 115.006 118.771 -3.765 18935 12993 1 17 . 1 1 15 15 ARG C C 15 176.265 176.265 176.507 -0.242 18935 12994 1 17 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.560 1.324 18935 12995 1 17 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.956 -0.884 18935 12996 1 17 . 1 1 15 15 ARG H H 15 8.074 8.074 8.198 -0.124 18935 12997 1 17 . 1 1 16 16 SER N N 16 107.778 107.778 112.777 -4.999 18935 12998 1 17 . 1 1 16 16 SER C C 16 176.009 176.009 174.405 1.604 18935 12999 1 17 . 1 1 16 16 SER CA C 16 57.244 57.244 59.442 -2.198 18935 13000 1 17 . 1 1 16 16 SER CB C 16 63.525 63.525 63.738 -0.213 18935 13001 1 17 . 1 1 16 16 SER H H 16 7.136 7.136 8.193 -1.057 18935 13002 1 17 . 1 1 17 17 ARG N N 17 121.532 121.532 120.557 0.975 18935 13003 1 17 . 1 1 17 17 ARG C C 17 174.482 174.482 175.613 -1.131 18935 13004 1 17 . 1 1 17 17 ARG CA C 17 56.322 56.322 54.995 1.327 18935 13005 1 17 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.570 1.260 18935 13006 1 17 . 1 1 17 17 ARG H H 17 7.913 7.913 7.822 0.091 18935 13007 1 17 . 1 1 18 18 LEU N N 18 121.305 121.305 120.212 1.093 18935 13008 1 17 . 1 1 18 18 LEU C C 18 176.283 176.283 175.907 0.376 18935 13009 1 17 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.218 -0.520 18935 13010 1 17 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.135 -0.080 18935 13011 1 17 . 1 1 18 18 LEU H H 18 8.812 8.812 7.457 1.355 18935 13012 1 17 . 1 1 19 19 ALA N N 19 125.293 125.293 121.644 3.649 18935 13013 1 17 . 1 1 19 19 ALA C C 19 173.780 173.780 175.073 -1.293 18935 13014 1 17 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.723 -0.921 18935 13015 1 17 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.211 0.642 18935 13016 1 17 . 1 1 19 19 ALA H H 19 8.790 8.790 8.106 0.684 18935 13017 1 17 . 1 1 20 20 PHE N N 20 113.117 113.117 115.857 -2.740 18935 13018 1 17 . 1 1 20 20 PHE C C 20 172.708 172.708 173.489 -0.781 18935 13019 1 17 . 1 1 20 20 PHE CA C 20 55.598 55.598 55.936 -0.338 18935 13020 1 17 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.850 -0.125 18935 13021 1 17 . 1 1 20 20 PHE H H 20 8.925 8.925 8.907 0.018 18935 13022 1 17 . 1 1 21 21 GLU N N 21 121.532 121.532 120.141 1.391 18935 13023 1 17 . 1 1 21 21 GLU C C 21 174.830 174.830 175.315 -0.485 18935 13024 1 17 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.901 -0.938 18935 13025 1 17 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.285 -1.942 18935 13026 1 17 . 1 1 21 21 GLU H H 21 7.972 7.972 9.230 -1.258 18935 13027 1 17 . 1 1 22 22 TYR N N 22 125.339 125.339 120.056 5.283 18935 13028 1 17 . 1 1 22 22 TYR C C 22 174.864 174.864 174.524 0.340 18935 13029 1 17 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.603 -3.315 18935 13030 1 17 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.379 -0.520 18935 13031 1 17 . 1 1 22 22 TYR H H 22 9.016 9.016 8.552 0.464 18935 13032 1 17 . 1 1 23 23 ASN N N 23 127.024 127.024 124.931 2.093 18935 13033 1 17 . 1 1 23 23 ASN C C 23 175.410 175.410 175.596 -0.186 18935 13034 1 17 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.786 -0.732 18935 13035 1 17 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.986 -1.725 18935 13036 1 17 . 1 1 23 23 ASN H H 23 9.181 9.181 9.147 0.034 18935 13037 1 17 . 1 1 24 24 GLY N N 24 102.755 102.755 102.690 0.065 18935 13038 1 17 . 1 1 24 24 GLY C C 24 173.626 173.626 174.657 -1.031 18935 13039 1 17 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.044 -0.109 18935 13040 1 17 . 1 1 24 24 GLY H H 24 8.666 8.666 8.412 0.254 18935 13041 1 17 . 1 1 25 25 GLN N N 25 118.722 118.722 120.724 -2.002 18935 13042 1 17 . 1 1 25 25 GLN C C 25 173.657 173.657 174.837 -1.180 18935 13043 1 17 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.602 -1.369 18935 13044 1 17 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.869 -0.064 18935 13045 1 17 . 1 1 25 25 GLN H H 25 7.708 7.708 8.041 -0.333 18935 13046 1 17 . 1 1 26 26 LEU N N 26 123.526 123.526 120.657 2.869 18935 13047 1 17 . 1 1 26 26 LEU C C 26 175.842 175.842 176.249 -0.407 18935 13048 1 17 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.762 0.224 18935 13049 1 17 . 1 1 26 26 LEU CB C 26 40.807 40.807 44.064 -3.257 18935 13050 1 17 . 1 1 26 26 LEU H H 26 8.543 8.543 8.338 0.205 18935 13051 1 17 . 1 1 27 27 ILE N N 27 129.462 129.462 123.903 5.559 18935 13052 1 17 . 1 1 27 27 ILE C C 27 175.085 175.085 174.219 0.866 18935 13053 1 17 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.324 0.649 18935 13054 1 17 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.375 -2.823 18935 13055 1 17 . 1 1 27 27 ILE H H 27 8.989 8.989 9.073 -0.084 18935 13056 1 17 . 1 1 28 28 LYS N N 28 125.157 125.157 126.656 -1.499 18935 13057 1 17 . 1 1 28 28 LYS C C 28 176.725 176.725 175.328 1.397 18935 13058 1 17 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.610 1.200 18935 13059 1 17 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.290 -1.473 18935 13060 1 17 . 1 1 28 28 LYS H H 28 8.311 8.311 8.309 0.002 18935 13061 1 17 . 1 1 29 29 ILE N N 29 125.565 125.565 116.580 8.985 18935 13062 1 17 . 1 1 29 29 ILE C C 29 175.685 175.685 174.023 1.662 18935 13063 1 17 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.948 0.457 18935 13064 1 17 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.644 -3.613 18935 13065 1 17 . 1 1 29 29 ILE H H 29 8.209 8.209 7.989 0.220 18935 13066 1 17 . 1 1 30 30 LEU N N 30 127.831 127.831 120.429 7.402 18935 13067 1 17 . 1 1 30 30 LEU C C 30 178.794 178.794 177.337 1.457 18935 13068 1 17 . 1 1 30 30 LEU CA C 30 54.443 54.443 52.709 1.734 18935 13069 1 17 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.638 -4.801 18935 13070 1 17 . 1 1 30 30 LEU H H 30 9.027 9.027 8.192 0.835 18935 13071 1 17 . 1 1 31 31 SER N N 31 116.864 116.864 115.550 1.314 18935 13072 1 17 . 1 1 31 31 SER C C 31 177.464 177.464 176.157 1.307 18935 13073 1 17 . 1 1 31 31 SER CA C 31 61.180 61.180 61.792 -0.612 18935 13074 1 17 . 1 1 31 31 SER CB C 31 62.105 62.105 63.142 -1.036 18935 13075 1 17 . 1 1 31 31 SER H H 31 8.887 8.887 8.622 0.265 18935 13076 1 17 . 1 1 32 32 LYS N N 32 114.825 114.825 119.006 -4.181 18935 13077 1 17 . 1 1 32 32 LYS C C 32 176.243 176.243 175.775 0.468 18935 13078 1 17 . 1 1 32 32 LYS CA C 32 57.292 57.292 56.614 0.678 18935 13079 1 17 . 1 1 32 32 LYS CB C 32 30.266 30.266 30.667 -0.401 18935 13080 1 17 . 1 1 32 32 LYS H H 32 8.290 8.290 8.440 -0.150 18935 13081 1 17 . 1 1 33 33 ASN N N 33 117.564 117.564 113.883 3.681 18935 13082 1 17 . 1 1 33 33 ASN C C 33 172.253 172.253 173.748 -1.495 18935 13083 1 17 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.203 -1.111 18935 13084 1 17 . 1 1 33 33 ASN CB C 33 38.339 38.339 41.331 -2.992 18935 13085 1 17 . 1 1 33 33 ASN H H 33 8.051 8.051 8.161 -0.110 18935 13086 1 17 . 1 1 34 34 ILE N N 34 118.949 118.949 120.961 -2.012 18935 13087 1 17 . 1 1 34 34 ILE C C 34 175.343 175.343 174.682 0.661 18935 13088 1 17 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.170 0.383 18935 13089 1 17 . 1 1 34 34 ILE CB C 34 38.867 38.867 42.306 -3.439 18935 13090 1 17 . 1 1 34 34 ILE H H 34 7.670 7.670 8.061 -0.391 18935 13091 1 17 . 1 1 35 35 VAL N N 35 128.355 128.355 125.571 2.784 18935 13092 1 17 . 1 1 35 35 VAL C C 35 175.543 175.543 174.554 0.989 18935 13093 1 17 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.242 -0.229 18935 13094 1 17 . 1 1 35 35 VAL CB C 35 34.231 34.231 34.764 -0.533 18935 13095 1 17 . 1 1 35 35 VAL H H 35 9.698 9.698 9.132 0.567 18935 13096 1 17 . 1 1 36 36 ALA N N 36 129.553 129.553 131.905 -2.352 18935 13097 1 17 . 1 1 36 36 ALA C C 36 177.015 177.015 176.849 0.166 18935 13098 1 17 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.891 0.505 18935 13099 1 17 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.359 -0.737 18935 13100 1 17 . 1 1 36 36 ALA H H 36 8.917 8.917 8.659 0.258 18935 13101 1 17 . 1 1 37 37 VAL N N 37 115.006 115.006 119.524 -4.518 18935 13102 1 17 . 1 1 37 37 VAL C C 37 174.649 174.649 175.452 -0.803 18935 13103 1 17 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.580 -0.259 18935 13104 1 17 . 1 1 37 37 VAL CB C 37 32.386 32.386 34.086 -1.700 18935 13105 1 17 . 1 1 37 37 VAL H H 37 8.214 8.214 7.925 0.289 18935 13106 1 17 . 1 1 38 38 GLY N N 38 109.387 109.387 107.584 1.803 18935 13107 1 17 . 1 1 38 38 GLY C C 38 174.152 174.152 175.135 -0.983 18935 13108 1 17 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.274 0.223 18935 13109 1 17 . 1 1 38 38 GLY H H 38 8.677 8.677 8.045 0.632 18935 13110 1 17 . 1 1 39 39 SER N N 39 116.776 116.776 118.138 -1.362 18935 13111 1 17 . 1 1 39 39 SER C C 39 175.129 175.129 176.763 -1.634 18935 13112 1 17 . 1 1 39 39 SER CA C 39 60.036 60.036 62.610 -2.574 18935 13113 1 17 . 1 1 39 39 SER CB C 39 61.522 61.522 63.090 -1.567 18935 13114 1 17 . 1 1 39 39 SER H H 39 9.705 9.705 8.556 1.149 18935 13115 1 17 . 1 1 40 40 LEU N N 40 113.696 113.696 118.454 -4.758 18935 13116 1 17 . 1 1 40 40 LEU C C 40 180.558 180.558 177.651 2.907 18935 13117 1 17 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.551 0.822 18935 13118 1 17 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.557 0.320 18935 13119 1 17 . 1 1 40 40 LEU H H 40 7.311 7.311 8.211 -0.900 18935 13120 1 17 . 1 1 41 41 ARG N N 41 121.162 121.162 117.314 3.848 18935 13121 1 17 . 1 1 41 41 ARG C C 41 176.964 176.964 177.001 -0.037 18935 13122 1 17 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.741 1.710 18935 13123 1 17 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.440 -2.235 18935 13124 1 17 . 1 1 41 41 ARG H H 41 6.999 6.999 7.584 -0.585 18935 13125 1 17 . 1 1 42 42 ARG N N 42 111.109 111.109 118.774 -7.665 18935 13126 1 17 . 1 1 42 42 ARG C C 42 172.564 172.564 175.328 -2.764 18935 13127 1 17 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.860 0.520 18935 13128 1 17 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.428 -2.079 18935 13129 1 17 . 1 1 42 42 ARG H H 42 7.041 7.041 7.300 -0.259 18935 13130 1 17 . 1 1 43 43 GLU N N 43 111.924 111.924 115.672 -3.748 18935 13131 1 17 . 1 1 43 43 GLU C C 43 176.202 176.202 175.173 1.029 18935 13132 1 17 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.293 -0.839 18935 13133 1 17 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.503 -2.202 18935 13134 1 17 . 1 1 43 43 GLU H H 43 7.757 7.757 8.052 -0.295 18935 13135 1 17 . 1 1 44 44 GLU N N 44 117.861 117.861 118.267 -0.406 18935 13136 1 17 . 1 1 44 44 GLU C C 44 175.197 175.197 176.816 -1.619 18935 13137 1 17 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.405 -0.277 18935 13138 1 17 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.607 -2.048 18935 13139 1 17 . 1 1 44 44 GLU H H 44 7.461 7.461 7.707 -0.246 18935 13140 1 17 . 1 1 45 45 LYS N N 45 115.051 115.051 119.462 -4.411 18935 13141 1 17 . 1 1 45 45 LYS C C 45 177.733 177.733 176.583 1.150 18935 13142 1 17 . 1 1 45 45 LYS CA C 45 59.055 59.055 56.876 2.179 18935 13143 1 17 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.629 -1.602 18935 13144 1 17 . 1 1 45 45 LYS H H 45 8.123 8.123 8.577 -0.454 18935 13145 1 17 . 1 1 46 46 MET N N 46 114.009 114.009 119.537 -5.528 18935 13146 1 17 . 1 1 46 46 MET C C 46 174.067 174.067 174.107 -0.040 18935 13147 1 17 . 1 1 46 46 MET CA C 46 52.477 52.477 54.705 -2.228 18935 13148 1 17 . 1 1 46 46 MET CB C 46 33.974 33.974 34.914 -0.940 18935 13149 1 17 . 1 1 46 46 MET H H 46 7.767 7.767 7.629 0.138 18935 13150 1 17 . 1 1 47 47 LEU N N 47 120.263 120.263 125.890 -5.627 18935 13151 1 17 . 1 1 47 47 LEU C C 47 177.669 177.669 176.665 1.004 18935 13152 1 17 . 1 1 47 47 LEU CA C 47 52.201 52.201 54.355 -2.154 18935 13153 1 17 . 1 1 47 47 LEU CB C 47 42.908 42.908 42.494 0.414 18935 13154 1 17 . 1 1 47 47 LEU H H 47 9.481 9.481 8.734 0.747 18935 13155 1 17 . 1 1 48 48 ASN N N 48 118.632 118.632 118.850 -0.218 18935 13156 1 17 . 1 1 48 48 ASN C C 48 174.715 174.715 175.104 -0.389 18935 13157 1 17 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.882 1.619 18935 13158 1 17 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.329 -1.501 18935 13159 1 17 . 1 1 48 48 ASN H H 48 9.388 9.388 8.915 0.473 18935 13160 1 17 . 1 1 49 49 ASP N N 49 115.867 115.867 116.532 -0.665 18935 13161 1 17 . 1 1 49 49 ASP C C 49 174.111 174.111 173.748 0.363 18935 13162 1 17 . 1 1 49 49 ASP CA C 49 51.201 51.201 53.501 -2.300 18935 13163 1 17 . 1 1 49 49 ASP CB C 49 40.077 40.077 42.940 -2.863 18935 13164 1 17 . 1 1 49 49 ASP H H 49 7.670 7.670 7.606 0.064 18935 13165 1 17 . 1 1 50 50 VAL N N 50 119.185 119.185 118.374 0.811 18935 13166 1 17 . 1 1 50 50 VAL C C 50 172.333 172.333 174.573 -2.240 18935 13167 1 17 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.255 0.660 18935 13168 1 17 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.474 -1.509 18935 13169 1 17 . 1 1 50 50 VAL H H 50 8.339 8.339 8.170 0.169 18935 13170 1 17 . 1 1 51 51 ASP N N 51 124.704 124.704 125.747 -1.043 18935 13171 1 17 . 1 1 51 51 ASP C C 51 173.725 173.725 175.222 -1.497 18935 13172 1 17 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.239 -0.211 18935 13173 1 17 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.928 -0.099 18935 13174 1 17 . 1 1 51 51 ASP H H 51 8.984 8.984 8.287 0.697 18935 13175 1 17 . 1 1 52 52 LEU N N 52 120.943 120.943 120.577 0.366 18935 13176 1 17 . 1 1 52 52 LEU C C 52 173.045 173.045 174.403 -1.358 18935 13177 1 17 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.695 -0.824 18935 13178 1 17 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.303 -2.050 18935 13179 1 17 . 1 1 52 52 LEU H H 52 9.081 9.081 8.306 0.775 18935 13180 1 17 . 1 1 53 53 LEU N N 53 123.027 123.027 124.465 -1.438 18935 13181 1 17 . 1 1 53 53 LEU C C 53 173.750 173.750 175.149 -1.399 18935 13182 1 17 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.477 -1.145 18935 13183 1 17 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.382 -0.374 18935 13184 1 17 . 1 1 53 53 LEU H H 53 9.146 9.146 8.851 0.295 18935 13185 1 17 . 1 1 54 54 ILE N N 54 126.562 126.562 126.480 0.082 18935 13186 1 17 . 1 1 54 54 ILE C C 54 175.132 175.132 175.206 -0.074 18935 13187 1 17 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.917 -1.319 18935 13188 1 17 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.992 -1.431 18935 13189 1 17 . 1 1 54 54 ILE H H 54 9.440 9.440 9.024 0.416 18935 13190 1 17 . 1 1 55 55 ILE N N 55 126.879 126.879 126.323 0.556 18935 13191 1 17 . 1 1 55 55 ILE C C 55 175.655 175.655 175.313 0.342 18935 13192 1 17 . 1 1 55 55 ILE CA C 55 57.561 57.561 59.710 -2.149 18935 13193 1 17 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.614 -5.308 18935 13194 1 17 . 1 1 55 55 ILE H H 55 9.381 9.381 8.525 0.856 18935 13195 1 17 . 1 1 56 56 VAL N N 56 128.936 128.936 121.570 7.366 18935 13196 1 17 . 1 1 56 56 VAL C C 56 176.389 176.389 174.956 1.433 18935 13197 1 17 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.724 -0.093 18935 13198 1 17 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.775 -0.991 18935 13199 1 17 . 1 1 56 56 VAL H H 56 9.227 9.227 8.862 0.365 18935 13200 1 17 . 1 1 58 58 GLU N N 58 112.423 112.423 118.325 -5.902 18935 13201 1 17 . 1 1 58 58 GLU C C 58 175.946 175.946 176.363 -0.417 18935 13202 1 17 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.692 -1.392 18935 13203 1 17 . 1 1 58 58 GLU CB C 58 32.097 32.097 30.642 1.454 18935 13204 1 17 . 1 1 58 58 GLU H H 58 6.685 6.685 8.103 -1.418 18935 13205 1 17 . 1 1 59 59 LYS N N 59 125.293 125.293 119.723 5.570 18935 13206 1 17 . 1 1 59 59 LYS C C 59 179.248 179.248 175.911 3.337 18935 13207 1 17 . 1 1 59 59 LYS CA C 59 59.774 59.774 56.944 2.830 18935 13208 1 17 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.452 -1.375 18935 13209 1 17 . 1 1 59 59 LYS H H 59 9.108 9.108 8.623 0.485 18935 13210 1 17 . 1 1 60 60 LYS N N 60 117.408 117.408 117.554 -0.146 18935 13211 1 17 . 1 1 60 60 LYS C C 60 177.198 177.198 177.278 -0.080 18935 13212 1 17 . 1 1 60 60 LYS CA C 60 58.213 58.213 57.424 0.789 18935 13213 1 17 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.714 -2.131 18935 13214 1 17 . 1 1 60 60 LYS H H 60 9.102 9.102 7.670 1.432 18935 13215 1 17 . 1 1 61 61 LEU N N 61 114.779 114.779 121.772 -6.993 18935 13216 1 17 . 1 1 61 61 LEU C C 61 178.790 178.790 178.922 -0.132 18935 13217 1 17 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.389 -2.365 18935 13218 1 17 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.500 -0.636 18935 13219 1 17 . 1 1 61 61 LEU H H 61 7.455 7.455 8.232 -0.777 18935 13220 1 17 . 1 1 62 62 LEU N N 62 119.629 119.629 118.195 1.434 18935 13221 1 17 . 1 1 62 62 LEU C C 62 177.762 177.762 177.909 -0.147 18935 13222 1 17 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.814 0.384 18935 13223 1 17 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.934 -1.203 18935 13224 1 17 . 1 1 62 62 LEU H H 62 7.714 7.714 7.553 0.161 18935 13225 1 17 . 1 1 63 63 LYS N N 63 112.921 112.921 116.451 -3.530 18935 13226 1 17 . 1 1 63 63 LYS C C 63 175.386 175.386 177.037 -1.651 18935 13227 1 17 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.018 0.338 18935 13228 1 17 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.417 -1.454 18935 13229 1 17 . 1 1 63 63 LYS H H 63 7.751 7.751 8.272 -0.521 18935 13230 1 17 . 1 1 64 64 HIS N N 64 112.468 112.468 117.371 -4.903 18935 13231 1 17 . 1 1 64 64 HIS C C 64 176.081 176.081 176.110 -0.029 18935 13232 1 17 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.809 -2.040 18935 13233 1 17 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.369 1.000 18935 13234 1 17 . 1 1 64 64 HIS H H 64 7.697 7.697 7.440 0.257 18935 13235 1 17 . 1 1 65 65 VAL N N 65 117.499 117.499 119.129 -1.630 18935 13236 1 17 . 1 1 65 65 VAL C C 65 174.301 174.301 176.926 -2.625 18935 13237 1 17 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.240 3.090 18935 13238 1 17 . 1 1 65 65 VAL CB C 65 29.360 29.360 30.852 -1.492 18935 13239 1 17 . 1 1 65 65 VAL H H 65 6.917 6.917 7.382 -0.465 18935 13240 1 17 . 1 1 66 66 LEU N N 66 113.873 113.873 119.327 -5.454 18935 13241 1 17 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.601 0.249 18935 13242 1 17 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.108 -3.050 18935 13243 1 17 . 1 1 66 66 LEU H H 66 9.102 9.102 7.615 1.487 18935 13244 1 17 . 1 1 68 68 ASN N N 68 110.792 110.792 115.801 -5.009 18935 13245 1 17 . 1 1 68 68 ASN C C 68 174.877 174.877 173.425 1.452 18935 13246 1 17 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.313 -1.498 18935 13247 1 17 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.454 -1.143 18935 13248 1 17 . 1 1 68 68 ASN H H 68 7.234 7.234 8.412 -1.178 18935 13249 1 17 . 1 1 69 69 ILE N N 69 122.348 122.348 124.802 -2.454 18935 13250 1 17 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.075 -0.163 18935 13251 1 17 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.906 -2.868 18935 13252 1 17 . 1 1 69 69 ILE H H 69 7.428 7.428 8.670 -1.242 18935 13253 1 17 . 1 1 70 70 ARG N N 70 125.701 125.701 126.704 -1.003 18935 13254 1 17 . 1 1 70 70 ARG C C 70 174.596 174.596 173.447 1.149 18935 13255 1 17 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.402 -1.241 18935 13256 1 17 . 1 1 70 70 ARG CB C 70 32.453 32.453 33.816 -1.363 18935 13257 1 17 . 1 1 70 70 ARG H H 70 9.083 9.083 8.979 0.104 18935 13258 1 17 . 1 1 71 71 ILE N N 71 118.496 118.496 117.916 0.580 18935 13259 1 17 . 1 1 71 71 ILE C C 71 175.625 175.625 175.854 -0.229 18935 13260 1 17 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.276 0.500 18935 13261 1 17 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.740 -2.773 18935 13262 1 17 . 1 1 71 71 ILE H H 71 7.864 7.864 7.946 -0.082 18935 13263 1 17 . 1 1 72 72 LYS N N 72 127.423 127.423 122.817 4.606 18935 13264 1 17 . 1 1 72 72 LYS C C 72 177.659 177.659 176.692 0.967 18935 13265 1 17 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.368 2.060 18935 13266 1 17 . 1 1 72 72 LYS CB C 72 31.374 31.374 33.269 -1.895 18935 13267 1 17 . 1 1 72 72 LYS H H 72 8.720 8.720 8.594 0.126 18935 13268 1 17 . 1 1 73 73 GLY N N 73 112.604 112.604 112.944 -0.340 18935 13269 1 17 . 1 1 73 73 GLY C C 73 173.729 173.729 174.202 -0.473 18935 13270 1 17 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.852 -0.021 18935 13271 1 17 . 1 1 73 73 GLY H H 73 8.930 8.930 8.922 0.008 18935 13272 1 17 . 1 1 74 74 LEU N N 74 119.538 119.538 119.952 -0.414 18935 13273 1 17 . 1 1 74 74 LEU C C 74 175.802 175.802 175.729 0.073 18935 13274 1 17 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.681 -0.021 18935 13275 1 17 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.399 -0.346 18935 13276 1 17 . 1 1 74 74 LEU H H 74 7.547 7.547 7.734 -0.187 18935 13277 1 17 . 1 1 75 75 SER N N 75 118.994 118.994 115.932 3.062 18935 13278 1 17 . 1 1 75 75 SER C C 75 173.111 173.111 172.755 0.356 18935 13279 1 17 . 1 1 75 75 SER CA C 75 57.696 57.696 58.072 -0.376 18935 13280 1 17 . 1 1 75 75 SER CB C 75 63.073 63.073 63.737 -0.664 18935 13281 1 17 . 1 1 75 75 SER H H 75 9.076 9.076 8.520 0.556 18935 13282 1 17 . 1 1 76 76 PHE N N 76 117.802 117.802 120.210 -2.408 18935 13283 1 17 . 1 1 76 76 PHE C C 76 173.564 173.564 174.400 -0.836 18935 13284 1 17 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.411 -1.002 18935 13285 1 17 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.588 -0.745 18935 13286 1 17 . 1 1 76 76 PHE H H 76 8.119 8.119 7.759 0.360 18935 13287 1 17 . 1 1 77 77 SER N N 77 113.918 113.918 116.486 -2.568 18935 13288 1 17 . 1 1 77 77 SER C C 77 173.194 173.194 173.640 -0.446 18935 13289 1 17 . 1 1 77 77 SER CA C 77 55.999 55.999 56.339 -0.340 18935 13290 1 17 . 1 1 77 77 SER CB C 77 65.218 65.218 65.138 0.080 18935 13291 1 17 . 1 1 77 77 SER H H 77 8.989 8.989 8.524 0.465 18935 13292 1 17 . 1 1 78 78 VAL N N 78 123.662 123.662 128.109 -4.447 18935 13293 1 17 . 1 1 78 78 VAL C C 78 176.057 176.057 175.835 0.222 18935 13294 1 17 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.849 -0.758 18935 13295 1 17 . 1 1 78 78 VAL CB C 78 32.294 32.294 32.003 0.291 18935 13296 1 17 . 1 1 78 78 VAL H H 78 8.995 8.995 8.900 0.095 18935 13297 1 17 . 1 1 79 79 LYS N N 79 129.417 129.417 128.895 0.522 18935 13298 1 17 . 1 1 79 79 LYS C C 79 176.436 176.436 174.509 1.927 18935 13299 1 17 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.302 3.350 18935 13300 1 17 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.280 -3.807 18935 13301 1 17 . 1 1 79 79 LYS H H 79 9.425 9.425 8.998 0.427 18935 13302 1 17 . 1 1 80 80 VAL N N 80 108.616 108.616 120.398 -11.782 18935 13303 1 17 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.125 -2.028 18935 13304 1 17 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.931 0.152 18935 13305 1 17 . 1 1 80 80 VAL H H 80 7.380 7.380 8.445 -1.065 18935 13306 1 17 . 1 1 81 81 CYS N N 81 123.254 123.254 128.765 -5.511 18935 13307 1 17 . 1 1 81 81 CYS C C 81 172.053 172.053 174.383 -2.330 18935 13308 1 17 . 1 1 81 81 CYS CA C 81 59.739 59.739 58.342 1.397 18935 13309 1 17 . 1 1 81 81 CYS CB C 81 27.332 27.332 29.385 -2.053 18935 13310 1 17 . 1 1 81 81 CYS H H 81 9.759 9.759 8.245 1.514 18935 13311 1 17 . 1 1 82 82 GLY N N 82 118.450 118.450 115.882 2.568 18935 13312 1 17 . 1 1 82 82 GLY C C 82 171.814 171.814 174.326 -2.512 18935 13313 1 17 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.381 -2.028 18935 13314 1 17 . 1 1 82 82 GLY H H 82 8.537 8.537 8.599 -0.062 18935 13315 1 17 . 1 1 83 83 GLU N N 83 113.964 113.964 121.165 -7.201 18935 13316 1 17 . 1 1 83 83 GLU C C 83 179.320 179.320 177.446 1.874 18935 13317 1 17 . 1 1 83 83 GLU CA C 83 57.675 57.675 58.198 -0.523 18935 13318 1 17 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.791 0.116 18935 13319 1 17 . 1 1 83 83 GLU H H 83 8.473 8.473 8.668 -0.195 18935 13320 1 17 . 1 1 84 84 ARG N N 84 117.544 117.544 117.847 -0.303 18935 13321 1 17 . 1 1 84 84 ARG C C 84 177.252 177.252 176.363 0.889 18935 13322 1 17 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.493 -0.989 18935 13323 1 17 . 1 1 84 84 ARG CB C 84 31.546 31.546 30.355 1.192 18935 13324 1 17 . 1 1 84 84 ARG H H 84 9.760 9.760 8.421 1.339 18935 13325 1 17 . 1 1 85 85 LYS N N 85 124.160 124.160 121.075 3.085 18935 13326 1 17 . 1 1 85 85 LYS C C 85 173.379 173.379 175.921 -2.542 18935 13327 1 17 . 1 1 85 85 LYS CA C 85 55.232 55.232 57.172 -1.940 18935 13328 1 17 . 1 1 85 85 LYS CB C 85 34.212 34.212 33.850 0.362 18935 13329 1 17 . 1 1 85 85 LYS H H 85 8.494 8.494 7.813 0.681 18935 13330 1 17 . 1 1 86 86 CYS N N 86 126.472 126.472 117.607 8.865 18935 13331 1 17 . 1 1 86 86 CYS C C 86 171.935 171.935 172.959 -1.024 18935 13332 1 17 . 1 1 86 86 CYS CA C 86 55.878 55.878 58.151 -2.273 18935 13333 1 17 . 1 1 86 86 CYS CB C 86 30.304 30.304 31.022 -0.718 18935 13334 1 17 . 1 1 86 86 CYS H H 86 9.221 9.221 8.562 0.659 18935 13335 1 17 . 1 1 87 87 VAL N N 87 126.426 126.426 123.149 3.277 18935 13336 1 17 . 1 1 87 87 VAL C C 87 173.760 173.760 173.122 0.638 18935 13337 1 17 . 1 1 87 87 VAL CA C 87 61.333 61.333 59.758 1.575 18935 13338 1 17 . 1 1 87 87 VAL CB C 87 33.338 33.338 35.517 -2.179 18935 13339 1 17 . 1 1 87 87 VAL H H 87 8.623 8.623 8.484 0.139 18935 13340 1 17 . 1 1 88 88 LEU N N 88 125.701 125.701 127.993 -2.292 18935 13341 1 17 . 1 1 88 88 LEU C C 88 175.424 175.424 175.188 0.236 18935 13342 1 17 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.370 -1.285 18935 13343 1 17 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.758 -2.214 18935 13344 1 17 . 1 1 88 88 LEU H H 88 9.592 9.592 9.037 0.555 18935 13345 1 17 . 1 1 89 89 PHE N N 89 118.314 118.314 122.365 -4.051 18935 13346 1 17 . 1 1 89 89 PHE C C 89 177.068 177.068 176.020 1.048 18935 13347 1 17 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.659 -0.784 18935 13348 1 17 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.460 -0.623 18935 13349 1 17 . 1 1 89 89 PHE H H 89 8.979 8.979 8.895 0.084 18935 13350 1 17 . 1 1 90 90 ILE N N 90 119.039 119.039 120.194 -1.155 18935 13351 1 17 . 1 1 90 90 ILE C C 90 173.692 173.692 175.323 -1.631 18935 13352 1 17 . 1 1 90 90 ILE CA C 90 58.672 58.672 60.403 -1.731 18935 13353 1 17 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.172 1.011 18935 13354 1 17 . 1 1 90 90 ILE H H 90 9.447 9.447 8.147 1.300 18935 13355 1 17 . 1 1 91 91 GLU N N 91 122.801 122.801 125.507 -2.706 18935 13356 1 17 . 1 1 91 91 GLU C C 91 175.565 175.565 175.185 0.380 18935 13357 1 17 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.265 -0.800 18935 13358 1 17 . 1 1 91 91 GLU CB C 91 29.662 29.662 32.083 -2.421 18935 13359 1 17 . 1 1 91 91 GLU H H 91 8.360 8.360 8.523 -0.163 18935 13360 1 17 . 1 1 92 92 TRP N N 92 126.018 126.018 120.163 5.855 18935 13361 1 17 . 1 1 92 92 TRP C C 92 175.070 175.070 174.985 0.085 18935 13362 1 17 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.372 -0.182 18935 13363 1 17 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.262 -0.679 18935 13364 1 17 . 1 1 92 92 TRP H H 92 9.425 9.425 8.071 1.354 18935 13365 1 17 . 1 1 93 93 GLU N N 93 126.381 126.381 121.077 5.304 18935 13366 1 17 . 1 1 93 93 GLU C C 93 175.637 175.637 176.306 -0.669 18935 13367 1 17 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.792 -1.023 18935 13368 1 17 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.272 -2.328 18935 13369 1 17 . 1 1 93 93 GLU H H 93 8.914 8.914 9.316 -0.402 18935 13370 1 17 . 1 1 94 94 LYS N N 94 107.891 107.891 113.082 -5.191 18935 13371 1 17 . 1 1 94 94 LYS C C 94 175.359 175.359 175.713 -0.354 18935 13372 1 17 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.353 0.076 18935 13373 1 17 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.487 -1.845 18935 13374 1 17 . 1 1 94 94 LYS H H 94 8.634 8.634 8.643 -0.009 18935 13375 1 17 . 1 1 95 95 LYS N N 95 120.490 120.490 118.357 2.133 18935 13376 1 17 . 1 1 95 95 LYS C C 95 174.369 174.369 174.079 0.290 18935 13377 1 17 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.957 -0.604 18935 13378 1 17 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.704 -1.241 18935 13379 1 17 . 1 1 95 95 LYS H H 95 7.924 7.924 7.542 0.382 18935 13380 1 17 . 1 1 96 96 THR N N 96 115.278 115.278 112.303 2.975 18935 13381 1 17 . 1 1 96 96 THR C C 96 174.317 174.317 172.973 1.344 18935 13382 1 17 . 1 1 96 96 THR CA C 96 61.203 61.203 60.462 0.741 18935 13383 1 17 . 1 1 96 96 THR CB C 96 69.348 69.348 70.501 -1.153 18935 13384 1 17 . 1 1 96 96 THR H H 96 7.967 7.967 7.645 0.322 18935 13385 1 17 . 1 1 97 97 TYR N N 97 123.254 123.254 124.819 -1.565 18935 13386 1 17 . 1 1 97 97 TYR C C 97 173.320 173.320 174.345 -1.025 18935 13387 1 17 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.247 -0.363 18935 13388 1 17 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.791 -0.655 18935 13389 1 17 . 1 1 97 97 TYR H H 97 9.232 9.232 8.945 0.287 18935 13390 1 17 . 1 1 98 98 GLN N N 98 122.574 122.574 118.180 4.394 18935 13391 1 17 . 1 1 98 98 GLN C C 98 172.781 172.781 174.508 -1.727 18935 13392 1 17 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.161 0.010 18935 13393 1 17 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.531 -2.132 18935 13394 1 17 . 1 1 98 98 GLN H H 98 9.000 9.000 8.756 0.244 18935 13395 1 17 . 1 1 99 99 LEU N N 99 130.218 130.218 124.583 5.635 18935 13396 1 17 . 1 1 99 99 LEU C C 99 172.806 172.806 174.376 -1.570 18935 13397 1 17 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.441 -1.391 18935 13398 1 17 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.793 -1.041 18935 13399 1 17 . 1 1 99 99 LEU H H 99 9.246 9.246 8.905 0.341 18935 13400 1 17 . 1 1 100 100 ASP N N 100 124.931 124.931 126.908 -1.977 18935 13401 1 17 . 1 1 100 100 ASP C C 100 172.626 172.626 174.204 -1.578 18935 13402 1 17 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.188 -2.758 18935 13403 1 17 . 1 1 100 100 ASP CB C 100 37.328 37.328 42.906 -5.578 18935 13404 1 17 . 1 1 100 100 ASP H H 100 9.253 9.253 8.155 1.098 18935 13405 1 17 . 1 1 101 101 LEU N N 101 119.402 119.402 123.974 -4.572 18935 13406 1 17 . 1 1 101 101 LEU C C 101 173.869 173.869 175.104 -1.235 18935 13407 1 17 . 1 1 101 101 LEU CA C 101 51.655 51.655 53.812 -2.157 18935 13408 1 17 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.797 0.369 18935 13409 1 17 . 1 1 101 101 LEU H H 101 8.726 8.726 7.633 1.093 18935 13410 1 17 . 1 1 102 102 PHE N N 102 117.952 117.952 117.916 0.036 18935 13411 1 17 . 1 1 102 102 PHE C C 102 175.853 175.853 174.988 0.865 18935 13412 1 17 . 1 1 102 102 PHE CA C 102 53.282 53.282 56.097 -2.815 18935 13413 1 17 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.368 1.456 18935 13414 1 17 . 1 1 102 102 PHE H H 102 8.236 8.236 8.728 -0.492 18935 13415 1 17 . 1 1 103 103 THR N N 103 106.853 106.853 117.028 -10.175 18935 13416 1 17 . 1 1 103 103 THR C C 103 175.154 175.154 174.157 0.997 18935 13417 1 17 . 1 1 103 103 THR CA C 103 57.685 57.685 60.644 -2.959 18935 13418 1 17 . 1 1 103 103 THR CB C 103 71.037 71.037 69.966 1.071 18935 13419 1 17 . 1 1 103 103 THR H H 103 7.917 7.917 8.542 -0.625 18935 13420 1 17 . 1 1 104 104 ALA N N 104 122.348 122.348 129.244 -6.896 18935 13421 1 17 . 1 1 104 104 ALA C C 104 175.947 175.947 174.811 1.136 18935 13422 1 17 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.599 -0.792 18935 13423 1 17 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.382 0.046 18935 13424 1 17 . 1 1 104 104 ALA H H 104 8.930 8.930 8.765 0.165 18935 13425 1 17 . 1 1 105 105 LEU N N 105 119.855 119.855 119.061 0.794 18935 13426 1 17 . 1 1 105 105 LEU C C 105 179.628 179.628 179.072 0.556 18935 13427 1 17 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.005 -0.882 18935 13428 1 17 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.387 -2.053 18935 13429 1 17 . 1 1 105 105 LEU H H 105 8.316 8.316 9.475 -1.159 18935 13430 1 17 . 1 1 106 106 ALA N N 106 123.662 123.662 124.896 -1.234 18935 13431 1 17 . 1 1 106 106 ALA C C 106 181.056 181.056 178.030 3.026 18935 13432 1 17 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.368 0.981 18935 13433 1 17 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.602 -1.287 18935 13434 1 17 . 1 1 106 106 ALA H H 106 8.306 8.306 8.273 0.033 18935 13435 1 17 . 1 1 107 107 GLU N N 107 114.825 114.825 114.712 0.113 18935 13436 1 17 . 1 1 107 107 GLU C C 107 177.854 177.854 177.128 0.726 18935 13437 1 17 . 1 1 107 107 GLU CA C 107 58.386 58.386 58.010 0.376 18935 13438 1 17 . 1 1 107 107 GLU CB C 107 27.844 27.844 29.114 -1.270 18935 13439 1 17 . 1 1 107 107 GLU H H 107 9.754 9.754 8.672 1.082 18935 13440 1 17 . 1 1 108 108 GLU N N 108 115.097 115.097 119.347 -4.250 18935 13441 1 17 . 1 1 108 108 GLU C C 108 178.001 178.001 177.759 0.242 18935 13442 1 17 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.867 -1.941 18935 13443 1 17 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.598 0.403 18935 13444 1 17 . 1 1 108 108 GLU H H 108 7.859 7.859 7.970 -0.111 18935 13445 1 17 . 1 1 109 109 LYS N N 109 118.360 118.360 121.370 -3.010 18935 13446 1 17 . 1 1 109 109 LYS C C 109 172.691 172.691 176.074 -3.383 18935 13447 1 17 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.933 0.969 18935 13448 1 17 . 1 1 109 109 LYS CB C 109 30.541 30.541 31.015 -0.474 18935 13449 1 17 . 1 1 109 109 LYS H H 109 7.660 7.660 7.559 0.101 18935 13450 1 17 . 1 1 111 111 TYR N N 111 114.054 114.054 118.389 -4.335 18935 13451 1 17 . 1 1 111 111 TYR C C 111 179.764 179.764 178.102 1.662 18935 13452 1 17 . 1 1 111 111 TYR CA C 111 58.998 58.998 61.111 -2.113 18935 13453 1 17 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.418 -1.462 18935 13454 1 17 . 1 1 111 111 TYR H H 111 6.583 6.583 8.434 -1.851 18935 13455 1 17 . 1 1 112 112 ALA N N 112 124.749 124.749 121.827 2.922 18935 13456 1 17 . 1 1 112 112 ALA C C 112 179.430 179.430 179.243 0.187 18935 13457 1 17 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.653 0.316 18935 13458 1 17 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.929 -0.117 18935 13459 1 17 . 1 1 112 112 ALA H H 112 8.753 8.753 8.732 0.021 18935 13460 1 17 . 1 1 113 113 ILE N N 113 119.130 119.130 120.700 -1.570 18935 13461 1 17 . 1 1 113 113 ILE C C 113 178.646 178.646 178.476 0.170 18935 13462 1 17 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.590 1.811 18935 13463 1 17 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.681 0.556 18935 13464 1 17 . 1 1 113 113 ILE H H 113 8.946 8.946 8.545 0.401 18935 13465 1 17 . 1 1 114 114 PHE N N 114 121.758 121.758 120.648 1.110 18935 13466 1 17 . 1 1 114 114 PHE C C 114 177.954 177.954 177.099 0.855 18935 13467 1 17 . 1 1 114 114 PHE CA C 114 59.777 59.777 60.391 -0.614 18935 13468 1 17 . 1 1 114 114 PHE CB C 114 39.064 39.064 37.915 1.149 18935 13469 1 17 . 1 1 114 114 PHE H H 114 7.940 7.940 8.447 -0.507 18935 13470 1 17 . 1 1 115 115 HIS N N 115 116.547 116.547 119.067 -2.520 18935 13471 1 17 . 1 1 115 115 HIS C C 115 176.161 176.161 176.540 -0.379 18935 13472 1 17 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.539 -0.420 18935 13473 1 17 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.439 1.628 18935 13474 1 17 . 1 1 115 115 HIS H H 115 7.767 7.767 7.694 0.073 18935 13475 1 17 . 1 1 116 116 PHE N N 116 109.387 109.387 113.544 -4.157 18935 13476 1 17 . 1 1 116 116 PHE C C 116 177.282 177.282 177.213 0.069 18935 13477 1 17 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.520 1.914 18935 13478 1 17 . 1 1 116 116 PHE CB C 116 37.255 37.255 38.938 -1.683 18935 13479 1 17 . 1 1 116 116 PHE H H 116 8.989 8.989 8.311 0.678 18935 13480 1 17 . 1 1 117 117 THR N N 117 116.864 116.864 115.749 1.115 18935 13481 1 17 . 1 1 117 117 THR C C 117 172.889 172.889 175.097 -2.208 18935 13482 1 17 . 1 1 117 117 THR CA C 117 66.997 66.997 65.495 1.502 18935 13483 1 17 . 1 1 117 117 THR CB C 117 67.948 67.948 69.357 -1.409 18935 13484 1 17 . 1 1 117 117 THR H H 117 7.988 7.988 8.161 -0.173 18935 13485 1 17 . 1 1 118 118 GLY N N 118 103.320 103.320 108.610 -5.290 18935 13486 1 17 . 1 1 118 118 GLY C C 118 176.912 176.912 171.934 4.978 18935 13487 1 17 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.917 1.265 18935 13488 1 17 . 1 1 118 118 GLY H H 118 6.550 6.550 7.810 -1.260 18935 13489 1 17 . 1 1 120 120 VAL N N 120 120.671 120.671 126.561 -5.890 18935 13490 1 17 . 1 1 120 120 VAL C C 120 176.283 176.283 177.299 -1.016 18935 13491 1 17 . 1 1 120 120 VAL CA C 120 66.940 66.940 66.411 0.529 18935 13492 1 17 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.820 -1.968 18935 13493 1 17 . 1 1 120 120 VAL H H 120 8.408 8.408 8.477 -0.069 18935 13494 1 17 . 1 1 121 121 SER N N 121 111.789 111.789 114.491 -2.702 18935 13495 1 17 . 1 1 121 121 SER C C 121 175.658 175.658 176.223 -0.565 18935 13496 1 17 . 1 1 121 121 SER CA C 121 60.814 60.814 61.595 -0.781 18935 13497 1 17 . 1 1 121 121 SER CB C 121 60.253 60.253 62.507 -2.254 18935 13498 1 17 . 1 1 121 121 SER H H 121 8.290 8.290 8.285 0.005 18935 13499 1 17 . 1 1 122 122 TYR N N 122 123.254 123.254 122.561 0.693 18935 13500 1 17 . 1 1 122 122 TYR C C 122 174.611 174.611 177.014 -2.403 18935 13501 1 17 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.765 -2.219 18935 13502 1 17 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.298 -0.159 18935 13503 1 17 . 1 1 122 122 TYR H H 122 6.303 6.303 7.500 -1.197 18935 13504 1 17 . 1 1 123 123 LEU N N 123 114.825 114.825 119.494 -4.669 18935 13505 1 17 . 1 1 123 123 LEU C C 123 178.891 178.891 179.113 -0.222 18935 13506 1 17 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.836 -1.057 18935 13507 1 17 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.824 -0.186 18935 13508 1 17 . 1 1 123 123 LEU H H 123 6.965 6.965 7.358 -0.393 18935 13509 1 17 . 1 1 124 124 ILE N N 124 114.915 114.915 117.971 -3.056 18935 13510 1 17 . 1 1 124 124 ILE C C 124 177.187 177.187 178.060 -0.873 18935 13511 1 17 . 1 1 124 124 ILE CA C 124 64.431 64.431 63.904 0.527 18935 13512 1 17 . 1 1 124 124 ILE CB C 124 36.555 36.555 36.248 0.307 18935 13513 1 17 . 1 1 124 124 ILE H H 124 7.531 7.531 7.600 -0.069 18935 13514 1 17 . 1 1 125 125 ARG N N 125 115.278 115.278 119.055 -3.777 18935 13515 1 17 . 1 1 125 125 ARG C C 125 178.473 178.473 178.586 -0.113 18935 13516 1 17 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.630 -0.171 18935 13517 1 17 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.607 -2.528 18935 13518 1 17 . 1 1 125 125 ARG H H 125 6.809 6.809 7.698 -0.889 18935 13519 1 17 . 1 1 126 126 ILE N N 126 124.160 124.160 117.665 6.495 18935 13520 1 17 . 1 1 126 126 ILE C C 126 178.172 178.172 176.862 1.310 18935 13521 1 17 . 1 1 126 126 ILE CA C 126 60.927 60.927 61.781 -0.854 18935 13522 1 17 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.886 -3.420 18935 13523 1 17 . 1 1 126 126 ILE H H 126 7.408 7.408 7.265 0.143 18935 13524 1 17 . 1 1 127 127 ARG N N 127 117.136 117.136 122.466 -5.330 18935 13525 1 17 . 1 1 127 127 ARG C C 127 179.227 179.227 178.222 1.005 18935 13526 1 17 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.271 0.945 18935 13527 1 17 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.369 -1.579 18935 13528 1 17 . 1 1 127 127 ARG H H 127 8.230 8.230 8.132 0.098 18935 13529 1 17 . 1 1 128 128 ALA N N 128 121.305 121.305 120.904 0.401 18935 13530 1 17 . 1 1 128 128 ALA C C 128 179.933 179.933 178.817 1.116 18935 13531 1 17 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.242 -0.536 18935 13532 1 17 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.098 0.240 18935 13533 1 17 . 1 1 128 128 ALA H H 128 8.666 8.666 7.812 0.854 18935 13534 1 17 . 1 1 129 129 ALA N N 129 120.943 120.943 121.669 -0.726 18935 13535 1 17 . 1 1 129 129 ALA C C 129 181.336 181.336 180.022 1.314 18935 13536 1 17 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.856 -0.148 18935 13537 1 17 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.140 -1.280 18935 13538 1 17 . 1 1 129 129 ALA H H 129 7.837 7.837 7.711 0.126 18935 13539 1 17 . 1 1 130 130 LEU N N 130 117.726 117.726 117.889 -0.163 18935 13540 1 17 . 1 1 130 130 LEU C C 130 179.432 179.432 179.505 -0.073 18935 13541 1 17 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.765 -0.589 18935 13542 1 17 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.957 -1.391 18935 13543 1 17 . 1 1 130 130 LEU H H 130 8.114 8.114 8.168 -0.054 18935 13544 1 17 . 1 1 131 131 LYS N N 131 124.115 124.115 121.322 2.793 18935 13545 1 17 . 1 1 131 131 LYS C C 131 181.452 181.452 179.609 1.843 18935 13546 1 17 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.955 -0.069 18935 13547 1 17 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.812 0.386 18935 13548 1 17 . 1 1 131 131 LYS H H 131 8.849 8.849 7.988 0.861 18935 13549 1 17 . 1 1 132 132 LYS N N 132 119.447 119.447 118.143 1.304 18935 13550 1 17 . 1 1 132 132 LYS C C 132 177.607 177.607 178.127 -0.520 18935 13551 1 17 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.553 -0.601 18935 13552 1 17 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.865 -0.440 18935 13553 1 17 . 1 1 132 132 LYS H H 132 7.778 7.778 8.147 -0.369 18935 13554 1 17 . 1 1 133 133 LYS N N 133 116.638 116.638 116.054 0.584 18935 13555 1 17 . 1 1 133 133 LYS C C 133 174.681 174.681 175.818 -1.137 18935 13556 1 17 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.614 -0.535 18935 13557 1 17 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.581 -0.941 18935 13558 1 17 . 1 1 133 133 LYS H H 133 7.617 7.617 7.679 -0.062 18935 13559 1 17 . 1 1 134 134 ASN N N 134 110.792 110.792 116.327 -5.535 18935 13560 1 17 . 1 1 134 134 ASN C C 134 174.034 174.034 173.322 0.712 18935 13561 1 17 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.027 0.588 18935 13562 1 17 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.236 -1.184 18935 13563 1 17 . 1 1 134 134 ASN H H 134 8.123 8.123 8.405 -0.282 18935 13564 1 17 . 1 1 135 135 TYR N N 135 115.867 115.867 116.568 -0.701 18935 13565 1 17 . 1 1 135 135 TYR C C 135 175.122 175.122 173.732 1.390 18935 13566 1 17 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.227 0.525 18935 13567 1 17 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.196 -1.280 18935 13568 1 17 . 1 1 135 135 TYR H H 135 8.133 8.133 7.892 0.241 18935 13569 1 17 . 1 1 136 136 LYS N N 136 119.870 119.870 123.851 -3.981 18935 13570 1 17 . 1 1 136 136 LYS C C 136 174.324 174.324 174.084 0.240 18935 13571 1 17 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.471 0.710 18935 13572 1 17 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.291 -2.218 18935 13573 1 17 . 1 1 136 136 LYS H H 136 9.234 9.234 9.036 0.198 18935 13574 1 17 . 1 1 137 137 LEU N N 137 129.708 129.708 128.570 1.138 18935 13575 1 17 . 1 1 137 137 LEU C C 137 173.798 173.798 175.228 -1.430 18935 13576 1 17 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.509 -1.675 18935 13577 1 17 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.782 1.200 18935 13578 1 17 . 1 1 137 137 LEU H H 137 8.959 8.959 8.772 0.187 18935 13579 1 17 . 1 1 140 140 TYR N N 140 120.580 120.580 111.768 8.812 18935 13580 1 17 . 1 1 140 140 TYR C C 140 174.705 174.705 176.085 -1.380 18935 13581 1 17 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.556 -1.104 18935 13582 1 17 . 1 1 140 140 TYR CB C 140 38.301 38.301 39.059 -0.758 18935 13583 1 17 . 1 1 140 140 TYR H H 140 8.962 8.962 7.419 1.543 18935 13584 1 17 . 1 1 141 141 GLY N N 141 104.986 104.986 104.706 0.280 18935 13585 1 17 . 1 1 141 141 GLY C C 141 181.854 181.854 171.903 9.951 18935 13586 1 17 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.700 -0.578 18935 13587 1 17 . 1 1 141 141 GLY H H 141 7.555 7.555 7.525 0.030 18935 13588 1 17 . 1 1 142 142 LEU N N 142 118.269 118.269 121.283 -3.014 18935 13589 1 17 . 1 1 142 142 LEU C C 142 174.067 174.067 175.555 -1.488 18935 13590 1 17 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.157 -0.655 18935 13591 1 17 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.391 1.151 18935 13592 1 17 . 1 1 142 142 LEU H H 142 7.794 7.794 8.247 -0.453 18935 13593 1 17 . 1 1 143 143 PHE N N 143 122.076 122.076 125.130 -3.054 18935 13594 1 17 . 1 1 143 143 PHE C C 143 175.199 175.199 175.335 -0.136 18935 13595 1 17 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.472 -1.440 18935 13596 1 17 . 1 1 143 143 PHE CB C 143 42.070 42.070 40.736 1.335 18935 13597 1 17 . 1 1 143 143 PHE H H 143 9.522 9.522 9.559 -0.037 18935 13598 1 17 . 1 1 144 144 LYS N N 144 121.305 121.305 124.714 -3.409 18935 13599 1 17 . 1 1 144 144 LYS C C 144 176.917 176.917 176.277 0.640 18935 13600 1 17 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.364 0.992 18935 13601 1 17 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.965 -0.286 18935 13602 1 17 . 1 1 144 144 LYS H H 144 9.076 9.076 9.207 -0.131 18935 13603 1 17 . 1 1 145 145 ASN N N 145 126.834 126.834 123.402 3.432 18935 13604 1 17 . 1 1 145 145 ASN C C 145 175.070 175.070 175.190 -0.120 18935 13605 1 17 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.274 0.490 18935 13606 1 17 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.654 -1.224 18935 13607 1 17 . 1 1 145 145 ASN H H 145 9.618 9.618 9.345 0.273 18935 13608 1 17 . 1 1 146 146 GLN N N 146 110.112 110.112 110.498 -0.386 18935 13609 1 17 . 1 1 146 146 GLN C C 146 175.198 175.198 174.692 0.506 18935 13610 1 17 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.339 -0.443 18935 13611 1 17 . 1 1 146 146 GLN CB C 146 26.368 26.368 28.093 -1.725 18935 13612 1 17 . 1 1 146 146 GLN H H 146 9.140 9.140 8.744 0.396 18935 13613 1 17 . 1 1 147 147 THR N N 147 116.003 116.003 115.775 0.228 18935 13614 1 17 . 1 1 147 147 THR C C 147 173.224 173.224 173.519 -0.295 18935 13615 1 17 . 1 1 147 147 THR CA C 147 61.450 61.450 61.197 0.253 18935 13616 1 17 . 1 1 147 147 THR CB C 147 70.285 70.285 69.955 0.330 18935 13617 1 17 . 1 1 147 147 THR H H 147 8.069 8.069 7.652 0.417 18935 13618 1 17 . 1 1 148 148 LEU N N 148 129.281 129.281 130.116 -0.835 18935 13619 1 17 . 1 1 148 148 LEU C C 148 176.703 176.703 175.400 1.303 18935 13620 1 17 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.139 0.327 18935 13621 1 17 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.885 -1.160 18935 13622 1 17 . 1 1 148 148 LEU H H 148 8.831 8.831 8.958 -0.127 18935 13623 1 17 . 1 1 149 149 VAL N N 149 130.189 130.189 126.998 3.191 18935 13624 1 17 . 1 1 149 149 VAL C C 149 175.012 175.012 173.862 1.150 18935 13625 1 17 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.781 0.488 18935 13626 1 17 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.425 -3.969 18935 13627 1 17 . 1 1 149 149 VAL H H 149 9.243 9.243 8.537 0.706 18935 13628 1 17 . 1 1 151 151 LEU N N 151 123.481 123.481 115.324 8.157 18935 13629 1 17 . 1 1 151 151 LEU C C 151 177.679 177.679 177.040 0.639 18935 13630 1 17 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.030 0.967 18935 13631 1 17 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.795 0.824 18935 13632 1 17 . 1 1 151 151 LEU H H 151 8.080 8.080 8.101 -0.021 18935 13633 1 17 . 1 1 152 152 LYS N N 152 126.381 126.381 121.434 4.947 18935 13634 1 17 . 1 1 152 152 LYS C C 152 175.115 175.115 175.292 -0.177 18935 13635 1 17 . 1 1 152 152 LYS CA C 152 54.596 54.596 55.894 -1.298 18935 13636 1 17 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.983 -2.918 18935 13637 1 17 . 1 1 152 152 LYS H H 152 9.112 9.112 8.875 0.237 18935 13638 1 17 . 1 1 153 153 ILE N N 153 113.737 113.737 115.068 -1.331 18935 13639 1 17 . 1 1 153 153 ILE C C 153 175.748 175.748 173.371 2.377 18935 13640 1 17 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.301 -0.912 18935 13641 1 17 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.772 1.031 18935 13642 1 17 . 1 1 153 153 ILE H H 153 7.304 7.304 7.242 0.062 18935 13643 1 17 . 1 1 154 154 THR N N 154 110.656 110.656 114.127 -3.471 18935 13644 1 17 . 1 1 154 154 THR C C 154 174.864 174.864 173.652 1.212 18935 13645 1 17 . 1 1 154 154 THR CA C 154 62.141 62.141 61.820 0.321 18935 13646 1 17 . 1 1 154 154 THR CB C 154 70.413 70.413 71.147 -0.734 18935 13647 1 17 . 1 1 154 154 THR H H 154 9.382 9.382 9.298 0.084 18935 13648 1 17 . 1 1 155 155 THR N N 155 110.746 110.746 117.693 -6.947 18935 13649 1 17 . 1 1 155 155 THR C C 155 174.718 174.718 174.827 -0.109 18935 13650 1 17 . 1 1 155 155 THR CA C 155 58.785 58.785 60.390 -1.605 18935 13651 1 17 . 1 1 155 155 THR CB C 155 72.277 72.277 71.421 0.856 18935 13652 1 17 . 1 1 155 155 THR H H 155 7.746 7.746 8.021 -0.275 18935 13653 1 17 . 1 1 156 156 GLU N N 156 122.302 122.302 124.064 -1.762 18935 13654 1 17 . 1 1 156 156 GLU C C 156 177.289 177.289 178.177 -0.888 18935 13655 1 17 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.707 -1.883 18935 13656 1 17 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.016 -0.635 18935 13657 1 17 . 1 1 156 156 GLU H H 156 9.490 9.490 9.055 0.435 18935 13658 1 17 . 1 1 157 157 LYS N N 157 118.905 118.905 118.724 0.181 18935 13659 1 17 . 1 1 157 157 LYS C C 157 178.241 178.241 178.933 -0.692 18935 13660 1 17 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.266 1.499 18935 13661 1 17 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.700 -0.422 18935 13662 1 17 . 1 1 157 157 LYS H H 157 8.329 8.329 8.306 0.023 18935 13663 1 17 . 1 1 158 158 GLU N N 158 116.230 116.230 120.591 -4.361 18935 13664 1 17 . 1 1 158 158 GLU C C 158 178.988 178.988 178.764 0.224 18935 13665 1 17 . 1 1 158 158 GLU CA C 158 58.256 58.256 59.458 -1.202 18935 13666 1 17 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.301 -0.243 18935 13667 1 17 . 1 1 158 158 GLU H H 158 7.611 7.611 8.176 -0.565 18935 13668 1 17 . 1 1 159 159 LEU N N 159 118.978 118.978 120.628 -1.650 18935 13669 1 17 . 1 1 159 159 LEU C C 159 176.347 176.347 178.465 -2.118 18935 13670 1 17 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.377 -5.138 18935 13671 1 17 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.938 -2.395 18935 13672 1 17 . 1 1 159 159 LEU H H 159 7.704 7.704 8.309 -0.605 18935 13673 1 17 . 1 1 160 160 ILE N N 160 117.227 117.227 114.788 2.439 18935 13674 1 17 . 1 1 160 160 ILE C C 160 177.219 177.219 177.586 -0.367 18935 13675 1 17 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.797 0.818 18935 13676 1 17 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.094 0.463 18935 13677 1 17 . 1 1 160 160 ILE H H 160 7.886 7.886 7.279 0.607 18935 13678 1 17 . 1 1 161 161 LYS N N 161 115.912 115.912 119.715 -3.803 18935 13679 1 17 . 1 1 161 161 LYS C C 161 180.990 180.990 179.087 1.903 18935 13680 1 17 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.273 0.358 18935 13681 1 17 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.511 -0.763 18935 13682 1 17 . 1 1 161 161 LYS H H 161 7.536 7.536 8.030 -0.494 18935 13683 1 17 . 1 1 162 162 GLU N N 162 120.852 120.852 119.251 1.601 18935 13684 1 17 . 1 1 162 162 GLU C C 162 178.793 178.793 178.834 -0.041 18935 13685 1 17 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.630 -0.648 18935 13686 1 17 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.894 -2.102 18935 13687 1 17 . 1 1 162 162 GLU H H 162 8.392 8.392 7.861 0.531 18935 13688 1 17 . 1 1 163 163 LEU N N 163 115.912 115.912 117.356 -1.444 18935 13689 1 17 . 1 1 163 163 LEU C C 163 176.370 176.370 176.927 -0.557 18935 13690 1 17 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.944 -0.850 18935 13691 1 17 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.776 -1.602 18935 13692 1 17 . 1 1 163 163 LEU H H 163 8.031 8.031 7.990 0.041 18935 13693 1 17 . 1 1 164 164 GLY N N 164 103.160 103.160 104.312 -1.152 18935 13694 1 17 . 1 1 164 164 GLY C C 164 174.240 174.240 174.239 0.001 18935 13695 1 17 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.619 -0.317 18935 13696 1 17 . 1 1 164 164 GLY H H 164 7.625 7.625 8.012 -0.387 18935 13697 1 17 . 1 1 165 165 PHE N N 165 117.952 117.952 118.353 -0.401 18935 13698 1 17 . 1 1 165 165 PHE C C 165 174.556 174.556 175.040 -0.484 18935 13699 1 17 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.969 -0.504 18935 13700 1 17 . 1 1 165 165 PHE CB C 165 40.762 40.762 40.676 0.086 18935 13701 1 17 . 1 1 165 165 PHE H H 165 7.283 7.283 7.859 -0.576 18935 13702 1 17 . 1 1 166 166 THR N N 166 118.178 118.178 114.727 3.451 18935 13703 1 17 . 1 1 166 166 THR C C 166 175.306 175.306 173.256 2.050 18935 13704 1 17 . 1 1 166 166 THR CA C 166 63.466 63.466 60.637 2.829 18935 13705 1 17 . 1 1 166 166 THR CB C 166 68.721 68.721 70.935 -2.214 18935 13706 1 17 . 1 1 166 166 THR H H 166 9.678 9.678 8.802 0.876 18935 13707 1 17 . 1 1 167 167 TYR N N 167 128.239 128.239 124.278 3.961 18935 13708 1 17 . 1 1 167 167 TYR C C 167 173.297 173.297 175.001 -1.704 18935 13709 1 17 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.386 1.026 18935 13710 1 17 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.356 -2.634 18935 13711 1 17 . 1 1 167 167 TYR H H 167 9.264 9.264 8.561 0.703 18935 13712 1 17 . 1 1 168 168 ARG N N 168 126.789 126.789 124.933 1.856 18935 13713 1 17 . 1 1 168 168 ARG C C 168 175.297 175.297 174.577 0.720 18935 13714 1 17 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.243 -1.478 18935 13715 1 17 . 1 1 168 168 ARG CB C 168 31.326 31.326 33.058 -1.732 18935 13716 1 17 . 1 1 168 168 ARG H H 168 7.030 7.030 8.213 -1.183 18935 13717 1 17 . 1 1 169 169 ILE N N 169 119.221 119.221 119.048 0.173 18935 13718 1 17 . 1 1 169 169 ILE C C 169 174.522 174.522 175.552 -1.030 18935 13719 1 17 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.502 2.777 18935 13720 1 17 . 1 1 169 169 ILE CB C 169 34.647 34.647 38.821 -4.174 18935 13721 1 17 . 1 1 169 169 ILE H H 169 8.349 8.349 8.450 -0.101 18935 13722 1 17 . 1 1 171 171 LYS N N 171 111.335 111.335 118.181 -6.846 18935 13723 1 17 . 1 1 171 171 LYS C C 171 176.638 176.638 178.090 -1.452 18935 13724 1 17 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.197 -1.659 18935 13725 1 17 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.611 0.356 18935 13726 1 17 . 1 1 171 171 LYS H H 171 8.198 8.198 8.559 -0.361 18935 13727 1 17 . 1 1 172 172 LYS N N 172 116.411 116.411 116.465 -0.054 18935 13728 1 17 . 1 1 172 172 LYS C C 172 175.331 175.331 175.967 -0.636 18935 13729 1 17 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.203 -1.202 18935 13730 1 17 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.716 -1.898 18935 13731 1 17 . 1 1 172 172 LYS H H 172 7.843 7.843 7.439 0.404 18935 13732 1 17 . 1 1 173 173 ARG N N 173 120.490 120.490 118.163 2.327 18935 13733 1 17 . 1 1 173 173 ARG C C 173 172.830 172.830 174.995 -2.165 18935 13734 1 17 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.677 0.498 18935 13735 1 17 . 1 1 173 173 ARG CB C 173 28.829 28.829 30.083 -1.254 18935 13736 1 17 . 1 1 173 173 ARG H H 173 6.917 6.917 7.449 -0.532 18935 13737 1 18 . 1 1 2 2 LEU N N 2 119.937 119.937 115.900 4.037 18935 13738 1 18 . 1 1 2 2 LEU C C 2 175.307 175.307 175.065 0.242 18935 13739 1 18 . 1 1 2 2 LEU CA C 2 54.292 54.292 53.853 0.439 18935 13740 1 18 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.014 -1.330 18935 13741 1 18 . 1 1 2 2 LEU H H 2 9.251 9.251 8.082 1.169 18935 13742 1 18 . 1 1 3 3 THR N N 3 111.335 111.335 110.159 1.176 18935 13743 1 18 . 1 1 3 3 THR C C 3 175.854 175.854 175.737 0.117 18935 13744 1 18 . 1 1 3 3 THR CA C 3 60.540 60.540 59.896 0.644 18935 13745 1 18 . 1 1 3 3 THR CB C 3 70.782 70.782 70.890 -0.108 18935 13746 1 18 . 1 1 3 3 THR H H 3 8.677 8.677 8.073 0.604 18935 13747 1 18 . 1 1 4 4 LEU N N 4 120.988 120.988 123.574 -2.586 18935 13748 1 18 . 1 1 4 4 LEU C C 4 178.391 178.391 178.240 0.151 18935 13749 1 18 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.092 -0.028 18935 13750 1 18 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.998 -2.737 18935 13751 1 18 . 1 1 4 4 LEU H H 4 7.746 7.746 8.024 -0.278 18935 13752 1 18 . 1 1 5 5 ILE N N 5 114.236 114.236 114.551 -0.315 18935 13753 1 18 . 1 1 5 5 ILE C C 5 178.339 178.339 177.883 0.456 18935 13754 1 18 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.628 -1.046 18935 13755 1 18 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.152 -0.353 18935 13756 1 18 . 1 1 5 5 ILE H H 5 7.821 7.821 7.751 0.070 18935 13757 1 18 . 1 1 6 6 GLN N N 6 120.399 120.399 120.875 -0.476 18935 13758 1 18 . 1 1 6 6 GLN C C 6 178.783 178.783 178.439 0.344 18935 13759 1 18 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.130 -0.910 18935 13760 1 18 . 1 1 6 6 GLN CB C 6 28.115 28.115 27.973 0.142 18935 13761 1 18 . 1 1 6 6 GLN H H 6 7.810 7.810 7.768 0.042 18935 13762 1 18 . 1 1 7 7 GLY N N 7 106.277 106.277 105.924 0.353 18935 13763 1 18 . 1 1 7 7 GLY C C 7 174.554 174.554 176.110 -1.556 18935 13764 1 18 . 1 1 7 7 GLY CA C 7 46.934 46.934 47.122 -0.188 18935 13765 1 18 . 1 1 7 7 GLY H H 7 8.733 8.733 8.010 0.723 18935 13766 1 18 . 1 1 8 8 LYS N N 8 119.991 119.991 121.098 -1.107 18935 13767 1 18 . 1 1 8 8 LYS C C 8 179.433 179.433 178.070 1.363 18935 13768 1 18 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.172 1.720 18935 13769 1 18 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.166 -0.834 18935 13770 1 18 . 1 1 8 8 LYS H H 8 8.688 8.688 7.103 1.585 18935 13771 1 18 . 1 1 9 9 LYS N N 9 119.175 119.175 120.426 -1.251 18935 13772 1 18 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.956 -0.574 18935 13773 1 18 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.426 -0.991 18935 13774 1 18 . 1 1 9 9 LYS H H 9 8.015 8.015 7.848 0.167 18935 13775 1 18 . 1 1 10 10 ILE N N 10 120.308 120.308 116.403 3.905 18935 13776 1 18 . 1 1 10 10 ILE C C 10 177.766 177.766 177.582 0.184 18935 13777 1 18 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.914 -0.238 18935 13778 1 18 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.512 -1.199 18935 13779 1 18 . 1 1 10 10 ILE H H 10 7.967 7.967 8.145 -0.178 18935 13780 1 18 . 1 1 11 11 VAL N N 11 119.130 119.130 120.833 -1.703 18935 13781 1 18 . 1 1 11 11 VAL C C 11 176.606 176.606 178.243 -1.637 18935 13782 1 18 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.615 1.025 18935 13783 1 18 . 1 1 11 11 VAL CB C 11 30.209 30.209 31.253 -1.044 18935 13784 1 18 . 1 1 11 11 VAL H H 11 8.128 8.128 7.637 0.491 18935 13785 1 18 . 1 1 12 12 ASN N N 12 115.822 115.822 116.884 -1.062 18935 13786 1 18 . 1 1 12 12 ASN C C 12 177.375 177.375 177.629 -0.254 18935 13787 1 18 . 1 1 12 12 ASN CA C 12 55.970 55.970 55.863 0.107 18935 13788 1 18 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.498 -0.935 18935 13789 1 18 . 1 1 12 12 ASN H H 12 8.203 8.203 7.866 0.337 18935 13790 1 18 . 1 1 13 13 HIS N N 13 117.659 117.659 117.167 0.492 18935 13791 1 18 . 1 1 13 13 HIS C C 13 177.287 177.287 176.274 1.013 18935 13792 1 18 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.682 1.005 18935 13793 1 18 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.360 -0.339 18935 13794 1 18 . 1 1 13 13 HIS H H 13 7.861 7.861 7.864 -0.003 18935 13795 1 18 . 1 1 14 14 LEU N N 14 115.595 115.595 118.596 -3.001 18935 13796 1 18 . 1 1 14 14 LEU C C 14 179.092 179.092 177.586 1.506 18935 13797 1 18 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.046 0.595 18935 13798 1 18 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.647 -1.627 18935 13799 1 18 . 1 1 14 14 LEU H H 14 8.376 8.376 8.154 0.222 18935 13800 1 18 . 1 1 15 15 ARG N N 15 115.006 115.006 117.820 -2.814 18935 13801 1 18 . 1 1 15 15 ARG C C 15 176.265 176.265 177.222 -0.957 18935 13802 1 18 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.058 1.826 18935 13803 1 18 . 1 1 15 15 ARG CB C 15 29.072 29.072 30.262 -1.190 18935 13804 1 18 . 1 1 15 15 ARG H H 15 8.074 8.074 7.902 0.172 18935 13805 1 18 . 1 1 16 16 SER N N 16 107.778 107.778 113.122 -5.344 18935 13806 1 18 . 1 1 16 16 SER C C 16 176.009 176.009 174.855 1.154 18935 13807 1 18 . 1 1 16 16 SER CA C 16 57.244 57.244 59.211 -1.967 18935 13808 1 18 . 1 1 16 16 SER CB C 16 63.525 63.525 63.458 0.067 18935 13809 1 18 . 1 1 16 16 SER H H 16 7.136 7.136 8.229 -1.093 18935 13810 1 18 . 1 1 17 17 ARG N N 17 121.532 121.532 120.639 0.893 18935 13811 1 18 . 1 1 17 17 ARG C C 17 174.482 174.482 175.508 -1.026 18935 13812 1 18 . 1 1 17 17 ARG CA C 17 56.322 56.322 54.886 1.436 18935 13813 1 18 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.738 1.092 18935 13814 1 18 . 1 1 17 17 ARG H H 17 7.913 7.913 7.811 0.102 18935 13815 1 18 . 1 1 18 18 LEU N N 18 121.305 121.305 119.816 1.489 18935 13816 1 18 . 1 1 18 18 LEU C C 18 176.283 176.283 175.725 0.558 18935 13817 1 18 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.223 -0.525 18935 13818 1 18 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.236 -0.181 18935 13819 1 18 . 1 1 18 18 LEU H H 18 8.812 8.812 7.469 1.343 18935 13820 1 18 . 1 1 19 19 ALA N N 19 125.293 125.293 122.222 3.071 18935 13821 1 18 . 1 1 19 19 ALA C C 19 173.780 173.780 175.214 -1.434 18935 13822 1 18 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.602 -0.800 18935 13823 1 18 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.462 0.392 18935 13824 1 18 . 1 1 19 19 ALA H H 19 8.790 8.790 8.186 0.604 18935 13825 1 18 . 1 1 20 20 PHE N N 20 113.117 113.117 115.965 -2.848 18935 13826 1 18 . 1 1 20 20 PHE C C 20 172.708 172.708 172.609 0.099 18935 13827 1 18 . 1 1 20 20 PHE CA C 20 55.598 55.598 57.000 -1.402 18935 13828 1 18 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.879 -0.154 18935 13829 1 18 . 1 1 20 20 PHE H H 20 8.925 8.925 8.867 0.058 18935 13830 1 18 . 1 1 21 21 GLU N N 21 121.532 121.532 121.614 -0.082 18935 13831 1 18 . 1 1 21 21 GLU C C 21 174.830 174.830 174.918 -0.088 18935 13832 1 18 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.030 -0.067 18935 13833 1 18 . 1 1 21 21 GLU CB C 21 30.343 30.343 31.729 -1.385 18935 13834 1 18 . 1 1 21 21 GLU H H 21 7.972 7.972 9.169 -1.197 18935 13835 1 18 . 1 1 22 22 TYR N N 22 125.339 125.339 126.434 -1.095 18935 13836 1 18 . 1 1 22 22 TYR C C 22 174.864 174.864 175.321 -0.457 18935 13837 1 18 . 1 1 22 22 TYR CA C 22 55.288 55.288 56.604 -1.316 18935 13838 1 18 . 1 1 22 22 TYR CB C 22 39.859 39.859 41.143 -1.284 18935 13839 1 18 . 1 1 22 22 TYR H H 22 9.016 9.016 8.059 0.957 18935 13840 1 18 . 1 1 23 23 ASN N N 23 127.024 127.024 126.967 0.057 18935 13841 1 18 . 1 1 23 23 ASN C C 23 175.410 175.410 174.769 0.641 18935 13842 1 18 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.474 -0.420 18935 13843 1 18 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.348 -1.087 18935 13844 1 18 . 1 1 23 23 ASN H H 23 9.181 9.181 9.320 -0.139 18935 13845 1 18 . 1 1 24 24 GLY N N 24 102.755 102.755 102.985 -0.230 18935 13846 1 18 . 1 1 24 24 GLY C C 24 173.626 173.626 174.725 -1.099 18935 13847 1 18 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.047 -0.112 18935 13848 1 18 . 1 1 24 24 GLY H H 24 8.666 8.666 8.158 0.508 18935 13849 1 18 . 1 1 25 25 GLN N N 25 118.722 118.722 120.288 -1.566 18935 13850 1 18 . 1 1 25 25 GLN C C 25 173.657 173.657 174.805 -1.148 18935 13851 1 18 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.872 -1.639 18935 13852 1 18 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.651 0.154 18935 13853 1 18 . 1 1 25 25 GLN H H 25 7.708 7.708 7.902 -0.194 18935 13854 1 18 . 1 1 26 26 LEU N N 26 123.526 123.526 120.971 2.555 18935 13855 1 18 . 1 1 26 26 LEU C C 26 175.842 175.842 176.414 -0.572 18935 13856 1 18 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.622 0.364 18935 13857 1 18 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.893 -3.086 18935 13858 1 18 . 1 1 26 26 LEU H H 26 8.543 8.543 8.330 0.213 18935 13859 1 18 . 1 1 27 27 ILE N N 27 129.462 129.462 124.049 5.413 18935 13860 1 18 . 1 1 27 27 ILE C C 27 175.085 175.085 174.373 0.712 18935 13861 1 18 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.759 0.214 18935 13862 1 18 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.657 -3.105 18935 13863 1 18 . 1 1 27 27 ILE H H 27 8.989 8.989 8.916 0.073 18935 13864 1 18 . 1 1 28 28 LYS N N 28 125.157 125.157 126.993 -1.836 18935 13865 1 18 . 1 1 28 28 LYS C C 28 176.725 176.725 175.399 1.326 18935 13866 1 18 . 1 1 28 28 LYS CA C 28 56.810 56.810 56.142 0.668 18935 13867 1 18 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.264 -1.447 18935 13868 1 18 . 1 1 28 28 LYS H H 28 8.311 8.311 8.394 -0.083 18935 13869 1 18 . 1 1 29 29 ILE N N 29 125.565 125.565 119.937 5.628 18935 13870 1 18 . 1 1 29 29 ILE C C 29 175.685 175.685 174.192 1.493 18935 13871 1 18 . 1 1 29 29 ILE CA C 29 60.405 60.405 60.072 0.333 18935 13872 1 18 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.504 -3.473 18935 13873 1 18 . 1 1 29 29 ILE H H 29 8.209 8.209 8.231 -0.022 18935 13874 1 18 . 1 1 30 30 LEU N N 30 127.831 127.831 120.918 6.913 18935 13875 1 18 . 1 1 30 30 LEU C C 30 178.794 178.794 176.596 2.198 18935 13876 1 18 . 1 1 30 30 LEU CA C 30 54.443 54.443 52.815 1.628 18935 13877 1 18 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.943 -5.107 18935 13878 1 18 . 1 1 30 30 LEU H H 30 9.027 9.027 8.152 0.875 18935 13879 1 18 . 1 1 31 31 SER N N 31 116.864 116.864 115.735 1.129 18935 13880 1 18 . 1 1 31 31 SER C C 31 177.464 177.464 176.120 1.344 18935 13881 1 18 . 1 1 31 31 SER CA C 31 61.180 61.180 62.107 -0.927 18935 13882 1 18 . 1 1 31 31 SER CB C 31 62.105 62.105 63.161 -1.056 18935 13883 1 18 . 1 1 31 31 SER H H 31 8.887 8.887 8.696 0.191 18935 13884 1 18 . 1 1 32 32 LYS N N 32 114.825 114.825 118.919 -4.094 18935 13885 1 18 . 1 1 32 32 LYS C C 32 176.243 176.243 175.740 0.503 18935 13886 1 18 . 1 1 32 32 LYS CA C 32 57.292 57.292 56.857 0.435 18935 13887 1 18 . 1 1 32 32 LYS CB C 32 30.266 30.266 30.774 -0.508 18935 13888 1 18 . 1 1 32 32 LYS H H 32 8.290 8.290 8.376 -0.086 18935 13889 1 18 . 1 1 33 33 ASN N N 33 117.564 117.564 113.911 3.653 18935 13890 1 18 . 1 1 33 33 ASN C C 33 172.253 172.253 173.649 -1.396 18935 13891 1 18 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.136 -1.044 18935 13892 1 18 . 1 1 33 33 ASN CB C 33 38.339 38.339 41.487 -3.148 18935 13893 1 18 . 1 1 33 33 ASN H H 33 8.051 8.051 8.158 -0.107 18935 13894 1 18 . 1 1 34 34 ILE N N 34 118.949 118.949 120.126 -1.177 18935 13895 1 18 . 1 1 34 34 ILE C C 34 175.343 175.343 175.205 0.138 18935 13896 1 18 . 1 1 34 34 ILE CA C 34 60.553 60.553 59.195 1.358 18935 13897 1 18 . 1 1 34 34 ILE CB C 34 38.867 38.867 40.436 -1.569 18935 13898 1 18 . 1 1 34 34 ILE H H 34 7.670 7.670 8.083 -0.413 18935 13899 1 18 . 1 1 35 35 VAL N N 35 128.355 128.355 124.543 3.812 18935 13900 1 18 . 1 1 35 35 VAL C C 35 175.543 175.543 174.319 1.224 18935 13901 1 18 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.563 -0.549 18935 13902 1 18 . 1 1 35 35 VAL CB C 35 34.231 34.231 36.264 -2.033 18935 13903 1 18 . 1 1 35 35 VAL H H 35 9.698 9.698 9.224 0.474 18935 13904 1 18 . 1 1 36 36 ALA N N 36 129.553 129.553 131.414 -1.861 18935 13905 1 18 . 1 1 36 36 ALA C C 36 177.015 177.015 176.811 0.204 18935 13906 1 18 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.226 1.170 18935 13907 1 18 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.311 -0.690 18935 13908 1 18 . 1 1 36 36 ALA H H 36 8.917 8.917 8.592 0.325 18935 13909 1 18 . 1 1 37 37 VAL N N 37 115.006 115.006 120.087 -5.081 18935 13910 1 18 . 1 1 37 37 VAL C C 37 174.649 174.649 175.957 -1.308 18935 13911 1 18 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.429 -0.108 18935 13912 1 18 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.938 -1.552 18935 13913 1 18 . 1 1 37 37 VAL H H 37 8.214 8.214 7.692 0.522 18935 13914 1 18 . 1 1 38 38 GLY N N 38 109.387 109.387 107.996 1.391 18935 13915 1 18 . 1 1 38 38 GLY C C 38 174.152 174.152 175.754 -1.602 18935 13916 1 18 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.960 -0.463 18935 13917 1 18 . 1 1 38 38 GLY H H 38 8.677 8.677 7.859 0.818 18935 13918 1 18 . 1 1 39 39 SER N N 39 116.776 116.776 119.711 -2.935 18935 13919 1 18 . 1 1 39 39 SER C C 39 175.129 175.129 176.576 -1.447 18935 13920 1 18 . 1 1 39 39 SER CA C 39 60.036 60.036 61.607 -1.571 18935 13921 1 18 . 1 1 39 39 SER CB C 39 61.522 61.522 63.051 -1.530 18935 13922 1 18 . 1 1 39 39 SER H H 39 9.705 9.705 8.547 1.158 18935 13923 1 18 . 1 1 40 40 LEU N N 40 113.696 113.696 120.488 -6.792 18935 13924 1 18 . 1 1 40 40 LEU C C 40 180.558 180.558 178.299 2.259 18935 13925 1 18 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.862 1.511 18935 13926 1 18 . 1 1 40 40 LEU CB C 40 41.877 41.877 40.781 1.096 18935 13927 1 18 . 1 1 40 40 LEU H H 40 7.311 7.311 8.024 -0.713 18935 13928 1 18 . 1 1 41 41 ARG N N 41 121.162 121.162 116.087 5.075 18935 13929 1 18 . 1 1 41 41 ARG C C 41 176.964 176.964 177.505 -0.541 18935 13930 1 18 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.712 1.739 18935 13931 1 18 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.671 -2.466 18935 13932 1 18 . 1 1 41 41 ARG H H 41 6.999 6.999 7.673 -0.674 18935 13933 1 18 . 1 1 42 42 ARG N N 42 111.109 111.109 119.097 -7.988 18935 13934 1 18 . 1 1 42 42 ARG C C 42 172.564 172.564 176.402 -3.838 18935 13935 1 18 . 1 1 42 42 ARG CA C 42 56.380 56.380 56.950 -0.570 18935 13936 1 18 . 1 1 42 42 ARG CB C 42 28.349 28.349 31.246 -2.897 18935 13937 1 18 . 1 1 42 42 ARG H H 42 7.041 7.041 7.619 -0.578 18935 13938 1 18 . 1 1 43 43 GLU N N 43 111.924 111.924 116.315 -4.391 18935 13939 1 18 . 1 1 43 43 GLU C C 43 176.202 176.202 175.038 1.164 18935 13940 1 18 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.284 -0.830 18935 13941 1 18 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.215 -1.914 18935 13942 1 18 . 1 1 43 43 GLU H H 43 7.757 7.757 8.528 -0.771 18935 13943 1 18 . 1 1 44 44 GLU N N 44 117.861 117.861 117.919 -0.058 18935 13944 1 18 . 1 1 44 44 GLU C C 44 175.197 175.197 175.838 -0.641 18935 13945 1 18 . 1 1 44 44 GLU CA C 44 56.128 56.128 55.564 0.564 18935 13946 1 18 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.562 -2.003 18935 13947 1 18 . 1 1 44 44 GLU H H 44 7.461 7.461 7.578 -0.117 18935 13948 1 18 . 1 1 45 45 LYS N N 45 115.051 115.051 120.889 -5.838 18935 13949 1 18 . 1 1 45 45 LYS C C 45 177.733 177.733 176.649 1.084 18935 13950 1 18 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.914 1.141 18935 13951 1 18 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.165 -1.138 18935 13952 1 18 . 1 1 45 45 LYS H H 45 8.123 8.123 8.755 -0.632 18935 13953 1 18 . 1 1 46 46 MET N N 46 114.009 114.009 119.840 -5.831 18935 13954 1 18 . 1 1 46 46 MET C C 46 174.067 174.067 174.637 -0.570 18935 13955 1 18 . 1 1 46 46 MET CA C 46 52.477 52.477 53.903 -1.426 18935 13956 1 18 . 1 1 46 46 MET CB C 46 33.974 33.974 33.912 0.062 18935 13957 1 18 . 1 1 46 46 MET H H 46 7.767 7.767 7.587 0.180 18935 13958 1 18 . 1 1 47 47 LEU N N 47 120.263 120.263 123.191 -2.928 18935 13959 1 18 . 1 1 47 47 LEU C C 47 177.669 177.669 175.844 1.825 18935 13960 1 18 . 1 1 47 47 LEU CA C 47 52.201 52.201 52.917 -0.716 18935 13961 1 18 . 1 1 47 47 LEU CB C 47 42.908 42.908 44.178 -1.270 18935 13962 1 18 . 1 1 47 47 LEU H H 47 9.481 9.481 8.099 1.382 18935 13963 1 18 . 1 1 48 48 ASN N N 48 118.632 118.632 117.491 1.141 18935 13964 1 18 . 1 1 48 48 ASN C C 48 174.715 174.715 174.354 0.361 18935 13965 1 18 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.793 1.708 18935 13966 1 18 . 1 1 48 48 ASN CB C 48 38.828 38.828 41.129 -2.300 18935 13967 1 18 . 1 1 48 48 ASN H H 48 9.388 9.388 8.994 0.394 18935 13968 1 18 . 1 1 49 49 ASP N N 49 115.867 115.867 115.520 0.347 18935 13969 1 18 . 1 1 49 49 ASP C C 49 174.111 174.111 174.370 -0.259 18935 13970 1 18 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.768 -1.567 18935 13971 1 18 . 1 1 49 49 ASP CB C 49 40.077 40.077 44.078 -4.001 18935 13972 1 18 . 1 1 49 49 ASP H H 49 7.670 7.670 7.788 -0.118 18935 13973 1 18 . 1 1 50 50 VAL N N 50 119.185 119.185 117.730 1.455 18935 13974 1 18 . 1 1 50 50 VAL C C 50 172.333 172.333 174.715 -2.382 18935 13975 1 18 . 1 1 50 50 VAL CA C 50 61.915 61.915 60.742 1.173 18935 13976 1 18 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.813 -0.848 18935 13977 1 18 . 1 1 50 50 VAL H H 50 8.339 8.339 7.779 0.560 18935 13978 1 18 . 1 1 51 51 ASP N N 51 124.704 124.704 125.333 -0.629 18935 13979 1 18 . 1 1 51 51 ASP C C 51 173.725 173.725 175.171 -1.446 18935 13980 1 18 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.151 -0.123 18935 13981 1 18 . 1 1 51 51 ASP CB C 51 43.829 43.829 44.148 -0.319 18935 13982 1 18 . 1 1 51 51 ASP H H 51 8.984 8.984 8.331 0.653 18935 13983 1 18 . 1 1 52 52 LEU N N 52 120.943 120.943 121.948 -1.005 18935 13984 1 18 . 1 1 52 52 LEU C C 52 173.045 173.045 174.522 -1.477 18935 13985 1 18 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.504 -1.633 18935 13986 1 18 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.931 -2.678 18935 13987 1 18 . 1 1 52 52 LEU H H 52 9.081 9.081 8.479 0.602 18935 13988 1 18 . 1 1 53 53 LEU N N 53 123.027 123.027 122.830 0.197 18935 13989 1 18 . 1 1 53 53 LEU C C 53 173.750 173.750 175.043 -1.293 18935 13990 1 18 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.618 -1.285 18935 13991 1 18 . 1 1 53 53 LEU CB C 53 45.008 45.008 46.105 -1.097 18935 13992 1 18 . 1 1 53 53 LEU H H 53 9.146 9.146 9.145 0.001 18935 13993 1 18 . 1 1 54 54 ILE N N 54 126.562 126.562 125.200 1.362 18935 13994 1 18 . 1 1 54 54 ILE C C 54 175.132 175.132 175.293 -0.161 18935 13995 1 18 . 1 1 54 54 ILE CA C 54 58.598 58.598 60.013 -1.415 18935 13996 1 18 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.678 -1.117 18935 13997 1 18 . 1 1 54 54 ILE H H 54 9.440 9.440 9.085 0.355 18935 13998 1 18 . 1 1 55 55 ILE N N 55 126.879 126.879 128.548 -1.669 18935 13999 1 18 . 1 1 55 55 ILE C C 55 175.655 175.655 175.075 0.580 18935 14000 1 18 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.230 -2.668 18935 14001 1 18 . 1 1 55 55 ILE CB C 55 34.306 34.306 40.225 -5.920 18935 14002 1 18 . 1 1 55 55 ILE H H 55 9.381 9.381 7.921 1.460 18935 14003 1 18 . 1 1 56 56 VAL N N 56 128.936 128.936 123.332 5.604 18935 14004 1 18 . 1 1 56 56 VAL C C 56 176.389 176.389 174.527 1.862 18935 14005 1 18 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.311 0.319 18935 14006 1 18 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.383 -0.599 18935 14007 1 18 . 1 1 56 56 VAL H H 56 9.227 9.227 8.660 0.567 18935 14008 1 18 . 1 1 58 58 GLU N N 58 112.423 112.423 118.132 -5.709 18935 14009 1 18 . 1 1 58 58 GLU C C 58 175.946 175.946 176.333 -0.387 18935 14010 1 18 . 1 1 58 58 GLU CA C 58 54.300 54.300 54.993 -0.693 18935 14011 1 18 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.144 0.953 18935 14012 1 18 . 1 1 58 58 GLU H H 58 6.685 6.685 7.947 -1.262 18935 14013 1 18 . 1 1 59 59 LYS N N 59 125.293 125.293 119.859 5.434 18935 14014 1 18 . 1 1 59 59 LYS C C 59 179.248 179.248 175.782 3.466 18935 14015 1 18 . 1 1 59 59 LYS CA C 59 59.774 59.774 56.506 3.268 18935 14016 1 18 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.561 -1.484 18935 14017 1 18 . 1 1 59 59 LYS H H 59 9.108 9.108 8.663 0.445 18935 14018 1 18 . 1 1 60 60 LYS N N 60 117.408 117.408 116.520 0.888 18935 14019 1 18 . 1 1 60 60 LYS C C 60 177.198 177.198 177.177 0.021 18935 14020 1 18 . 1 1 60 60 LYS CA C 60 58.213 58.213 56.373 1.840 18935 14021 1 18 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.937 -2.354 18935 14022 1 18 . 1 1 60 60 LYS H H 60 9.102 9.102 7.296 1.806 18935 14023 1 18 . 1 1 61 61 LEU N N 61 114.779 114.779 121.192 -6.413 18935 14024 1 18 . 1 1 61 61 LEU C C 61 178.790 178.790 178.745 0.045 18935 14025 1 18 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.233 -2.209 18935 14026 1 18 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.497 -0.633 18935 14027 1 18 . 1 1 61 61 LEU H H 61 7.455 7.455 7.852 -0.397 18935 14028 1 18 . 1 1 62 62 LEU N N 62 119.629 119.629 118.239 1.390 18935 14029 1 18 . 1 1 62 62 LEU C C 62 177.762 177.762 178.064 -0.302 18935 14030 1 18 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.780 0.418 18935 14031 1 18 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.840 -1.109 18935 14032 1 18 . 1 1 62 62 LEU H H 62 7.714 7.714 7.339 0.375 18935 14033 1 18 . 1 1 63 63 LYS N N 63 112.921 112.921 116.469 -3.548 18935 14034 1 18 . 1 1 63 63 LYS C C 63 175.386 175.386 177.701 -2.315 18935 14035 1 18 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.102 0.254 18935 14036 1 18 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.693 -1.730 18935 14037 1 18 . 1 1 63 63 LYS H H 63 7.751 7.751 8.215 -0.464 18935 14038 1 18 . 1 1 64 64 HIS N N 64 112.468 112.468 117.527 -5.059 18935 14039 1 18 . 1 1 64 64 HIS C C 64 176.081 176.081 176.775 -0.694 18935 14040 1 18 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.665 -1.896 18935 14041 1 18 . 1 1 64 64 HIS CB C 64 32.370 32.370 30.855 1.515 18935 14042 1 18 . 1 1 64 64 HIS H H 64 7.697 7.697 7.641 0.056 18935 14043 1 18 . 1 1 65 65 VAL N N 65 117.499 117.499 116.317 1.182 18935 14044 1 18 . 1 1 65 65 VAL C C 65 174.301 174.301 176.418 -2.117 18935 14045 1 18 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.555 2.775 18935 14046 1 18 . 1 1 65 65 VAL CB C 65 29.360 29.360 30.975 -1.615 18935 14047 1 18 . 1 1 65 65 VAL H H 65 6.917 6.917 7.113 -0.196 18935 14048 1 18 . 1 1 66 66 LEU N N 66 113.873 113.873 119.779 -5.906 18935 14049 1 18 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.969 -0.119 18935 14050 1 18 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.327 -3.269 18935 14051 1 18 . 1 1 66 66 LEU H H 66 9.102 9.102 8.174 0.928 18935 14052 1 18 . 1 1 68 68 ASN N N 68 110.792 110.792 116.659 -5.867 18935 14053 1 18 . 1 1 68 68 ASN C C 68 174.877 174.877 173.343 1.534 18935 14054 1 18 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.661 -1.846 18935 14055 1 18 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.009 -0.698 18935 14056 1 18 . 1 1 68 68 ASN H H 68 7.234 7.234 8.422 -1.188 18935 14057 1 18 . 1 1 69 69 ILE N N 69 122.348 122.348 124.244 -1.896 18935 14058 1 18 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.614 -0.702 18935 14059 1 18 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.401 -2.362 18935 14060 1 18 . 1 1 69 69 ILE H H 69 7.428 7.428 8.783 -1.355 18935 14061 1 18 . 1 1 70 70 ARG N N 70 125.701 125.701 127.534 -1.833 18935 14062 1 18 . 1 1 70 70 ARG C C 70 174.596 174.596 173.534 1.062 18935 14063 1 18 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.655 -1.494 18935 14064 1 18 . 1 1 70 70 ARG CB C 70 32.453 32.453 34.975 -2.522 18935 14065 1 18 . 1 1 70 70 ARG H H 70 9.083 9.083 8.760 0.323 18935 14066 1 18 . 1 1 71 71 ILE N N 71 118.496 118.496 118.659 -0.163 18935 14067 1 18 . 1 1 71 71 ILE C C 71 175.625 175.625 174.904 0.721 18935 14068 1 18 . 1 1 71 71 ILE CA C 71 59.776 59.776 58.894 0.882 18935 14069 1 18 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.830 -2.863 18935 14070 1 18 . 1 1 71 71 ILE H H 71 7.864 7.864 7.718 0.146 18935 14071 1 18 . 1 1 72 72 LYS N N 72 127.423 127.423 125.352 2.071 18935 14072 1 18 . 1 1 72 72 LYS C C 72 177.659 177.659 176.534 1.125 18935 14073 1 18 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.020 2.408 18935 14074 1 18 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.762 -1.388 18935 14075 1 18 . 1 1 72 72 LYS H H 72 8.720 8.720 8.377 0.343 18935 14076 1 18 . 1 1 73 73 GLY N N 73 112.604 112.604 112.632 -0.028 18935 14077 1 18 . 1 1 73 73 GLY C C 73 173.729 173.729 174.001 -0.272 18935 14078 1 18 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.382 0.449 18935 14079 1 18 . 1 1 73 73 GLY H H 73 8.930 8.930 8.878 0.052 18935 14080 1 18 . 1 1 74 74 LEU N N 74 119.538 119.538 119.823 -0.285 18935 14081 1 18 . 1 1 74 74 LEU C C 74 175.802 175.802 175.211 0.591 18935 14082 1 18 . 1 1 74 74 LEU CA C 74 53.661 53.661 54.012 -0.351 18935 14083 1 18 . 1 1 74 74 LEU CB C 74 44.053 44.053 45.338 -1.285 18935 14084 1 18 . 1 1 74 74 LEU H H 74 7.547 7.547 8.006 -0.459 18935 14085 1 18 . 1 1 75 75 SER N N 75 118.994 118.994 116.794 2.200 18935 14086 1 18 . 1 1 75 75 SER C C 75 173.111 173.111 173.152 -0.041 18935 14087 1 18 . 1 1 75 75 SER CA C 75 57.696 57.696 58.267 -0.571 18935 14088 1 18 . 1 1 75 75 SER CB C 75 63.073 63.073 63.886 -0.813 18935 14089 1 18 . 1 1 75 75 SER H H 75 9.076 9.076 8.742 0.334 18935 14090 1 18 . 1 1 76 76 PHE N N 76 117.802 117.802 121.185 -3.383 18935 14091 1 18 . 1 1 76 76 PHE C C 76 173.564 173.564 174.667 -1.103 18935 14092 1 18 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.185 -0.777 18935 14093 1 18 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.584 -0.741 18935 14094 1 18 . 1 1 76 76 PHE H H 76 8.119 8.119 7.735 0.384 18935 14095 1 18 . 1 1 77 77 SER N N 77 113.918 113.918 118.004 -4.086 18935 14096 1 18 . 1 1 77 77 SER C C 77 173.194 173.194 173.481 -0.287 18935 14097 1 18 . 1 1 77 77 SER CA C 77 55.999 55.999 57.305 -1.306 18935 14098 1 18 . 1 1 77 77 SER CB C 77 65.218 65.218 65.257 -0.039 18935 14099 1 18 . 1 1 77 77 SER H H 77 8.989 8.989 8.734 0.255 18935 14100 1 18 . 1 1 78 78 VAL N N 78 123.662 123.662 126.793 -3.131 18935 14101 1 18 . 1 1 78 78 VAL C C 78 176.057 176.057 176.187 -0.130 18935 14102 1 18 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.476 -0.385 18935 14103 1 18 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.320 0.974 18935 14104 1 18 . 1 1 78 78 VAL H H 78 8.995 8.995 8.996 -0.001 18935 14105 1 18 . 1 1 79 79 LYS N N 79 129.417 129.417 128.945 0.472 18935 14106 1 18 . 1 1 79 79 LYS C C 79 176.436 176.436 174.802 1.634 18935 14107 1 18 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.367 3.285 18935 14108 1 18 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.373 -3.900 18935 14109 1 18 . 1 1 79 79 LYS H H 79 9.425 9.425 8.855 0.570 18935 14110 1 18 . 1 1 80 80 VAL N N 80 108.616 108.616 119.185 -10.569 18935 14111 1 18 . 1 1 80 80 VAL CA C 80 59.097 59.097 60.197 -1.100 18935 14112 1 18 . 1 1 80 80 VAL CB C 80 34.082 34.082 34.378 -0.296 18935 14113 1 18 . 1 1 80 80 VAL H H 80 7.380 7.380 8.419 -1.039 18935 14114 1 18 . 1 1 81 81 CYS N N 81 123.254 123.254 127.692 -4.438 18935 14115 1 18 . 1 1 81 81 CYS C C 81 172.053 172.053 174.515 -2.462 18935 14116 1 18 . 1 1 81 81 CYS CA C 81 59.739 59.739 58.488 1.251 18935 14117 1 18 . 1 1 81 81 CYS CB C 81 27.332 27.332 29.390 -2.058 18935 14118 1 18 . 1 1 81 81 CYS H H 81 9.759 9.759 8.251 1.508 18935 14119 1 18 . 1 1 82 82 GLY N N 82 118.450 118.450 114.599 3.851 18935 14120 1 18 . 1 1 82 82 GLY C C 82 171.814 171.814 174.570 -2.756 18935 14121 1 18 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.851 -2.498 18935 14122 1 18 . 1 1 82 82 GLY H H 82 8.537 8.537 8.693 -0.156 18935 14123 1 18 . 1 1 83 83 GLU N N 83 113.964 113.964 122.079 -8.115 18935 14124 1 18 . 1 1 83 83 GLU C C 83 179.320 179.320 177.427 1.893 18935 14125 1 18 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.109 0.566 18935 14126 1 18 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.252 -0.345 18935 14127 1 18 . 1 1 83 83 GLU H H 83 8.473 8.473 8.708 -0.235 18935 14128 1 18 . 1 1 84 84 ARG N N 84 117.544 117.544 118.611 -1.067 18935 14129 1 18 . 1 1 84 84 ARG C C 84 177.252 177.252 176.490 0.762 18935 14130 1 18 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.644 -1.140 18935 14131 1 18 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.021 0.525 18935 14132 1 18 . 1 1 84 84 ARG H H 84 9.760 9.760 8.147 1.613 18935 14133 1 18 . 1 1 85 85 LYS N N 85 124.160 124.160 119.247 4.913 18935 14134 1 18 . 1 1 85 85 LYS C C 85 173.379 173.379 175.801 -2.422 18935 14135 1 18 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.090 -0.858 18935 14136 1 18 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.166 0.046 18935 14137 1 18 . 1 1 85 85 LYS H H 85 8.494 8.494 7.770 0.724 18935 14138 1 18 . 1 1 86 86 CYS N N 86 126.472 126.472 119.066 7.406 18935 14139 1 18 . 1 1 86 86 CYS C C 86 171.935 171.935 172.196 -0.261 18935 14140 1 18 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.486 -1.608 18935 14141 1 18 . 1 1 86 86 CYS CB C 86 30.304 30.304 29.651 0.653 18935 14142 1 18 . 1 1 86 86 CYS H H 86 9.221 9.221 8.553 0.668 18935 14143 1 18 . 1 1 87 87 VAL N N 87 126.426 126.426 126.746 -0.320 18935 14144 1 18 . 1 1 87 87 VAL C C 87 173.760 173.760 172.934 0.826 18935 14145 1 18 . 1 1 87 87 VAL CA C 87 61.333 61.333 59.529 1.804 18935 14146 1 18 . 1 1 87 87 VAL CB C 87 33.338 33.338 35.493 -2.155 18935 14147 1 18 . 1 1 87 87 VAL H H 87 8.623 8.623 7.988 0.635 18935 14148 1 18 . 1 1 88 88 LEU N N 88 125.701 125.701 127.971 -2.270 18935 14149 1 18 . 1 1 88 88 LEU C C 88 175.424 175.424 175.269 0.155 18935 14150 1 18 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.438 -1.353 18935 14151 1 18 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.283 -1.739 18935 14152 1 18 . 1 1 88 88 LEU H H 88 9.592 9.592 8.981 0.611 18935 14153 1 18 . 1 1 89 89 PHE N N 89 118.314 118.314 122.852 -4.538 18935 14154 1 18 . 1 1 89 89 PHE C C 89 177.068 177.068 176.117 0.951 18935 14155 1 18 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.675 -0.800 18935 14156 1 18 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.067 -0.230 18935 14157 1 18 . 1 1 89 89 PHE H H 89 8.979 8.979 8.857 0.122 18935 14158 1 18 . 1 1 90 90 ILE N N 90 119.039 119.039 119.547 -0.508 18935 14159 1 18 . 1 1 90 90 ILE C C 90 173.692 173.692 175.339 -1.647 18935 14160 1 18 . 1 1 90 90 ILE CA C 90 58.672 58.672 60.212 -1.540 18935 14161 1 18 . 1 1 90 90 ILE CB C 90 40.183 40.183 39.507 0.676 18935 14162 1 18 . 1 1 90 90 ILE H H 90 9.447 9.447 8.187 1.260 18935 14163 1 18 . 1 1 91 91 GLU N N 91 122.801 122.801 124.604 -1.803 18935 14164 1 18 . 1 1 91 91 GLU C C 91 175.565 175.565 175.112 0.453 18935 14165 1 18 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.016 -0.551 18935 14166 1 18 . 1 1 91 91 GLU CB C 91 29.662 29.662 31.794 -2.131 18935 14167 1 18 . 1 1 91 91 GLU H H 91 8.360 8.360 8.766 -0.406 18935 14168 1 18 . 1 1 92 92 TRP N N 92 126.018 126.018 119.553 6.465 18935 14169 1 18 . 1 1 92 92 TRP C C 92 175.070 175.070 175.164 -0.094 18935 14170 1 18 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.746 -0.556 18935 14171 1 18 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.029 -0.447 18935 14172 1 18 . 1 1 92 92 TRP H H 92 9.425 9.425 8.250 1.175 18935 14173 1 18 . 1 1 93 93 GLU N N 93 126.381 126.381 120.274 6.107 18935 14174 1 18 . 1 1 93 93 GLU C C 93 175.637 175.637 175.654 -0.017 18935 14175 1 18 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.720 -0.951 18935 14176 1 18 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.054 -2.110 18935 14177 1 18 . 1 1 93 93 GLU H H 93 8.914 8.914 9.200 -0.286 18935 14178 1 18 . 1 1 94 94 LYS N N 94 107.891 107.891 112.063 -4.172 18935 14179 1 18 . 1 1 94 94 LYS C C 94 175.359 175.359 175.663 -0.304 18935 14180 1 18 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.061 0.368 18935 14181 1 18 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.860 -2.218 18935 14182 1 18 . 1 1 94 94 LYS H H 94 8.634 8.634 8.498 0.136 18935 14183 1 18 . 1 1 95 95 LYS N N 95 120.490 120.490 118.624 1.866 18935 14184 1 18 . 1 1 95 95 LYS C C 95 174.369 174.369 174.225 0.144 18935 14185 1 18 . 1 1 95 95 LYS CA C 95 54.353 54.353 55.015 -0.662 18935 14186 1 18 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.959 -1.496 18935 14187 1 18 . 1 1 95 95 LYS H H 95 7.924 7.924 7.563 0.361 18935 14188 1 18 . 1 1 96 96 THR N N 96 115.278 115.278 112.272 3.006 18935 14189 1 18 . 1 1 96 96 THR C C 96 174.317 174.317 173.285 1.032 18935 14190 1 18 . 1 1 96 96 THR CA C 96 61.203 61.203 60.264 0.939 18935 14191 1 18 . 1 1 96 96 THR CB C 96 69.348 69.348 70.455 -1.107 18935 14192 1 18 . 1 1 96 96 THR H H 96 7.967 7.967 7.745 0.222 18935 14193 1 18 . 1 1 97 97 TYR N N 97 123.254 123.254 124.768 -1.514 18935 14194 1 18 . 1 1 97 97 TYR C C 97 173.320 173.320 174.824 -1.504 18935 14195 1 18 . 1 1 97 97 TYR CA C 97 55.884 55.884 55.780 0.104 18935 14196 1 18 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.617 -0.481 18935 14197 1 18 . 1 1 97 97 TYR H H 97 9.232 9.232 9.021 0.211 18935 14198 1 18 . 1 1 98 98 GLN N N 98 122.574 122.574 119.238 3.336 18935 14199 1 18 . 1 1 98 98 GLN C C 98 172.781 172.781 174.197 -1.416 18935 14200 1 18 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.191 -0.020 18935 14201 1 18 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.459 -2.060 18935 14202 1 18 . 1 1 98 98 GLN H H 98 9.000 9.000 8.906 0.094 18935 14203 1 18 . 1 1 99 99 LEU N N 99 130.218 130.218 126.276 3.942 18935 14204 1 18 . 1 1 99 99 LEU C C 99 172.806 172.806 174.388 -1.582 18935 14205 1 18 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.400 -1.350 18935 14206 1 18 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.080 -0.328 18935 14207 1 18 . 1 1 99 99 LEU H H 99 9.246 9.246 8.992 0.254 18935 14208 1 18 . 1 1 100 100 ASP N N 100 124.931 124.931 127.274 -2.343 18935 14209 1 18 . 1 1 100 100 ASP C C 100 172.626 172.626 174.115 -1.489 18935 14210 1 18 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.441 -3.011 18935 14211 1 18 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.064 -5.736 18935 14212 1 18 . 1 1 100 100 ASP H H 100 9.253 9.253 8.363 0.890 18935 14213 1 18 . 1 1 101 101 LEU N N 101 119.402 119.402 123.827 -4.425 18935 14214 1 18 . 1 1 101 101 LEU C C 101 173.869 173.869 174.898 -1.029 18935 14215 1 18 . 1 1 101 101 LEU CA C 101 51.655 51.655 53.511 -1.856 18935 14216 1 18 . 1 1 101 101 LEU CB C 101 44.166 44.166 44.161 0.005 18935 14217 1 18 . 1 1 101 101 LEU H H 101 8.726 8.726 7.627 1.099 18935 14218 1 18 . 1 1 102 102 PHE N N 102 117.952 117.952 117.914 0.038 18935 14219 1 18 . 1 1 102 102 PHE C C 102 175.853 175.853 174.901 0.952 18935 14220 1 18 . 1 1 102 102 PHE CA C 102 53.282 53.282 56.466 -3.184 18935 14221 1 18 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.866 0.958 18935 14222 1 18 . 1 1 102 102 PHE H H 102 8.236 8.236 8.667 -0.431 18935 14223 1 18 . 1 1 103 103 THR N N 103 106.853 106.853 117.694 -10.841 18935 14224 1 18 . 1 1 103 103 THR C C 103 175.154 175.154 174.209 0.945 18935 14225 1 18 . 1 1 103 103 THR CA C 103 57.685 57.685 60.544 -2.858 18935 14226 1 18 . 1 1 103 103 THR CB C 103 71.037 71.037 69.716 1.321 18935 14227 1 18 . 1 1 103 103 THR H H 103 7.917 7.917 8.628 -0.711 18935 14228 1 18 . 1 1 104 104 ALA N N 104 122.348 122.348 129.390 -7.042 18935 14229 1 18 . 1 1 104 104 ALA C C 104 175.947 175.947 174.844 1.103 18935 14230 1 18 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.593 -0.786 18935 14231 1 18 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.307 0.121 18935 14232 1 18 . 1 1 104 104 ALA H H 104 8.930 8.930 8.496 0.434 18935 14233 1 18 . 1 1 105 105 LEU N N 105 119.855 119.855 118.595 1.260 18935 14234 1 18 . 1 1 105 105 LEU C C 105 179.628 179.628 179.050 0.578 18935 14235 1 18 . 1 1 105 105 LEU CA C 105 53.123 53.123 53.668 -0.545 18935 14236 1 18 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.279 -1.945 18935 14237 1 18 . 1 1 105 105 LEU H H 105 8.316 8.316 9.166 -0.850 18935 14238 1 18 . 1 1 106 106 ALA N N 106 123.662 123.662 124.400 -0.738 18935 14239 1 18 . 1 1 106 106 ALA C C 106 181.056 181.056 179.293 1.763 18935 14240 1 18 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.329 1.020 18935 14241 1 18 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.378 -1.063 18935 14242 1 18 . 1 1 106 106 ALA H H 106 8.306 8.306 8.546 -0.240 18935 14243 1 18 . 1 1 107 107 GLU N N 107 114.825 114.825 115.810 -0.985 18935 14244 1 18 . 1 1 107 107 GLU C C 107 177.854 177.854 176.906 0.948 18935 14245 1 18 . 1 1 107 107 GLU CA C 107 58.386 58.386 58.137 0.249 18935 14246 1 18 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.412 -0.568 18935 14247 1 18 . 1 1 107 107 GLU H H 107 9.754 9.754 8.773 0.981 18935 14248 1 18 . 1 1 108 108 GLU N N 108 115.097 115.097 118.322 -3.225 18935 14249 1 18 . 1 1 108 108 GLU C C 108 178.001 178.001 177.302 0.699 18935 14250 1 18 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.349 -1.423 18935 14251 1 18 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.857 0.144 18935 14252 1 18 . 1 1 108 108 GLU H H 108 7.859 7.859 7.685 0.174 18935 14253 1 18 . 1 1 109 109 LYS N N 109 118.360 118.360 121.600 -3.240 18935 14254 1 18 . 1 1 109 109 LYS C C 109 172.691 172.691 176.307 -3.616 18935 14255 1 18 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.347 0.555 18935 14256 1 18 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.712 -0.171 18935 14257 1 18 . 1 1 109 109 LYS H H 109 7.660 7.660 7.422 0.238 18935 14258 1 18 . 1 1 111 111 TYR N N 111 114.054 114.054 118.924 -4.870 18935 14259 1 18 . 1 1 111 111 TYR C C 111 179.764 179.764 177.965 1.799 18935 14260 1 18 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.520 -1.522 18935 14261 1 18 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.242 -1.286 18935 14262 1 18 . 1 1 111 111 TYR H H 111 6.583 6.583 8.313 -1.730 18935 14263 1 18 . 1 1 112 112 ALA N N 112 124.749 124.749 122.456 2.293 18935 14264 1 18 . 1 1 112 112 ALA C C 112 179.430 179.430 179.608 -0.178 18935 14265 1 18 . 1 1 112 112 ALA CA C 112 54.969 54.969 55.281 -0.311 18935 14266 1 18 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.676 0.136 18935 14267 1 18 . 1 1 112 112 ALA H H 112 8.753 8.753 8.955 -0.202 18935 14268 1 18 . 1 1 113 113 ILE N N 113 119.130 119.130 119.797 -0.667 18935 14269 1 18 . 1 1 113 113 ILE C C 113 178.646 178.646 178.672 -0.026 18935 14270 1 18 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.550 1.851 18935 14271 1 18 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.595 0.642 18935 14272 1 18 . 1 1 113 113 ILE H H 113 8.946 8.946 8.404 0.542 18935 14273 1 18 . 1 1 114 114 PHE N N 114 121.758 121.758 120.893 0.865 18935 14274 1 18 . 1 1 114 114 PHE C C 114 177.954 177.954 176.999 0.955 18935 14275 1 18 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.609 -1.832 18935 14276 1 18 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.599 0.465 18935 14277 1 18 . 1 1 114 114 PHE H H 114 7.940 7.940 8.381 -0.441 18935 14278 1 18 . 1 1 115 115 HIS N N 115 116.547 116.547 119.573 -3.026 18935 14279 1 18 . 1 1 115 115 HIS C C 115 176.161 176.161 176.649 -0.488 18935 14280 1 18 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.376 -0.257 18935 14281 1 18 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.569 1.498 18935 14282 1 18 . 1 1 115 115 HIS H H 115 7.767 7.767 8.115 -0.348 18935 14283 1 18 . 1 1 116 116 PHE N N 116 109.387 109.387 113.609 -4.222 18935 14284 1 18 . 1 1 116 116 PHE C C 116 177.282 177.282 176.832 0.450 18935 14285 1 18 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.946 1.488 18935 14286 1 18 . 1 1 116 116 PHE CB C 116 37.255 37.255 38.955 -1.700 18935 14287 1 18 . 1 1 116 116 PHE H H 116 8.989 8.989 8.354 0.635 18935 14288 1 18 . 1 1 117 117 THR N N 117 116.864 116.864 113.818 3.046 18935 14289 1 18 . 1 1 117 117 THR C C 117 172.889 172.889 175.050 -2.161 18935 14290 1 18 . 1 1 117 117 THR CA C 117 66.997 66.997 64.829 2.168 18935 14291 1 18 . 1 1 117 117 THR CB C 117 67.948 67.948 69.726 -1.778 18935 14292 1 18 . 1 1 117 117 THR H H 117 7.988 7.988 7.915 0.073 18935 14293 1 18 . 1 1 118 118 GLY N N 118 103.320 103.320 109.191 -5.871 18935 14294 1 18 . 1 1 118 118 GLY C C 118 176.912 176.912 171.561 5.351 18935 14295 1 18 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.856 1.326 18935 14296 1 18 . 1 1 118 118 GLY H H 118 6.550 6.550 7.270 -0.720 18935 14297 1 18 . 1 1 120 120 VAL N N 120 120.671 120.671 126.870 -6.199 18935 14298 1 18 . 1 1 120 120 VAL C C 120 176.283 176.283 177.224 -0.941 18935 14299 1 18 . 1 1 120 120 VAL CA C 120 66.940 66.940 65.635 1.306 18935 14300 1 18 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.839 -1.987 18935 14301 1 18 . 1 1 120 120 VAL H H 120 8.408 8.408 8.532 -0.124 18935 14302 1 18 . 1 1 121 121 SER N N 121 111.789 111.789 114.099 -2.310 18935 14303 1 18 . 1 1 121 121 SER C C 121 175.658 175.658 176.670 -1.012 18935 14304 1 18 . 1 1 121 121 SER CA C 121 60.814 60.814 61.672 -0.858 18935 14305 1 18 . 1 1 121 121 SER CB C 121 60.253 60.253 62.428 -2.175 18935 14306 1 18 . 1 1 121 121 SER H H 121 8.290 8.290 8.308 -0.018 18935 14307 1 18 . 1 1 122 122 TYR N N 122 123.254 123.254 122.183 1.071 18935 14308 1 18 . 1 1 122 122 TYR C C 122 174.611 174.611 177.298 -2.687 18935 14309 1 18 . 1 1 122 122 TYR CA C 122 58.546 58.546 61.326 -2.780 18935 14310 1 18 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.384 -0.245 18935 14311 1 18 . 1 1 122 122 TYR H H 122 6.303 6.303 7.777 -1.474 18935 14312 1 18 . 1 1 123 123 LEU N N 123 114.825 114.825 119.520 -4.695 18935 14313 1 18 . 1 1 123 123 LEU C C 123 178.891 178.891 179.218 -0.327 18935 14314 1 18 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.905 -1.126 18935 14315 1 18 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.911 -0.273 18935 14316 1 18 . 1 1 123 123 LEU H H 123 6.965 6.965 7.344 -0.379 18935 14317 1 18 . 1 1 124 124 ILE N N 124 114.915 114.915 118.227 -3.312 18935 14318 1 18 . 1 1 124 124 ILE C C 124 177.187 177.187 177.773 -0.586 18935 14319 1 18 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.467 -1.036 18935 14320 1 18 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.358 -0.804 18935 14321 1 18 . 1 1 124 124 ILE H H 124 7.531 7.531 7.659 -0.128 18935 14322 1 18 . 1 1 125 125 ARG N N 125 115.278 115.278 119.832 -4.554 18935 14323 1 18 . 1 1 125 125 ARG C C 125 178.473 178.473 178.632 -0.159 18935 14324 1 18 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.737 -0.278 18935 14325 1 18 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.386 -2.307 18935 14326 1 18 . 1 1 125 125 ARG H H 125 6.809 6.809 7.562 -0.753 18935 14327 1 18 . 1 1 126 126 ILE N N 126 124.160 124.160 119.099 5.061 18935 14328 1 18 . 1 1 126 126 ILE C C 126 178.172 178.172 177.311 0.861 18935 14329 1 18 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.126 -1.199 18935 14330 1 18 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.553 -3.087 18935 14331 1 18 . 1 1 126 126 ILE H H 126 7.408 7.408 7.403 0.005 18935 14332 1 18 . 1 1 127 127 ARG N N 127 117.136 117.136 121.129 -3.993 18935 14333 1 18 . 1 1 127 127 ARG C C 127 179.227 179.227 178.870 0.357 18935 14334 1 18 . 1 1 127 127 ARG CA C 127 60.216 60.216 60.008 0.208 18935 14335 1 18 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.561 -1.772 18935 14336 1 18 . 1 1 127 127 ARG H H 127 8.230 8.230 8.110 0.120 18935 14337 1 18 . 1 1 128 128 ALA N N 128 121.305 121.305 120.767 0.538 18935 14338 1 18 . 1 1 128 128 ALA C C 128 179.933 179.933 179.026 0.907 18935 14339 1 18 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.156 -0.450 18935 14340 1 18 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.177 0.161 18935 14341 1 18 . 1 1 128 128 ALA H H 128 8.666 8.666 8.016 0.650 18935 14342 1 18 . 1 1 129 129 ALA N N 129 120.943 120.943 121.534 -0.591 18935 14343 1 18 . 1 1 129 129 ALA C C 129 181.336 181.336 179.782 1.554 18935 14344 1 18 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.855 -0.147 18935 14345 1 18 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.243 -1.383 18935 14346 1 18 . 1 1 129 129 ALA H H 129 7.837 7.837 7.497 0.340 18935 14347 1 18 . 1 1 130 130 LEU N N 130 117.726 117.726 117.464 0.262 18935 14348 1 18 . 1 1 130 130 LEU C C 130 179.432 179.432 179.703 -0.271 18935 14349 1 18 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.662 -0.486 18935 14350 1 18 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.865 -1.299 18935 14351 1 18 . 1 1 130 130 LEU H H 130 8.114 8.114 8.210 -0.096 18935 14352 1 18 . 1 1 131 131 LYS N N 131 124.115 124.115 121.959 2.156 18935 14353 1 18 . 1 1 131 131 LYS C C 131 181.452 181.452 179.440 2.012 18935 14354 1 18 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.972 -0.086 18935 14355 1 18 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.841 0.357 18935 14356 1 18 . 1 1 131 131 LYS H H 131 8.849 8.849 8.256 0.593 18935 14357 1 18 . 1 1 132 132 LYS N N 132 119.447 119.447 118.162 1.285 18935 14358 1 18 . 1 1 132 132 LYS C C 132 177.607 177.607 177.819 -0.212 18935 14359 1 18 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.514 -0.562 18935 14360 1 18 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.848 -0.423 18935 14361 1 18 . 1 1 132 132 LYS H H 132 7.778 7.778 7.992 -0.214 18935 14362 1 18 . 1 1 133 133 LYS N N 133 116.638 116.638 114.768 1.870 18935 14363 1 18 . 1 1 133 133 LYS C C 133 174.681 174.681 176.137 -1.456 18935 14364 1 18 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.134 -0.056 18935 14365 1 18 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.617 -0.977 18935 14366 1 18 . 1 1 133 133 LYS H H 133 7.617 7.617 7.744 -0.127 18935 14367 1 18 . 1 1 134 134 ASN N N 134 110.792 110.792 117.815 -7.023 18935 14368 1 18 . 1 1 134 134 ASN C C 134 174.034 174.034 172.869 1.165 18935 14369 1 18 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.009 0.606 18935 14370 1 18 . 1 1 134 134 ASN CB C 134 36.052 36.052 36.842 -0.790 18935 14371 1 18 . 1 1 134 134 ASN H H 134 8.123 8.123 8.448 -0.325 18935 14372 1 18 . 1 1 135 135 TYR N N 135 115.867 115.867 115.987 -0.120 18935 14373 1 18 . 1 1 135 135 TYR C C 135 175.122 175.122 174.638 0.484 18935 14374 1 18 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.249 -0.497 18935 14375 1 18 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.413 -1.497 18935 14376 1 18 . 1 1 135 135 TYR H H 135 8.133 8.133 7.811 0.322 18935 14377 1 18 . 1 1 136 136 LYS N N 136 119.870 119.870 121.069 -1.199 18935 14378 1 18 . 1 1 136 136 LYS C C 136 174.324 174.324 175.841 -1.517 18935 14379 1 18 . 1 1 136 136 LYS CA C 136 55.181 55.181 55.505 -0.324 18935 14380 1 18 . 1 1 136 136 LYS CB C 136 34.073 34.073 33.456 0.617 18935 14381 1 18 . 1 1 136 136 LYS H H 136 9.234 9.234 8.573 0.661 18935 14382 1 18 . 1 1 137 137 LEU N N 137 129.708 129.708 124.332 5.376 18935 14383 1 18 . 1 1 137 137 LEU C C 137 173.798 173.798 175.268 -1.470 18935 14384 1 18 . 1 1 137 137 LEU CA C 137 52.834 52.834 56.053 -3.219 18935 14385 1 18 . 1 1 137 137 LEU CB C 137 44.983 44.983 41.801 3.182 18935 14386 1 18 . 1 1 137 137 LEU H H 137 8.959 8.959 8.104 0.855 18935 14387 1 18 . 1 1 140 140 TYR N N 140 120.580 120.580 112.650 7.930 18935 14388 1 18 . 1 1 140 140 TYR C C 140 174.705 174.705 175.577 -0.872 18935 14389 1 18 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.810 -1.358 18935 14390 1 18 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.589 -0.288 18935 14391 1 18 . 1 1 140 140 TYR H H 140 8.962 8.962 7.284 1.678 18935 14392 1 18 . 1 1 141 141 GLY N N 141 104.986 104.986 105.513 -0.527 18935 14393 1 18 . 1 1 141 141 GLY C C 141 181.854 181.854 172.162 9.692 18935 14394 1 18 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.698 -0.576 18935 14395 1 18 . 1 1 141 141 GLY H H 141 7.555 7.555 7.480 0.075 18935 14396 1 18 . 1 1 142 142 LEU N N 142 118.269 118.269 122.594 -4.325 18935 14397 1 18 . 1 1 142 142 LEU C C 142 174.067 174.067 175.518 -1.451 18935 14398 1 18 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.076 -0.574 18935 14399 1 18 . 1 1 142 142 LEU CB C 142 44.542 44.542 42.789 1.753 18935 14400 1 18 . 1 1 142 142 LEU H H 142 7.794 7.794 8.445 -0.651 18935 14401 1 18 . 1 1 143 143 PHE N N 143 122.076 122.076 125.302 -3.226 18935 14402 1 18 . 1 1 143 143 PHE C C 143 175.199 175.199 175.520 -0.321 18935 14403 1 18 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.726 -1.694 18935 14404 1 18 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.019 3.051 18935 14405 1 18 . 1 1 143 143 PHE H H 143 9.522 9.522 8.773 0.749 18935 14406 1 18 . 1 1 144 144 LYS N N 144 121.305 121.305 125.242 -3.937 18935 14407 1 18 . 1 1 144 144 LYS C C 144 176.917 176.917 176.626 0.291 18935 14408 1 18 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.148 1.208 18935 14409 1 18 . 1 1 144 144 LYS CB C 144 33.679 33.679 32.765 0.914 18935 14410 1 18 . 1 1 144 144 LYS H H 144 9.076 9.076 9.151 -0.075 18935 14411 1 18 . 1 1 145 145 ASN N N 145 126.834 126.834 124.976 1.858 18935 14412 1 18 . 1 1 145 145 ASN C C 145 175.070 175.070 174.956 0.114 18935 14413 1 18 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.509 0.255 18935 14414 1 18 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.964 -1.534 18935 14415 1 18 . 1 1 145 145 ASN H H 145 9.618 9.618 9.246 0.372 18935 14416 1 18 . 1 1 146 146 GLN N N 146 110.112 110.112 111.491 -1.379 18935 14417 1 18 . 1 1 146 146 GLN C C 146 175.198 175.198 174.658 0.540 18935 14418 1 18 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.447 -0.551 18935 14419 1 18 . 1 1 146 146 GLN CB C 146 26.368 26.368 28.178 -1.810 18935 14420 1 18 . 1 1 146 146 GLN H H 146 9.140 9.140 8.790 0.350 18935 14421 1 18 . 1 1 147 147 THR N N 147 116.003 116.003 116.205 -0.202 18935 14422 1 18 . 1 1 147 147 THR C C 147 173.224 173.224 173.288 -0.064 18935 14423 1 18 . 1 1 147 147 THR CA C 147 61.450 61.450 61.358 0.092 18935 14424 1 18 . 1 1 147 147 THR CB C 147 70.285 70.285 70.171 0.114 18935 14425 1 18 . 1 1 147 147 THR H H 147 8.069 8.069 7.584 0.485 18935 14426 1 18 . 1 1 148 148 LEU N N 148 129.281 129.281 130.396 -1.115 18935 14427 1 18 . 1 1 148 148 LEU C C 148 176.703 176.703 175.550 1.153 18935 14428 1 18 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.182 0.284 18935 14429 1 18 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.892 -1.167 18935 14430 1 18 . 1 1 148 148 LEU H H 148 8.831 8.831 8.877 -0.046 18935 14431 1 18 . 1 1 149 149 VAL N N 149 130.189 130.189 126.881 3.308 18935 14432 1 18 . 1 1 149 149 VAL C C 149 175.012 175.012 173.958 1.054 18935 14433 1 18 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.326 0.943 18935 14434 1 18 . 1 1 149 149 VAL CB C 149 31.456 31.456 34.796 -3.340 18935 14435 1 18 . 1 1 149 149 VAL H H 149 9.243 9.243 8.417 0.826 18935 14436 1 18 . 1 1 151 151 LEU N N 151 123.481 123.481 116.544 6.937 18935 14437 1 18 . 1 1 151 151 LEU C C 151 177.679 177.679 176.885 0.794 18935 14438 1 18 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.465 0.532 18935 14439 1 18 . 1 1 151 151 LEU CB C 151 43.619 43.619 41.900 1.719 18935 14440 1 18 . 1 1 151 151 LEU H H 151 8.080 8.080 8.151 -0.071 18935 14441 1 18 . 1 1 152 152 LYS N N 152 126.381 126.381 122.520 3.861 18935 14442 1 18 . 1 1 152 152 LYS C C 152 175.115 175.115 174.972 0.143 18935 14443 1 18 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.107 -1.511 18935 14444 1 18 . 1 1 152 152 LYS CB C 152 29.065 29.065 31.434 -2.369 18935 14445 1 18 . 1 1 152 152 LYS H H 152 9.112 9.112 8.762 0.350 18935 14446 1 18 . 1 1 153 153 ILE N N 153 113.737 113.737 115.696 -1.959 18935 14447 1 18 . 1 1 153 153 ILE C C 153 175.748 175.748 173.598 2.150 18935 14448 1 18 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.558 -1.169 18935 14449 1 18 . 1 1 153 153 ILE CB C 153 41.803 41.803 41.026 0.777 18935 14450 1 18 . 1 1 153 153 ILE H H 153 7.304 7.304 7.527 -0.223 18935 14451 1 18 . 1 1 154 154 THR N N 154 110.656 110.656 114.165 -3.509 18935 14452 1 18 . 1 1 154 154 THR C C 154 174.864 174.864 173.523 1.341 18935 14453 1 18 . 1 1 154 154 THR CA C 154 62.141 62.141 62.171 -0.030 18935 14454 1 18 . 1 1 154 154 THR CB C 154 70.413 70.413 70.442 -0.028 18935 14455 1 18 . 1 1 154 154 THR H H 154 9.382 9.382 8.341 1.041 18935 14456 1 18 . 1 1 155 155 THR N N 155 110.746 110.746 117.689 -6.943 18935 14457 1 18 . 1 1 155 155 THR C C 155 174.718 174.718 174.821 -0.103 18935 14458 1 18 . 1 1 155 155 THR CA C 155 58.785 58.785 60.881 -2.096 18935 14459 1 18 . 1 1 155 155 THR CB C 155 72.277 72.277 71.012 1.265 18935 14460 1 18 . 1 1 155 155 THR H H 155 7.746 7.746 7.750 -0.004 18935 14461 1 18 . 1 1 156 156 GLU N N 156 122.302 122.302 124.926 -2.624 18935 14462 1 18 . 1 1 156 156 GLU C C 156 177.289 177.289 177.859 -0.570 18935 14463 1 18 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.704 -1.880 18935 14464 1 18 . 1 1 156 156 GLU CB C 156 28.381 28.381 28.936 -0.555 18935 14465 1 18 . 1 1 156 156 GLU H H 156 9.490 9.490 9.090 0.400 18935 14466 1 18 . 1 1 157 157 LYS N N 157 118.905 118.905 116.003 2.902 18935 14467 1 18 . 1 1 157 157 LYS C C 157 178.241 178.241 178.873 -0.632 18935 14468 1 18 . 1 1 157 157 LYS CA C 157 59.765 59.765 57.692 2.073 18935 14469 1 18 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.750 -0.472 18935 14470 1 18 . 1 1 157 157 LYS H H 157 8.329 8.329 8.470 -0.141 18935 14471 1 18 . 1 1 158 158 GLU N N 158 116.230 116.230 121.121 -4.891 18935 14472 1 18 . 1 1 158 158 GLU C C 158 178.988 178.988 178.337 0.651 18935 14473 1 18 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.210 0.046 18935 14474 1 18 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.372 -0.314 18935 14475 1 18 . 1 1 158 158 GLU H H 158 7.611 7.611 7.661 -0.050 18935 14476 1 18 . 1 1 159 159 LEU N N 159 118.978 118.978 121.329 -2.351 18935 14477 1 18 . 1 1 159 159 LEU C C 159 176.347 176.347 178.354 -2.007 18935 14478 1 18 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.316 -5.077 18935 14479 1 18 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.766 -2.223 18935 14480 1 18 . 1 1 159 159 LEU H H 159 7.704 7.704 8.207 -0.503 18935 14481 1 18 . 1 1 160 160 ILE N N 160 117.227 117.227 114.322 2.905 18935 14482 1 18 . 1 1 160 160 ILE C C 160 177.219 177.219 177.037 0.182 18935 14483 1 18 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.156 0.459 18935 14484 1 18 . 1 1 160 160 ILE CB C 160 37.557 37.557 36.975 0.582 18935 14485 1 18 . 1 1 160 160 ILE H H 160 7.886 7.886 7.386 0.500 18935 14486 1 18 . 1 1 161 161 LYS N N 161 115.912 115.912 119.577 -3.665 18935 14487 1 18 . 1 1 161 161 LYS C C 161 180.990 180.990 178.683 2.307 18935 14488 1 18 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.334 0.297 18935 14489 1 18 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.871 -1.123 18935 14490 1 18 . 1 1 161 161 LYS H H 161 7.536 7.536 7.392 0.144 18935 14491 1 18 . 1 1 162 162 GLU N N 162 120.852 120.852 120.776 0.076 18935 14492 1 18 . 1 1 162 162 GLU C C 162 178.793 178.793 177.959 0.834 18935 14493 1 18 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.355 -0.374 18935 14494 1 18 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.278 -1.486 18935 14495 1 18 . 1 1 162 162 GLU H H 162 8.392 8.392 8.001 0.391 18935 14496 1 18 . 1 1 163 163 LEU N N 163 115.912 115.912 116.252 -0.340 18935 14497 1 18 . 1 1 163 163 LEU C C 163 176.370 176.370 176.824 -0.454 18935 14498 1 18 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.494 -0.400 18935 14499 1 18 . 1 1 163 163 LEU CB C 163 41.174 41.174 43.033 -1.859 18935 14500 1 18 . 1 1 163 163 LEU H H 163 8.031 8.031 7.821 0.210 18935 14501 1 18 . 1 1 164 164 GLY N N 164 103.160 103.160 103.926 -0.766 18935 14502 1 18 . 1 1 164 164 GLY C C 164 174.240 174.240 174.136 0.104 18935 14503 1 18 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.767 -0.465 18935 14504 1 18 . 1 1 164 164 GLY H H 164 7.625 7.625 7.352 0.273 18935 14505 1 18 . 1 1 165 165 PHE N N 165 117.952 117.952 118.088 -0.136 18935 14506 1 18 . 1 1 165 165 PHE C C 165 174.556 174.556 174.775 -0.219 18935 14507 1 18 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.863 -0.398 18935 14508 1 18 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.576 -0.814 18935 14509 1 18 . 1 1 165 165 PHE H H 165 7.283 7.283 8.415 -1.132 18935 14510 1 18 . 1 1 166 166 THR N N 166 118.178 118.178 114.310 3.868 18935 14511 1 18 . 1 1 166 166 THR C C 166 175.306 175.306 174.509 0.797 18935 14512 1 18 . 1 1 166 166 THR CA C 166 63.466 63.466 60.213 3.253 18935 14513 1 18 . 1 1 166 166 THR CB C 166 68.721 68.721 70.642 -1.921 18935 14514 1 18 . 1 1 166 166 THR H H 166 9.678 9.678 8.438 1.240 18935 14515 1 18 . 1 1 167 167 TYR N N 167 128.239 128.239 121.391 6.848 18935 14516 1 18 . 1 1 167 167 TYR C C 167 173.297 173.297 175.908 -2.611 18935 14517 1 18 . 1 1 167 167 TYR CA C 167 60.412 60.412 58.478 1.934 18935 14518 1 18 . 1 1 167 167 TYR CB C 167 36.722 36.722 37.807 -1.085 18935 14519 1 18 . 1 1 167 167 TYR H H 167 9.264 9.264 8.290 0.974 18935 14520 1 18 . 1 1 168 168 ARG N N 168 126.789 126.789 125.039 1.750 18935 14521 1 18 . 1 1 168 168 ARG C C 168 175.297 175.297 175.289 0.008 18935 14522 1 18 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.805 -2.040 18935 14523 1 18 . 1 1 168 168 ARG CB C 168 31.326 31.326 31.240 0.086 18935 14524 1 18 . 1 1 168 168 ARG H H 168 7.030 7.030 8.810 -1.780 18935 14525 1 18 . 1 1 169 169 ILE N N 169 119.221 119.221 118.860 0.361 18935 14526 1 18 . 1 1 169 169 ILE C C 169 174.522 174.522 174.539 -0.017 18935 14527 1 18 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.414 2.865 18935 14528 1 18 . 1 1 169 169 ILE CB C 169 34.647 34.647 40.160 -5.513 18935 14529 1 18 . 1 1 169 169 ILE H H 169 8.349 8.349 8.296 0.053 18935 14530 1 18 . 1 1 171 171 LYS N N 171 111.335 111.335 118.174 -6.839 18935 14531 1 18 . 1 1 171 171 LYS C C 171 176.638 176.638 178.610 -1.972 18935 14532 1 18 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.580 -2.042 18935 14533 1 18 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.962 0.005 18935 14534 1 18 . 1 1 171 171 LYS H H 171 8.198 8.198 8.601 -0.403 18935 14535 1 18 . 1 1 172 172 LYS N N 172 116.411 116.411 117.309 -0.898 18935 14536 1 18 . 1 1 172 172 LYS C C 172 175.331 175.331 176.218 -0.887 18935 14537 1 18 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.435 -1.434 18935 14538 1 18 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.318 -1.500 18935 14539 1 18 . 1 1 172 172 LYS H H 172 7.843 7.843 7.387 0.456 18935 14540 1 18 . 1 1 173 173 ARG N N 173 120.490 120.490 116.838 3.652 18935 14541 1 18 . 1 1 173 173 ARG C C 173 172.830 172.830 174.766 -1.936 18935 14542 1 18 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.664 0.511 18935 14543 1 18 . 1 1 173 173 ARG CB C 173 28.829 28.829 29.217 -0.388 18935 14544 1 18 . 1 1 173 173 ARG H H 173 6.917 6.917 7.705 -0.788 18935 14545 1 19 . 1 1 2 2 LEU N N 2 119.937 119.937 119.756 0.181 18935 14546 1 19 . 1 1 2 2 LEU C C 2 175.307 175.307 176.140 -0.833 18935 14547 1 19 . 1 1 2 2 LEU CA C 2 54.292 54.292 54.758 -0.466 18935 14548 1 19 . 1 1 2 2 LEU CB C 2 42.684 42.684 42.598 0.086 18935 14549 1 19 . 1 1 2 2 LEU H H 2 9.251 9.251 8.143 1.108 18935 14550 1 19 . 1 1 3 3 THR N N 3 111.335 111.335 108.620 2.715 18935 14551 1 19 . 1 1 3 3 THR C C 3 175.854 175.854 174.764 1.090 18935 14552 1 19 . 1 1 3 3 THR CA C 3 60.540 60.540 60.393 0.147 18935 14553 1 19 . 1 1 3 3 THR CB C 3 70.782 70.782 71.031 -0.249 18935 14554 1 19 . 1 1 3 3 THR H H 3 8.677 8.677 7.985 0.692 18935 14555 1 19 . 1 1 4 4 LEU N N 4 120.988 120.988 122.918 -1.930 18935 14556 1 19 . 1 1 4 4 LEU C C 4 178.391 178.391 177.984 0.407 18935 14557 1 19 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.330 -0.265 18935 14558 1 19 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.075 -2.814 18935 14559 1 19 . 1 1 4 4 LEU H H 4 7.746 7.746 8.773 -1.027 18935 14560 1 19 . 1 1 5 5 ILE N N 5 114.236 114.236 113.307 0.929 18935 14561 1 19 . 1 1 5 5 ILE C C 5 178.339 178.339 177.731 0.608 18935 14562 1 19 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.072 -0.490 18935 14563 1 19 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.154 -0.355 18935 14564 1 19 . 1 1 5 5 ILE H H 5 7.821 7.821 7.492 0.329 18935 14565 1 19 . 1 1 6 6 GLN N N 6 120.399 120.399 120.308 0.091 18935 14566 1 19 . 1 1 6 6 GLN C C 6 178.783 178.783 178.711 0.072 18935 14567 1 19 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.564 -0.344 18935 14568 1 19 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.035 0.080 18935 14569 1 19 . 1 1 6 6 GLN H H 6 7.810 7.810 7.920 -0.110 18935 14570 1 19 . 1 1 7 7 GLY N N 7 106.277 106.277 105.574 0.703 18935 14571 1 19 . 1 1 7 7 GLY C C 7 174.554 174.554 175.489 -0.935 18935 14572 1 19 . 1 1 7 7 GLY CA C 7 46.934 46.934 46.046 0.888 18935 14573 1 19 . 1 1 7 7 GLY H H 7 8.733 8.733 7.879 0.854 18935 14574 1 19 . 1 1 8 8 LYS N N 8 119.991 119.991 121.670 -1.679 18935 14575 1 19 . 1 1 8 8 LYS C C 8 179.433 179.433 177.963 1.470 18935 14576 1 19 . 1 1 8 8 LYS CA C 8 59.892 59.892 57.673 2.219 18935 14577 1 19 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.578 -1.246 18935 14578 1 19 . 1 1 8 8 LYS H H 8 8.688 8.688 7.343 1.345 18935 14579 1 19 . 1 1 9 9 LYS N N 9 119.175 119.175 120.391 -1.216 18935 14580 1 19 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.992 -0.610 18935 14581 1 19 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.556 -1.121 18935 14582 1 19 . 1 1 9 9 LYS H H 9 8.015 8.015 8.144 -0.129 18935 14583 1 19 . 1 1 10 10 ILE N N 10 120.308 120.308 116.879 3.429 18935 14584 1 19 . 1 1 10 10 ILE C C 10 177.766 177.766 177.862 -0.096 18935 14585 1 19 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.686 -0.010 18935 14586 1 19 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.447 -1.134 18935 14587 1 19 . 1 1 10 10 ILE H H 10 7.967 7.967 7.542 0.425 18935 14588 1 19 . 1 1 11 11 VAL N N 11 119.130 119.130 119.960 -0.830 18935 14589 1 19 . 1 1 11 11 VAL C C 11 176.606 176.606 178.306 -1.700 18935 14590 1 19 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.365 1.275 18935 14591 1 19 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.523 -0.314 18935 14592 1 19 . 1 1 11 11 VAL H H 11 8.128 8.128 7.722 0.406 18935 14593 1 19 . 1 1 12 12 ASN N N 12 115.822 115.822 116.733 -0.911 18935 14594 1 19 . 1 1 12 12 ASN C C 12 177.375 177.375 177.077 0.298 18935 14595 1 19 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.267 -0.298 18935 14596 1 19 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.732 -1.169 18935 14597 1 19 . 1 1 12 12 ASN H H 12 8.203 8.203 7.736 0.467 18935 14598 1 19 . 1 1 13 13 HIS N N 13 117.659 117.659 116.841 0.818 18935 14599 1 19 . 1 1 13 13 HIS C C 13 177.287 177.287 176.907 0.380 18935 14600 1 19 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.328 1.359 18935 14601 1 19 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.749 -0.728 18935 14602 1 19 . 1 1 13 13 HIS H H 13 7.861 7.861 8.024 -0.163 18935 14603 1 19 . 1 1 14 14 LEU N N 14 115.595 115.595 120.542 -4.947 18935 14604 1 19 . 1 1 14 14 LEU C C 14 179.092 179.092 177.996 1.096 18935 14605 1 19 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.724 -0.083 18935 14606 1 19 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.872 -0.852 18935 14607 1 19 . 1 1 14 14 LEU H H 14 8.376 8.376 8.451 -0.075 18935 14608 1 19 . 1 1 15 15 ARG N N 15 115.006 115.006 118.249 -3.243 18935 14609 1 19 . 1 1 15 15 ARG C C 15 176.265 176.265 176.741 -0.476 18935 14610 1 19 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.140 1.744 18935 14611 1 19 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.879 -0.807 18935 14612 1 19 . 1 1 15 15 ARG H H 15 8.074 8.074 7.996 0.078 18935 14613 1 19 . 1 1 16 16 SER N N 16 107.778 107.778 112.886 -5.108 18935 14614 1 19 . 1 1 16 16 SER C C 16 176.009 176.009 175.440 0.569 18935 14615 1 19 . 1 1 16 16 SER CA C 16 57.244 57.244 59.449 -2.205 18935 14616 1 19 . 1 1 16 16 SER CB C 16 63.525 63.525 63.474 0.051 18935 14617 1 19 . 1 1 16 16 SER H H 16 7.136 7.136 8.040 -0.904 18935 14618 1 19 . 1 1 17 17 ARG N N 17 121.532 121.532 120.184 1.348 18935 14619 1 19 . 1 1 17 17 ARG C C 17 174.482 174.482 175.336 -0.854 18935 14620 1 19 . 1 1 17 17 ARG CA C 17 56.322 56.322 54.615 1.707 18935 14621 1 19 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.816 1.014 18935 14622 1 19 . 1 1 17 17 ARG H H 17 7.913 7.913 7.644 0.269 18935 14623 1 19 . 1 1 18 18 LEU N N 18 121.305 121.305 120.671 0.634 18935 14624 1 19 . 1 1 18 18 LEU C C 18 176.283 176.283 175.767 0.516 18935 14625 1 19 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.409 -0.711 18935 14626 1 19 . 1 1 18 18 LEU CB C 18 43.055 43.055 42.998 0.057 18935 14627 1 19 . 1 1 18 18 LEU H H 18 8.812 8.812 7.443 1.369 18935 14628 1 19 . 1 1 19 19 ALA N N 19 125.293 125.293 122.915 2.378 18935 14629 1 19 . 1 1 19 19 ALA C C 19 173.780 173.780 175.054 -1.274 18935 14630 1 19 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.777 -0.975 18935 14631 1 19 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.194 0.659 18935 14632 1 19 . 1 1 19 19 ALA H H 19 8.790 8.790 8.113 0.677 18935 14633 1 19 . 1 1 20 20 PHE N N 20 113.117 113.117 115.439 -2.322 18935 14634 1 19 . 1 1 20 20 PHE C C 20 172.708 172.708 173.147 -0.439 18935 14635 1 19 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.497 -0.899 18935 14636 1 19 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.704 0.021 18935 14637 1 19 . 1 1 20 20 PHE H H 20 8.925 8.925 8.820 0.105 18935 14638 1 19 . 1 1 21 21 GLU N N 21 121.532 121.532 119.235 2.297 18935 14639 1 19 . 1 1 21 21 GLU C C 21 174.830 174.830 175.124 -0.294 18935 14640 1 19 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.117 -0.154 18935 14641 1 19 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.842 -2.499 18935 14642 1 19 . 1 1 21 21 GLU H H 21 7.972 7.972 9.367 -1.395 18935 14643 1 19 . 1 1 22 22 TYR N N 22 125.339 125.339 119.650 5.689 18935 14644 1 19 . 1 1 22 22 TYR C C 22 174.864 174.864 174.396 0.468 18935 14645 1 19 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.271 -2.983 18935 14646 1 19 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.382 -0.523 18935 14647 1 19 . 1 1 22 22 TYR H H 22 9.016 9.016 8.443 0.573 18935 14648 1 19 . 1 1 23 23 ASN N N 23 127.024 127.024 126.409 0.615 18935 14649 1 19 . 1 1 23 23 ASN C C 23 175.410 175.410 175.597 -0.187 18935 14650 1 19 . 1 1 23 23 ASN CA C 23 53.054 53.054 54.015 -0.961 18935 14651 1 19 . 1 1 23 23 ASN CB C 23 36.261 36.261 36.879 -0.618 18935 14652 1 19 . 1 1 23 23 ASN H H 23 9.181 9.181 9.236 -0.055 18935 14653 1 19 . 1 1 24 24 GLY N N 24 102.755 102.755 102.321 0.434 18935 14654 1 19 . 1 1 24 24 GLY C C 24 173.626 173.626 174.523 -0.897 18935 14655 1 19 . 1 1 24 24 GLY CA C 24 44.935 44.935 44.932 0.003 18935 14656 1 19 . 1 1 24 24 GLY H H 24 8.666 8.666 8.520 0.146 18935 14657 1 19 . 1 1 25 25 GLN N N 25 118.722 118.722 120.454 -1.732 18935 14658 1 19 . 1 1 25 25 GLN C C 25 173.657 173.657 174.821 -1.164 18935 14659 1 19 . 1 1 25 25 GLN CA C 25 53.233 53.233 55.079 -1.846 18935 14660 1 19 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.596 0.209 18935 14661 1 19 . 1 1 25 25 GLN H H 25 7.708 7.708 7.976 -0.268 18935 14662 1 19 . 1 1 26 26 LEU N N 26 123.526 123.526 120.566 2.960 18935 14663 1 19 . 1 1 26 26 LEU C C 26 175.842 175.842 176.015 -0.173 18935 14664 1 19 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.794 0.192 18935 14665 1 19 . 1 1 26 26 LEU CB C 26 40.807 40.807 44.061 -3.254 18935 14666 1 19 . 1 1 26 26 LEU H H 26 8.543 8.543 8.352 0.191 18935 14667 1 19 . 1 1 27 27 ILE N N 27 129.462 129.462 124.265 5.197 18935 14668 1 19 . 1 1 27 27 ILE C C 27 175.085 175.085 174.381 0.704 18935 14669 1 19 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.300 0.673 18935 14670 1 19 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.043 -2.491 18935 14671 1 19 . 1 1 27 27 ILE H H 27 8.989 8.989 8.975 0.014 18935 14672 1 19 . 1 1 28 28 LYS N N 28 125.157 125.157 127.162 -2.005 18935 14673 1 19 . 1 1 28 28 LYS C C 28 176.725 176.725 175.058 1.667 18935 14674 1 19 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.351 1.459 18935 14675 1 19 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.260 -1.443 18935 14676 1 19 . 1 1 28 28 LYS H H 28 8.311 8.311 8.328 -0.017 18935 14677 1 19 . 1 1 29 29 ILE N N 29 125.565 125.565 115.777 9.788 18935 14678 1 19 . 1 1 29 29 ILE C C 29 175.685 175.685 173.553 2.132 18935 14679 1 19 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.694 0.711 18935 14680 1 19 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.279 -3.248 18935 14681 1 19 . 1 1 29 29 ILE H H 29 8.209 8.209 7.629 0.580 18935 14682 1 19 . 1 1 30 30 LEU N N 30 127.831 127.831 120.728 7.103 18935 14683 1 19 . 1 1 30 30 LEU C C 30 178.794 178.794 176.338 2.456 18935 14684 1 19 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.408 1.035 18935 14685 1 19 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.728 -4.892 18935 14686 1 19 . 1 1 30 30 LEU H H 30 9.027 9.027 8.172 0.855 18935 14687 1 19 . 1 1 31 31 SER N N 31 116.864 116.864 115.047 1.817 18935 14688 1 19 . 1 1 31 31 SER C C 31 177.464 177.464 175.673 1.791 18935 14689 1 19 . 1 1 31 31 SER CA C 31 61.180 61.180 60.992 0.188 18935 14690 1 19 . 1 1 31 31 SER CB C 31 62.105 62.105 63.166 -1.061 18935 14691 1 19 . 1 1 31 31 SER H H 31 8.887 8.887 8.317 0.570 18935 14692 1 19 . 1 1 32 32 LYS N N 32 114.825 114.825 119.061 -4.236 18935 14693 1 19 . 1 1 32 32 LYS C C 32 176.243 176.243 175.768 0.475 18935 14694 1 19 . 1 1 32 32 LYS CA C 32 57.292 57.292 56.707 0.585 18935 14695 1 19 . 1 1 32 32 LYS CB C 32 30.266 30.266 30.839 -0.573 18935 14696 1 19 . 1 1 32 32 LYS H H 32 8.290 8.290 8.385 -0.095 18935 14697 1 19 . 1 1 33 33 ASN N N 33 117.564 117.564 114.455 3.109 18935 14698 1 19 . 1 1 33 33 ASN C C 33 172.253 172.253 173.770 -1.517 18935 14699 1 19 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.151 -1.060 18935 14700 1 19 . 1 1 33 33 ASN CB C 33 38.339 38.339 41.278 -2.939 18935 14701 1 19 . 1 1 33 33 ASN H H 33 8.051 8.051 8.191 -0.140 18935 14702 1 19 . 1 1 34 34 ILE N N 34 118.949 118.949 120.798 -1.849 18935 14703 1 19 . 1 1 34 34 ILE C C 34 175.343 175.343 174.654 0.689 18935 14704 1 19 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.741 -0.188 18935 14705 1 19 . 1 1 34 34 ILE CB C 34 38.867 38.867 42.429 -3.562 18935 14706 1 19 . 1 1 34 34 ILE H H 34 7.670 7.670 7.862 -0.192 18935 14707 1 19 . 1 1 35 35 VAL N N 35 128.355 128.355 125.889 2.466 18935 14708 1 19 . 1 1 35 35 VAL C C 35 175.543 175.543 174.368 1.175 18935 14709 1 19 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.419 -0.405 18935 14710 1 19 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.671 -1.440 18935 14711 1 19 . 1 1 35 35 VAL H H 35 9.698 9.698 9.212 0.486 18935 14712 1 19 . 1 1 36 36 ALA N N 36 129.553 129.553 132.132 -2.579 18935 14713 1 19 . 1 1 36 36 ALA C C 36 177.015 177.015 176.780 0.235 18935 14714 1 19 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.427 0.969 18935 14715 1 19 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.552 -0.930 18935 14716 1 19 . 1 1 36 36 ALA H H 36 8.917 8.917 8.602 0.315 18935 14717 1 19 . 1 1 37 37 VAL N N 37 115.006 115.006 119.037 -4.031 18935 14718 1 19 . 1 1 37 37 VAL C C 37 174.649 174.649 175.556 -0.907 18935 14719 1 19 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.755 -0.434 18935 14720 1 19 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.648 -1.262 18935 14721 1 19 . 1 1 37 37 VAL H H 37 8.214 8.214 8.222 -0.008 18935 14722 1 19 . 1 1 38 38 GLY N N 38 109.387 109.387 107.338 2.049 18935 14723 1 19 . 1 1 38 38 GLY C C 38 174.152 174.152 175.812 -1.660 18935 14724 1 19 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.007 0.490 18935 14725 1 19 . 1 1 38 38 GLY H H 38 8.677 8.677 7.844 0.833 18935 14726 1 19 . 1 1 39 39 SER N N 39 116.776 116.776 118.584 -1.808 18935 14727 1 19 . 1 1 39 39 SER C C 39 175.129 175.129 177.060 -1.931 18935 14728 1 19 . 1 1 39 39 SER CA C 39 60.036 60.036 61.852 -1.816 18935 14729 1 19 . 1 1 39 39 SER CB C 39 61.522 61.522 63.336 -1.814 18935 14730 1 19 . 1 1 39 39 SER H H 39 9.705 9.705 8.691 1.014 18935 14731 1 19 . 1 1 40 40 LEU N N 40 113.696 113.696 117.814 -4.118 18935 14732 1 19 . 1 1 40 40 LEU C C 40 180.558 180.558 177.763 2.795 18935 14733 1 19 . 1 1 40 40 LEU CA C 40 58.373 58.373 56.855 1.518 18935 14734 1 19 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.240 0.637 18935 14735 1 19 . 1 1 40 40 LEU H H 40 7.311 7.311 8.059 -0.748 18935 14736 1 19 . 1 1 41 41 ARG N N 41 121.162 121.162 117.533 3.629 18935 14737 1 19 . 1 1 41 41 ARG C C 41 176.964 176.964 176.965 -0.001 18935 14738 1 19 . 1 1 41 41 ARG CA C 41 58.451 58.451 57.240 1.211 18935 14739 1 19 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.430 -2.225 18935 14740 1 19 . 1 1 41 41 ARG H H 41 6.999 6.999 7.573 -0.574 18935 14741 1 19 . 1 1 42 42 ARG N N 42 111.109 111.109 118.613 -7.504 18935 14742 1 19 . 1 1 42 42 ARG C C 42 172.564 172.564 175.817 -3.253 18935 14743 1 19 . 1 1 42 42 ARG CA C 42 56.380 56.380 55.936 0.444 18935 14744 1 19 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.882 -2.533 18935 14745 1 19 . 1 1 42 42 ARG H H 42 7.041 7.041 7.710 -0.669 18935 14746 1 19 . 1 1 43 43 GLU N N 43 111.924 111.924 116.569 -4.645 18935 14747 1 19 . 1 1 43 43 GLU C C 43 176.202 176.202 174.978 1.224 18935 14748 1 19 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.358 -0.904 18935 14749 1 19 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.405 -2.104 18935 14750 1 19 . 1 1 43 43 GLU H H 43 7.757 7.757 7.933 -0.176 18935 14751 1 19 . 1 1 44 44 GLU N N 44 117.861 117.861 121.131 -3.270 18935 14752 1 19 . 1 1 44 44 GLU C C 44 175.197 175.197 176.322 -1.125 18935 14753 1 19 . 1 1 44 44 GLU CA C 44 56.128 56.128 55.810 0.318 18935 14754 1 19 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.555 -1.996 18935 14755 1 19 . 1 1 44 44 GLU H H 44 7.461 7.461 8.046 -0.585 18935 14756 1 19 . 1 1 45 45 LYS N N 45 115.051 115.051 117.636 -2.585 18935 14757 1 19 . 1 1 45 45 LYS C C 45 177.733 177.733 175.366 2.367 18935 14758 1 19 . 1 1 45 45 LYS CA C 45 59.055 59.055 56.613 2.442 18935 14759 1 19 . 1 1 45 45 LYS CB C 45 32.027 32.027 34.457 -2.430 18935 14760 1 19 . 1 1 45 45 LYS H H 45 8.123 8.123 8.391 -0.268 18935 14761 1 19 . 1 1 46 46 MET N N 46 114.009 114.009 120.495 -6.486 18935 14762 1 19 . 1 1 46 46 MET C C 46 174.067 174.067 173.934 0.133 18935 14763 1 19 . 1 1 46 46 MET CA C 46 52.477 52.477 54.972 -2.495 18935 14764 1 19 . 1 1 46 46 MET CB C 46 33.974 33.974 34.988 -1.014 18935 14765 1 19 . 1 1 46 46 MET H H 46 7.767 7.767 7.578 0.189 18935 14766 1 19 . 1 1 47 47 LEU N N 47 120.263 120.263 125.671 -5.408 18935 14767 1 19 . 1 1 47 47 LEU C C 47 177.669 177.669 176.090 1.579 18935 14768 1 19 . 1 1 47 47 LEU CA C 47 52.201 52.201 54.300 -2.099 18935 14769 1 19 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.694 -0.786 18935 14770 1 19 . 1 1 47 47 LEU H H 47 9.481 9.481 8.522 0.959 18935 14771 1 19 . 1 1 48 48 ASN N N 48 118.632 118.632 117.832 0.800 18935 14772 1 19 . 1 1 48 48 ASN C C 48 174.715 174.715 173.695 1.020 18935 14773 1 19 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.645 1.856 18935 14774 1 19 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.332 -1.504 18935 14775 1 19 . 1 1 48 48 ASN H H 48 9.388 9.388 8.802 0.586 18935 14776 1 19 . 1 1 49 49 ASP N N 49 115.867 115.867 115.212 0.655 18935 14777 1 19 . 1 1 49 49 ASP C C 49 174.111 174.111 174.497 -0.386 18935 14778 1 19 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.641 -1.440 18935 14779 1 19 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.755 -3.679 18935 14780 1 19 . 1 1 49 49 ASP H H 49 7.670 7.670 7.617 0.053 18935 14781 1 19 . 1 1 50 50 VAL N N 50 119.185 119.185 119.034 0.151 18935 14782 1 19 . 1 1 50 50 VAL C C 50 172.333 172.333 174.255 -1.922 18935 14783 1 19 . 1 1 50 50 VAL CA C 50 61.915 61.915 60.808 1.107 18935 14784 1 19 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.778 -0.813 18935 14785 1 19 . 1 1 50 50 VAL H H 50 8.339 8.339 8.171 0.168 18935 14786 1 19 . 1 1 51 51 ASP N N 51 124.704 124.704 126.575 -1.871 18935 14787 1 19 . 1 1 51 51 ASP C C 51 173.725 173.725 175.325 -1.600 18935 14788 1 19 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.422 -0.394 18935 14789 1 19 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.464 0.365 18935 14790 1 19 . 1 1 51 51 ASP H H 51 8.984 8.984 8.182 0.802 18935 14791 1 19 . 1 1 52 52 LEU N N 52 120.943 120.943 118.839 2.104 18935 14792 1 19 . 1 1 52 52 LEU C C 52 173.045 173.045 174.660 -1.615 18935 14793 1 19 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.228 -1.357 18935 14794 1 19 . 1 1 52 52 LEU CB C 52 44.253 44.253 45.093 -0.840 18935 14795 1 19 . 1 1 52 52 LEU H H 52 9.081 9.081 8.271 0.810 18935 14796 1 19 . 1 1 53 53 LEU N N 53 123.027 123.027 117.544 5.483 18935 14797 1 19 . 1 1 53 53 LEU C C 53 173.750 173.750 175.793 -2.043 18935 14798 1 19 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.416 -1.083 18935 14799 1 19 . 1 1 53 53 LEU CB C 53 45.008 45.008 44.252 0.756 18935 14800 1 19 . 1 1 53 53 LEU H H 53 9.146 9.146 9.089 0.057 18935 14801 1 19 . 1 1 54 54 ILE N N 54 126.562 126.562 121.831 4.731 18935 14802 1 19 . 1 1 54 54 ILE C C 54 175.132 175.132 175.573 -0.441 18935 14803 1 19 . 1 1 54 54 ILE CA C 54 58.598 58.598 60.034 -1.436 18935 14804 1 19 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.449 -0.888 18935 14805 1 19 . 1 1 54 54 ILE H H 54 9.440 9.440 8.661 0.779 18935 14806 1 19 . 1 1 55 55 ILE N N 55 126.879 126.879 128.204 -1.325 18935 14807 1 19 . 1 1 55 55 ILE C C 55 175.655 175.655 175.523 0.132 18935 14808 1 19 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.202 -2.641 18935 14809 1 19 . 1 1 55 55 ILE CB C 55 34.306 34.306 39.889 -5.583 18935 14810 1 19 . 1 1 55 55 ILE H H 55 9.381 9.381 7.940 1.441 18935 14811 1 19 . 1 1 56 56 VAL N N 56 128.936 128.936 123.040 5.896 18935 14812 1 19 . 1 1 56 56 VAL C C 56 176.389 176.389 174.331 2.058 18935 14813 1 19 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.624 0.006 18935 14814 1 19 . 1 1 56 56 VAL CB C 56 32.784 32.784 32.810 -0.026 18935 14815 1 19 . 1 1 56 56 VAL H H 56 9.227 9.227 8.694 0.533 18935 14816 1 19 . 1 1 58 58 GLU N N 58 112.423 112.423 117.672 -5.249 18935 14817 1 19 . 1 1 58 58 GLU C C 58 175.946 175.946 175.847 0.099 18935 14818 1 19 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.115 -0.815 18935 14819 1 19 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.689 0.408 18935 14820 1 19 . 1 1 58 58 GLU H H 58 6.685 6.685 7.811 -1.126 18935 14821 1 19 . 1 1 59 59 LYS N N 59 125.293 125.293 119.739 5.554 18935 14822 1 19 . 1 1 59 59 LYS C C 59 179.248 179.248 176.061 3.187 18935 14823 1 19 . 1 1 59 59 LYS CA C 59 59.774 59.774 56.745 3.029 18935 14824 1 19 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.754 -1.677 18935 14825 1 19 . 1 1 59 59 LYS H H 59 9.108 9.108 8.682 0.426 18935 14826 1 19 . 1 1 60 60 LYS N N 60 117.408 117.408 119.817 -2.409 18935 14827 1 19 . 1 1 60 60 LYS C C 60 177.198 177.198 177.862 -0.664 18935 14828 1 19 . 1 1 60 60 LYS CA C 60 58.213 58.213 57.695 0.518 18935 14829 1 19 . 1 1 60 60 LYS CB C 60 30.583 30.583 33.200 -2.616 18935 14830 1 19 . 1 1 60 60 LYS H H 60 9.102 9.102 7.535 1.567 18935 14831 1 19 . 1 1 61 61 LEU N N 61 114.779 114.779 121.844 -7.065 18935 14832 1 19 . 1 1 61 61 LEU C C 61 178.790 178.790 178.712 0.078 18935 14833 1 19 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.806 -2.782 18935 14834 1 19 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.442 -0.578 18935 14835 1 19 . 1 1 61 61 LEU H H 61 7.455 7.455 7.924 -0.469 18935 14836 1 19 . 1 1 62 62 LEU N N 62 119.629 119.629 117.799 1.830 18935 14837 1 19 . 1 1 62 62 LEU C C 62 177.762 177.762 177.809 -0.047 18935 14838 1 19 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.759 0.439 18935 14839 1 19 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.868 -1.137 18935 14840 1 19 . 1 1 62 62 LEU H H 62 7.714 7.714 7.651 0.063 18935 14841 1 19 . 1 1 63 63 LYS N N 63 112.921 112.921 116.638 -3.717 18935 14842 1 19 . 1 1 63 63 LYS C C 63 175.386 175.386 177.211 -1.825 18935 14843 1 19 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.079 0.277 18935 14844 1 19 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.461 -1.498 18935 14845 1 19 . 1 1 63 63 LYS H H 63 7.751 7.751 8.436 -0.685 18935 14846 1 19 . 1 1 64 64 HIS N N 64 112.468 112.468 116.937 -4.469 18935 14847 1 19 . 1 1 64 64 HIS C C 64 176.081 176.081 176.681 -0.600 18935 14848 1 19 . 1 1 64 64 HIS CA C 64 55.769 55.769 58.223 -2.454 18935 14849 1 19 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.918 0.452 18935 14850 1 19 . 1 1 64 64 HIS H H 64 7.697 7.697 7.668 0.029 18935 14851 1 19 . 1 1 65 65 VAL N N 65 117.499 117.499 119.649 -2.150 18935 14852 1 19 . 1 1 65 65 VAL C C 65 174.301 174.301 176.815 -2.514 18935 14853 1 19 . 1 1 65 65 VAL CA C 65 66.330 66.330 64.760 1.570 18935 14854 1 19 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.430 -2.070 18935 14855 1 19 . 1 1 65 65 VAL H H 65 6.917 6.917 7.472 -0.555 18935 14856 1 19 . 1 1 66 66 LEU N N 66 113.873 113.873 119.122 -5.249 18935 14857 1 19 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.933 -0.083 18935 14858 1 19 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.840 -3.781 18935 14859 1 19 . 1 1 66 66 LEU H H 66 9.102 9.102 7.449 1.653 18935 14860 1 19 . 1 1 68 68 ASN N N 68 110.792 110.792 117.469 -6.677 18935 14861 1 19 . 1 1 68 68 ASN C C 68 174.877 174.877 173.374 1.503 18935 14862 1 19 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.760 -1.945 18935 14863 1 19 . 1 1 68 68 ASN CB C 68 40.311 40.311 40.822 -0.511 18935 14864 1 19 . 1 1 68 68 ASN H H 68 7.234 7.234 8.204 -0.970 18935 14865 1 19 . 1 1 69 69 ILE N N 69 122.348 122.348 124.962 -2.614 18935 14866 1 19 . 1 1 69 69 ILE CA C 69 59.912 59.912 59.894 0.018 18935 14867 1 19 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.807 -2.769 18935 14868 1 19 . 1 1 69 69 ILE H H 69 7.428 7.428 8.694 -1.266 18935 14869 1 19 . 1 1 70 70 ARG N N 70 125.701 125.701 125.598 0.103 18935 14870 1 19 . 1 1 70 70 ARG C C 70 174.596 174.596 173.622 0.974 18935 14871 1 19 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.316 -1.155 18935 14872 1 19 . 1 1 70 70 ARG CB C 70 32.453 32.453 33.012 -0.559 18935 14873 1 19 . 1 1 70 70 ARG H H 70 9.083 9.083 8.928 0.155 18935 14874 1 19 . 1 1 71 71 ILE N N 71 118.496 118.496 118.591 -0.095 18935 14875 1 19 . 1 1 71 71 ILE C C 71 175.625 175.625 176.263 -0.638 18935 14876 1 19 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.514 0.263 18935 14877 1 19 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.693 -2.726 18935 14878 1 19 . 1 1 71 71 ILE H H 71 7.864 7.864 8.066 -0.202 18935 14879 1 19 . 1 1 72 72 LYS N N 72 127.423 127.423 124.292 3.131 18935 14880 1 19 . 1 1 72 72 LYS C C 72 177.659 177.659 176.891 0.768 18935 14881 1 19 . 1 1 72 72 LYS CA C 72 57.428 57.428 55.653 1.776 18935 14882 1 19 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.144 -0.770 18935 14883 1 19 . 1 1 72 72 LYS H H 72 8.720 8.720 8.443 0.277 18935 14884 1 19 . 1 1 73 73 GLY N N 73 112.604 112.604 114.018 -1.414 18935 14885 1 19 . 1 1 73 73 GLY C C 73 173.729 173.729 174.155 -0.426 18935 14886 1 19 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.120 0.711 18935 14887 1 19 . 1 1 73 73 GLY H H 73 8.930 8.930 8.772 0.158 18935 14888 1 19 . 1 1 74 74 LEU N N 74 119.538 119.538 119.225 0.313 18935 14889 1 19 . 1 1 74 74 LEU C C 74 175.802 175.802 175.842 -0.040 18935 14890 1 19 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.894 -0.233 18935 14891 1 19 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.125 -0.072 18935 14892 1 19 . 1 1 74 74 LEU H H 74 7.547 7.547 7.867 -0.320 18935 14893 1 19 . 1 1 75 75 SER N N 75 118.994 118.994 116.571 2.423 18935 14894 1 19 . 1 1 75 75 SER C C 75 173.111 173.111 172.752 0.359 18935 14895 1 19 . 1 1 75 75 SER CA C 75 57.696 57.696 58.244 -0.548 18935 14896 1 19 . 1 1 75 75 SER CB C 75 63.073 63.073 63.842 -0.769 18935 14897 1 19 . 1 1 75 75 SER H H 75 9.076 9.076 8.563 0.513 18935 14898 1 19 . 1 1 76 76 PHE N N 76 117.802 117.802 120.082 -2.280 18935 14899 1 19 . 1 1 76 76 PHE C C 76 173.564 173.564 174.990 -1.426 18935 14900 1 19 . 1 1 76 76 PHE CA C 76 55.409 55.409 55.153 0.257 18935 14901 1 19 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.169 -0.327 18935 14902 1 19 . 1 1 76 76 PHE H H 76 8.119 8.119 7.352 0.767 18935 14903 1 19 . 1 1 77 77 SER N N 77 113.918 113.918 116.368 -2.450 18935 14904 1 19 . 1 1 77 77 SER C C 77 173.194 173.194 173.178 0.016 18935 14905 1 19 . 1 1 77 77 SER CA C 77 55.999 55.999 57.444 -1.445 18935 14906 1 19 . 1 1 77 77 SER CB C 77 65.218 65.218 66.101 -0.883 18935 14907 1 19 . 1 1 77 77 SER H H 77 8.989 8.989 8.525 0.464 18935 14908 1 19 . 1 1 78 78 VAL N N 78 123.662 123.662 125.871 -2.209 18935 14909 1 19 . 1 1 78 78 VAL C C 78 176.057 176.057 175.847 0.210 18935 14910 1 19 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.716 -0.625 18935 14911 1 19 . 1 1 78 78 VAL CB C 78 32.294 32.294 32.461 -0.167 18935 14912 1 19 . 1 1 78 78 VAL H H 78 8.995 8.995 8.795 0.200 18935 14913 1 19 . 1 1 79 79 LYS N N 79 129.417 129.417 128.947 0.470 18935 14914 1 19 . 1 1 79 79 LYS C C 79 176.436 176.436 174.931 1.505 18935 14915 1 19 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.648 3.004 18935 14916 1 19 . 1 1 79 79 LYS CB C 79 32.473 32.473 34.666 -2.193 18935 14917 1 19 . 1 1 79 79 LYS H H 79 9.425 9.425 8.876 0.549 18935 14918 1 19 . 1 1 80 80 VAL N N 80 108.616 108.616 119.755 -11.139 18935 14919 1 19 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.461 -2.364 18935 14920 1 19 . 1 1 80 80 VAL CB C 80 34.082 34.082 34.648 -0.566 18935 14921 1 19 . 1 1 80 80 VAL H H 80 7.380 7.380 8.268 -0.888 18935 14922 1 19 . 1 1 81 81 CYS N N 81 123.254 123.254 127.751 -4.497 18935 14923 1 19 . 1 1 81 81 CYS C C 81 172.053 172.053 173.799 -1.746 18935 14924 1 19 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.788 1.951 18935 14925 1 19 . 1 1 81 81 CYS CB C 81 27.332 27.332 29.005 -1.673 18935 14926 1 19 . 1 1 81 81 CYS H H 81 9.759 9.759 8.474 1.285 18935 14927 1 19 . 1 1 82 82 GLY N N 82 118.450 118.450 115.606 2.844 18935 14928 1 19 . 1 1 82 82 GLY C C 82 171.814 171.814 174.380 -2.566 18935 14929 1 19 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.280 -1.927 18935 14930 1 19 . 1 1 82 82 GLY H H 82 8.537 8.537 8.520 0.017 18935 14931 1 19 . 1 1 83 83 GLU N N 83 113.964 113.964 120.325 -6.361 18935 14932 1 19 . 1 1 83 83 GLU C C 83 179.320 179.320 177.590 1.730 18935 14933 1 19 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.551 0.124 18935 14934 1 19 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.156 -0.249 18935 14935 1 19 . 1 1 83 83 GLU H H 83 8.473 8.473 8.707 -0.234 18935 14936 1 19 . 1 1 84 84 ARG N N 84 117.544 117.544 117.416 0.128 18935 14937 1 19 . 1 1 84 84 ARG C C 84 177.252 177.252 175.797 1.455 18935 14938 1 19 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.577 -1.073 18935 14939 1 19 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.372 0.174 18935 14940 1 19 . 1 1 84 84 ARG H H 84 9.760 9.760 8.307 1.453 18935 14941 1 19 . 1 1 85 85 LYS N N 85 124.160 124.160 120.121 4.039 18935 14942 1 19 . 1 1 85 85 LYS C C 85 173.379 173.379 175.685 -2.306 18935 14943 1 19 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.016 -0.784 18935 14944 1 19 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.934 -0.722 18935 14945 1 19 . 1 1 85 85 LYS H H 85 8.494 8.494 7.770 0.724 18935 14946 1 19 . 1 1 86 86 CYS N N 86 126.472 126.472 120.035 6.437 18935 14947 1 19 . 1 1 86 86 CYS C C 86 171.935 171.935 173.120 -1.185 18935 14948 1 19 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.456 -1.578 18935 14949 1 19 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.425 -0.121 18935 14950 1 19 . 1 1 86 86 CYS H H 86 9.221 9.221 8.511 0.710 18935 14951 1 19 . 1 1 87 87 VAL N N 87 126.426 126.426 125.077 1.349 18935 14952 1 19 . 1 1 87 87 VAL C C 87 173.760 173.760 174.601 -0.841 18935 14953 1 19 . 1 1 87 87 VAL CA C 87 61.333 61.333 62.062 -0.729 18935 14954 1 19 . 1 1 87 87 VAL CB C 87 33.338 33.338 33.177 0.161 18935 14955 1 19 . 1 1 87 87 VAL H H 87 8.623 8.623 8.718 -0.095 18935 14956 1 19 . 1 1 88 88 LEU N N 88 125.701 125.701 128.506 -2.805 18935 14957 1 19 . 1 1 88 88 LEU C C 88 175.424 175.424 174.964 0.460 18935 14958 1 19 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.565 -1.480 18935 14959 1 19 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.041 -1.497 18935 14960 1 19 . 1 1 88 88 LEU H H 88 9.592 9.592 9.212 0.380 18935 14961 1 19 . 1 1 89 89 PHE N N 89 118.314 118.314 125.573 -7.259 18935 14962 1 19 . 1 1 89 89 PHE C C 89 177.068 177.068 173.639 3.429 18935 14963 1 19 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.160 -0.285 18935 14964 1 19 . 1 1 89 89 PHE CB C 89 38.837 38.837 40.413 -1.576 18935 14965 1 19 . 1 1 89 89 PHE H H 89 8.979 8.979 9.034 -0.055 18935 14966 1 19 . 1 1 90 90 ILE N N 90 119.039 119.039 125.979 -6.940 18935 14967 1 19 . 1 1 90 90 ILE C C 90 173.692 173.692 175.026 -1.334 18935 14968 1 19 . 1 1 90 90 ILE CA C 90 58.672 58.672 58.951 -0.279 18935 14969 1 19 . 1 1 90 90 ILE CB C 90 40.183 40.183 41.301 -1.118 18935 14970 1 19 . 1 1 90 90 ILE H H 90 9.447 9.447 8.506 0.941 18935 14971 1 19 . 1 1 91 91 GLU N N 91 122.801 122.801 121.020 1.781 18935 14972 1 19 . 1 1 91 91 GLU C C 91 175.565 175.565 175.435 0.130 18935 14973 1 19 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.231 -0.766 18935 14974 1 19 . 1 1 91 91 GLU CB C 91 29.662 29.662 32.381 -2.719 18935 14975 1 19 . 1 1 91 91 GLU H H 91 8.360 8.360 8.139 0.221 18935 14976 1 19 . 1 1 92 92 TRP N N 92 126.018 126.018 124.007 2.011 18935 14977 1 19 . 1 1 92 92 TRP C C 92 175.070 175.070 175.427 -0.357 18935 14978 1 19 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.574 -0.384 18935 14979 1 19 . 1 1 92 92 TRP CB C 92 30.582 30.582 32.169 -1.587 18935 14980 1 19 . 1 1 92 92 TRP H H 92 9.425 9.425 9.376 0.049 18935 14981 1 19 . 1 1 93 93 GLU N N 93 126.381 126.381 124.774 1.607 18935 14982 1 19 . 1 1 93 93 GLU C C 93 175.637 175.637 175.223 0.414 18935 14983 1 19 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.080 -0.311 18935 14984 1 19 . 1 1 93 93 GLU CB C 93 25.944 25.944 27.795 -1.851 18935 14985 1 19 . 1 1 93 93 GLU H H 93 8.914 8.914 8.882 0.032 18935 14986 1 19 . 1 1 94 94 LYS N N 94 107.891 107.891 110.581 -2.690 18935 14987 1 19 . 1 1 94 94 LYS C C 94 175.359 175.359 175.812 -0.453 18935 14988 1 19 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.161 0.268 18935 14989 1 19 . 1 1 94 94 LYS CB C 94 28.642 28.642 31.215 -2.574 18935 14990 1 19 . 1 1 94 94 LYS H H 94 8.634 8.634 8.261 0.373 18935 14991 1 19 . 1 1 95 95 LYS N N 95 120.490 120.490 119.386 1.104 18935 14992 1 19 . 1 1 95 95 LYS C C 95 174.369 174.369 174.917 -0.548 18935 14993 1 19 . 1 1 95 95 LYS CA C 95 54.353 54.353 55.036 -0.683 18935 14994 1 19 . 1 1 95 95 LYS CB C 95 34.463 34.463 34.862 -0.399 18935 14995 1 19 . 1 1 95 95 LYS H H 95 7.924 7.924 7.559 0.365 18935 14996 1 19 . 1 1 96 96 THR N N 96 115.278 115.278 113.435 1.843 18935 14997 1 19 . 1 1 96 96 THR C C 96 174.317 174.317 173.590 0.727 18935 14998 1 19 . 1 1 96 96 THR CA C 96 61.203 61.203 60.951 0.252 18935 14999 1 19 . 1 1 96 96 THR CB C 96 69.348 69.348 71.150 -1.802 18935 15000 1 19 . 1 1 96 96 THR H H 96 7.967 7.967 8.286 -0.319 18935 15001 1 19 . 1 1 97 97 TYR N N 97 123.254 123.254 123.775 -0.521 18935 15002 1 19 . 1 1 97 97 TYR C C 97 173.320 173.320 173.508 -0.188 18935 15003 1 19 . 1 1 97 97 TYR CA C 97 55.884 55.884 54.966 0.918 18935 15004 1 19 . 1 1 97 97 TYR CB C 97 41.136 41.136 40.252 0.884 18935 15005 1 19 . 1 1 97 97 TYR H H 97 9.232 9.232 9.174 0.058 18935 15006 1 19 . 1 1 98 98 GLN N N 98 122.574 122.574 121.381 1.193 18935 15007 1 19 . 1 1 98 98 GLN C C 98 172.781 172.781 174.546 -1.765 18935 15008 1 19 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.571 -0.400 18935 15009 1 19 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.352 -1.953 18935 15010 1 19 . 1 1 98 98 GLN H H 98 9.000 9.000 8.698 0.302 18935 15011 1 19 . 1 1 99 99 LEU N N 99 130.218 130.218 123.491 6.727 18935 15012 1 19 . 1 1 99 99 LEU C C 99 172.806 172.806 174.500 -1.694 18935 15013 1 19 . 1 1 99 99 LEU CA C 99 52.050 52.050 52.920 -0.870 18935 15014 1 19 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.813 -1.061 18935 15015 1 19 . 1 1 99 99 LEU H H 99 9.246 9.246 9.070 0.176 18935 15016 1 19 . 1 1 100 100 ASP N N 100 124.931 124.931 125.104 -0.173 18935 15017 1 19 . 1 1 100 100 ASP C C 100 172.626 172.626 174.638 -2.012 18935 15018 1 19 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.099 -2.669 18935 15019 1 19 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.344 -6.016 18935 15020 1 19 . 1 1 100 100 ASP H H 100 9.253 9.253 8.317 0.936 18935 15021 1 19 . 1 1 101 101 LEU N N 101 119.402 119.402 119.960 -0.558 18935 15022 1 19 . 1 1 101 101 LEU C C 101 173.869 173.869 174.642 -0.773 18935 15023 1 19 . 1 1 101 101 LEU CA C 101 51.655 51.655 52.421 -0.766 18935 15024 1 19 . 1 1 101 101 LEU CB C 101 44.166 44.166 44.042 0.124 18935 15025 1 19 . 1 1 101 101 LEU H H 101 8.726 8.726 7.626 1.100 18935 15026 1 19 . 1 1 102 102 PHE N N 102 117.952 117.952 117.560 0.392 18935 15027 1 19 . 1 1 102 102 PHE C C 102 175.853 175.853 175.841 0.012 18935 15028 1 19 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.760 -2.478 18935 15029 1 19 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.760 1.064 18935 15030 1 19 . 1 1 102 102 PHE H H 102 8.236 8.236 8.324 -0.088 18935 15031 1 19 . 1 1 103 103 THR N N 103 106.853 106.853 118.523 -11.670 18935 15032 1 19 . 1 1 103 103 THR C C 103 175.154 175.154 173.719 1.435 18935 15033 1 19 . 1 1 103 103 THR CA C 103 57.685 57.685 60.806 -3.122 18935 15034 1 19 . 1 1 103 103 THR CB C 103 71.037 71.037 68.680 2.357 18935 15035 1 19 . 1 1 103 103 THR H H 103 7.917 7.917 8.693 -0.776 18935 15036 1 19 . 1 1 104 104 ALA N N 104 122.348 122.348 128.569 -6.221 18935 15037 1 19 . 1 1 104 104 ALA C C 104 175.947 175.947 174.862 1.085 18935 15038 1 19 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.367 -0.560 18935 15039 1 19 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.530 -0.102 18935 15040 1 19 . 1 1 104 104 ALA H H 104 8.930 8.930 8.552 0.378 18935 15041 1 19 . 1 1 105 105 LEU N N 105 119.855 119.855 119.261 0.594 18935 15042 1 19 . 1 1 105 105 LEU C C 105 179.628 179.628 178.911 0.717 18935 15043 1 19 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.338 -1.215 18935 15044 1 19 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.155 -1.821 18935 15045 1 19 . 1 1 105 105 LEU H H 105 8.316 8.316 9.219 -0.903 18935 15046 1 19 . 1 1 106 106 ALA N N 106 123.662 123.662 124.432 -0.770 18935 15047 1 19 . 1 1 106 106 ALA C C 106 181.056 181.056 177.747 3.309 18935 15048 1 19 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.024 1.325 18935 15049 1 19 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.649 -1.334 18935 15050 1 19 . 1 1 106 106 ALA H H 106 8.306 8.306 8.340 -0.034 18935 15051 1 19 . 1 1 107 107 GLU N N 107 114.825 114.825 114.120 0.705 18935 15052 1 19 . 1 1 107 107 GLU C C 107 177.854 177.854 176.619 1.235 18935 15053 1 19 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.428 0.958 18935 15054 1 19 . 1 1 107 107 GLU CB C 107 27.844 27.844 29.108 -1.264 18935 15055 1 19 . 1 1 107 107 GLU H H 107 9.754 9.754 8.571 1.183 18935 15056 1 19 . 1 1 108 108 GLU N N 108 115.097 115.097 117.755 -2.658 18935 15057 1 19 . 1 1 108 108 GLU C C 108 178.001 178.001 177.327 0.674 18935 15058 1 19 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.157 -1.231 18935 15059 1 19 . 1 1 108 108 GLU CB C 108 30.001 30.001 30.515 -0.514 18935 15060 1 19 . 1 1 108 108 GLU H H 108 7.859 7.859 7.707 0.152 18935 15061 1 19 . 1 1 109 109 LYS N N 109 118.360 118.360 122.238 -3.878 18935 15062 1 19 . 1 1 109 109 LYS C C 109 172.691 172.691 176.433 -3.742 18935 15063 1 19 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.103 0.799 18935 15064 1 19 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.885 -0.344 18935 15065 1 19 . 1 1 109 109 LYS H H 109 7.660 7.660 7.609 0.051 18935 15066 1 19 . 1 1 111 111 TYR N N 111 114.054 114.054 118.307 -4.253 18935 15067 1 19 . 1 1 111 111 TYR C C 111 179.764 179.764 177.832 1.932 18935 15068 1 19 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.780 -1.782 18935 15069 1 19 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.350 -1.394 18935 15070 1 19 . 1 1 111 111 TYR H H 111 6.583 6.583 8.322 -1.739 18935 15071 1 19 . 1 1 112 112 ALA N N 112 124.749 124.749 122.936 1.813 18935 15072 1 19 . 1 1 112 112 ALA C C 112 179.430 179.430 179.390 0.040 18935 15073 1 19 . 1 1 112 112 ALA CA C 112 54.969 54.969 55.013 -0.044 18935 15074 1 19 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.690 0.122 18935 15075 1 19 . 1 1 112 112 ALA H H 112 8.753 8.753 8.485 0.268 18935 15076 1 19 . 1 1 113 113 ILE N N 113 119.130 119.130 119.878 -0.748 18935 15077 1 19 . 1 1 113 113 ILE C C 113 178.646 178.646 178.342 0.304 18935 15078 1 19 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.088 2.313 18935 15079 1 19 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.605 0.632 18935 15080 1 19 . 1 1 113 113 ILE H H 113 8.946 8.946 8.168 0.778 18935 15081 1 19 . 1 1 114 114 PHE N N 114 121.758 121.758 121.098 0.660 18935 15082 1 19 . 1 1 114 114 PHE C C 114 177.954 177.954 178.429 -0.475 18935 15083 1 19 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.329 -1.552 18935 15084 1 19 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.518 0.546 18935 15085 1 19 . 1 1 114 114 PHE H H 114 7.940 7.940 8.363 -0.423 18935 15086 1 19 . 1 1 115 115 HIS N N 115 116.547 116.547 120.196 -3.649 18935 15087 1 19 . 1 1 115 115 HIS C C 115 176.161 176.161 177.243 -1.082 18935 15088 1 19 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.217 -0.098 18935 15089 1 19 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.818 1.249 18935 15090 1 19 . 1 1 115 115 HIS H H 115 7.767 7.767 7.935 -0.168 18935 15091 1 19 . 1 1 116 116 PHE N N 116 109.387 109.387 114.960 -5.573 18935 15092 1 19 . 1 1 116 116 PHE C C 116 177.282 177.282 176.618 0.664 18935 15093 1 19 . 1 1 116 116 PHE CA C 116 61.434 61.434 58.971 2.463 18935 15094 1 19 . 1 1 116 116 PHE CB C 116 37.255 37.255 37.966 -0.711 18935 15095 1 19 . 1 1 116 116 PHE H H 116 8.989 8.989 8.463 0.526 18935 15096 1 19 . 1 1 117 117 THR N N 117 116.864 116.864 114.979 1.885 18935 15097 1 19 . 1 1 117 117 THR C C 117 172.889 172.889 175.200 -2.311 18935 15098 1 19 . 1 1 117 117 THR CA C 117 66.997 66.997 66.198 0.799 18935 15099 1 19 . 1 1 117 117 THR CB C 117 67.948 67.948 69.089 -1.141 18935 15100 1 19 . 1 1 117 117 THR H H 117 7.988 7.988 7.787 0.201 18935 15101 1 19 . 1 1 118 118 GLY N N 118 103.320 103.320 107.132 -3.812 18935 15102 1 19 . 1 1 118 118 GLY C C 118 176.912 176.912 171.852 5.060 18935 15103 1 19 . 1 1 118 118 GLY CA C 118 44.182 44.182 45.170 -0.988 18935 15104 1 19 . 1 1 118 118 GLY H H 118 6.550 6.550 7.673 -1.123 18935 15105 1 19 . 1 1 120 120 VAL N N 120 120.671 120.671 121.176 -0.505 18935 15106 1 19 . 1 1 120 120 VAL C C 120 176.283 176.283 177.267 -0.984 18935 15107 1 19 . 1 1 120 120 VAL CA C 120 66.940 66.940 63.302 3.638 18935 15108 1 19 . 1 1 120 120 VAL CB C 120 29.852 29.852 32.612 -2.760 18935 15109 1 19 . 1 1 120 120 VAL H H 120 8.408 8.408 8.160 0.248 18935 15110 1 19 . 1 1 121 121 SER N N 121 111.789 111.789 116.558 -4.769 18935 15111 1 19 . 1 1 121 121 SER C C 121 175.658 175.658 176.136 -0.478 18935 15112 1 19 . 1 1 121 121 SER CA C 121 60.814 60.814 61.218 -0.404 18935 15113 1 19 . 1 1 121 121 SER CB C 121 60.253 60.253 62.191 -1.938 18935 15114 1 19 . 1 1 121 121 SER H H 121 8.290 8.290 8.283 0.007 18935 15115 1 19 . 1 1 122 122 TYR N N 122 123.254 123.254 121.011 2.243 18935 15116 1 19 . 1 1 122 122 TYR C C 122 174.611 174.611 177.013 -2.402 18935 15117 1 19 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.863 -2.317 18935 15118 1 19 . 1 1 122 122 TYR CB C 122 38.139 38.139 37.916 0.223 18935 15119 1 19 . 1 1 122 122 TYR H H 122 6.303 6.303 8.418 -2.115 18935 15120 1 19 . 1 1 123 123 LEU N N 123 114.825 114.825 118.362 -3.537 18935 15121 1 19 . 1 1 123 123 LEU C C 123 178.891 178.891 178.732 0.159 18935 15122 1 19 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.507 -0.728 18935 15123 1 19 . 1 1 123 123 LEU CB C 123 40.638 40.638 41.454 -0.816 18935 15124 1 19 . 1 1 123 123 LEU H H 123 6.965 6.965 7.468 -0.503 18935 15125 1 19 . 1 1 124 124 ILE N N 124 114.915 114.915 119.062 -4.147 18935 15126 1 19 . 1 1 124 124 ILE C C 124 177.187 177.187 177.751 -0.564 18935 15127 1 19 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.441 -1.010 18935 15128 1 19 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.496 -0.941 18935 15129 1 19 . 1 1 124 124 ILE H H 124 7.531 7.531 7.656 -0.125 18935 15130 1 19 . 1 1 125 125 ARG N N 125 115.278 115.278 119.304 -4.026 18935 15131 1 19 . 1 1 125 125 ARG C C 125 178.473 178.473 178.956 -0.483 18935 15132 1 19 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.639 -0.180 18935 15133 1 19 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.418 -2.339 18935 15134 1 19 . 1 1 125 125 ARG H H 125 6.809 6.809 8.193 -1.384 18935 15135 1 19 . 1 1 126 126 ILE N N 126 124.160 124.160 119.382 4.778 18935 15136 1 19 . 1 1 126 126 ILE C C 126 178.172 178.172 177.316 0.856 18935 15137 1 19 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.656 -1.729 18935 15138 1 19 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.677 -3.211 18935 15139 1 19 . 1 1 126 126 ILE H H 126 7.408 7.408 7.577 -0.169 18935 15140 1 19 . 1 1 127 127 ARG N N 127 117.136 117.136 120.840 -3.704 18935 15141 1 19 . 1 1 127 127 ARG C C 127 179.227 179.227 178.476 0.751 18935 15142 1 19 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.773 0.443 18935 15143 1 19 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.482 -1.693 18935 15144 1 19 . 1 1 127 127 ARG H H 127 8.230 8.230 8.301 -0.071 18935 15145 1 19 . 1 1 128 128 ALA N N 128 121.305 121.305 120.627 0.678 18935 15146 1 19 . 1 1 128 128 ALA C C 128 179.933 179.933 178.943 0.990 18935 15147 1 19 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.160 -0.454 18935 15148 1 19 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.170 0.168 18935 15149 1 19 . 1 1 128 128 ALA H H 128 8.666 8.666 8.072 0.594 18935 15150 1 19 . 1 1 129 129 ALA N N 129 120.943 120.943 121.918 -0.975 18935 15151 1 19 . 1 1 129 129 ALA C C 129 181.336 181.336 179.709 1.627 18935 15152 1 19 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.854 -0.146 18935 15153 1 19 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.272 -1.412 18935 15154 1 19 . 1 1 129 129 ALA H H 129 7.837 7.837 7.536 0.301 18935 15155 1 19 . 1 1 130 130 LEU N N 130 117.726 117.726 118.392 -0.666 18935 15156 1 19 . 1 1 130 130 LEU C C 130 179.432 179.432 179.745 -0.313 18935 15157 1 19 . 1 1 130 130 LEU CA C 130 57.176 57.176 58.008 -0.832 18935 15158 1 19 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.753 -1.187 18935 15159 1 19 . 1 1 130 130 LEU H H 130 8.114 8.114 8.232 -0.118 18935 15160 1 19 . 1 1 131 131 LYS N N 131 124.115 124.115 121.269 2.846 18935 15161 1 19 . 1 1 131 131 LYS C C 131 181.452 181.452 179.409 2.043 18935 15162 1 19 . 1 1 131 131 LYS CA C 131 58.886 58.886 59.096 -0.210 18935 15163 1 19 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.941 0.258 18935 15164 1 19 . 1 1 131 131 LYS H H 131 8.849 8.849 8.256 0.593 18935 15165 1 19 . 1 1 132 132 LYS N N 132 119.447 119.447 117.450 1.997 18935 15166 1 19 . 1 1 132 132 LYS C C 132 177.607 177.607 177.986 -0.379 18935 15167 1 19 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.316 -0.365 18935 15168 1 19 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.707 -0.282 18935 15169 1 19 . 1 1 132 132 LYS H H 132 7.778 7.778 8.318 -0.540 18935 15170 1 19 . 1 1 133 133 LYS N N 133 116.638 116.638 115.882 0.756 18935 15171 1 19 . 1 1 133 133 LYS C C 133 174.681 174.681 175.582 -0.901 18935 15172 1 19 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.384 -0.306 18935 15173 1 19 . 1 1 133 133 LYS CB C 133 31.640 31.640 33.081 -1.441 18935 15174 1 19 . 1 1 133 133 LYS H H 133 7.617 7.617 7.804 -0.187 18935 15175 1 19 . 1 1 134 134 ASN N N 134 110.792 110.792 115.227 -4.435 18935 15176 1 19 . 1 1 134 134 ASN C C 134 174.034 174.034 173.506 0.528 18935 15177 1 19 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.291 0.325 18935 15178 1 19 . 1 1 134 134 ASN CB C 134 36.052 36.052 36.821 -0.769 18935 15179 1 19 . 1 1 134 134 ASN H H 134 8.123 8.123 8.567 -0.444 18935 15180 1 19 . 1 1 135 135 TYR N N 135 115.867 115.867 116.678 -0.811 18935 15181 1 19 . 1 1 135 135 TYR C C 135 175.122 175.122 174.129 0.993 18935 15182 1 19 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.434 -0.682 18935 15183 1 19 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.766 -1.850 18935 15184 1 19 . 1 1 135 135 TYR H H 135 8.133 8.133 7.666 0.467 18935 15185 1 19 . 1 1 136 136 LYS N N 136 119.870 119.870 120.453 -0.583 18935 15186 1 19 . 1 1 136 136 LYS C C 136 174.324 174.324 174.535 -0.211 18935 15187 1 19 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.964 0.217 18935 15188 1 19 . 1 1 136 136 LYS CB C 136 34.073 34.073 36.478 -2.405 18935 15189 1 19 . 1 1 136 136 LYS H H 136 9.234 9.234 8.538 0.696 18935 15190 1 19 . 1 1 137 137 LEU N N 137 129.708 129.708 126.752 2.956 18935 15191 1 19 . 1 1 137 137 LEU C C 137 173.798 173.798 174.939 -1.141 18935 15192 1 19 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.306 -1.472 18935 15193 1 19 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.819 1.164 18935 15194 1 19 . 1 1 137 137 LEU H H 137 8.959 8.959 8.757 0.202 18935 15195 1 19 . 1 1 140 140 TYR N N 140 120.580 120.580 113.817 6.763 18935 15196 1 19 . 1 1 140 140 TYR C C 140 174.705 174.705 176.075 -1.370 18935 15197 1 19 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.069 -1.617 18935 15198 1 19 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.347 -0.047 18935 15199 1 19 . 1 1 140 140 TYR H H 140 8.962 8.962 7.341 1.621 18935 15200 1 19 . 1 1 141 141 GLY N N 141 104.986 104.986 105.640 -0.654 18935 15201 1 19 . 1 1 141 141 GLY C C 141 181.854 181.854 172.285 9.569 18935 15202 1 19 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.557 -0.435 18935 15203 1 19 . 1 1 141 141 GLY H H 141 7.555 7.555 7.556 -0.001 18935 15204 1 19 . 1 1 142 142 LEU N N 142 118.269 118.269 121.073 -2.804 18935 15205 1 19 . 1 1 142 142 LEU C C 142 174.067 174.067 176.058 -1.991 18935 15206 1 19 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.597 -1.095 18935 15207 1 19 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.442 1.100 18935 15208 1 19 . 1 1 142 142 LEU H H 142 7.794 7.794 8.484 -0.690 18935 15209 1 19 . 1 1 143 143 PHE N N 143 122.076 122.076 124.953 -2.877 18935 15210 1 19 . 1 1 143 143 PHE C C 143 175.199 175.199 175.214 -0.015 18935 15211 1 19 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.528 -1.496 18935 15212 1 19 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.790 2.280 18935 15213 1 19 . 1 1 143 143 PHE H H 143 9.522 9.522 9.327 0.195 18935 15214 1 19 . 1 1 144 144 LYS N N 144 121.305 121.305 124.829 -3.524 18935 15215 1 19 . 1 1 144 144 LYS C C 144 176.917 176.917 176.645 0.272 18935 15216 1 19 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.258 1.099 18935 15217 1 19 . 1 1 144 144 LYS CB C 144 33.679 33.679 32.676 1.003 18935 15218 1 19 . 1 1 144 144 LYS H H 144 9.076 9.076 8.933 0.143 18935 15219 1 19 . 1 1 145 145 ASN N N 145 126.834 126.834 124.644 2.190 18935 15220 1 19 . 1 1 145 145 ASN C C 145 175.070 175.070 174.996 0.074 18935 15221 1 19 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.123 0.641 18935 15222 1 19 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.912 -1.482 18935 15223 1 19 . 1 1 145 145 ASN H H 145 9.618 9.618 9.210 0.408 18935 15224 1 19 . 1 1 146 146 GLN N N 146 110.112 110.112 109.766 0.346 18935 15225 1 19 . 1 1 146 146 GLN C C 146 175.198 175.198 175.119 0.079 18935 15226 1 19 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.461 -0.565 18935 15227 1 19 . 1 1 146 146 GLN CB C 146 26.368 26.368 26.942 -0.574 18935 15228 1 19 . 1 1 146 146 GLN H H 146 9.140 9.140 8.815 0.325 18935 15229 1 19 . 1 1 147 147 THR N N 147 116.003 116.003 116.330 -0.327 18935 15230 1 19 . 1 1 147 147 THR C C 147 173.224 173.224 173.258 -0.034 18935 15231 1 19 . 1 1 147 147 THR CA C 147 61.450 61.450 61.850 -0.400 18935 15232 1 19 . 1 1 147 147 THR CB C 147 70.285 70.285 69.983 0.302 18935 15233 1 19 . 1 1 147 147 THR H H 147 8.069 8.069 7.512 0.557 18935 15234 1 19 . 1 1 148 148 LEU N N 148 129.281 129.281 130.314 -1.033 18935 15235 1 19 . 1 1 148 148 LEU C C 148 176.703 176.703 175.622 1.081 18935 15236 1 19 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.263 0.203 18935 15237 1 19 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.771 -1.046 18935 15238 1 19 . 1 1 148 148 LEU H H 148 8.831 8.831 8.876 -0.045 18935 15239 1 19 . 1 1 149 149 VAL N N 149 130.189 130.189 127.895 2.294 18935 15240 1 19 . 1 1 149 149 VAL C C 149 175.012 175.012 173.834 1.178 18935 15241 1 19 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.977 0.291 18935 15242 1 19 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.004 -3.547 18935 15243 1 19 . 1 1 149 149 VAL H H 149 9.243 9.243 8.538 0.705 18935 15244 1 19 . 1 1 151 151 LEU N N 151 123.481 123.481 116.958 6.523 18935 15245 1 19 . 1 1 151 151 LEU C C 151 177.679 177.679 176.908 0.771 18935 15246 1 19 . 1 1 151 151 LEU CA C 151 53.997 53.997 54.375 -0.378 18935 15247 1 19 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.845 0.774 18935 15248 1 19 . 1 1 151 151 LEU H H 151 8.080 8.080 8.020 0.060 18935 15249 1 19 . 1 1 152 152 LYS N N 152 126.381 126.381 121.785 4.596 18935 15250 1 19 . 1 1 152 152 LYS C C 152 175.115 175.115 175.457 -0.342 18935 15251 1 19 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.326 -1.730 18935 15252 1 19 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.213 -3.148 18935 15253 1 19 . 1 1 152 152 LYS H H 152 9.112 9.112 8.665 0.447 18935 15254 1 19 . 1 1 153 153 ILE N N 153 113.737 113.737 115.717 -1.980 18935 15255 1 19 . 1 1 153 153 ILE C C 153 175.748 175.748 173.360 2.388 18935 15256 1 19 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.478 -1.089 18935 15257 1 19 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.972 0.831 18935 15258 1 19 . 1 1 153 153 ILE H H 153 7.304 7.304 7.452 -0.148 18935 15259 1 19 . 1 1 154 154 THR N N 154 110.656 110.656 113.466 -2.810 18935 15260 1 19 . 1 1 154 154 THR C C 154 174.864 174.864 173.737 1.127 18935 15261 1 19 . 1 1 154 154 THR CA C 154 62.141 62.141 61.976 0.165 18935 15262 1 19 . 1 1 154 154 THR CB C 154 70.413 70.413 71.049 -0.635 18935 15263 1 19 . 1 1 154 154 THR H H 154 9.382 9.382 9.514 -0.132 18935 15264 1 19 . 1 1 155 155 THR N N 155 110.746 110.746 118.228 -7.482 18935 15265 1 19 . 1 1 155 155 THR C C 155 174.718 174.718 174.860 -0.142 18935 15266 1 19 . 1 1 155 155 THR CA C 155 58.785 58.785 61.235 -2.450 18935 15267 1 19 . 1 1 155 155 THR CB C 155 72.277 72.277 71.464 0.813 18935 15268 1 19 . 1 1 155 155 THR H H 155 7.746 7.746 8.430 -0.684 18935 15269 1 19 . 1 1 156 156 GLU N N 156 122.302 122.302 124.101 -1.799 18935 15270 1 19 . 1 1 156 156 GLU C C 156 177.289 177.289 178.186 -0.897 18935 15271 1 19 . 1 1 156 156 GLU CA C 156 58.824 58.824 61.073 -2.249 18935 15272 1 19 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.530 -1.149 18935 15273 1 19 . 1 1 156 156 GLU H H 156 9.490 9.490 9.015 0.475 18935 15274 1 19 . 1 1 157 157 LYS N N 157 118.905 118.905 118.299 0.606 18935 15275 1 19 . 1 1 157 157 LYS C C 157 178.241 178.241 179.201 -0.960 18935 15276 1 19 . 1 1 157 157 LYS CA C 157 59.765 59.765 59.114 0.651 18935 15277 1 19 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.676 -0.398 18935 15278 1 19 . 1 1 157 157 LYS H H 157 8.329 8.329 8.617 -0.288 18935 15279 1 19 . 1 1 158 158 GLU N N 158 116.230 116.230 120.175 -3.945 18935 15280 1 19 . 1 1 158 158 GLU C C 158 178.988 178.988 178.849 0.139 18935 15281 1 19 . 1 1 158 158 GLU CA C 158 58.256 58.256 59.449 -1.193 18935 15282 1 19 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.331 -0.273 18935 15283 1 19 . 1 1 158 158 GLU H H 158 7.611 7.611 8.160 -0.549 18935 15284 1 19 . 1 1 159 159 LEU N N 159 118.978 118.978 120.866 -1.888 18935 15285 1 19 . 1 1 159 159 LEU C C 159 176.347 176.347 178.571 -2.224 18935 15286 1 19 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.266 -5.027 18935 15287 1 19 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.909 -2.366 18935 15288 1 19 . 1 1 159 159 LEU H H 159 7.704 7.704 8.330 -0.626 18935 15289 1 19 . 1 1 160 160 ILE N N 160 117.227 117.227 114.898 2.329 18935 15290 1 19 . 1 1 160 160 ILE C C 160 177.219 177.219 177.568 -0.349 18935 15291 1 19 . 1 1 160 160 ILE CA C 160 65.615 65.615 64.968 0.647 18935 15292 1 19 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.168 0.389 18935 15293 1 19 . 1 1 160 160 ILE H H 160 7.886 7.886 7.617 0.269 18935 15294 1 19 . 1 1 161 161 LYS N N 161 115.912 115.912 119.713 -3.801 18935 15295 1 19 . 1 1 161 161 LYS C C 161 180.990 180.990 179.339 1.651 18935 15296 1 19 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.250 0.381 18935 15297 1 19 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.927 -1.179 18935 15298 1 19 . 1 1 161 161 LYS H H 161 7.536 7.536 7.902 -0.366 18935 15299 1 19 . 1 1 162 162 GLU N N 162 120.852 120.852 119.789 1.063 18935 15300 1 19 . 1 1 162 162 GLU C C 162 178.793 178.793 178.024 0.769 18935 15301 1 19 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.553 -0.571 18935 15302 1 19 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.442 -1.649 18935 15303 1 19 . 1 1 162 162 GLU H H 162 8.392 8.392 7.967 0.425 18935 15304 1 19 . 1 1 163 163 LEU N N 163 115.912 115.912 117.337 -1.425 18935 15305 1 19 . 1 1 163 163 LEU C C 163 176.370 176.370 177.914 -1.544 18935 15306 1 19 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.523 -0.429 18935 15307 1 19 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.833 -1.659 18935 15308 1 19 . 1 1 163 163 LEU H H 163 8.031 8.031 7.835 0.196 18935 15309 1 19 . 1 1 164 164 GLY N N 164 103.160 103.160 104.903 -1.743 18935 15310 1 19 . 1 1 164 164 GLY C C 164 174.240 174.240 173.909 0.331 18935 15311 1 19 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.972 -0.671 18935 15312 1 19 . 1 1 164 164 GLY H H 164 7.625 7.625 7.743 -0.118 18935 15313 1 19 . 1 1 165 165 PHE N N 165 117.952 117.952 117.960 -0.008 18935 15314 1 19 . 1 1 165 165 PHE C C 165 174.556 174.556 174.628 -0.072 18935 15315 1 19 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.202 -0.737 18935 15316 1 19 . 1 1 165 165 PHE CB C 165 40.762 40.762 42.373 -1.611 18935 15317 1 19 . 1 1 165 165 PHE H H 165 7.283 7.283 8.113 -0.830 18935 15318 1 19 . 1 1 166 166 THR N N 166 118.178 118.178 114.798 3.380 18935 15319 1 19 . 1 1 166 166 THR C C 166 175.306 175.306 174.069 1.237 18935 15320 1 19 . 1 1 166 166 THR CA C 166 63.466 63.466 60.609 2.857 18935 15321 1 19 . 1 1 166 166 THR CB C 166 68.721 68.721 70.573 -1.852 18935 15322 1 19 . 1 1 166 166 THR H H 166 9.678 9.678 8.674 1.004 18935 15323 1 19 . 1 1 167 167 TYR N N 167 128.239 128.239 121.539 6.700 18935 15324 1 19 . 1 1 167 167 TYR C C 167 173.297 173.297 175.606 -2.309 18935 15325 1 19 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.395 1.017 18935 15326 1 19 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.224 -2.502 18935 15327 1 19 . 1 1 167 167 TYR H H 167 9.264 9.264 8.499 0.765 18935 15328 1 19 . 1 1 168 168 ARG N N 168 126.789 126.789 124.156 2.633 18935 15329 1 19 . 1 1 168 168 ARG C C 168 175.297 175.297 174.939 0.358 18935 15330 1 19 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.521 -1.756 18935 15331 1 19 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.370 -1.044 18935 15332 1 19 . 1 1 168 168 ARG H H 168 7.030 7.030 8.228 -1.198 18935 15333 1 19 . 1 1 169 169 ILE N N 169 119.221 119.221 117.962 1.259 18935 15334 1 19 . 1 1 169 169 ILE C C 169 174.522 174.522 174.720 -0.198 18935 15335 1 19 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.558 2.721 18935 15336 1 19 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.118 -4.471 18935 15337 1 19 . 1 1 169 169 ILE H H 169 8.349 8.349 8.397 -0.048 18935 15338 1 19 . 1 1 171 171 LYS N N 171 111.335 111.335 116.202 -4.867 18935 15339 1 19 . 1 1 171 171 LYS C C 171 176.638 176.638 178.146 -1.508 18935 15340 1 19 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.657 -1.119 18935 15341 1 19 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.796 0.171 18935 15342 1 19 . 1 1 171 171 LYS H H 171 8.198 8.198 8.348 -0.150 18935 15343 1 19 . 1 1 172 172 LYS N N 172 116.411 116.411 116.254 0.157 18935 15344 1 19 . 1 1 172 172 LYS C C 172 175.331 175.331 176.383 -1.052 18935 15345 1 19 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.452 -1.451 18935 15346 1 19 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.537 -1.719 18935 15347 1 19 . 1 1 172 172 LYS H H 172 7.843 7.843 7.510 0.333 18935 15348 1 19 . 1 1 173 173 ARG N N 173 120.490 120.490 117.187 3.303 18935 15349 1 19 . 1 1 173 173 ARG C C 173 172.830 172.830 175.216 -2.386 18935 15350 1 19 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.692 0.483 18935 15351 1 19 . 1 1 173 173 ARG CB C 173 28.829 28.829 29.276 -0.447 18935 15352 1 19 . 1 1 173 173 ARG H H 173 6.917 6.917 7.910 -0.993 18935 15353 1 20 . 1 1 2 2 LEU N N 2 119.937 119.937 117.294 2.643 18935 15354 1 20 . 1 1 2 2 LEU C C 2 175.307 175.307 175.393 -0.086 18935 15355 1 20 . 1 1 2 2 LEU CA C 2 54.292 54.292 54.108 0.184 18935 15356 1 20 . 1 1 2 2 LEU CB C 2 42.684 42.684 43.543 -0.859 18935 15357 1 20 . 1 1 2 2 LEU H H 2 9.251 9.251 8.122 1.129 18935 15358 1 20 . 1 1 3 3 THR N N 3 111.335 111.335 110.947 0.388 18935 15359 1 20 . 1 1 3 3 THR C C 3 175.854 175.854 175.737 0.117 18935 15360 1 20 . 1 1 3 3 THR CA C 3 60.540 60.540 60.193 0.347 18935 15361 1 20 . 1 1 3 3 THR CB C 3 70.782 70.782 70.346 0.436 18935 15362 1 20 . 1 1 3 3 THR H H 3 8.677 8.677 8.231 0.446 18935 15363 1 20 . 1 1 4 4 LEU N N 4 120.988 120.988 122.652 -1.664 18935 15364 1 20 . 1 1 4 4 LEU C C 4 178.391 178.391 177.984 0.407 18935 15365 1 20 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.263 -0.199 18935 15366 1 20 . 1 1 4 4 LEU CB C 4 39.261 39.261 42.185 -2.924 18935 15367 1 20 . 1 1 4 4 LEU H H 4 7.746 7.746 8.079 -0.333 18935 15368 1 20 . 1 1 5 5 ILE N N 5 114.236 114.236 112.411 1.825 18935 15369 1 20 . 1 1 5 5 ILE C C 5 178.339 178.339 177.433 0.906 18935 15370 1 20 . 1 1 5 5 ILE CA C 5 63.582 63.582 63.027 0.555 18935 15371 1 20 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.488 -0.689 18935 15372 1 20 . 1 1 5 5 ILE H H 5 7.821 7.821 7.829 -0.008 18935 15373 1 20 . 1 1 6 6 GLN N N 6 120.399 120.399 121.323 -0.924 18935 15374 1 20 . 1 1 6 6 GLN C C 6 178.783 178.783 178.512 0.271 18935 15375 1 20 . 1 1 6 6 GLN CA C 6 58.220 58.220 58.928 -0.708 18935 15376 1 20 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.419 -0.304 18935 15377 1 20 . 1 1 6 6 GLN H H 6 7.810 7.810 7.966 -0.156 18935 15378 1 20 . 1 1 7 7 GLY N N 7 106.277 106.277 107.857 -1.580 18935 15379 1 20 . 1 1 7 7 GLY C C 7 174.554 174.554 175.726 -1.172 18935 15380 1 20 . 1 1 7 7 GLY CA C 7 46.934 46.934 46.498 0.436 18935 15381 1 20 . 1 1 7 7 GLY H H 7 8.733 8.733 7.912 0.821 18935 15382 1 20 . 1 1 8 8 LYS N N 8 119.991 119.991 122.387 -2.396 18935 15383 1 20 . 1 1 8 8 LYS C C 8 179.433 179.433 178.647 0.786 18935 15384 1 20 . 1 1 8 8 LYS CA C 8 59.892 59.892 59.118 0.774 18935 15385 1 20 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.290 -0.958 18935 15386 1 20 . 1 1 8 8 LYS H H 8 8.688 8.688 7.605 1.083 18935 15387 1 20 . 1 1 9 9 LYS N N 9 119.175 119.175 118.317 0.858 18935 15388 1 20 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.819 -0.437 18935 15389 1 20 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.287 -0.852 18935 15390 1 20 . 1 1 9 9 LYS H H 9 8.015 8.015 7.744 0.271 18935 15391 1 20 . 1 1 10 10 ILE N N 10 120.308 120.308 116.794 3.514 18935 15392 1 20 . 1 1 10 10 ILE C C 10 177.766 177.766 177.954 -0.188 18935 15393 1 20 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.398 0.278 18935 15394 1 20 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.455 -1.142 18935 15395 1 20 . 1 1 10 10 ILE H H 10 7.967 7.967 7.264 0.703 18935 15396 1 20 . 1 1 11 11 VAL N N 11 119.130 119.130 120.451 -1.321 18935 15397 1 20 . 1 1 11 11 VAL C C 11 176.606 176.606 178.195 -1.589 18935 15398 1 20 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.207 1.433 18935 15399 1 20 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.127 0.082 18935 15400 1 20 . 1 1 11 11 VAL H H 11 8.128 8.128 8.679 -0.551 18935 15401 1 20 . 1 1 12 12 ASN N N 12 115.822 115.822 117.522 -1.700 18935 15402 1 20 . 1 1 12 12 ASN C C 12 177.375 177.375 177.656 -0.281 18935 15403 1 20 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.200 -0.230 18935 15404 1 20 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.365 -0.802 18935 15405 1 20 . 1 1 12 12 ASN H H 12 8.203 8.203 7.865 0.338 18935 15406 1 20 . 1 1 13 13 HIS N N 13 117.659 117.659 117.441 0.218 18935 15407 1 20 . 1 1 13 13 HIS C C 13 177.287 177.287 177.380 -0.093 18935 15408 1 20 . 1 1 13 13 HIS CA C 13 58.687 58.687 57.666 1.021 18935 15409 1 20 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.674 -0.652 18935 15410 1 20 . 1 1 13 13 HIS H H 13 7.861 7.861 8.078 -0.217 18935 15411 1 20 . 1 1 14 14 LEU N N 14 115.595 115.595 120.538 -4.943 18935 15412 1 20 . 1 1 14 14 LEU C C 14 179.092 179.092 177.817 1.275 18935 15413 1 20 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.349 0.292 18935 15414 1 20 . 1 1 14 14 LEU CB C 14 41.020 41.020 41.854 -0.834 18935 15415 1 20 . 1 1 14 14 LEU H H 14 8.376 8.376 8.544 -0.168 18935 15416 1 20 . 1 1 15 15 ARG N N 15 115.006 115.006 116.741 -1.735 18935 15417 1 20 . 1 1 15 15 ARG C C 15 176.265 176.265 176.923 -0.658 18935 15418 1 20 . 1 1 15 15 ARG CA C 15 59.884 59.884 56.498 3.386 18935 15419 1 20 . 1 1 15 15 ARG CB C 15 29.072 29.072 28.999 0.073 18935 15420 1 20 . 1 1 15 15 ARG H H 15 8.074 8.074 7.941 0.133 18935 15421 1 20 . 1 1 16 16 SER N N 16 107.778 107.778 113.098 -5.320 18935 15422 1 20 . 1 1 16 16 SER C C 16 176.009 176.009 175.231 0.778 18935 15423 1 20 . 1 1 16 16 SER CA C 16 57.244 57.244 59.119 -1.875 18935 15424 1 20 . 1 1 16 16 SER CB C 16 63.525 63.525 63.882 -0.357 18935 15425 1 20 . 1 1 16 16 SER H H 16 7.136 7.136 7.543 -0.407 18935 15426 1 20 . 1 1 17 17 ARG N N 17 121.532 121.532 122.044 -0.512 18935 15427 1 20 . 1 1 17 17 ARG C C 17 174.482 174.482 175.583 -1.101 18935 15428 1 20 . 1 1 17 17 ARG CA C 17 56.322 56.322 56.104 0.218 18935 15429 1 20 . 1 1 17 17 ARG CB C 17 31.830 31.830 31.000 0.830 18935 15430 1 20 . 1 1 17 17 ARG H H 17 7.913 7.913 7.627 0.286 18935 15431 1 20 . 1 1 18 18 LEU N N 18 121.305 121.305 119.922 1.383 18935 15432 1 20 . 1 1 18 18 LEU C C 18 176.283 176.283 175.229 1.054 18935 15433 1 20 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.459 -0.761 18935 15434 1 20 . 1 1 18 18 LEU CB C 18 43.055 43.055 42.935 0.120 18935 15435 1 20 . 1 1 18 18 LEU H H 18 8.812 8.812 7.514 1.298 18935 15436 1 20 . 1 1 19 19 ALA N N 19 125.293 125.293 123.270 2.023 18935 15437 1 20 . 1 1 19 19 ALA C C 19 173.780 173.780 175.166 -1.386 18935 15438 1 20 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.654 -0.852 18935 15439 1 20 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.294 0.559 18935 15440 1 20 . 1 1 19 19 ALA H H 19 8.790 8.790 7.979 0.811 18935 15441 1 20 . 1 1 20 20 PHE N N 20 113.117 113.117 115.863 -2.746 18935 15442 1 20 . 1 1 20 20 PHE C C 20 172.708 172.708 172.918 -0.210 18935 15443 1 20 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.843 -1.245 18935 15444 1 20 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.722 0.003 18935 15445 1 20 . 1 1 20 20 PHE H H 20 8.925 8.925 8.935 -0.010 18935 15446 1 20 . 1 1 21 21 GLU N N 21 121.532 121.532 119.722 1.810 18935 15447 1 20 . 1 1 21 21 GLU C C 21 174.830 174.830 175.175 -0.345 18935 15448 1 20 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.207 -0.244 18935 15449 1 20 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.385 -2.042 18935 15450 1 20 . 1 1 21 21 GLU H H 21 7.972 7.972 9.139 -1.167 18935 15451 1 20 . 1 1 22 22 TYR N N 22 125.339 125.339 120.749 4.590 18935 15452 1 20 . 1 1 22 22 TYR C C 22 174.864 174.864 174.406 0.458 18935 15453 1 20 . 1 1 22 22 TYR CA C 22 55.288 55.288 58.478 -3.190 18935 15454 1 20 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.605 -0.746 18935 15455 1 20 . 1 1 22 22 TYR H H 22 9.016 9.016 8.760 0.256 18935 15456 1 20 . 1 1 23 23 ASN N N 23 127.024 127.024 126.432 0.592 18935 15457 1 20 . 1 1 23 23 ASN C C 23 175.410 175.410 175.221 0.189 18935 15458 1 20 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.930 -0.876 18935 15459 1 20 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.548 -1.287 18935 15460 1 20 . 1 1 23 23 ASN H H 23 9.181 9.181 8.979 0.202 18935 15461 1 20 . 1 1 24 24 GLY N N 24 102.755 102.755 102.420 0.335 18935 15462 1 20 . 1 1 24 24 GLY C C 24 173.626 173.626 174.728 -1.102 18935 15463 1 20 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.054 -0.119 18935 15464 1 20 . 1 1 24 24 GLY H H 24 8.666 8.666 8.193 0.473 18935 15465 1 20 . 1 1 25 25 GLN N N 25 118.722 118.722 120.677 -1.955 18935 15466 1 20 . 1 1 25 25 GLN C C 25 173.657 173.657 174.938 -1.281 18935 15467 1 20 . 1 1 25 25 GLN CA C 25 53.233 53.233 55.308 -2.075 18935 15468 1 20 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.432 0.373 18935 15469 1 20 . 1 1 25 25 GLN H H 25 7.708 7.708 8.150 -0.442 18935 15470 1 20 . 1 1 26 26 LEU N N 26 123.526 123.526 121.283 2.243 18935 15471 1 20 . 1 1 26 26 LEU C C 26 175.842 175.842 176.127 -0.285 18935 15472 1 20 . 1 1 26 26 LEU CA C 26 53.986 53.986 53.904 0.083 18935 15473 1 20 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.429 -2.622 18935 15474 1 20 . 1 1 26 26 LEU H H 26 8.543 8.543 8.397 0.146 18935 15475 1 20 . 1 1 27 27 ILE N N 27 129.462 129.462 124.067 5.395 18935 15476 1 20 . 1 1 27 27 ILE C C 27 175.085 175.085 174.196 0.889 18935 15477 1 20 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.659 0.314 18935 15478 1 20 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.185 -2.633 18935 15479 1 20 . 1 1 27 27 ILE H H 27 8.989 8.989 8.965 0.024 18935 15480 1 20 . 1 1 28 28 LYS N N 28 125.157 125.157 125.935 -0.778 18935 15481 1 20 . 1 1 28 28 LYS C C 28 176.725 176.725 175.803 0.922 18935 15482 1 20 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.680 1.130 18935 15483 1 20 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.449 -1.632 18935 15484 1 20 . 1 1 28 28 LYS H H 28 8.311 8.311 8.256 0.055 18935 15485 1 20 . 1 1 29 29 ILE N N 29 125.565 125.565 118.050 7.515 18935 15486 1 20 . 1 1 29 29 ILE C C 29 175.685 175.685 174.401 1.284 18935 15487 1 20 . 1 1 29 29 ILE CA C 29 60.405 60.405 60.070 0.335 18935 15488 1 20 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.256 -3.225 18935 15489 1 20 . 1 1 29 29 ILE H H 29 8.209 8.209 7.948 0.261 18935 15490 1 20 . 1 1 30 30 LEU N N 30 127.831 127.831 121.704 6.127 18935 15491 1 20 . 1 1 30 30 LEU C C 30 178.794 178.794 177.519 1.275 18935 15492 1 20 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.020 1.423 18935 15493 1 20 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.143 -4.307 18935 15494 1 20 . 1 1 30 30 LEU H H 30 9.027 9.027 8.336 0.691 18935 15495 1 20 . 1 1 31 31 SER N N 31 116.864 116.864 115.822 1.042 18935 15496 1 20 . 1 1 31 31 SER C C 31 177.464 177.464 175.715 1.749 18935 15497 1 20 . 1 1 31 31 SER CA C 31 61.180 61.180 61.488 -0.308 18935 15498 1 20 . 1 1 31 31 SER CB C 31 62.105 62.105 63.088 -0.983 18935 15499 1 20 . 1 1 31 31 SER H H 31 8.887 8.887 8.664 0.223 18935 15500 1 20 . 1 1 32 32 LYS N N 32 114.825 114.825 120.004 -5.179 18935 15501 1 20 . 1 1 32 32 LYS C C 32 176.243 176.243 175.970 0.273 18935 15502 1 20 . 1 1 32 32 LYS CA C 32 57.292 57.292 57.292 0.000 18935 15503 1 20 . 1 1 32 32 LYS CB C 32 30.266 30.266 31.643 -1.377 18935 15504 1 20 . 1 1 32 32 LYS H H 32 8.290 8.290 8.242 0.048 18935 15505 1 20 . 1 1 33 33 ASN N N 33 117.564 117.564 115.628 1.936 18935 15506 1 20 . 1 1 33 33 ASN C C 33 172.253 172.253 173.431 -1.178 18935 15507 1 20 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.257 -1.166 18935 15508 1 20 . 1 1 33 33 ASN CB C 33 38.339 38.339 40.840 -2.501 18935 15509 1 20 . 1 1 33 33 ASN H H 33 8.051 8.051 7.675 0.376 18935 15510 1 20 . 1 1 34 34 ILE N N 34 118.949 118.949 119.386 -0.437 18935 15511 1 20 . 1 1 34 34 ILE C C 34 175.343 175.343 174.337 1.006 18935 15512 1 20 . 1 1 34 34 ILE CA C 34 60.553 60.553 59.778 0.775 18935 15513 1 20 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.040 -2.173 18935 15514 1 20 . 1 1 34 34 ILE H H 34 7.670 7.670 7.770 -0.100 18935 15515 1 20 . 1 1 35 35 VAL N N 35 128.355 128.355 123.738 4.617 18935 15516 1 20 . 1 1 35 35 VAL C C 35 175.543 175.543 174.607 0.936 18935 15517 1 20 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.006 0.008 18935 15518 1 20 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.872 -1.641 18935 15519 1 20 . 1 1 35 35 VAL H H 35 9.698 9.698 8.753 0.945 18935 15520 1 20 . 1 1 36 36 ALA N N 36 129.553 129.553 131.373 -1.820 18935 15521 1 20 . 1 1 36 36 ALA C C 36 177.015 177.015 176.695 0.320 18935 15522 1 20 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.285 1.111 18935 15523 1 20 . 1 1 36 36 ALA CB C 36 17.622 17.622 17.926 -0.304 18935 15524 1 20 . 1 1 36 36 ALA H H 36 8.917 8.917 8.536 0.381 18935 15525 1 20 . 1 1 37 37 VAL N N 37 115.006 115.006 119.344 -4.338 18935 15526 1 20 . 1 1 37 37 VAL C C 37 174.649 174.649 176.245 -1.596 18935 15527 1 20 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.645 -0.324 18935 15528 1 20 . 1 1 37 37 VAL CB C 37 32.386 32.386 32.699 -0.313 18935 15529 1 20 . 1 1 37 37 VAL H H 37 8.214 8.214 7.619 0.595 18935 15530 1 20 . 1 1 38 38 GLY N N 38 109.387 109.387 106.792 2.595 18935 15531 1 20 . 1 1 38 38 GLY C C 38 174.152 174.152 175.838 -1.686 18935 15532 1 20 . 1 1 38 38 GLY CA C 38 45.497 45.497 46.312 -0.815 18935 15533 1 20 . 1 1 38 38 GLY H H 38 8.677 8.677 7.682 0.995 18935 15534 1 20 . 1 1 39 39 SER N N 39 116.776 116.776 119.420 -2.644 18935 15535 1 20 . 1 1 39 39 SER C C 39 175.129 175.129 176.747 -1.618 18935 15536 1 20 . 1 1 39 39 SER CA C 39 60.036 60.036 62.323 -2.287 18935 15537 1 20 . 1 1 39 39 SER CB C 39 61.522 61.522 63.147 -1.625 18935 15538 1 20 . 1 1 39 39 SER H H 39 9.705 9.705 8.294 1.411 18935 15539 1 20 . 1 1 40 40 LEU N N 40 113.696 113.696 119.262 -5.566 18935 15540 1 20 . 1 1 40 40 LEU C C 40 180.558 180.558 178.119 2.439 18935 15541 1 20 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.180 1.193 18935 15542 1 20 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.533 0.344 18935 15543 1 20 . 1 1 40 40 LEU H H 40 7.311 7.311 7.643 -0.332 18935 15544 1 20 . 1 1 41 41 ARG N N 41 121.162 121.162 116.886 4.276 18935 15545 1 20 . 1 1 41 41 ARG C C 41 176.964 176.964 177.608 -0.644 18935 15546 1 20 . 1 1 41 41 ARG CA C 41 58.451 58.451 57.046 1.405 18935 15547 1 20 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.544 -2.339 18935 15548 1 20 . 1 1 41 41 ARG H H 41 6.999 6.999 7.622 -0.623 18935 15549 1 20 . 1 1 42 42 ARG N N 42 111.109 111.109 118.341 -7.232 18935 15550 1 20 . 1 1 42 42 ARG C C 42 172.564 172.564 176.177 -3.613 18935 15551 1 20 . 1 1 42 42 ARG CA C 42 56.380 56.380 57.583 -1.203 18935 15552 1 20 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.805 -2.456 18935 15553 1 20 . 1 1 42 42 ARG H H 42 7.041 7.041 7.819 -0.778 18935 15554 1 20 . 1 1 43 43 GLU N N 43 111.924 111.924 115.232 -3.308 18935 15555 1 20 . 1 1 43 43 GLU C C 43 176.202 176.202 175.174 1.028 18935 15556 1 20 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.317 -0.863 18935 15557 1 20 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.253 -1.952 18935 15558 1 20 . 1 1 43 43 GLU H H 43 7.757 7.757 8.277 -0.520 18935 15559 1 20 . 1 1 44 44 GLU N N 44 117.861 117.861 118.421 -0.560 18935 15560 1 20 . 1 1 44 44 GLU C C 44 175.197 175.197 176.643 -1.446 18935 15561 1 20 . 1 1 44 44 GLU CA C 44 56.128 56.128 55.158 0.970 18935 15562 1 20 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.795 -2.236 18935 15563 1 20 . 1 1 44 44 GLU H H 44 7.461 7.461 7.510 -0.049 18935 15564 1 20 . 1 1 45 45 LYS N N 45 115.051 115.051 119.657 -4.606 18935 15565 1 20 . 1 1 45 45 LYS C C 45 177.733 177.733 176.802 0.931 18935 15566 1 20 . 1 1 45 45 LYS CA C 45 59.055 59.055 58.070 0.985 18935 15567 1 20 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.198 -1.171 18935 15568 1 20 . 1 1 45 45 LYS H H 45 8.123 8.123 8.564 -0.441 18935 15569 1 20 . 1 1 46 46 MET N N 46 114.009 114.009 117.179 -3.170 18935 15570 1 20 . 1 1 46 46 MET C C 46 174.067 174.067 174.602 -0.535 18935 15571 1 20 . 1 1 46 46 MET CA C 46 52.477 52.477 54.194 -1.717 18935 15572 1 20 . 1 1 46 46 MET CB C 46 33.974 33.974 35.539 -1.565 18935 15573 1 20 . 1 1 46 46 MET H H 46 7.767 7.767 7.622 0.145 18935 15574 1 20 . 1 1 47 47 LEU N N 47 120.263 120.263 121.100 -0.837 18935 15575 1 20 . 1 1 47 47 LEU C C 47 177.669 177.669 175.495 2.174 18935 15576 1 20 . 1 1 47 47 LEU CA C 47 52.201 52.201 52.785 -0.584 18935 15577 1 20 . 1 1 47 47 LEU CB C 47 42.908 42.908 44.193 -1.285 18935 15578 1 20 . 1 1 47 47 LEU H H 47 9.481 9.481 9.102 0.379 18935 15579 1 20 . 1 1 48 48 ASN N N 48 118.632 118.632 118.041 0.591 18935 15580 1 20 . 1 1 48 48 ASN C C 48 174.715 174.715 175.320 -0.605 18935 15581 1 20 . 1 1 48 48 ASN CA C 48 55.501 55.501 54.537 0.964 18935 15582 1 20 . 1 1 48 48 ASN CB C 48 38.828 38.828 39.702 -0.874 18935 15583 1 20 . 1 1 48 48 ASN H H 48 9.388 9.388 8.916 0.472 18935 15584 1 20 . 1 1 49 49 ASP N N 49 115.867 115.867 119.200 -3.333 18935 15585 1 20 . 1 1 49 49 ASP C C 49 174.111 174.111 174.390 -0.279 18935 15586 1 20 . 1 1 49 49 ASP CA C 49 51.201 51.201 53.365 -2.164 18935 15587 1 20 . 1 1 49 49 ASP CB C 49 40.077 40.077 44.994 -4.917 18935 15588 1 20 . 1 1 49 49 ASP H H 49 7.670 7.670 8.099 -0.429 18935 15589 1 20 . 1 1 50 50 VAL N N 50 119.185 119.185 118.917 0.268 18935 15590 1 20 . 1 1 50 50 VAL C C 50 172.333 172.333 174.106 -1.773 18935 15591 1 20 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.490 0.425 18935 15592 1 20 . 1 1 50 50 VAL CB C 50 32.965 32.965 34.196 -1.231 18935 15593 1 20 . 1 1 50 50 VAL H H 50 8.339 8.339 8.044 0.295 18935 15594 1 20 . 1 1 51 51 ASP N N 51 124.704 124.704 125.953 -1.249 18935 15595 1 20 . 1 1 51 51 ASP C C 51 173.725 173.725 174.880 -1.155 18935 15596 1 20 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.358 -0.330 18935 15597 1 20 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.890 -0.061 18935 15598 1 20 . 1 1 51 51 ASP H H 51 8.984 8.984 8.563 0.420 18935 15599 1 20 . 1 1 52 52 LEU N N 52 120.943 120.943 122.357 -1.414 18935 15600 1 20 . 1 1 52 52 LEU C C 52 173.045 173.045 174.520 -1.475 18935 15601 1 20 . 1 1 52 52 LEU CA C 52 52.871 52.871 53.953 -1.082 18935 15602 1 20 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.622 -2.369 18935 15603 1 20 . 1 1 52 52 LEU H H 52 9.081 9.081 8.722 0.359 18935 15604 1 20 . 1 1 53 53 LEU N N 53 123.027 123.027 124.354 -1.327 18935 15605 1 20 . 1 1 53 53 LEU C C 53 173.750 173.750 175.484 -1.734 18935 15606 1 20 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.093 -0.760 18935 15607 1 20 . 1 1 53 53 LEU CB C 53 45.008 45.008 43.287 1.721 18935 15608 1 20 . 1 1 53 53 LEU H H 53 9.146 9.146 8.608 0.538 18935 15609 1 20 . 1 1 54 54 ILE N N 54 126.562 126.562 125.521 1.041 18935 15610 1 20 . 1 1 54 54 ILE C C 54 175.132 175.132 176.190 -1.058 18935 15611 1 20 . 1 1 54 54 ILE CA C 54 58.598 58.598 60.418 -1.820 18935 15612 1 20 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.536 -0.975 18935 15613 1 20 . 1 1 54 54 ILE H H 54 9.440 9.440 8.821 0.619 18935 15614 1 20 . 1 1 55 55 ILE N N 55 126.879 126.879 119.064 7.815 18935 15615 1 20 . 1 1 55 55 ILE C C 55 175.655 175.655 174.440 1.215 18935 15616 1 20 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.763 -3.202 18935 15617 1 20 . 1 1 55 55 ILE CB C 55 34.306 34.306 42.254 -7.948 18935 15618 1 20 . 1 1 55 55 ILE H H 55 9.381 9.381 7.818 1.563 18935 15619 1 20 . 1 1 56 56 VAL N N 56 128.936 128.936 122.927 6.009 18935 15620 1 20 . 1 1 56 56 VAL C C 56 176.389 176.389 174.279 2.110 18935 15621 1 20 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.582 0.048 18935 15622 1 20 . 1 1 56 56 VAL CB C 56 32.784 32.784 34.159 -1.375 18935 15623 1 20 . 1 1 56 56 VAL H H 56 9.227 9.227 8.486 0.741 18935 15624 1 20 . 1 1 58 58 GLU N N 58 112.423 112.423 118.544 -6.121 18935 15625 1 20 . 1 1 58 58 GLU C C 58 175.946 175.946 177.513 -1.567 18935 15626 1 20 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.112 -0.812 18935 15627 1 20 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.122 0.975 18935 15628 1 20 . 1 1 58 58 GLU H H 58 6.685 6.685 8.156 -1.471 18935 15629 1 20 . 1 1 59 59 LYS N N 59 125.293 125.293 122.405 2.888 18935 15630 1 20 . 1 1 59 59 LYS C C 59 179.248 179.248 178.433 0.815 18935 15631 1 20 . 1 1 59 59 LYS CA C 59 59.774 59.774 60.031 -0.257 18935 15632 1 20 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.532 -1.456 18935 15633 1 20 . 1 1 59 59 LYS H H 59 9.108 9.108 8.769 0.339 18935 15634 1 20 . 1 1 60 60 LYS N N 60 117.408 117.408 120.235 -2.827 18935 15635 1 20 . 1 1 60 60 LYS C C 60 177.198 177.198 178.745 -1.547 18935 15636 1 20 . 1 1 60 60 LYS CA C 60 58.213 58.213 58.969 -0.756 18935 15637 1 20 . 1 1 60 60 LYS CB C 60 30.583 30.583 31.549 -0.966 18935 15638 1 20 . 1 1 60 60 LYS H H 60 9.102 9.102 8.293 0.809 18935 15639 1 20 . 1 1 61 61 LEU N N 61 114.779 114.779 117.541 -2.762 18935 15640 1 20 . 1 1 61 61 LEU C C 61 178.790 178.790 178.963 -0.173 18935 15641 1 20 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.642 -2.619 18935 15642 1 20 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.148 -0.284 18935 15643 1 20 . 1 1 61 61 LEU H H 61 7.455 7.455 8.032 -0.577 18935 15644 1 20 . 1 1 62 62 LEU N N 62 119.629 119.629 118.689 0.940 18935 15645 1 20 . 1 1 62 62 LEU C C 62 177.762 177.762 177.904 -0.142 18935 15646 1 20 . 1 1 62 62 LEU CA C 62 58.198 58.198 58.184 0.014 18935 15647 1 20 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.960 -1.229 18935 15648 1 20 . 1 1 62 62 LEU H H 62 7.714 7.714 7.532 0.182 18935 15649 1 20 . 1 1 63 63 LYS N N 63 112.921 112.921 117.037 -4.116 18935 15650 1 20 . 1 1 63 63 LYS C C 63 175.386 175.386 177.457 -2.071 18935 15651 1 20 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.953 -0.597 18935 15652 1 20 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.193 -1.230 18935 15653 1 20 . 1 1 63 63 LYS H H 63 7.751 7.751 7.854 -0.103 18935 15654 1 20 . 1 1 64 64 HIS N N 64 112.468 112.468 115.870 -3.402 18935 15655 1 20 . 1 1 64 64 HIS C C 64 176.081 176.081 175.943 0.138 18935 15656 1 20 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.335 -1.566 18935 15657 1 20 . 1 1 64 64 HIS CB C 64 32.370 32.370 32.079 0.291 18935 15658 1 20 . 1 1 64 64 HIS H H 64 7.697 7.697 7.802 -0.105 18935 15659 1 20 . 1 1 65 65 VAL N N 65 117.499 117.499 119.400 -1.901 18935 15660 1 20 . 1 1 65 65 VAL C C 65 174.301 174.301 176.700 -2.399 18935 15661 1 20 . 1 1 65 65 VAL CA C 65 66.330 66.330 64.521 1.809 18935 15662 1 20 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.640 -2.280 18935 15663 1 20 . 1 1 65 65 VAL H H 65 6.917 6.917 7.217 -0.300 18935 15664 1 20 . 1 1 66 66 LEU N N 66 113.873 113.873 119.616 -5.743 18935 15665 1 20 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.953 -0.103 18935 15666 1 20 . 1 1 66 66 LEU CB C 66 36.058 36.058 40.509 -4.451 18935 15667 1 20 . 1 1 66 66 LEU H H 66 9.102 9.102 7.286 1.816 18935 15668 1 20 . 1 1 68 68 ASN N N 68 110.792 110.792 117.044 -6.252 18935 15669 1 20 . 1 1 68 68 ASN C C 68 174.877 174.877 173.432 1.445 18935 15670 1 20 . 1 1 68 68 ASN CA C 68 50.815 50.815 53.070 -2.255 18935 15671 1 20 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.355 -1.044 18935 15672 1 20 . 1 1 68 68 ASN H H 68 7.234 7.234 8.090 -0.856 18935 15673 1 20 . 1 1 69 69 ILE N N 69 122.348 122.348 124.984 -2.636 18935 15674 1 20 . 1 1 69 69 ILE CA C 69 59.912 59.912 59.853 0.059 18935 15675 1 20 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.960 -2.922 18935 15676 1 20 . 1 1 69 69 ILE H H 69 7.428 7.428 8.729 -1.301 18935 15677 1 20 . 1 1 70 70 ARG N N 70 125.701 125.701 127.445 -1.744 18935 15678 1 20 . 1 1 70 70 ARG C C 70 174.596 174.596 173.262 1.334 18935 15679 1 20 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.858 -1.698 18935 15680 1 20 . 1 1 70 70 ARG CB C 70 32.453 32.453 34.041 -1.589 18935 15681 1 20 . 1 1 70 70 ARG H H 70 9.083 9.083 9.131 -0.048 18935 15682 1 20 . 1 1 71 71 ILE N N 71 118.496 118.496 121.188 -2.692 18935 15683 1 20 . 1 1 71 71 ILE C C 71 175.625 175.625 174.467 1.158 18935 15684 1 20 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.249 0.527 18935 15685 1 20 . 1 1 71 71 ILE CB C 71 37.967 37.967 41.457 -3.490 18935 15686 1 20 . 1 1 71 71 ILE H H 71 7.864 7.864 8.091 -0.227 18935 15687 1 20 . 1 1 72 72 LYS N N 72 127.423 127.423 128.503 -1.080 18935 15688 1 20 . 1 1 72 72 LYS C C 72 177.659 177.659 176.606 1.053 18935 15689 1 20 . 1 1 72 72 LYS CA C 72 57.428 57.428 56.299 1.129 18935 15690 1 20 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.584 -1.210 18935 15691 1 20 . 1 1 72 72 LYS H H 72 8.720 8.720 8.740 -0.020 18935 15692 1 20 . 1 1 73 73 GLY N N 73 112.604 112.604 111.176 1.428 18935 15693 1 20 . 1 1 73 73 GLY C C 73 173.729 173.729 173.906 -0.177 18935 15694 1 20 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.277 0.554 18935 15695 1 20 . 1 1 73 73 GLY H H 73 8.930 8.930 8.824 0.106 18935 15696 1 20 . 1 1 74 74 LEU N N 74 119.538 119.538 120.540 -1.002 18935 15697 1 20 . 1 1 74 74 LEU C C 74 175.802 175.802 175.215 0.587 18935 15698 1 20 . 1 1 74 74 LEU CA C 74 53.661 53.661 54.084 -0.423 18935 15699 1 20 . 1 1 74 74 LEU CB C 74 44.053 44.053 45.161 -1.108 18935 15700 1 20 . 1 1 74 74 LEU H H 74 7.547 7.547 7.928 -0.381 18935 15701 1 20 . 1 1 75 75 SER N N 75 118.994 118.994 116.620 2.374 18935 15702 1 20 . 1 1 75 75 SER C C 75 173.111 173.111 172.559 0.552 18935 15703 1 20 . 1 1 75 75 SER CA C 75 57.696 57.696 57.850 -0.154 18935 15704 1 20 . 1 1 75 75 SER CB C 75 63.073 63.073 63.595 -0.522 18935 15705 1 20 . 1 1 75 75 SER H H 75 9.076 9.076 8.532 0.544 18935 15706 1 20 . 1 1 76 76 PHE N N 76 117.802 117.802 120.709 -2.907 18935 15707 1 20 . 1 1 76 76 PHE C C 76 173.564 173.564 174.317 -0.753 18935 15708 1 20 . 1 1 76 76 PHE CA C 76 55.409 55.409 55.955 -0.546 18935 15709 1 20 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.366 -0.523 18935 15710 1 20 . 1 1 76 76 PHE H H 76 8.119 8.119 7.724 0.395 18935 15711 1 20 . 1 1 77 77 SER N N 77 113.918 113.918 117.431 -3.513 18935 15712 1 20 . 1 1 77 77 SER C C 77 173.194 173.194 173.382 -0.188 18935 15713 1 20 . 1 1 77 77 SER CA C 77 55.999 55.999 57.574 -1.575 18935 15714 1 20 . 1 1 77 77 SER CB C 77 65.218 65.218 66.124 -0.906 18935 15715 1 20 . 1 1 77 77 SER H H 77 8.989 8.989 8.772 0.217 18935 15716 1 20 . 1 1 78 78 VAL N N 78 123.662 123.662 125.748 -2.086 18935 15717 1 20 . 1 1 78 78 VAL C C 78 176.057 176.057 176.315 -0.258 18935 15718 1 20 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.387 -0.296 18935 15719 1 20 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.749 0.545 18935 15720 1 20 . 1 1 78 78 VAL H H 78 8.995 8.995 8.807 0.188 18935 15721 1 20 . 1 1 79 79 LYS N N 79 129.417 129.417 129.435 -0.018 18935 15722 1 20 . 1 1 79 79 LYS C C 79 176.436 176.436 174.888 1.548 18935 15723 1 20 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.214 3.438 18935 15724 1 20 . 1 1 79 79 LYS CB C 79 32.473 32.473 33.779 -1.306 18935 15725 1 20 . 1 1 79 79 LYS H H 79 9.425 9.425 9.159 0.266 18935 15726 1 20 . 1 1 80 80 VAL N N 80 108.616 108.616 124.281 -15.665 18935 15727 1 20 . 1 1 80 80 VAL CA C 80 59.097 59.097 63.227 -4.130 18935 15728 1 20 . 1 1 80 80 VAL CB C 80 34.082 34.082 32.517 1.565 18935 15729 1 20 . 1 1 80 80 VAL H H 80 7.380 7.380 8.652 -1.272 18935 15730 1 20 . 1 1 81 81 CYS N N 81 123.254 123.254 127.803 -4.549 18935 15731 1 20 . 1 1 81 81 CYS C C 81 172.053 172.053 173.477 -1.424 18935 15732 1 20 . 1 1 81 81 CYS CA C 81 59.739 59.739 58.138 1.601 18935 15733 1 20 . 1 1 81 81 CYS CB C 81 27.332 27.332 28.894 -1.562 18935 15734 1 20 . 1 1 81 81 CYS H H 81 9.759 9.759 8.413 1.346 18935 15735 1 20 . 1 1 82 82 GLY N N 82 118.450 118.450 116.015 2.435 18935 15736 1 20 . 1 1 82 82 GLY C C 82 171.814 171.814 174.511 -2.697 18935 15737 1 20 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.144 -1.790 18935 15738 1 20 . 1 1 82 82 GLY H H 82 8.537 8.537 8.597 -0.060 18935 15739 1 20 . 1 1 83 83 GLU N N 83 113.964 113.964 121.909 -7.945 18935 15740 1 20 . 1 1 83 83 GLU C C 83 179.320 179.320 176.978 2.342 18935 15741 1 20 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.526 0.149 18935 15742 1 20 . 1 1 83 83 GLU CB C 83 29.907 29.907 30.285 -0.378 18935 15743 1 20 . 1 1 83 83 GLU H H 83 8.473 8.473 8.627 -0.154 18935 15744 1 20 . 1 1 84 84 ARG N N 84 117.544 117.544 117.040 0.504 18935 15745 1 20 . 1 1 84 84 ARG C C 84 177.252 177.252 175.447 1.805 18935 15746 1 20 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.212 -0.708 18935 15747 1 20 . 1 1 84 84 ARG CB C 84 31.546 31.546 30.727 0.819 18935 15748 1 20 . 1 1 84 84 ARG H H 84 9.760 9.760 8.510 1.250 18935 15749 1 20 . 1 1 85 85 LYS N N 85 124.160 124.160 119.993 4.167 18935 15750 1 20 . 1 1 85 85 LYS C C 85 173.379 173.379 175.118 -1.739 18935 15751 1 20 . 1 1 85 85 LYS CA C 85 55.232 55.232 55.132 0.100 18935 15752 1 20 . 1 1 85 85 LYS CB C 85 34.212 34.212 33.623 0.589 18935 15753 1 20 . 1 1 85 85 LYS H H 85 8.494 8.494 7.445 1.049 18935 15754 1 20 . 1 1 86 86 CYS N N 86 126.472 126.472 119.424 7.048 18935 15755 1 20 . 1 1 86 86 CYS C C 86 171.935 171.935 173.225 -1.290 18935 15756 1 20 . 1 1 86 86 CYS CA C 86 55.878 55.878 58.031 -2.153 18935 15757 1 20 . 1 1 86 86 CYS CB C 86 30.304 30.304 29.562 0.742 18935 15758 1 20 . 1 1 86 86 CYS H H 86 9.221 9.221 8.256 0.965 18935 15759 1 20 . 1 1 87 87 VAL N N 87 126.426 126.426 124.808 1.618 18935 15760 1 20 . 1 1 87 87 VAL C C 87 173.760 173.760 174.459 -0.699 18935 15761 1 20 . 1 1 87 87 VAL CA C 87 61.333 61.333 61.494 -0.161 18935 15762 1 20 . 1 1 87 87 VAL CB C 87 33.338 33.338 33.806 -0.468 18935 15763 1 20 . 1 1 87 87 VAL H H 87 8.623 8.623 8.755 -0.132 18935 15764 1 20 . 1 1 88 88 LEU N N 88 125.701 125.701 126.795 -1.094 18935 15765 1 20 . 1 1 88 88 LEU C C 88 175.424 175.424 175.344 0.080 18935 15766 1 20 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.835 -1.750 18935 15767 1 20 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.082 -1.538 18935 15768 1 20 . 1 1 88 88 LEU H H 88 9.592 9.592 9.210 0.382 18935 15769 1 20 . 1 1 89 89 PHE N N 89 118.314 118.314 125.052 -6.738 18935 15770 1 20 . 1 1 89 89 PHE C C 89 177.068 177.068 173.716 3.352 18935 15771 1 20 . 1 1 89 89 PHE CA C 89 55.875 55.875 55.874 0.000 18935 15772 1 20 . 1 1 89 89 PHE CB C 89 38.837 38.837 41.318 -2.481 18935 15773 1 20 . 1 1 89 89 PHE H H 89 8.979 8.979 8.966 0.013 18935 15774 1 20 . 1 1 90 90 ILE N N 90 119.039 119.039 119.435 -0.396 18935 15775 1 20 . 1 1 90 90 ILE C C 90 173.692 173.692 173.657 0.035 18935 15776 1 20 . 1 1 90 90 ILE CA C 90 58.672 58.672 58.589 0.083 18935 15777 1 20 . 1 1 90 90 ILE CB C 90 40.183 40.183 42.423 -2.240 18935 15778 1 20 . 1 1 90 90 ILE H H 90 9.447 9.447 8.992 0.455 18935 15779 1 20 . 1 1 91 91 GLU N N 91 122.801 122.801 122.557 0.244 18935 15780 1 20 . 1 1 91 91 GLU C C 91 175.565 175.565 174.311 1.254 18935 15781 1 20 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.275 -0.810 18935 15782 1 20 . 1 1 91 91 GLU CB C 91 29.662 29.662 33.122 -3.460 18935 15783 1 20 . 1 1 91 91 GLU H H 91 8.360 8.360 8.357 0.003 18935 15784 1 20 . 1 1 92 92 TRP N N 92 126.018 126.018 123.952 2.066 18935 15785 1 20 . 1 1 92 92 TRP C C 92 175.070 175.070 175.063 0.007 18935 15786 1 20 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.611 -0.421 18935 15787 1 20 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.719 -1.137 18935 15788 1 20 . 1 1 92 92 TRP H H 92 9.425 9.425 8.392 1.033 18935 15789 1 20 . 1 1 93 93 GLU N N 93 126.381 126.381 119.403 6.978 18935 15790 1 20 . 1 1 93 93 GLU C C 93 175.637 175.637 175.768 -0.131 18935 15791 1 20 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.544 -0.775 18935 15792 1 20 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.407 -2.463 18935 15793 1 20 . 1 1 93 93 GLU H H 93 8.914 8.914 9.075 -0.161 18935 15794 1 20 . 1 1 94 94 LYS N N 94 107.891 107.891 111.611 -3.720 18935 15795 1 20 . 1 1 94 94 LYS C C 94 175.359 175.359 175.724 -0.365 18935 15796 1 20 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.169 0.261 18935 15797 1 20 . 1 1 94 94 LYS CB C 94 28.642 28.642 31.045 -2.403 18935 15798 1 20 . 1 1 94 94 LYS H H 94 8.634 8.634 8.486 0.148 18935 15799 1 20 . 1 1 95 95 LYS N N 95 120.490 120.490 118.262 2.228 18935 15800 1 20 . 1 1 95 95 LYS C C 95 174.369 174.369 174.016 0.353 18935 15801 1 20 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.457 -0.104 18935 15802 1 20 . 1 1 95 95 LYS CB C 95 34.463 34.463 36.081 -1.618 18935 15803 1 20 . 1 1 95 95 LYS H H 95 7.924 7.924 7.651 0.273 18935 15804 1 20 . 1 1 96 96 THR N N 96 115.278 115.278 112.539 2.739 18935 15805 1 20 . 1 1 96 96 THR C C 96 174.317 174.317 173.345 0.972 18935 15806 1 20 . 1 1 96 96 THR CA C 96 61.203 61.203 60.340 0.863 18935 15807 1 20 . 1 1 96 96 THR CB C 96 69.348 69.348 69.850 -0.502 18935 15808 1 20 . 1 1 96 96 THR H H 96 7.967 7.967 7.751 0.216 18935 15809 1 20 . 1 1 97 97 TYR N N 97 123.254 123.254 124.926 -1.672 18935 15810 1 20 . 1 1 97 97 TYR C C 97 173.320 173.320 174.797 -1.477 18935 15811 1 20 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.420 -0.536 18935 15812 1 20 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.516 -0.380 18935 15813 1 20 . 1 1 97 97 TYR H H 97 9.232 9.232 8.751 0.481 18935 15814 1 20 . 1 1 98 98 GLN N N 98 122.574 122.574 118.792 3.782 18935 15815 1 20 . 1 1 98 98 GLN C C 98 172.781 172.781 174.475 -1.694 18935 15816 1 20 . 1 1 98 98 GLN CA C 98 55.171 55.171 54.991 0.180 18935 15817 1 20 . 1 1 98 98 GLN CB C 98 28.399 28.399 31.284 -2.885 18935 15818 1 20 . 1 1 98 98 GLN H H 98 9.000 9.000 8.938 0.062 18935 15819 1 20 . 1 1 99 99 LEU N N 99 130.218 130.218 124.573 5.645 18935 15820 1 20 . 1 1 99 99 LEU C C 99 172.806 172.806 174.804 -1.998 18935 15821 1 20 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.444 -1.393 18935 15822 1 20 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.838 -1.086 18935 15823 1 20 . 1 1 99 99 LEU H H 99 9.246 9.246 9.268 -0.022 18935 15824 1 20 . 1 1 100 100 ASP N N 100 124.931 124.931 124.823 0.108 18935 15825 1 20 . 1 1 100 100 ASP C C 100 172.626 172.626 174.765 -2.139 18935 15826 1 20 . 1 1 100 100 ASP CA C 100 50.430 50.430 54.121 -3.691 18935 15827 1 20 . 1 1 100 100 ASP CB C 100 37.328 37.328 44.276 -6.948 18935 15828 1 20 . 1 1 100 100 ASP H H 100 9.253 9.253 8.592 0.661 18935 15829 1 20 . 1 1 101 101 LEU N N 101 119.402 119.402 124.063 -4.661 18935 15830 1 20 . 1 1 101 101 LEU C C 101 173.869 173.869 175.445 -1.576 18935 15831 1 20 . 1 1 101 101 LEU CA C 101 51.655 51.655 54.141 -2.486 18935 15832 1 20 . 1 1 101 101 LEU CB C 101 44.166 44.166 46.184 -2.018 18935 15833 1 20 . 1 1 101 101 LEU H H 101 8.726 8.726 8.599 0.127 18935 15834 1 20 . 1 1 102 102 PHE N N 102 117.952 117.952 120.634 -2.682 18935 15835 1 20 . 1 1 102 102 PHE C C 102 175.853 175.853 175.722 0.131 18935 15836 1 20 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.326 -2.044 18935 15837 1 20 . 1 1 102 102 PHE CB C 102 41.824 41.824 41.435 0.389 18935 15838 1 20 . 1 1 102 102 PHE H H 102 8.236 8.236 8.968 -0.732 18935 15839 1 20 . 1 1 103 103 THR N N 103 106.853 106.853 120.051 -13.198 18935 15840 1 20 . 1 1 103 103 THR C C 103 175.154 175.154 173.963 1.191 18935 15841 1 20 . 1 1 103 103 THR CA C 103 57.685 57.685 62.051 -4.366 18935 15842 1 20 . 1 1 103 103 THR CB C 103 71.037 71.037 68.709 2.328 18935 15843 1 20 . 1 1 103 103 THR H H 103 7.917 7.917 8.755 -0.838 18935 15844 1 20 . 1 1 104 104 ALA N N 104 122.348 122.348 128.296 -5.948 18935 15845 1 20 . 1 1 104 104 ALA C C 104 175.947 175.947 175.134 0.813 18935 15846 1 20 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.630 -0.823 18935 15847 1 20 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.417 0.011 18935 15848 1 20 . 1 1 104 104 ALA H H 104 8.930 8.930 8.002 0.928 18935 15849 1 20 . 1 1 105 105 LEU N N 105 119.855 119.855 118.935 0.920 18935 15850 1 20 . 1 1 105 105 LEU C C 105 179.628 179.628 179.139 0.489 18935 15851 1 20 . 1 1 105 105 LEU CA C 105 53.123 53.123 53.899 -0.776 18935 15852 1 20 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.428 -2.094 18935 15853 1 20 . 1 1 105 105 LEU H H 105 8.316 8.316 9.258 -0.942 18935 15854 1 20 . 1 1 106 106 ALA N N 106 123.662 123.662 124.161 -0.499 18935 15855 1 20 . 1 1 106 106 ALA C C 106 181.056 181.056 179.144 1.912 18935 15856 1 20 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.327 1.022 18935 15857 1 20 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.428 -1.113 18935 15858 1 20 . 1 1 106 106 ALA H H 106 8.306 8.306 8.763 -0.457 18935 15859 1 20 . 1 1 107 107 GLU N N 107 114.825 114.825 115.425 -0.600 18935 15860 1 20 . 1 1 107 107 GLU C C 107 177.854 177.854 176.748 1.106 18935 15861 1 20 . 1 1 107 107 GLU CA C 107 58.386 58.386 58.017 0.369 18935 15862 1 20 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.546 -0.702 18935 15863 1 20 . 1 1 107 107 GLU H H 107 9.754 9.754 8.765 0.989 18935 15864 1 20 . 1 1 108 108 GLU N N 108 115.097 115.097 118.182 -3.085 18935 15865 1 20 . 1 1 108 108 GLU C C 108 178.001 178.001 177.218 0.783 18935 15866 1 20 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.373 -1.447 18935 15867 1 20 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.925 0.076 18935 15868 1 20 . 1 1 108 108 GLU H H 108 7.859 7.859 7.690 0.169 18935 15869 1 20 . 1 1 109 109 LYS N N 109 118.360 118.360 121.716 -3.356 18935 15870 1 20 . 1 1 109 109 LYS C C 109 172.691 172.691 176.268 -3.577 18935 15871 1 20 . 1 1 109 109 LYS CA C 109 62.902 62.902 62.169 0.733 18935 15872 1 20 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.742 -0.201 18935 15873 1 20 . 1 1 109 109 LYS H H 109 7.660 7.660 7.324 0.336 18935 15874 1 20 . 1 1 111 111 TYR N N 111 114.054 114.054 117.889 -3.835 18935 15875 1 20 . 1 1 111 111 TYR C C 111 179.764 179.764 178.094 1.670 18935 15876 1 20 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.367 -1.369 18935 15877 1 20 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.111 -1.155 18935 15878 1 20 . 1 1 111 111 TYR H H 111 6.583 6.583 8.439 -1.856 18935 15879 1 20 . 1 1 112 112 ALA N N 112 124.749 124.749 123.526 1.223 18935 15880 1 20 . 1 1 112 112 ALA C C 112 179.430 179.430 179.026 0.404 18935 15881 1 20 . 1 1 112 112 ALA CA C 112 54.969 54.969 55.087 -0.118 18935 15882 1 20 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.512 0.300 18935 15883 1 20 . 1 1 112 112 ALA H H 112 8.753 8.753 8.629 0.124 18935 15884 1 20 . 1 1 113 113 ILE N N 113 119.130 119.130 119.705 -0.575 18935 15885 1 20 . 1 1 113 113 ILE C C 113 178.646 178.646 178.249 0.397 18935 15886 1 20 . 1 1 113 113 ILE CA C 113 66.401 66.401 63.583 2.818 18935 15887 1 20 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.669 0.568 18935 15888 1 20 . 1 1 113 113 ILE H H 113 8.946 8.946 7.865 1.081 18935 15889 1 20 . 1 1 114 114 PHE N N 114 121.758 121.758 117.740 4.018 18935 15890 1 20 . 1 1 114 114 PHE C C 114 177.954 177.954 175.522 2.432 18935 15891 1 20 . 1 1 114 114 PHE CA C 114 59.777 59.777 60.647 -0.870 18935 15892 1 20 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.897 0.167 18935 15893 1 20 . 1 1 114 114 PHE H H 114 7.940 7.940 8.107 -0.167 18935 15894 1 20 . 1 1 115 115 HIS N N 115 116.547 116.547 114.810 1.737 18935 15895 1 20 . 1 1 115 115 HIS C C 115 176.161 176.161 175.252 0.909 18935 15896 1 20 . 1 1 115 115 HIS CA C 115 59.119 59.119 56.487 2.632 18935 15897 1 20 . 1 1 115 115 HIS CB C 115 31.067 31.067 31.171 -0.104 18935 15898 1 20 . 1 1 115 115 HIS H H 115 7.767 7.767 7.422 0.345 18935 15899 1 20 . 1 1 116 116 PHE N N 116 109.387 109.387 119.927 -10.540 18935 15900 1 20 . 1 1 116 116 PHE C C 116 177.282 177.282 176.325 0.957 18935 15901 1 20 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.829 1.605 18935 15902 1 20 . 1 1 116 116 PHE CB C 116 37.255 37.255 40.852 -3.597 18935 15903 1 20 . 1 1 116 116 PHE H H 116 8.989 8.989 7.747 1.242 18935 15904 1 20 . 1 1 117 117 THR N N 117 116.864 116.864 109.413 7.451 18935 15905 1 20 . 1 1 117 117 THR C C 117 172.889 172.889 174.890 -2.001 18935 15906 1 20 . 1 1 117 117 THR CA C 117 66.997 66.997 62.629 4.368 18935 15907 1 20 . 1 1 117 117 THR CB C 117 67.948 67.948 69.888 -1.940 18935 15908 1 20 . 1 1 117 117 THR H H 117 7.988 7.988 8.123 -0.135 18935 15909 1 20 . 1 1 118 118 GLY N N 118 103.320 103.320 110.118 -6.798 18935 15910 1 20 . 1 1 118 118 GLY C C 118 176.912 176.912 171.929 4.983 18935 15911 1 20 . 1 1 118 118 GLY CA C 118 44.182 44.182 42.917 1.265 18935 15912 1 20 . 1 1 118 118 GLY H H 118 6.550 6.550 7.656 -1.106 18935 15913 1 20 . 1 1 120 120 VAL N N 120 120.671 120.671 122.820 -2.149 18935 15914 1 20 . 1 1 120 120 VAL C C 120 176.283 176.283 177.308 -1.025 18935 15915 1 20 . 1 1 120 120 VAL CA C 120 66.940 66.940 65.845 1.095 18935 15916 1 20 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.880 -2.028 18935 15917 1 20 . 1 1 120 120 VAL H H 120 8.408 8.408 8.525 -0.117 18935 15918 1 20 . 1 1 121 121 SER N N 121 111.789 111.789 116.861 -5.072 18935 15919 1 20 . 1 1 121 121 SER C C 121 175.658 175.658 176.407 -0.749 18935 15920 1 20 . 1 1 121 121 SER CA C 121 60.814 60.814 61.811 -0.997 18935 15921 1 20 . 1 1 121 121 SER CB C 121 60.253 60.253 62.136 -1.883 18935 15922 1 20 . 1 1 121 121 SER H H 121 8.290 8.290 8.292 -0.002 18935 15923 1 20 . 1 1 122 122 TYR N N 122 123.254 123.254 123.148 0.106 18935 15924 1 20 . 1 1 122 122 TYR C C 122 174.611 174.611 177.162 -2.551 18935 15925 1 20 . 1 1 122 122 TYR CA C 122 58.546 58.546 61.151 -2.604 18935 15926 1 20 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.324 -0.185 18935 15927 1 20 . 1 1 122 122 TYR H H 122 6.303 6.303 7.816 -1.513 18935 15928 1 20 . 1 1 123 123 LEU N N 123 114.825 114.825 119.210 -4.385 18935 15929 1 20 . 1 1 123 123 LEU C C 123 178.891 178.891 179.290 -0.399 18935 15930 1 20 . 1 1 123 123 LEU CA C 123 56.779 56.779 58.177 -1.398 18935 15931 1 20 . 1 1 123 123 LEU CB C 123 40.638 40.638 41.465 -0.827 18935 15932 1 20 . 1 1 123 123 LEU H H 123 6.965 6.965 7.661 -0.696 18935 15933 1 20 . 1 1 124 124 ILE N N 124 114.915 114.915 118.426 -3.511 18935 15934 1 20 . 1 1 124 124 ILE C C 124 177.187 177.187 177.890 -0.703 18935 15935 1 20 . 1 1 124 124 ILE CA C 124 64.431 64.431 64.931 -0.501 18935 15936 1 20 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.443 -0.888 18935 15937 1 20 . 1 1 124 124 ILE H H 124 7.531 7.531 8.137 -0.606 18935 15938 1 20 . 1 1 125 125 ARG N N 125 115.278 115.278 119.869 -4.591 18935 15939 1 20 . 1 1 125 125 ARG C C 125 178.473 178.473 178.892 -0.419 18935 15940 1 20 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.788 -0.329 18935 15941 1 20 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.513 -2.434 18935 15942 1 20 . 1 1 125 125 ARG H H 125 6.809 6.809 7.870 -1.061 18935 15943 1 20 . 1 1 126 126 ILE N N 126 124.160 124.160 119.260 4.900 18935 15944 1 20 . 1 1 126 126 ILE C C 126 178.172 178.172 177.543 0.629 18935 15945 1 20 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.666 -1.740 18935 15946 1 20 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.385 -2.918 18935 15947 1 20 . 1 1 126 126 ILE H H 126 7.408 7.408 7.940 -0.532 18935 15948 1 20 . 1 1 127 127 ARG N N 127 117.136 117.136 121.153 -4.017 18935 15949 1 20 . 1 1 127 127 ARG C C 127 179.227 179.227 178.758 0.469 18935 15950 1 20 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.747 0.469 18935 15951 1 20 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.479 -1.690 18935 15952 1 20 . 1 1 127 127 ARG H H 127 8.230 8.230 8.286 -0.056 18935 15953 1 20 . 1 1 128 128 ALA N N 128 121.305 121.305 120.744 0.561 18935 15954 1 20 . 1 1 128 128 ALA C C 128 179.933 179.933 179.076 0.857 18935 15955 1 20 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.206 -0.500 18935 15956 1 20 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.161 0.177 18935 15957 1 20 . 1 1 128 128 ALA H H 128 8.666 8.666 8.238 0.428 18935 15958 1 20 . 1 1 129 129 ALA N N 129 120.943 120.943 121.676 -0.733 18935 15959 1 20 . 1 1 129 129 ALA C C 129 181.336 181.336 179.865 1.471 18935 15960 1 20 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.846 -0.138 18935 15961 1 20 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.279 -1.419 18935 15962 1 20 . 1 1 129 129 ALA H H 129 7.837 7.837 7.405 0.432 18935 15963 1 20 . 1 1 130 130 LEU N N 130 117.726 117.726 118.650 -0.924 18935 15964 1 20 . 1 1 130 130 LEU C C 130 179.432 179.432 180.001 -0.569 18935 15965 1 20 . 1 1 130 130 LEU CA C 130 57.176 57.176 58.084 -0.908 18935 15966 1 20 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.816 -1.250 18935 15967 1 20 . 1 1 130 130 LEU H H 130 8.114 8.114 8.475 -0.361 18935 15968 1 20 . 1 1 131 131 LYS N N 131 124.115 124.115 121.086 3.029 18935 15969 1 20 . 1 1 131 131 LYS C C 131 181.452 181.452 179.599 1.853 18935 15970 1 20 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.858 0.028 18935 15971 1 20 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.797 0.401 18935 15972 1 20 . 1 1 131 131 LYS H H 131 8.849 8.849 8.557 0.292 18935 15973 1 20 . 1 1 132 132 LYS N N 132 119.447 119.447 118.228 1.219 18935 15974 1 20 . 1 1 132 132 LYS C C 132 177.607 177.607 177.903 -0.296 18935 15975 1 20 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.483 -0.532 18935 15976 1 20 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.933 -0.508 18935 15977 1 20 . 1 1 132 132 LYS H H 132 7.778 7.778 8.063 -0.285 18935 15978 1 20 . 1 1 133 133 LYS N N 133 116.638 116.638 115.645 0.993 18935 15979 1 20 . 1 1 133 133 LYS C C 133 174.681 174.681 175.399 -0.718 18935 15980 1 20 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.198 -0.120 18935 15981 1 20 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.937 -1.297 18935 15982 1 20 . 1 1 133 133 LYS H H 133 7.617 7.617 7.776 -0.159 18935 15983 1 20 . 1 1 134 134 ASN N N 134 110.792 110.792 116.973 -6.181 18935 15984 1 20 . 1 1 134 134 ASN C C 134 174.034 174.034 173.133 0.901 18935 15985 1 20 . 1 1 134 134 ASN CA C 134 54.615 54.615 53.875 0.740 18935 15986 1 20 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.014 -0.962 18935 15987 1 20 . 1 1 134 134 ASN H H 134 8.123 8.123 8.368 -0.245 18935 15988 1 20 . 1 1 135 135 TYR N N 135 115.867 115.867 116.326 -0.459 18935 15989 1 20 . 1 1 135 135 TYR C C 135 175.122 175.122 174.703 0.419 18935 15990 1 20 . 1 1 135 135 TYR CA C 135 56.752 56.752 57.118 -0.366 18935 15991 1 20 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.184 -1.268 18935 15992 1 20 . 1 1 135 135 TYR H H 135 8.133 8.133 7.591 0.542 18935 15993 1 20 . 1 1 136 136 LYS N N 136 119.870 119.870 121.349 -1.479 18935 15994 1 20 . 1 1 136 136 LYS C C 136 174.324 174.324 175.197 -0.873 18935 15995 1 20 . 1 1 136 136 LYS CA C 136 55.181 55.181 55.531 -0.350 18935 15996 1 20 . 1 1 136 136 LYS CB C 136 34.073 34.073 34.914 -0.841 18935 15997 1 20 . 1 1 136 136 LYS H H 136 9.234 9.234 8.546 0.688 18935 15998 1 20 . 1 1 137 137 LEU N N 137 129.708 129.708 124.997 4.711 18935 15999 1 20 . 1 1 137 137 LEU C C 137 173.798 173.798 174.949 -1.151 18935 16000 1 20 . 1 1 137 137 LEU CA C 137 52.834 52.834 55.991 -3.157 18935 16001 1 20 . 1 1 137 137 LEU CB C 137 44.983 44.983 41.729 3.254 18935 16002 1 20 . 1 1 137 137 LEU H H 137 8.959 8.959 8.372 0.587 18935 16003 1 20 . 1 1 140 140 TYR N N 140 120.580 120.580 113.225 7.355 18935 16004 1 20 . 1 1 140 140 TYR C C 140 174.705 174.705 176.151 -1.446 18935 16005 1 20 . 1 1 140 140 TYR CA C 140 56.452 56.452 58.768 -2.316 18935 16006 1 20 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.891 -0.590 18935 16007 1 20 . 1 1 140 140 TYR H H 140 8.962 8.962 7.548 1.414 18935 16008 1 20 . 1 1 141 141 GLY N N 141 104.986 104.986 102.958 2.028 18935 16009 1 20 . 1 1 141 141 GLY C C 141 181.854 181.854 172.118 9.736 18935 16010 1 20 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.648 -0.526 18935 16011 1 20 . 1 1 141 141 GLY H H 141 7.555 7.555 7.282 0.273 18935 16012 1 20 . 1 1 142 142 LEU N N 142 118.269 118.269 122.494 -4.225 18935 16013 1 20 . 1 1 142 142 LEU C C 142 174.067 174.067 175.785 -1.718 18935 16014 1 20 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.047 -0.545 18935 16015 1 20 . 1 1 142 142 LEU CB C 142 44.542 44.542 41.480 3.062 18935 16016 1 20 . 1 1 142 142 LEU H H 142 7.794 7.794 8.423 -0.629 18935 16017 1 20 . 1 1 143 143 PHE N N 143 122.076 122.076 125.689 -3.613 18935 16018 1 20 . 1 1 143 143 PHE C C 143 175.199 175.199 175.670 -0.471 18935 16019 1 20 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.125 -1.093 18935 16020 1 20 . 1 1 143 143 PHE CB C 143 42.070 42.070 38.716 3.354 18935 16021 1 20 . 1 1 143 143 PHE H H 143 9.522 9.522 7.974 1.548 18935 16022 1 20 . 1 1 144 144 LYS N N 144 121.305 121.305 125.504 -4.199 18935 16023 1 20 . 1 1 144 144 LYS C C 144 176.917 176.917 176.214 0.703 18935 16024 1 20 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.236 1.119 18935 16025 1 20 . 1 1 144 144 LYS CB C 144 33.679 33.679 32.387 1.292 18935 16026 1 20 . 1 1 144 144 LYS H H 144 9.076 9.076 9.107 -0.031 18935 16027 1 20 . 1 1 145 145 ASN N N 145 126.834 126.834 121.636 5.198 18935 16028 1 20 . 1 1 145 145 ASN C C 145 175.070 175.070 175.387 -0.317 18935 16029 1 20 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.388 0.376 18935 16030 1 20 . 1 1 145 145 ASN CB C 145 36.430 36.430 38.060 -1.630 18935 16031 1 20 . 1 1 145 145 ASN H H 145 9.618 9.618 8.782 0.836 18935 16032 1 20 . 1 1 146 146 GLN N N 146 110.112 110.112 111.953 -1.841 18935 16033 1 20 . 1 1 146 146 GLN C C 146 175.198 175.198 175.335 -0.137 18935 16034 1 20 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.863 -0.967 18935 16035 1 20 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.866 -1.498 18935 16036 1 20 . 1 1 146 146 GLN H H 146 9.140 9.140 8.763 0.377 18935 16037 1 20 . 1 1 147 147 THR N N 147 116.003 116.003 117.509 -1.506 18935 16038 1 20 . 1 1 147 147 THR C C 147 173.224 173.224 173.762 -0.538 18935 16039 1 20 . 1 1 147 147 THR CA C 147 61.450 61.450 61.638 -0.188 18935 16040 1 20 . 1 1 147 147 THR CB C 147 70.285 70.285 69.178 1.107 18935 16041 1 20 . 1 1 147 147 THR H H 147 8.069 8.069 7.451 0.618 18935 16042 1 20 . 1 1 148 148 LEU N N 148 129.281 129.281 130.587 -1.306 18935 16043 1 20 . 1 1 148 148 LEU C C 148 176.703 176.703 175.462 1.241 18935 16044 1 20 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.738 -0.272 18935 16045 1 20 . 1 1 148 148 LEU CB C 148 41.725 41.725 43.091 -1.366 18935 16046 1 20 . 1 1 148 148 LEU H H 148 8.831 8.831 8.687 0.144 18935 16047 1 20 . 1 1 149 149 VAL N N 149 130.189 130.189 126.335 3.854 18935 16048 1 20 . 1 1 149 149 VAL C C 149 175.012 175.012 174.020 0.992 18935 16049 1 20 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.651 0.618 18935 16050 1 20 . 1 1 149 149 VAL CB C 149 31.456 31.456 34.962 -3.506 18935 16051 1 20 . 1 1 149 149 VAL H H 149 9.243 9.243 8.189 1.054 18935 16052 1 20 . 1 1 151 151 LEU N N 151 123.481 123.481 115.657 7.824 18935 16053 1 20 . 1 1 151 151 LEU C C 151 177.679 177.679 176.757 0.922 18935 16054 1 20 . 1 1 151 151 LEU CA C 151 53.997 53.997 52.924 1.073 18935 16055 1 20 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.405 1.214 18935 16056 1 20 . 1 1 151 151 LEU H H 151 8.080 8.080 8.135 -0.055 18935 16057 1 20 . 1 1 152 152 LYS N N 152 126.381 126.381 121.820 4.561 18935 16058 1 20 . 1 1 152 152 LYS C C 152 175.115 175.115 175.312 -0.197 18935 16059 1 20 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.306 -1.710 18935 16060 1 20 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.280 -3.215 18935 16061 1 20 . 1 1 152 152 LYS H H 152 9.112 9.112 8.864 0.248 18935 16062 1 20 . 1 1 153 153 ILE N N 153 113.737 113.737 116.163 -2.426 18935 16063 1 20 . 1 1 153 153 ILE C C 153 175.748 175.748 173.859 1.889 18935 16064 1 20 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.245 -0.856 18935 16065 1 20 . 1 1 153 153 ILE CB C 153 41.803 41.803 41.244 0.559 18935 16066 1 20 . 1 1 153 153 ILE H H 153 7.304 7.304 7.587 -0.283 18935 16067 1 20 . 1 1 154 154 THR N N 154 110.656 110.656 112.999 -2.343 18935 16068 1 20 . 1 1 154 154 THR C C 154 174.864 174.864 173.521 1.343 18935 16069 1 20 . 1 1 154 154 THR CA C 154 62.141 62.141 62.377 -0.236 18935 16070 1 20 . 1 1 154 154 THR CB C 154 70.413 70.413 70.175 0.238 18935 16071 1 20 . 1 1 154 154 THR H H 154 9.382 9.382 8.337 1.045 18935 16072 1 20 . 1 1 155 155 THR N N 155 110.746 110.746 117.034 -6.288 18935 16073 1 20 . 1 1 155 155 THR C C 155 174.718 174.718 175.230 -0.512 18935 16074 1 20 . 1 1 155 155 THR CA C 155 58.785 58.785 61.283 -2.498 18935 16075 1 20 . 1 1 155 155 THR CB C 155 72.277 72.277 70.962 1.315 18935 16076 1 20 . 1 1 155 155 THR H H 155 7.746 7.746 7.761 -0.015 18935 16077 1 20 . 1 1 156 156 GLU N N 156 122.302 122.302 124.337 -2.035 18935 16078 1 20 . 1 1 156 156 GLU C C 156 177.289 177.289 178.429 -1.140 18935 16079 1 20 . 1 1 156 156 GLU CA C 156 58.824 58.824 61.306 -2.482 18935 16080 1 20 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.098 -0.716 18935 16081 1 20 . 1 1 156 156 GLU H H 156 9.490 9.490 9.070 0.420 18935 16082 1 20 . 1 1 157 157 LYS N N 157 118.905 118.905 117.753 1.152 18935 16083 1 20 . 1 1 157 157 LYS C C 157 178.241 178.241 179.176 -0.935 18935 16084 1 20 . 1 1 157 157 LYS CA C 157 59.765 59.765 59.620 0.145 18935 16085 1 20 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.684 -0.406 18935 16086 1 20 . 1 1 157 157 LYS H H 157 8.329 8.329 8.519 -0.190 18935 16087 1 20 . 1 1 158 158 GLU N N 158 116.230 116.230 119.399 -3.169 18935 16088 1 20 . 1 1 158 158 GLU C C 158 178.988 178.988 179.006 -0.018 18935 16089 1 20 . 1 1 158 158 GLU CA C 158 58.256 58.256 59.492 -1.236 18935 16090 1 20 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.154 -0.096 18935 16091 1 20 . 1 1 158 158 GLU H H 158 7.611 7.611 8.063 -0.452 18935 16092 1 20 . 1 1 159 159 LEU N N 159 118.978 118.978 121.034 -2.056 18935 16093 1 20 . 1 1 159 159 LEU C C 159 176.347 176.347 178.199 -1.852 18935 16094 1 20 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.669 -5.430 18935 16095 1 20 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.932 -2.389 18935 16096 1 20 . 1 1 159 159 LEU H H 159 7.704 7.704 8.088 -0.384 18935 16097 1 20 . 1 1 160 160 ILE N N 160 117.227 117.227 115.753 1.474 18935 16098 1 20 . 1 1 160 160 ILE C C 160 177.219 177.219 177.534 -0.315 18935 16099 1 20 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.422 0.193 18935 16100 1 20 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.223 0.334 18935 16101 1 20 . 1 1 160 160 ILE H H 160 7.886 7.886 8.406 -0.520 18935 16102 1 20 . 1 1 161 161 LYS N N 161 115.912 115.912 120.454 -4.542 18935 16103 1 20 . 1 1 161 161 LYS C C 161 180.990 180.990 179.360 1.630 18935 16104 1 20 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.189 0.442 18935 16105 1 20 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.894 -1.146 18935 16106 1 20 . 1 1 161 161 LYS H H 161 7.536 7.536 7.815 -0.279 18935 16107 1 20 . 1 1 162 162 GLU N N 162 120.852 120.852 120.072 0.780 18935 16108 1 20 . 1 1 162 162 GLU C C 162 178.793 178.793 178.079 0.714 18935 16109 1 20 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.876 -0.894 18935 16110 1 20 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.345 -1.553 18935 16111 1 20 . 1 1 162 162 GLU H H 162 8.392 8.392 8.160 0.232 18935 16112 1 20 . 1 1 163 163 LEU N N 163 115.912 115.912 117.047 -1.135 18935 16113 1 20 . 1 1 163 163 LEU C C 163 176.370 176.370 177.112 -0.742 18935 16114 1 20 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.660 -0.566 18935 16115 1 20 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.494 -1.320 18935 16116 1 20 . 1 1 163 163 LEU H H 163 8.031 8.031 7.918 0.113 18935 16117 1 20 . 1 1 164 164 GLY N N 164 103.160 103.160 103.750 -0.590 18935 16118 1 20 . 1 1 164 164 GLY C C 164 174.240 174.240 174.244 -0.004 18935 16119 1 20 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.594 -0.293 18935 16120 1 20 . 1 1 164 164 GLY H H 164 7.625 7.625 7.471 0.154 18935 16121 1 20 . 1 1 165 165 PHE N N 165 117.952 117.952 118.317 -0.365 18935 16122 1 20 . 1 1 165 165 PHE C C 165 174.556 174.556 174.828 -0.272 18935 16123 1 20 . 1 1 165 165 PHE CA C 165 55.465 55.465 55.815 -0.350 18935 16124 1 20 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.743 -0.981 18935 16125 1 20 . 1 1 165 165 PHE H H 165 7.283 7.283 8.362 -1.079 18935 16126 1 20 . 1 1 166 166 THR N N 166 118.178 118.178 114.576 3.602 18935 16127 1 20 . 1 1 166 166 THR C C 166 175.306 175.306 173.983 1.323 18935 16128 1 20 . 1 1 166 166 THR CA C 166 63.466 63.466 61.062 2.404 18935 16129 1 20 . 1 1 166 166 THR CB C 166 68.721 68.721 70.546 -1.825 18935 16130 1 20 . 1 1 166 166 THR H H 166 9.678 9.678 8.712 0.966 18935 16131 1 20 . 1 1 167 167 TYR N N 167 128.239 128.239 124.374 3.865 18935 16132 1 20 . 1 1 167 167 TYR C C 167 173.297 173.297 175.260 -1.963 18935 16133 1 20 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.336 1.076 18935 16134 1 20 . 1 1 167 167 TYR CB C 167 36.722 36.722 38.858 -2.136 18935 16135 1 20 . 1 1 167 167 TYR H H 167 9.264 9.264 8.558 0.706 18935 16136 1 20 . 1 1 168 168 ARG N N 168 126.789 126.789 127.492 -0.703 18935 16137 1 20 . 1 1 168 168 ARG C C 168 175.297 175.297 174.855 0.442 18935 16138 1 20 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.240 -1.475 18935 16139 1 20 . 1 1 168 168 ARG CB C 168 31.326 31.326 31.663 -0.337 18935 16140 1 20 . 1 1 168 168 ARG H H 168 7.030 7.030 8.142 -1.112 18935 16141 1 20 . 1 1 169 169 ILE N N 169 119.221 119.221 118.135 1.086 18935 16142 1 20 . 1 1 169 169 ILE C C 169 174.522 174.522 175.361 -0.839 18935 16143 1 20 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.230 3.049 18935 16144 1 20 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.842 -5.194 18935 16145 1 20 . 1 1 169 169 ILE H H 169 8.349 8.349 8.114 0.235 18935 16146 1 20 . 1 1 171 171 LYS N N 171 111.335 111.335 118.620 -7.285 18935 16147 1 20 . 1 1 171 171 LYS C C 171 176.638 176.638 177.537 -0.899 18935 16148 1 20 . 1 1 171 171 LYS CA C 171 57.538 57.538 58.928 -1.390 18935 16149 1 20 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.807 0.160 18935 16150 1 20 . 1 1 171 171 LYS H H 171 8.198 8.198 8.339 -0.141 18935 16151 1 20 . 1 1 172 172 LYS N N 172 116.411 116.411 118.064 -1.653 18935 16152 1 20 . 1 1 172 172 LYS C C 172 175.331 175.331 175.509 -0.178 18935 16153 1 20 . 1 1 172 172 LYS CA C 172 54.001 54.001 54.358 -0.357 18935 16154 1 20 . 1 1 172 172 LYS CB C 172 31.818 31.818 32.441 -0.623 18935 16155 1 20 . 1 1 172 172 LYS H H 172 7.843 7.843 7.610 0.233 18935 16156 1 20 . 1 1 173 173 ARG N N 173 120.490 120.490 119.576 0.914 18935 16157 1 20 . 1 1 173 173 ARG C C 173 172.830 172.830 174.873 -2.043 18935 16158 1 20 . 1 1 173 173 ARG CA C 173 57.175 57.175 57.331 -0.156 18935 16159 1 20 . 1 1 173 173 ARG CB C 173 28.829 28.829 30.411 -1.582 18935 16160 1 20 . 1 1 173 173 ARG H H 173 6.917 6.917 7.560 -0.643 18935 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 164 3.641 0.914 3.535 18935 2 1 1 "Average Difference" HA 0 0.000 0.000 0.000 18935 3 1 1 "Average Difference" C 160 1.489 0.003 1.494 18935 4 1 1 "Average Difference" CA 164 1.339 0.297 1.309 18935 5 1 1 "Average Difference" CB 156 1.678 0.998 1.353 18935 6 1 1 "Average Difference" HN 164 0.645 -0.125 0.635 18935 7 1 2 "Average Difference" N 164 3.743 0.829 3.661 18935 8 1 2 "Average Difference" HA 0 0.000 0.000 0.000 18935 9 1 2 "Average Difference" C 160 1.556 -0.107 1.558 18935 10 1 2 "Average Difference" CA 164 1.334 0.211 1.321 18935 11 1 2 "Average Difference" CB 156 1.783 1.026 1.463 18935 12 1 2 "Average Difference" HN 164 0.622 -0.136 0.609 18935 13 1 3 "Average Difference" N 164 3.602 0.842 3.513 18935 14 1 3 "Average Difference" HA 0 0.000 0.000 0.000 18935 15 1 3 "Average Difference" C 160 1.540 0.047 1.544 18935 16 1 3 "Average Difference" CA 164 1.399 0.327 1.364 18935 17 1 3 "Average Difference" CB 156 1.699 0.882 1.457 18935 18 1 3 "Average Difference" HN 164 0.622 -0.139 0.608 18935 19 1 4 "Average Difference" N 164 3.933 0.667 3.888 18935 20 1 4 "Average Difference" HA 0 0.000 0.000 0.000 18935 21 1 4 "Average Difference" C 160 1.540 -0.115 1.540 18935 22 1 4 "Average Difference" CA 164 1.337 0.226 1.322 18935 23 1 4 "Average Difference" CB 156 1.785 1.021 1.469 18935 24 1 4 "Average Difference" HN 164 0.612 -0.126 0.600 18935 25 1 5 "Average Difference" N 164 3.740 0.692 3.687 18935 26 1 5 "Average Difference" HA 0 0.000 0.000 0.000 18935 27 1 5 "Average Difference" C 160 1.542 -0.050 1.546 18935 28 1 5 "Average Difference" CA 164 1.397 0.266 1.376 18935 29 1 5 "Average Difference" CB 156 1.753 1.035 1.419 18935 30 1 5 "Average Difference" HN 164 0.652 -0.118 0.643 18935 31 1 6 "Average Difference" N 164 3.741 0.805 3.664 18935 32 1 6 "Average Difference" HA 0 0.000 0.000 0.000 18935 33 1 6 "Average Difference" C 160 1.524 -0.005 1.529 18935 34 1 6 "Average Difference" CA 164 1.377 0.255 1.357 18935 35 1 6 "Average Difference" CB 156 1.722 0.986 1.417 18935 36 1 6 "Average Difference" HN 164 0.637 -0.102 0.630 18935 37 1 7 "Average Difference" N 164 3.863 0.874 3.775 18935 38 1 7 "Average Difference" HA 0 0.000 0.000 0.000 18935 39 1 7 "Average Difference" C 160 1.516 -0.024 1.520 18935 40 1 7 "Average Difference" CA 164 1.457 0.396 1.407 18935 41 1 7 "Average Difference" CB 156 1.774 0.981 1.483 18935 42 1 7 "Average Difference" HN 164 0.631 -0.108 0.623 18935 43 1 8 "Average Difference" N 164 3.772 0.578 3.739 18935 44 1 8 "Average Difference" HA 0 0.000 0.000 0.000 18935 45 1 8 "Average Difference" C 160 1.504 -0.012 1.509 18935 46 1 8 "Average Difference" CA 164 1.480 0.229 1.466 18935 47 1 8 "Average Difference" CB 156 1.727 0.913 1.471 18935 48 1 8 "Average Difference" HN 164 0.634 -0.175 0.612 18935 49 1 9 "Average Difference" N 164 3.792 0.811 3.716 18935 50 1 9 "Average Difference" HA 0 0.000 0.000 0.000 18935 51 1 9 "Average Difference" C 160 1.546 -0.011 1.551 18935 52 1 9 "Average Difference" CA 164 1.442 0.220 1.429 18935 53 1 9 "Average Difference" CB 156 1.782 1.055 1.441 18935 54 1 9 "Average Difference" HN 164 0.630 -0.115 0.621 18935 55 1 10 "Average Difference" N 164 3.743 0.813 3.665 18935 56 1 10 "Average Difference" HA 0 0.000 0.000 0.000 18935 57 1 10 "Average Difference" C 160 1.517 -0.041 1.521 18935 58 1 10 "Average Difference" CA 164 1.343 0.338 1.304 18935 59 1 10 "Average Difference" CB 156 1.777 1.058 1.432 18935 60 1 10 "Average Difference" HN 164 0.596 -0.094 0.590 18935 61 1 11 "Average Difference" N 164 3.670 0.644 3.625 18935 62 1 11 "Average Difference" HA 0 0.000 0.000 0.000 18935 63 1 11 "Average Difference" C 160 1.557 -0.008 1.562 18935 64 1 11 "Average Difference" CA 164 1.352 0.341 1.312 18935 65 1 11 "Average Difference" CB 156 1.750 0.985 1.451 18935 66 1 11 "Average Difference" HN 164 0.625 -0.112 0.617 18935 67 1 12 "Average Difference" N 164 3.823 0.820 3.745 18935 68 1 12 "Average Difference" HA 0 0.000 0.000 0.000 18935 69 1 12 "Average Difference" C 160 1.537 -0.020 1.542 18935 70 1 12 "Average Difference" CA 164 1.371 0.259 1.351 18935 71 1 12 "Average Difference" CB 156 1.729 1.018 1.402 18935 72 1 12 "Average Difference" HN 164 0.638 -0.129 0.627 18935 73 1 13 "Average Difference" N 164 3.626 0.796 3.549 18935 74 1 13 "Average Difference" HA 0 0.000 0.000 0.000 18935 75 1 13 "Average Difference" C 160 1.534 0.009 1.539 18935 76 1 13 "Average Difference" CA 164 1.406 0.367 1.362 18935 77 1 13 "Average Difference" CB 156 1.791 1.039 1.463 18935 78 1 13 "Average Difference" HN 164 0.627 -0.107 0.620 18935 79 1 14 "Average Difference" N 164 3.716 0.673 3.666 18935 80 1 14 "Average Difference" HA 0 0.000 0.000 0.000 18935 81 1 14 "Average Difference" C 160 1.554 -0.022 1.559 18935 82 1 14 "Average Difference" CA 164 1.417 0.335 1.381 18935 83 1 14 "Average Difference" CB 156 1.830 1.044 1.507 18935 84 1 14 "Average Difference" HN 164 0.652 -0.136 0.640 18935 85 1 15 "Average Difference" N 164 3.708 0.731 3.646 18935 86 1 15 "Average Difference" HA 0 0.000 0.000 0.000 18935 87 1 15 "Average Difference" C 160 1.551 -0.065 1.555 18935 88 1 15 "Average Difference" CA 164 1.389 0.226 1.374 18935 89 1 15 "Average Difference" CB 156 1.751 1.028 1.422 18935 90 1 15 "Average Difference" HN 164 0.642 -0.123 0.632 18935 91 1 16 "Average Difference" N 164 3.853 0.776 3.786 18935 92 1 16 "Average Difference" HA 0 0.000 0.000 0.000 18935 93 1 16 "Average Difference" C 160 1.542 -0.030 1.547 18935 94 1 16 "Average Difference" CA 164 1.493 0.351 1.455 18935 95 1 16 "Average Difference" CB 156 1.787 1.065 1.439 18935 96 1 16 "Average Difference" HN 164 0.641 -0.080 0.638 18935 97 1 17 "Average Difference" N 164 3.804 0.587 3.770 18935 98 1 17 "Average Difference" HA 0 0.000 0.000 0.000 18935 99 1 17 "Average Difference" C 160 1.510 -0.042 1.515 18935 100 1 17 "Average Difference" CA 164 1.361 0.270 1.338 18935 101 1 17 "Average Difference" CB 156 1.742 1.073 1.377 18935 102 1 17 "Average Difference" HN 164 0.633 -0.101 0.627 18935 103 1 18 "Average Difference" N 164 3.759 0.697 3.705 18935 104 1 18 "Average Difference" HA 0 0.000 0.000 0.000 18935 105 1 18 "Average Difference" C 160 1.530 -0.019 1.534 18935 106 1 18 "Average Difference" CA 164 1.387 0.247 1.369 18935 107 1 18 "Average Difference" CB 156 1.785 1.016 1.473 18935 108 1 18 "Average Difference" HN 164 0.676 -0.151 0.661 18935 109 1 19 "Average Difference" N 164 3.663 0.558 3.631 18935 110 1 19 "Average Difference" HA 0 0.000 0.000 0.000 18935 111 1 19 "Average Difference" C 160 1.569 -0.035 1.574 18935 112 1 19 "Average Difference" CA 164 1.377 0.283 1.352 18935 113 1 19 "Average Difference" CB 156 1.737 1.059 1.381 18935 114 1 19 "Average Difference" HN 164 0.664 -0.110 0.657 18935 115 1 20 "Average Difference" N 164 3.938 0.697 3.888 18935 116 1 20 "Average Difference" HA 0 0.000 0.000 0.000 18935 117 1 20 "Average Difference" C 160 1.523 -0.007 1.528 18935 118 1 20 "Average Difference" CA 164 1.469 0.358 1.429 18935 119 1 20 "Average Difference" CB 156 1.913 1.062 1.597 18935 120 1 20 "Average Difference" HN 164 0.662 -0.125 0.652 18935 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 18935 _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 LEU N N 2 119.937 119.937 117.025 2.912 18935 2 1 . 1 1 2 2 LEU C C 2 175.307 175.307 175.306 0.001 18935 3 1 . 1 1 2 2 LEU CA C 2 54.292 54.292 54.003 0.289 18935 4 1 . 1 1 2 2 LEU CB C 2 42.684 42.684 44.316 -1.632 18935 5 1 . 1 1 2 2 LEU H H 2 9.251 9.251 8.166 1.085 18935 6 1 . 1 1 3 3 THR N N 3 111.335 111.335 110.704 0.631 18935 7 1 . 1 1 3 3 THR C C 3 175.854 175.854 175.604 0.250 18935 8 1 . 1 1 3 3 THR CA C 3 60.540 60.540 60.293 0.247 18935 9 1 . 1 1 3 3 THR CB C 3 70.782 70.782 70.635 0.147 18935 10 1 . 1 1 3 3 THR H H 3 8.677 8.677 8.135 0.542 18935 11 1 . 1 1 4 4 LEU N N 4 120.988 120.988 122.953 -1.965 18935 12 1 . 1 1 4 4 LEU C C 4 178.391 178.391 178.229 0.162 18935 13 1 . 1 1 4 4 LEU CA C 4 58.064 58.064 58.019 0.045 18935 14 1 . 1 1 4 4 LEU CB C 4 39.261 39.261 41.979 -2.718 18935 15 1 . 1 1 4 4 LEU H H 4 7.746 7.746 8.152 -0.406 18935 16 1 . 1 1 5 5 ILE N N 5 114.236 114.236 114.316 -0.080 18935 17 1 . 1 1 5 5 ILE C C 5 178.339 178.339 177.733 0.606 18935 18 1 . 1 1 5 5 ILE CA C 5 63.582 63.582 64.339 -0.757 18935 19 1 . 1 1 5 5 ILE CB C 5 36.799 36.799 37.149 -0.350 18935 20 1 . 1 1 5 5 ILE H H 5 7.821 7.821 7.768 0.053 18935 21 1 . 1 1 6 6 GLN N N 6 120.399 120.399 120.749 -0.350 18935 22 1 . 1 1 6 6 GLN C C 6 178.783 178.783 178.464 0.319 18935 23 1 . 1 1 6 6 GLN CA C 6 58.220 58.220 59.027 -0.807 18935 24 1 . 1 1 6 6 GLN CB C 6 28.115 28.115 28.075 0.040 18935 25 1 . 1 1 6 6 GLN H H 6 7.810 7.810 7.870 -0.060 18935 26 1 . 1 1 7 7 GLY N N 7 106.277 106.277 106.173 0.104 18935 27 1 . 1 1 7 7 GLY C C 7 174.554 174.554 176.063 -1.509 18935 28 1 . 1 1 7 7 GLY CA C 7 46.934 46.934 46.990 -0.056 18935 29 1 . 1 1 7 7 GLY H H 7 8.733 8.733 8.056 0.677 18935 30 1 . 1 1 8 8 LYS N N 8 119.991 119.991 121.450 -1.459 18935 31 1 . 1 1 8 8 LYS C C 8 179.433 179.433 178.173 1.260 18935 32 1 . 1 1 8 8 LYS CA C 8 59.892 59.892 58.120 1.772 18935 33 1 . 1 1 8 8 LYS CB C 8 31.332 31.332 32.233 -0.901 18935 34 1 . 1 1 8 8 LYS H H 8 8.688 8.688 7.343 1.345 18935 35 1 . 1 1 9 9 LYS N N 9 119.175 119.175 120.407 -1.232 18935 36 1 . 1 1 9 9 LYS CA C 9 59.382 59.382 59.869 -0.487 18935 37 1 . 1 1 9 9 LYS CB C 9 31.435 31.435 32.422 -0.987 18935 38 1 . 1 1 9 9 LYS H H 9 8.015 8.015 7.858 0.157 18935 39 1 . 1 1 10 10 ILE N N 10 120.308 120.308 116.462 3.846 18935 40 1 . 1 1 10 10 ILE C C 10 177.766 177.766 177.569 0.197 18935 41 1 . 1 1 10 10 ILE CA C 10 64.676 64.676 64.855 -0.179 18935 42 1 . 1 1 10 10 ILE CB C 10 36.313 36.313 37.419 -1.106 18935 43 1 . 1 1 10 10 ILE H H 10 7.967 7.967 8.101 -0.134 18935 44 1 . 1 1 11 11 VAL N N 11 119.130 119.130 120.607 -1.477 18935 45 1 . 1 1 11 11 VAL C C 11 176.606 176.606 178.159 -1.553 18935 46 1 . 1 1 11 11 VAL CA C 11 67.640 67.640 66.552 1.088 18935 47 1 . 1 1 11 11 VAL CB C 11 30.209 30.209 30.817 -0.608 18935 48 1 . 1 1 11 11 VAL H H 11 8.128 8.128 7.767 0.361 18935 49 1 . 1 1 12 12 ASN N N 12 115.822 115.822 117.224 -1.402 18935 50 1 . 1 1 12 12 ASN C C 12 177.375 177.375 177.005 0.370 18935 51 1 . 1 1 12 12 ASN CA C 12 55.970 55.970 56.243 -0.273 18935 52 1 . 1 1 12 12 ASN CB C 12 37.563 37.563 38.611 -1.048 18935 53 1 . 1 1 12 12 ASN H H 12 8.203 8.203 7.864 0.339 18935 54 1 . 1 1 13 13 HIS N N 13 117.659 117.659 117.231 0.428 18935 55 1 . 1 1 13 13 HIS C C 13 177.287 177.287 177.172 0.115 18935 56 1 . 1 1 13 13 HIS CA C 13 58.687 58.687 58.099 0.588 18935 57 1 . 1 1 13 13 HIS CB C 13 30.021 30.021 30.409 -0.388 18935 58 1 . 1 1 13 13 HIS H H 13 7.861 7.861 7.875 -0.014 18935 59 1 . 1 1 14 14 LEU N N 14 115.595 115.595 119.758 -4.163 18935 60 1 . 1 1 14 14 LEU C C 14 179.092 179.092 178.050 1.042 18935 61 1 . 1 1 14 14 LEU CA C 14 56.641 56.641 56.874 -0.233 18935 62 1 . 1 1 14 14 LEU CB C 14 41.020 41.020 42.191 -1.171 18935 63 1 . 1 1 14 14 LEU H H 14 8.376 8.376 8.568 -0.192 18935 64 1 . 1 1 15 15 ARG N N 15 115.006 115.006 117.739 -2.733 18935 65 1 . 1 1 15 15 ARG C C 15 176.265 176.265 177.087 -0.822 18935 66 1 . 1 1 15 15 ARG CA C 15 59.884 59.884 58.099 1.785 18935 67 1 . 1 1 15 15 ARG CB C 15 29.072 29.072 29.877 -0.805 18935 68 1 . 1 1 15 15 ARG H H 15 8.074 8.074 8.130 -0.056 18935 69 1 . 1 1 16 16 SER N N 16 107.778 107.778 112.560 -4.782 18935 70 1 . 1 1 16 16 SER C C 16 176.009 176.009 175.034 0.975 18935 71 1 . 1 1 16 16 SER CA C 16 57.244 57.244 59.374 -2.130 18935 72 1 . 1 1 16 16 SER CB C 16 63.525 63.525 63.957 -0.432 18935 73 1 . 1 1 16 16 SER H H 16 7.136 7.136 8.047 -0.911 18935 74 1 . 1 1 17 17 ARG N N 17 121.532 121.532 121.142 0.390 18935 75 1 . 1 1 17 17 ARG C C 17 174.482 174.482 175.613 -1.131 18935 76 1 . 1 1 17 17 ARG CA C 17 56.322 56.322 55.270 1.052 18935 77 1 . 1 1 17 17 ARG CB C 17 31.830 31.830 30.849 0.981 18935 78 1 . 1 1 17 17 ARG H H 17 7.913 7.913 7.640 0.273 18935 79 1 . 1 1 18 18 LEU N N 18 121.305 121.305 120.050 1.255 18935 80 1 . 1 1 18 18 LEU C C 18 176.283 176.283 175.566 0.717 18935 81 1 . 1 1 18 18 LEU CA C 18 54.698 54.698 55.344 -0.645 18935 82 1 . 1 1 18 18 LEU CB C 18 43.055 43.055 43.057 -0.002 18935 83 1 . 1 1 18 18 LEU H H 18 8.812 8.812 7.546 1.266 18935 84 1 . 1 1 19 19 ALA N N 19 125.293 125.293 122.170 3.123 18935 85 1 . 1 1 19 19 ALA C C 19 173.780 173.780 175.129 -1.349 18935 86 1 . 1 1 19 19 ALA CA C 19 50.802 50.802 51.743 -0.941 18935 87 1 . 1 1 19 19 ALA CB C 19 22.853 22.853 22.005 0.848 18935 88 1 . 1 1 19 19 ALA H H 19 8.790 8.790 7.919 0.871 18935 89 1 . 1 1 20 20 PHE N N 20 113.117 113.117 115.232 -2.115 18935 90 1 . 1 1 20 20 PHE C C 20 172.708 172.708 173.047 -0.339 18935 91 1 . 1 1 20 20 PHE CA C 20 55.598 55.598 56.425 -0.827 18935 92 1 . 1 1 20 20 PHE CB C 20 41.725 41.725 41.975 -0.250 18935 93 1 . 1 1 20 20 PHE H H 20 8.925 8.925 8.772 0.153 18935 94 1 . 1 1 21 21 GLU N N 21 121.532 121.532 121.071 0.461 18935 95 1 . 1 1 21 21 GLU C C 21 174.830 174.830 175.105 -0.275 18935 96 1 . 1 1 21 21 GLU CA C 21 54.963 54.963 55.175 -0.211 18935 97 1 . 1 1 21 21 GLU CB C 21 30.343 30.343 32.471 -2.128 18935 98 1 . 1 1 21 21 GLU H H 21 7.972 7.972 9.086 -1.114 18935 99 1 . 1 1 22 22 TYR N N 22 125.339 125.339 124.127 1.212 18935 100 1 . 1 1 22 22 TYR C C 22 174.864 174.864 174.979 -0.115 18935 101 1 . 1 1 22 22 TYR CA C 22 55.288 55.288 57.504 -2.216 18935 102 1 . 1 1 22 22 TYR CB C 22 39.859 39.859 40.220 -0.361 18935 103 1 . 1 1 22 22 TYR H H 22 9.016 9.016 8.515 0.501 18935 104 1 . 1 1 23 23 ASN N N 23 127.024 127.024 126.427 0.597 18935 105 1 . 1 1 23 23 ASN C C 23 175.410 175.410 175.091 0.319 18935 106 1 . 1 1 23 23 ASN CA C 23 53.054 53.054 53.908 -0.854 18935 107 1 . 1 1 23 23 ASN CB C 23 36.261 36.261 37.517 -1.256 18935 108 1 . 1 1 23 23 ASN H H 23 9.181 9.181 9.251 -0.070 18935 109 1 . 1 1 24 24 GLY N N 24 102.755 102.755 102.813 -0.058 18935 110 1 . 1 1 24 24 GLY C C 24 173.626 173.626 174.461 -0.835 18935 111 1 . 1 1 24 24 GLY CA C 24 44.935 44.935 45.012 -0.077 18935 112 1 . 1 1 24 24 GLY H H 24 8.666 8.666 8.333 0.333 18935 113 1 . 1 1 25 25 GLN N N 25 118.722 118.722 120.653 -1.931 18935 114 1 . 1 1 25 25 GLN C C 25 173.657 173.657 175.036 -1.379 18935 115 1 . 1 1 25 25 GLN CA C 25 53.233 53.233 54.827 -1.594 18935 116 1 . 1 1 25 25 GLN CB C 25 30.805 30.805 30.137 0.668 18935 117 1 . 1 1 25 25 GLN H H 25 7.708 7.708 8.042 -0.334 18935 118 1 . 1 1 26 26 LEU N N 26 123.526 123.526 122.249 1.277 18935 119 1 . 1 1 26 26 LEU C C 26 175.842 175.842 176.371 -0.529 18935 120 1 . 1 1 26 26 LEU CA C 26 53.986 53.986 54.118 -0.132 18935 121 1 . 1 1 26 26 LEU CB C 26 40.807 40.807 43.408 -2.601 18935 122 1 . 1 1 26 26 LEU H H 26 8.543 8.543 8.408 0.135 18935 123 1 . 1 1 27 27 ILE N N 27 129.462 129.462 124.360 5.102 18935 124 1 . 1 1 27 27 ILE C C 27 175.085 175.085 174.210 0.874 18935 125 1 . 1 1 27 27 ILE CA C 27 58.973 58.973 58.871 0.102 18935 126 1 . 1 1 27 27 ILE CB C 27 35.552 35.552 38.612 -3.060 18935 127 1 . 1 1 27 27 ILE H H 27 8.989 8.989 8.965 0.024 18935 128 1 . 1 1 28 28 LYS N N 28 125.157 125.157 126.691 -1.534 18935 129 1 . 1 1 28 28 LYS C C 28 176.725 176.725 175.476 1.249 18935 130 1 . 1 1 28 28 LYS CA C 28 56.810 56.810 55.713 1.097 18935 131 1 . 1 1 28 28 LYS CB C 28 31.817 31.817 33.282 -1.465 18935 132 1 . 1 1 28 28 LYS H H 28 8.311 8.311 8.292 0.019 18935 133 1 . 1 1 29 29 ILE N N 29 125.565 125.565 117.306 8.259 18935 134 1 . 1 1 29 29 ILE C C 29 175.685 175.685 174.252 1.433 18935 135 1 . 1 1 29 29 ILE CA C 29 60.405 60.405 59.788 0.617 18935 136 1 . 1 1 29 29 ILE CB C 29 37.031 37.031 40.202 -3.171 18935 137 1 . 1 1 29 29 ILE H H 29 8.209 8.209 7.886 0.323 18935 138 1 . 1 1 30 30 LEU N N 30 127.831 127.831 120.423 7.408 18935 139 1 . 1 1 30 30 LEU C C 30 178.794 178.794 177.603 1.191 18935 140 1 . 1 1 30 30 LEU CA C 30 54.443 54.443 53.219 1.224 18935 141 1 . 1 1 30 30 LEU CB C 30 40.836 40.836 45.186 -4.349 18935 142 1 . 1 1 30 30 LEU H H 30 9.027 9.027 8.264 0.763 18935 143 1 . 1 1 31 31 SER N N 31 116.864 116.864 117.390 -0.526 18935 144 1 . 1 1 31 31 SER C C 31 177.464 177.464 176.231 1.233 18935 145 1 . 1 1 31 31 SER CA C 31 61.180 61.180 61.585 -0.405 18935 146 1 . 1 1 31 31 SER CB C 31 62.105 62.105 62.975 -0.870 18935 147 1 . 1 1 31 31 SER H H 31 8.887 8.887 8.688 0.199 18935 148 1 . 1 1 32 32 LYS N N 32 114.825 114.825 120.261 -5.437 18935 149 1 . 1 1 32 32 LYS C C 32 176.243 176.243 176.555 -0.312 18935 150 1 . 1 1 32 32 LYS CA C 32 57.292 57.292 57.675 -0.383 18935 151 1 . 1 1 32 32 LYS CB C 32 30.266 30.266 31.589 -1.323 18935 152 1 . 1 1 32 32 LYS H H 32 8.290 8.290 8.340 -0.050 18935 153 1 . 1 1 33 33 ASN N N 33 117.564 117.564 115.076 2.488 18935 154 1 . 1 1 33 33 ASN C C 33 172.253 172.253 173.775 -1.522 18935 155 1 . 1 1 33 33 ASN CA C 33 52.091 52.091 53.122 -1.031 18935 156 1 . 1 1 33 33 ASN CB C 33 38.339 38.339 40.300 -1.961 18935 157 1 . 1 1 33 33 ASN H H 33 8.051 8.051 7.998 0.053 18935 158 1 . 1 1 34 34 ILE N N 34 118.949 118.949 120.400 -1.451 18935 159 1 . 1 1 34 34 ILE C C 34 175.343 175.343 174.741 0.602 18935 160 1 . 1 1 34 34 ILE CA C 34 60.553 60.553 60.094 0.459 18935 161 1 . 1 1 34 34 ILE CB C 34 38.867 38.867 41.129 -2.262 18935 162 1 . 1 1 34 34 ILE H H 34 7.670 7.670 7.839 -0.169 18935 163 1 . 1 1 35 35 VAL N N 35 128.355 128.355 125.870 2.485 18935 164 1 . 1 1 35 35 VAL C C 35 175.543 175.543 174.514 1.029 18935 165 1 . 1 1 35 35 VAL CA C 35 60.014 60.014 60.185 -0.171 18935 166 1 . 1 1 35 35 VAL CB C 35 34.231 34.231 35.528 -1.297 18935 167 1 . 1 1 35 35 VAL H H 35 9.698 9.698 9.161 0.537 18935 168 1 . 1 1 36 36 ALA N N 36 129.553 129.553 131.452 -1.899 18935 169 1 . 1 1 36 36 ALA C C 36 177.015 177.015 176.738 0.277 18935 170 1 . 1 1 36 36 ALA CA C 36 52.396 52.396 51.381 1.015 18935 171 1 . 1 1 36 36 ALA CB C 36 17.622 17.622 18.361 -0.739 18935 172 1 . 1 1 36 36 ALA H H 36 8.917 8.917 8.568 0.349 18935 173 1 . 1 1 37 37 VAL N N 37 115.006 115.006 120.019 -5.013 18935 174 1 . 1 1 37 37 VAL C C 37 174.649 174.649 175.840 -1.191 18935 175 1 . 1 1 37 37 VAL CA C 37 59.321 59.321 59.756 -0.435 18935 176 1 . 1 1 37 37 VAL CB C 37 32.386 32.386 33.691 -1.305 18935 177 1 . 1 1 37 37 VAL H H 37 8.214 8.214 7.751 0.463 18935 178 1 . 1 1 38 38 GLY N N 38 109.387 109.387 108.131 1.256 18935 179 1 . 1 1 38 38 GLY C C 38 174.152 174.152 175.881 -1.729 18935 180 1 . 1 1 38 38 GLY CA C 38 45.497 45.497 45.626 -0.129 18935 181 1 . 1 1 38 38 GLY H H 38 8.677 8.677 8.005 0.672 18935 182 1 . 1 1 39 39 SER N N 39 116.776 116.776 119.105 -2.330 18935 183 1 . 1 1 39 39 SER C C 39 175.129 175.129 176.655 -1.526 18935 184 1 . 1 1 39 39 SER CA C 39 60.036 60.036 61.978 -1.942 18935 185 1 . 1 1 39 39 SER CB C 39 61.522 61.522 63.120 -1.598 18935 186 1 . 1 1 39 39 SER H H 39 9.705 9.705 8.548 1.157 18935 187 1 . 1 1 40 40 LEU N N 40 113.696 113.696 119.176 -5.480 18935 188 1 . 1 1 40 40 LEU C C 40 180.558 180.558 178.085 2.473 18935 189 1 . 1 1 40 40 LEU CA C 40 58.373 58.373 57.027 1.346 18935 190 1 . 1 1 40 40 LEU CB C 40 41.877 41.877 41.185 0.692 18935 191 1 . 1 1 40 40 LEU H H 40 7.311 7.311 7.911 -0.600 18935 192 1 . 1 1 41 41 ARG N N 41 121.162 121.162 116.818 4.344 18935 193 1 . 1 1 41 41 ARG C C 41 176.964 176.964 177.281 -0.317 18935 194 1 . 1 1 41 41 ARG CA C 41 58.451 58.451 56.678 1.773 18935 195 1 . 1 1 41 41 ARG CB C 41 28.205 28.205 30.638 -2.433 18935 196 1 . 1 1 41 41 ARG H H 41 6.999 6.999 7.684 -0.685 18935 197 1 . 1 1 42 42 ARG N N 42 111.109 111.109 118.398 -7.289 18935 198 1 . 1 1 42 42 ARG C C 42 172.564 172.564 175.748 -3.184 18935 199 1 . 1 1 42 42 ARG CA C 42 56.380 56.380 56.306 0.074 18935 200 1 . 1 1 42 42 ARG CB C 42 28.349 28.349 30.787 -2.438 18935 201 1 . 1 1 42 42 ARG H H 42 7.041 7.041 7.623 -0.582 18935 202 1 . 1 1 43 43 GLU N N 43 111.924 111.924 115.682 -3.758 18935 203 1 . 1 1 43 43 GLU C C 43 176.202 176.202 175.153 1.049 18935 204 1 . 1 1 43 43 GLU CA C 43 56.454 56.454 57.326 -0.872 18935 205 1 . 1 1 43 43 GLU CB C 43 25.301 25.301 27.225 -1.924 18935 206 1 . 1 1 43 43 GLU H H 43 7.757 7.757 8.031 -0.274 18935 207 1 . 1 1 44 44 GLU N N 44 117.861 117.861 119.072 -1.211 18935 208 1 . 1 1 44 44 GLU C C 44 175.197 175.197 176.514 -1.317 18935 209 1 . 1 1 44 44 GLU CA C 44 56.128 56.128 56.208 -0.080 18935 210 1 . 1 1 44 44 GLU CB C 44 28.559 28.559 30.629 -2.070 18935 211 1 . 1 1 44 44 GLU H H 44 7.461 7.461 7.748 -0.287 18935 212 1 . 1 1 45 45 LYS N N 45 115.051 115.051 119.691 -4.640 18935 213 1 . 1 1 45 45 LYS C C 45 177.733 177.733 176.127 1.606 18935 214 1 . 1 1 45 45 LYS CA C 45 59.055 59.055 57.452 1.603 18935 215 1 . 1 1 45 45 LYS CB C 45 32.027 32.027 33.570 -1.543 18935 216 1 . 1 1 45 45 LYS H H 45 8.123 8.123 8.565 -0.442 18935 217 1 . 1 1 46 46 MET N N 46 114.009 114.009 119.006 -4.997 18935 218 1 . 1 1 46 46 MET C C 46 174.067 174.067 174.405 -0.338 18935 219 1 . 1 1 46 46 MET CA C 46 52.477 52.477 54.608 -2.131 18935 220 1 . 1 1 46 46 MET CB C 46 33.974 33.974 34.613 -0.639 18935 221 1 . 1 1 46 46 MET H H 46 7.767 7.767 7.588 0.179 18935 222 1 . 1 1 47 47 LEU N N 47 120.263 120.263 122.758 -2.495 18935 223 1 . 1 1 47 47 LEU C C 47 177.669 177.669 175.809 1.860 18935 224 1 . 1 1 47 47 LEU CA C 47 52.201 52.201 53.447 -1.246 18935 225 1 . 1 1 47 47 LEU CB C 47 42.908 42.908 43.668 -0.760 18935 226 1 . 1 1 47 47 LEU H H 47 9.481 9.481 8.542 0.939 18935 227 1 . 1 1 48 48 ASN N N 48 118.632 118.632 117.672 0.960 18935 228 1 . 1 1 48 48 ASN C C 48 174.715 174.715 174.388 0.327 18935 229 1 . 1 1 48 48 ASN CA C 48 55.501 55.501 53.924 1.577 18935 230 1 . 1 1 48 48 ASN CB C 48 38.828 38.828 40.609 -1.781 18935 231 1 . 1 1 48 48 ASN H H 48 9.388 9.388 8.951 0.437 18935 232 1 . 1 1 49 49 ASP N N 49 115.867 115.867 116.687 -0.820 18935 233 1 . 1 1 49 49 ASP C C 49 174.111 174.111 174.303 -0.192 18935 234 1 . 1 1 49 49 ASP CA C 49 51.201 51.201 52.941 -1.740 18935 235 1 . 1 1 49 49 ASP CB C 49 40.077 40.077 43.897 -3.820 18935 236 1 . 1 1 49 49 ASP H H 49 7.670 7.670 7.811 -0.141 18935 237 1 . 1 1 50 50 VAL N N 50 119.185 119.185 119.077 0.108 18935 238 1 . 1 1 50 50 VAL C C 50 172.333 172.333 174.430 -2.097 18935 239 1 . 1 1 50 50 VAL CA C 50 61.915 61.915 61.307 0.608 18935 240 1 . 1 1 50 50 VAL CB C 50 32.965 32.965 33.833 -0.868 18935 241 1 . 1 1 50 50 VAL H H 50 8.339 8.339 7.917 0.422 18935 242 1 . 1 1 51 51 ASP N N 51 124.704 124.704 126.375 -1.671 18935 243 1 . 1 1 51 51 ASP C C 51 173.725 173.725 175.154 -1.429 18935 244 1 . 1 1 51 51 ASP CA C 51 53.028 53.028 53.383 -0.355 18935 245 1 . 1 1 51 51 ASP CB C 51 43.829 43.829 43.626 0.203 18935 246 1 . 1 1 51 51 ASP H H 51 8.984 8.984 8.411 0.573 18935 247 1 . 1 1 52 52 LEU N N 52 120.943 120.943 121.957 -1.014 18935 248 1 . 1 1 52 52 LEU C C 52 173.045 173.045 174.325 -1.280 18935 249 1 . 1 1 52 52 LEU CA C 52 52.871 52.871 54.099 -1.228 18935 250 1 . 1 1 52 52 LEU CB C 52 44.253 44.253 46.328 -2.075 18935 251 1 . 1 1 52 52 LEU H H 52 9.081 9.081 8.316 0.765 18935 252 1 . 1 1 53 53 LEU N N 53 123.027 123.027 124.621 -1.594 18935 253 1 . 1 1 53 53 LEU C C 53 173.750 173.750 175.109 -1.359 18935 254 1 . 1 1 53 53 LEU CA C 53 52.333 52.333 53.434 -1.101 18935 255 1 . 1 1 53 53 LEU CB C 53 45.008 45.008 45.240 -0.232 18935 256 1 . 1 1 53 53 LEU H H 53 9.146 9.146 9.080 0.066 18935 257 1 . 1 1 54 54 ILE N N 54 126.562 126.562 126.035 0.528 18935 258 1 . 1 1 54 54 ILE C C 54 175.132 175.132 175.349 -0.217 18935 259 1 . 1 1 54 54 ILE CA C 54 58.598 58.598 59.981 -1.383 18935 260 1 . 1 1 54 54 ILE CB C 54 38.561 38.561 39.871 -1.310 18935 261 1 . 1 1 54 54 ILE H H 54 9.440 9.440 9.083 0.357 18935 262 1 . 1 1 55 55 ILE N N 55 126.879 126.879 126.980 -0.101 18935 263 1 . 1 1 55 55 ILE C C 55 175.655 175.655 175.326 0.329 18935 264 1 . 1 1 55 55 ILE CA C 55 57.561 57.561 60.102 -2.541 18935 265 1 . 1 1 55 55 ILE CB C 55 34.306 34.306 40.138 -5.832 18935 266 1 . 1 1 55 55 ILE H H 55 9.381 9.381 8.202 1.179 18935 267 1 . 1 1 56 56 VAL N N 56 128.936 128.936 123.882 5.054 18935 268 1 . 1 1 56 56 VAL C C 56 176.389 176.389 174.479 1.910 18935 269 1 . 1 1 56 56 VAL CA C 56 58.630 58.630 58.596 0.034 18935 270 1 . 1 1 56 56 VAL CB C 56 32.784 32.784 33.491 -0.707 18935 271 1 . 1 1 56 56 VAL H H 56 9.227 9.227 8.791 0.436 18935 272 1 . 1 1 58 58 GLU N N 58 112.423 112.423 118.604 -6.181 18935 273 1 . 1 1 58 58 GLU C C 58 175.946 175.946 176.567 -0.621 18935 274 1 . 1 1 58 58 GLU CA C 58 54.300 54.300 55.297 -0.998 18935 275 1 . 1 1 58 58 GLU CB C 58 32.097 32.097 31.284 0.813 18935 276 1 . 1 1 58 58 GLU H H 58 6.685 6.685 8.037 -1.352 18935 277 1 . 1 1 59 59 LYS N N 59 125.293 125.293 120.600 4.693 18935 278 1 . 1 1 59 59 LYS C C 59 179.248 179.248 176.265 2.983 18935 279 1 . 1 1 59 59 LYS CA C 59 59.774 59.774 57.249 2.525 18935 280 1 . 1 1 59 59 LYS CB C 59 31.077 31.077 32.303 -1.226 18935 281 1 . 1 1 59 59 LYS H H 59 9.108 9.108 8.602 0.506 18935 282 1 . 1 1 60 60 LYS N N 60 117.408 117.408 117.932 -0.524 18935 283 1 . 1 1 60 60 LYS C C 60 177.198 177.198 177.664 -0.466 18935 284 1 . 1 1 60 60 LYS CA C 60 58.213 58.213 57.195 1.018 18935 285 1 . 1 1 60 60 LYS CB C 60 30.583 30.583 32.781 -2.198 18935 286 1 . 1 1 60 60 LYS H H 60 9.102 9.102 7.560 1.542 18935 287 1 . 1 1 61 61 LEU N N 61 114.779 114.779 120.872 -6.093 18935 288 1 . 1 1 61 61 LEU C C 61 178.790 178.790 178.708 0.082 18935 289 1 . 1 1 61 61 LEU CA C 61 55.024 55.024 57.562 -2.538 18935 290 1 . 1 1 61 61 LEU CB C 61 40.864 40.864 41.340 -0.476 18935 291 1 . 1 1 61 61 LEU H H 61 7.455 7.455 8.108 -0.653 18935 292 1 . 1 1 62 62 LEU N N 62 119.629 119.629 118.211 1.418 18935 293 1 . 1 1 62 62 LEU C C 62 177.762 177.762 177.753 0.009 18935 294 1 . 1 1 62 62 LEU CA C 62 58.198 58.198 57.811 0.387 18935 295 1 . 1 1 62 62 LEU CB C 62 40.731 40.731 41.904 -1.173 18935 296 1 . 1 1 62 62 LEU H H 62 7.714 7.714 7.512 0.202 18935 297 1 . 1 1 63 63 LYS N N 63 112.921 112.921 115.794 -2.873 18935 298 1 . 1 1 63 63 LYS C C 63 175.386 175.386 177.607 -2.221 18935 299 1 . 1 1 63 63 LYS CA C 63 57.356 57.356 57.081 0.275 18935 300 1 . 1 1 63 63 LYS CB C 63 30.963 30.963 32.699 -1.736 18935 301 1 . 1 1 63 63 LYS H H 63 7.751 7.751 8.196 -0.445 18935 302 1 . 1 1 64 64 HIS N N 64 112.468 112.468 117.338 -4.870 18935 303 1 . 1 1 64 64 HIS C C 64 176.081 176.081 176.427 -0.346 18935 304 1 . 1 1 64 64 HIS CA C 64 55.769 55.769 57.996 -2.227 18935 305 1 . 1 1 64 64 HIS CB C 64 32.370 32.370 31.278 1.092 18935 306 1 . 1 1 64 64 HIS H H 64 7.697 7.697 7.720 -0.023 18935 307 1 . 1 1 65 65 VAL N N 65 117.499 117.499 117.803 -0.304 18935 308 1 . 1 1 65 65 VAL C C 65 174.301 174.301 176.658 -2.357 18935 309 1 . 1 1 65 65 VAL CA C 65 66.330 66.330 63.858 2.472 18935 310 1 . 1 1 65 65 VAL CB C 65 29.360 29.360 31.233 -1.873 18935 311 1 . 1 1 65 65 VAL H H 65 6.917 6.917 7.232 -0.315 18935 312 1 . 1 1 66 66 LEU N N 66 113.873 113.873 119.245 -5.372 18935 313 1 . 1 1 66 66 LEU CA C 66 57.850 57.850 57.814 0.036 18935 314 1 . 1 1 66 66 LEU CB C 66 36.058 36.058 39.410 -3.352 18935 315 1 . 1 1 66 66 LEU H H 66 9.102 9.102 7.889 1.213 18935 316 1 . 1 1 68 68 ASN N N 68 110.792 110.792 116.637 -5.845 18935 317 1 . 1 1 68 68 ASN C C 68 174.877 174.877 173.403 1.474 18935 318 1 . 1 1 68 68 ASN CA C 68 50.815 50.815 52.661 -1.846 18935 319 1 . 1 1 68 68 ASN CB C 68 40.311 40.311 41.027 -0.716 18935 320 1 . 1 1 68 68 ASN H H 68 7.234 7.234 8.354 -1.120 18935 321 1 . 1 1 69 69 ILE N N 69 122.348 122.348 124.699 -2.351 18935 322 1 . 1 1 69 69 ILE CA C 69 59.912 59.912 60.261 -0.349 18935 323 1 . 1 1 69 69 ILE CB C 69 38.038 38.038 40.322 -2.283 18935 324 1 . 1 1 69 69 ILE H H 69 7.428 7.428 8.591 -1.163 18935 325 1 . 1 1 70 70 ARG N N 70 125.701 125.701 126.237 -0.536 18935 326 1 . 1 1 70 70 ARG C C 70 174.596 174.596 173.516 1.080 18935 327 1 . 1 1 70 70 ARG CA C 70 53.161 53.161 54.625 -1.464 18935 328 1 . 1 1 70 70 ARG CB C 70 32.453 32.453 32.508 -0.055 18935 329 1 . 1 1 70 70 ARG H H 70 9.083 9.083 8.848 0.235 18935 330 1 . 1 1 71 71 ILE N N 71 118.496 118.496 119.211 -0.715 18935 331 1 . 1 1 71 71 ILE C C 71 175.625 175.625 175.749 -0.124 18935 332 1 . 1 1 71 71 ILE CA C 71 59.776 59.776 59.725 0.051 18935 333 1 . 1 1 71 71 ILE CB C 71 37.967 37.967 40.263 -2.296 18935 334 1 . 1 1 71 71 ILE H H 71 7.864 7.864 8.007 -0.143 18935 335 1 . 1 1 72 72 LYS N N 72 127.423 127.423 125.688 1.735 18935 336 1 . 1 1 72 72 LYS C C 72 177.659 177.659 176.842 0.817 18935 337 1 . 1 1 72 72 LYS CA C 72 57.428 57.428 56.068 1.360 18935 338 1 . 1 1 72 72 LYS CB C 72 31.374 31.374 32.595 -1.221 18935 339 1 . 1 1 72 72 LYS H H 72 8.720 8.720 8.712 0.008 18935 340 1 . 1 1 73 73 GLY N N 73 112.604 112.604 112.651 -0.047 18935 341 1 . 1 1 73 73 GLY C C 73 173.729 173.729 173.855 -0.126 18935 342 1 . 1 1 73 73 GLY CA C 73 45.831 45.831 45.331 0.500 18935 343 1 . 1 1 73 73 GLY H H 73 8.930 8.930 8.834 0.096 18935 344 1 . 1 1 74 74 LEU N N 74 119.538 119.538 119.809 -0.271 18935 345 1 . 1 1 74 74 LEU C C 74 175.802 175.802 175.504 0.298 18935 346 1 . 1 1 74 74 LEU CA C 74 53.661 53.661 53.603 0.058 18935 347 1 . 1 1 74 74 LEU CB C 74 44.053 44.053 44.914 -0.861 18935 348 1 . 1 1 74 74 LEU H H 74 7.547 7.547 7.767 -0.220 18935 349 1 . 1 1 75 75 SER N N 75 118.994 118.994 116.946 2.048 18935 350 1 . 1 1 75 75 SER C C 75 173.111 173.111 172.890 0.221 18935 351 1 . 1 1 75 75 SER CA C 75 57.696 57.696 57.945 -0.249 18935 352 1 . 1 1 75 75 SER CB C 75 63.073 63.073 63.504 -0.431 18935 353 1 . 1 1 75 75 SER H H 75 9.076 9.076 8.665 0.411 18935 354 1 . 1 1 76 76 PHE N N 76 117.802 117.802 120.804 -3.002 18935 355 1 . 1 1 76 76 PHE C C 76 173.564 173.564 174.601 -1.037 18935 356 1 . 1 1 76 76 PHE CA C 76 55.409 55.409 56.018 -0.609 18935 357 1 . 1 1 76 76 PHE CB C 76 41.843 41.843 42.127 -0.284 18935 358 1 . 1 1 76 76 PHE H H 76 8.119 8.119 7.771 0.348 18935 359 1 . 1 1 77 77 SER N N 77 113.918 113.918 117.499 -3.581 18935 360 1 . 1 1 77 77 SER C C 77 173.194 173.194 173.582 -0.388 18935 361 1 . 1 1 77 77 SER CA C 77 55.999 55.999 57.321 -1.322 18935 362 1 . 1 1 77 77 SER CB C 77 65.218 65.218 65.167 0.051 18935 363 1 . 1 1 77 77 SER H H 77 8.989 8.989 8.581 0.408 18935 364 1 . 1 1 78 78 VAL N N 78 123.662 123.662 126.138 -2.476 18935 365 1 . 1 1 78 78 VAL C C 78 176.057 176.057 176.053 0.004 18935 366 1 . 1 1 78 78 VAL CA C 78 62.091 62.091 62.765 -0.674 18935 367 1 . 1 1 78 78 VAL CB C 78 32.294 32.294 31.752 0.542 18935 368 1 . 1 1 78 78 VAL H H 78 8.995 8.995 8.774 0.221 18935 369 1 . 1 1 79 79 LYS N N 79 129.417 129.417 129.005 0.412 18935 370 1 . 1 1 79 79 LYS C C 79 176.436 176.436 174.684 1.752 18935 371 1 . 1 1 79 79 LYS CA C 79 57.652 57.652 54.458 3.194 18935 372 1 . 1 1 79 79 LYS CB C 79 32.473 32.473 36.028 -3.555 18935 373 1 . 1 1 79 79 LYS H H 79 9.425 9.425 8.934 0.491 18935 374 1 . 1 1 80 80 VAL N N 80 108.616 108.616 121.706 -13.090 18935 375 1 . 1 1 80 80 VAL CA C 80 59.097 59.097 61.628 -2.531 18935 376 1 . 1 1 80 80 VAL CB C 80 34.082 34.082 33.507 0.575 18935 377 1 . 1 1 80 80 VAL H H 80 7.380 7.380 8.471 -1.091 18935 378 1 . 1 1 81 81 CYS N N 81 123.254 123.254 128.302 -5.048 18935 379 1 . 1 1 81 81 CYS C C 81 172.053 172.053 173.957 -1.904 18935 380 1 . 1 1 81 81 CYS CA C 81 59.739 59.739 57.916 1.823 18935 381 1 . 1 1 81 81 CYS CB C 81 27.332 27.332 28.891 -1.559 18935 382 1 . 1 1 81 81 CYS H H 81 9.759 9.759 8.500 1.259 18935 383 1 . 1 1 82 82 GLY N N 82 118.450 118.450 114.612 3.838 18935 384 1 . 1 1 82 82 GLY C C 82 171.814 171.814 174.507 -2.693 18935 385 1 . 1 1 82 82 GLY CA C 82 44.353 44.353 46.067 -1.714 18935 386 1 . 1 1 82 82 GLY H H 82 8.537 8.537 8.432 0.105 18935 387 1 . 1 1 83 83 GLU N N 83 113.964 113.964 121.109 -7.145 18935 388 1 . 1 1 83 83 GLU C C 83 179.320 179.320 177.281 2.039 18935 389 1 . 1 1 83 83 GLU CA C 83 57.675 57.675 57.397 0.278 18935 390 1 . 1 1 83 83 GLU CB C 83 29.907 29.907 29.981 -0.074 18935 391 1 . 1 1 83 83 GLU H H 83 8.473 8.473 8.714 -0.241 18935 392 1 . 1 1 84 84 ARG N N 84 117.544 117.544 117.203 0.342 18935 393 1 . 1 1 84 84 ARG C C 84 177.252 177.252 175.937 1.315 18935 394 1 . 1 1 84 84 ARG CA C 84 54.504 54.504 55.401 -0.897 18935 395 1 . 1 1 84 84 ARG CB C 84 31.546 31.546 31.289 0.257 18935 396 1 . 1 1 84 84 ARG H H 84 9.760 9.760 8.255 1.505 18935 397 1 . 1 1 85 85 LYS N N 85 124.160 124.160 119.960 4.200 18935 398 1 . 1 1 85 85 LYS C C 85 173.379 173.379 175.427 -2.048 18935 399 1 . 1 1 85 85 LYS CA C 85 55.232 55.232 56.188 -0.956 18935 400 1 . 1 1 85 85 LYS CB C 85 34.212 34.212 34.949 -0.737 18935 401 1 . 1 1 85 85 LYS H H 85 8.494 8.494 7.756 0.738 18935 402 1 . 1 1 86 86 CYS N N 86 126.472 126.472 119.318 7.154 18935 403 1 . 1 1 86 86 CYS C C 86 171.935 171.935 172.917 -0.982 18935 404 1 . 1 1 86 86 CYS CA C 86 55.878 55.878 57.720 -1.842 18935 405 1 . 1 1 86 86 CYS CB C 86 30.304 30.304 30.207 0.097 18935 406 1 . 1 1 86 86 CYS H H 86 9.221 9.221 8.557 0.664 18935 407 1 . 1 1 87 87 VAL N N 87 126.426 126.426 124.416 2.010 18935 408 1 . 1 1 87 87 VAL C C 87 173.760 173.760 173.862 -0.102 18935 409 1 . 1 1 87 87 VAL CA C 87 61.333 61.333 60.842 0.492 18935 410 1 . 1 1 87 87 VAL CB C 87 33.338 33.338 34.226 -0.888 18935 411 1 . 1 1 87 87 VAL H H 87 8.623 8.623 8.729 -0.106 18935 412 1 . 1 1 88 88 LEU N N 88 125.701 125.701 127.291 -1.590 18935 413 1 . 1 1 88 88 LEU C C 88 175.424 175.424 175.185 0.239 18935 414 1 . 1 1 88 88 LEU CA C 88 52.085 52.085 53.515 -1.430 18935 415 1 . 1 1 88 88 LEU CB C 88 44.544 44.544 46.509 -1.965 18935 416 1 . 1 1 88 88 LEU H H 88 9.592 9.592 9.035 0.557 18935 417 1 . 1 1 89 89 PHE N N 89 118.314 118.314 123.314 -5.000 18935 418 1 . 1 1 89 89 PHE C C 89 177.068 177.068 175.532 1.536 18935 419 1 . 1 1 89 89 PHE CA C 89 55.875 55.875 56.504 -0.629 18935 420 1 . 1 1 89 89 PHE CB C 89 38.837 38.837 39.369 -0.532 18935 421 1 . 1 1 89 89 PHE H H 89 8.979 8.979 8.787 0.192 18935 422 1 . 1 1 90 90 ILE N N 90 119.039 119.039 120.350 -1.311 18935 423 1 . 1 1 90 90 ILE C C 90 173.692 173.692 174.890 -1.198 18935 424 1 . 1 1 90 90 ILE CA C 90 58.672 58.672 59.700 -1.028 18935 425 1 . 1 1 90 90 ILE CB C 90 40.183 40.183 40.079 0.104 18935 426 1 . 1 1 90 90 ILE H H 90 9.447 9.447 8.361 1.086 18935 427 1 . 1 1 91 91 GLU N N 91 122.801 122.801 124.260 -1.459 18935 428 1 . 1 1 91 91 GLU C C 91 175.565 175.565 174.930 0.635 18935 429 1 . 1 1 91 91 GLU CA C 91 54.465 54.465 55.006 -0.541 18935 430 1 . 1 1 91 91 GLU CB C 91 29.662 29.662 32.684 -3.022 18935 431 1 . 1 1 91 91 GLU H H 91 8.360 8.360 8.421 -0.061 18935 432 1 . 1 1 92 92 TRP N N 92 126.018 126.018 122.410 3.608 18935 433 1 . 1 1 92 92 TRP C C 92 175.070 175.070 175.293 -0.223 18935 434 1 . 1 1 92 92 TRP CA C 92 56.190 56.190 56.621 -0.431 18935 435 1 . 1 1 92 92 TRP CB C 92 30.582 30.582 31.496 -0.914 18935 436 1 . 1 1 92 92 TRP H H 92 9.425 9.425 8.536 0.890 18935 437 1 . 1 1 93 93 GLU N N 93 126.381 126.381 121.308 5.073 18935 438 1 . 1 1 93 93 GLU C C 93 175.637 175.637 175.782 -0.145 18935 439 1 . 1 1 93 93 GLU CA C 93 56.769 56.769 57.686 -0.917 18935 440 1 . 1 1 93 93 GLU CB C 93 25.944 25.944 28.190 -2.246 18935 441 1 . 1 1 93 93 GLU H H 93 8.914 8.914 9.126 -0.212 18935 442 1 . 1 1 94 94 LYS N N 94 107.891 107.891 111.643 -3.752 18935 443 1 . 1 1 94 94 LYS C C 94 175.359 175.359 175.781 -0.422 18935 444 1 . 1 1 94 94 LYS CA C 94 57.429 57.429 57.150 0.280 18935 445 1 . 1 1 94 94 LYS CB C 94 28.642 28.642 30.797 -2.155 18935 446 1 . 1 1 94 94 LYS H H 94 8.634 8.634 8.507 0.127 18935 447 1 . 1 1 95 95 LYS N N 95 120.490 120.490 118.797 1.693 18935 448 1 . 1 1 95 95 LYS C C 95 174.369 174.369 174.293 0.076 18935 449 1 . 1 1 95 95 LYS CA C 95 54.353 54.353 54.813 -0.460 18935 450 1 . 1 1 95 95 LYS CB C 95 34.463 34.463 35.581 -1.118 18935 451 1 . 1 1 95 95 LYS H H 95 7.924 7.924 7.657 0.267 18935 452 1 . 1 1 96 96 THR N N 96 115.278 115.278 113.248 2.029 18935 453 1 . 1 1 96 96 THR C C 96 174.317 174.317 173.307 1.010 18935 454 1 . 1 1 96 96 THR CA C 96 61.203 61.203 60.481 0.722 18935 455 1 . 1 1 96 96 THR CB C 96 69.348 69.348 70.027 -0.679 18935 456 1 . 1 1 96 96 THR H H 96 7.967 7.967 7.842 0.125 18935 457 1 . 1 1 97 97 TYR N N 97 123.254 123.254 125.033 -1.779 18935 458 1 . 1 1 97 97 TYR C C 97 173.320 173.320 174.596 -1.276 18935 459 1 . 1 1 97 97 TYR CA C 97 55.884 55.884 56.013 -0.129 18935 460 1 . 1 1 97 97 TYR CB C 97 41.136 41.136 41.406 -0.270 18935 461 1 . 1 1 97 97 TYR H H 97 9.232 9.232 8.970 0.262 18935 462 1 . 1 1 98 98 GLN N N 98 122.574 122.574 118.774 3.799 18935 463 1 . 1 1 98 98 GLN C C 98 172.781 172.781 174.432 -1.651 18935 464 1 . 1 1 98 98 GLN CA C 98 55.171 55.171 55.050 0.121 18935 465 1 . 1 1 98 98 GLN CB C 98 28.399 28.399 30.916 -2.517 18935 466 1 . 1 1 98 98 GLN H H 98 9.000 9.000 8.831 0.169 18935 467 1 . 1 1 99 99 LEU N N 99 130.218 130.218 125.113 5.105 18935 468 1 . 1 1 99 99 LEU C C 99 172.806 172.806 174.405 -1.600 18935 469 1 . 1 1 99 99 LEU CA C 99 52.050 52.050 53.444 -1.394 18935 470 1 . 1 1 99 99 LEU CB C 99 44.752 44.752 45.414 -0.662 18935 471 1 . 1 1 99 99 LEU H H 99 9.246 9.246 9.067 0.179 18935 472 1 . 1 1 100 100 ASP N N 100 124.931 124.931 126.832 -1.901 18935 473 1 . 1 1 100 100 ASP C C 100 172.626 172.626 174.431 -1.805 18935 474 1 . 1 1 100 100 ASP CA C 100 50.430 50.430 53.296 -2.866 18935 475 1 . 1 1 100 100 ASP CB C 100 37.328 37.328 43.039 -5.711 18935 476 1 . 1 1 100 100 ASP H H 100 9.253 9.253 8.460 0.793 18935 477 1 . 1 1 101 101 LEU N N 101 119.402 119.402 121.099 -1.697 18935 478 1 . 1 1 101 101 LEU C C 101 173.869 173.869 174.713 -0.844 18935 479 1 . 1 1 101 101 LEU CA C 101 51.655 51.655 53.038 -1.383 18935 480 1 . 1 1 101 101 LEU CB C 101 44.166 44.166 43.867 0.299 18935 481 1 . 1 1 101 101 LEU H H 101 8.726 8.726 7.789 0.937 18935 482 1 . 1 1 102 102 PHE N N 102 117.952 117.952 118.676 -0.724 18935 483 1 . 1 1 102 102 PHE C C 102 175.853 175.853 175.371 0.482 18935 484 1 . 1 1 102 102 PHE CA C 102 53.282 53.282 55.802 -2.520 18935 485 1 . 1 1 102 102 PHE CB C 102 41.824 41.824 40.884 0.940 18935 486 1 . 1 1 102 102 PHE H H 102 8.236 8.236 8.740 -0.504 18935 487 1 . 1 1 103 103 THR N N 103 106.853 106.853 118.611 -11.758 18935 488 1 . 1 1 103 103 THR C C 103 175.154 175.154 174.021 1.133 18935 489 1 . 1 1 103 103 THR CA C 103 57.685 57.685 60.779 -3.094 18935 490 1 . 1 1 103 103 THR CB C 103 71.037 71.037 69.262 1.775 18935 491 1 . 1 1 103 103 THR H H 103 7.917 7.917 8.582 -0.665 18935 492 1 . 1 1 104 104 ALA N N 104 122.348 122.348 128.617 -6.269 18935 493 1 . 1 1 104 104 ALA C C 104 175.947 175.947 174.857 1.090 18935 494 1 . 1 1 104 104 ALA CA C 104 49.807 49.807 50.369 -0.562 18935 495 1 . 1 1 104 104 ALA CB C 104 22.428 22.428 22.418 0.010 18935 496 1 . 1 1 104 104 ALA H H 104 8.930 8.930 8.730 0.200 18935 497 1 . 1 1 105 105 LEU N N 105 119.855 119.855 119.173 0.682 18935 498 1 . 1 1 105 105 LEU C C 105 179.628 179.628 178.945 0.683 18935 499 1 . 1 1 105 105 LEU CA C 105 53.123 53.123 54.087 -0.964 18935 500 1 . 1 1 105 105 LEU CB C 105 41.334 41.334 43.318 -1.984 18935 501 1 . 1 1 105 105 LEU H H 105 8.316 8.316 9.141 -0.825 18935 502 1 . 1 1 106 106 ALA N N 106 123.662 123.662 124.481 -0.819 18935 503 1 . 1 1 106 106 ALA C C 106 181.056 181.056 178.471 2.585 18935 504 1 . 1 1 106 106 ALA CA C 106 56.349 56.349 55.162 1.187 18935 505 1 . 1 1 106 106 ALA CB C 106 17.315 17.315 18.541 -1.226 18935 506 1 . 1 1 106 106 ALA H H 106 8.306 8.306 8.407 -0.101 18935 507 1 . 1 1 107 107 GLU N N 107 114.825 114.825 114.940 -0.115 18935 508 1 . 1 1 107 107 GLU C C 107 177.854 177.854 176.866 0.988 18935 509 1 . 1 1 107 107 GLU CA C 107 58.386 58.386 57.893 0.493 18935 510 1 . 1 1 107 107 GLU CB C 107 27.844 27.844 28.834 -0.990 18935 511 1 . 1 1 107 107 GLU H H 107 9.754 9.754 8.705 1.049 18935 512 1 . 1 1 108 108 GLU N N 108 115.097 115.097 118.342 -3.245 18935 513 1 . 1 1 108 108 GLU C C 108 178.001 178.001 177.426 0.574 18935 514 1 . 1 1 108 108 GLU CA C 108 54.926 54.926 56.376 -1.450 18935 515 1 . 1 1 108 108 GLU CB C 108 30.001 30.001 29.653 0.348 18935 516 1 . 1 1 108 108 GLU H H 108 7.859 7.859 7.714 0.145 18935 517 1 . 1 1 109 109 LYS N N 109 118.360 118.360 121.677 -3.317 18935 518 1 . 1 1 109 109 LYS C C 109 172.691 172.691 176.276 -3.585 18935 519 1 . 1 1 109 109 LYS CA C 109 62.902 62.902 61.985 0.917 18935 520 1 . 1 1 109 109 LYS CB C 109 30.541 30.541 30.672 -0.131 18935 521 1 . 1 1 109 109 LYS H H 109 7.660 7.660 7.446 0.214 18935 522 1 . 1 1 111 111 TYR N N 111 114.054 114.054 118.389 -4.335 18935 523 1 . 1 1 111 111 TYR C C 111 179.764 179.764 177.985 1.779 18935 524 1 . 1 1 111 111 TYR CA C 111 58.998 58.998 60.607 -1.609 18935 525 1 . 1 1 111 111 TYR CB C 111 35.956 35.956 37.255 -1.300 18935 526 1 . 1 1 111 111 TYR H H 111 6.583 6.583 8.216 -1.633 18935 527 1 . 1 1 112 112 ALA N N 112 124.749 124.749 122.364 2.385 18935 528 1 . 1 1 112 112 ALA C C 112 179.430 179.430 179.450 -0.020 18935 529 1 . 1 1 112 112 ALA CA C 112 54.969 54.969 54.838 0.131 18935 530 1 . 1 1 112 112 ALA CB C 112 18.812 18.812 18.845 -0.033 18935 531 1 . 1 1 112 112 ALA H H 112 8.753 8.753 8.636 0.117 18935 532 1 . 1 1 113 113 ILE N N 113 119.130 119.130 119.906 -0.776 18935 533 1 . 1 1 113 113 ILE C C 113 178.646 178.646 178.322 0.324 18935 534 1 . 1 1 113 113 ILE CA C 113 66.401 66.401 64.058 2.343 18935 535 1 . 1 1 113 113 ILE CB C 113 37.237 37.237 36.628 0.609 18935 536 1 . 1 1 113 113 ILE H H 113 8.946 8.946 8.460 0.486 18935 537 1 . 1 1 114 114 PHE N N 114 121.758 121.758 120.356 1.402 18935 538 1 . 1 1 114 114 PHE C C 114 177.954 177.954 176.898 1.056 18935 539 1 . 1 1 114 114 PHE CA C 114 59.777 59.777 61.226 -1.449 18935 540 1 . 1 1 114 114 PHE CB C 114 39.064 39.064 38.489 0.575 18935 541 1 . 1 1 114 114 PHE H H 114 7.940 7.940 8.317 -0.377 18935 542 1 . 1 1 115 115 HIS N N 115 116.547 116.547 118.728 -2.181 18935 543 1 . 1 1 115 115 HIS C C 115 176.161 176.161 176.510 -0.349 18935 544 1 . 1 1 115 115 HIS CA C 115 59.119 59.119 59.059 0.060 18935 545 1 . 1 1 115 115 HIS CB C 115 31.067 31.067 29.927 1.140 18935 546 1 . 1 1 115 115 HIS H H 115 7.767 7.767 7.883 -0.116 18935 547 1 . 1 1 116 116 PHE N N 116 109.387 109.387 114.981 -5.594 18935 548 1 . 1 1 116 116 PHE C C 116 177.282 177.282 176.710 0.572 18935 549 1 . 1 1 116 116 PHE CA C 116 61.434 61.434 59.787 1.647 18935 550 1 . 1 1 116 116 PHE CB C 116 37.255 37.255 39.371 -2.116 18935 551 1 . 1 1 116 116 PHE H H 116 8.989 8.989 8.234 0.755 18935 552 1 . 1 1 117 117 THR N N 117 116.864 116.864 114.007 2.857 18935 553 1 . 1 1 117 117 THR C C 117 172.889 172.889 174.896 -2.007 18935 554 1 . 1 1 117 117 THR CA C 117 66.997 66.997 64.478 2.519 18935 555 1 . 1 1 117 117 THR CB C 117 67.948 67.948 69.312 -1.364 18935 556 1 . 1 1 117 117 THR H H 117 7.988 7.988 7.953 0.035 18935 557 1 . 1 1 118 118 GLY N N 118 103.320 103.320 108.910 -5.590 18935 558 1 . 1 1 118 118 GLY C C 118 176.912 176.912 171.600 5.312 18935 559 1 . 1 1 118 118 GLY CA C 118 44.182 44.182 43.183 0.999 18935 560 1 . 1 1 118 118 GLY H H 118 6.550 6.550 7.373 -0.823 18935 561 1 . 1 1 120 120 VAL N N 120 120.671 120.671 125.068 -4.397 18935 562 1 . 1 1 120 120 VAL C C 120 176.283 176.283 177.234 -0.951 18935 563 1 . 1 1 120 120 VAL CA C 120 66.940 66.940 65.562 1.378 18935 564 1 . 1 1 120 120 VAL CB C 120 29.852 29.852 31.906 -2.054 18935 565 1 . 1 1 120 120 VAL H H 120 8.408 8.408 8.428 -0.020 18935 566 1 . 1 1 121 121 SER N N 121 111.789 111.789 115.055 -3.266 18935 567 1 . 1 1 121 121 SER C C 121 175.658 175.658 176.484 -0.826 18935 568 1 . 1 1 121 121 SER CA C 121 60.814 60.814 61.573 -0.759 18935 569 1 . 1 1 121 121 SER CB C 121 60.253 60.253 62.336 -2.083 18935 570 1 . 1 1 121 121 SER H H 121 8.290 8.290 8.277 0.013 18935 571 1 . 1 1 122 122 TYR N N 122 123.254 123.254 122.668 0.586 18935 572 1 . 1 1 122 122 TYR C C 122 174.611 174.611 177.316 -2.705 18935 573 1 . 1 1 122 122 TYR CA C 122 58.546 58.546 60.873 -2.327 18935 574 1 . 1 1 122 122 TYR CB C 122 38.139 38.139 38.283 -0.144 18935 575 1 . 1 1 122 122 TYR H H 122 6.303 6.303 7.705 -1.403 18935 576 1 . 1 1 123 123 LEU N N 123 114.825 114.825 119.449 -4.624 18935 577 1 . 1 1 123 123 LEU C C 123 178.891 178.891 179.061 -0.170 18935 578 1 . 1 1 123 123 LEU CA C 123 56.779 56.779 57.849 -1.070 18935 579 1 . 1 1 123 123 LEU CB C 123 40.638 40.638 40.986 -0.348 18935 580 1 . 1 1 123 123 LEU H H 123 6.965 6.965 7.580 -0.615 18935 581 1 . 1 1 124 124 ILE N N 124 114.915 114.915 118.539 -3.624 18935 582 1 . 1 1 124 124 ILE C C 124 177.187 177.187 177.849 -0.662 18935 583 1 . 1 1 124 124 ILE CA C 124 64.431 64.431 65.095 -0.664 18935 584 1 . 1 1 124 124 ILE CB C 124 36.555 36.555 37.129 -0.575 18935 585 1 . 1 1 124 124 ILE H H 124 7.531 7.531 7.823 -0.292 18935 586 1 . 1 1 125 125 ARG N N 125 115.278 115.278 119.025 -3.747 18935 587 1 . 1 1 125 125 ARG C C 125 178.473 178.473 178.535 -0.061 18935 588 1 . 1 1 125 125 ARG CA C 125 58.459 58.459 58.728 -0.269 18935 589 1 . 1 1 125 125 ARG CB C 125 27.079 27.079 29.386 -2.307 18935 590 1 . 1 1 125 125 ARG H H 125 6.809 6.809 7.693 -0.884 18935 591 1 . 1 1 126 126 ILE N N 126 124.160 124.160 118.819 5.341 18935 592 1 . 1 1 126 126 ILE C C 126 178.172 178.172 177.322 0.850 18935 593 1 . 1 1 126 126 ILE CA C 126 60.927 60.927 62.620 -1.693 18935 594 1 . 1 1 126 126 ILE CB C 126 34.466 34.466 37.701 -3.235 18935 595 1 . 1 1 126 126 ILE H H 126 7.408 7.408 7.493 -0.085 18935 596 1 . 1 1 127 127 ARG N N 127 117.136 117.136 121.048 -3.912 18935 597 1 . 1 1 127 127 ARG C C 127 179.227 179.227 178.461 0.766 18935 598 1 . 1 1 127 127 ARG CA C 127 60.216 60.216 59.508 0.708 18935 599 1 . 1 1 127 127 ARG CB C 127 27.789 27.789 29.583 -1.794 18935 600 1 . 1 1 127 127 ARG H H 127 8.230 8.230 8.087 0.143 18935 601 1 . 1 1 128 128 ALA N N 128 121.305 121.305 120.627 0.678 18935 602 1 . 1 1 128 128 ALA C C 128 179.933 179.933 178.929 1.004 18935 603 1 . 1 1 128 128 ALA CA C 128 54.706 54.706 55.003 -0.297 18935 604 1 . 1 1 128 128 ALA CB C 128 18.338 18.338 18.207 0.131 18935 605 1 . 1 1 128 128 ALA H H 128 8.666 8.666 8.096 0.570 18935 606 1 . 1 1 129 129 ALA N N 129 120.943 120.943 121.426 -0.483 18935 607 1 . 1 1 129 129 ALA C C 129 181.336 181.336 179.766 1.570 18935 608 1 . 1 1 129 129 ALA CA C 129 54.708 54.708 54.661 0.047 18935 609 1 . 1 1 129 129 ALA CB C 129 16.860 16.860 18.373 -1.513 18935 610 1 . 1 1 129 129 ALA H H 129 7.837 7.837 7.565 0.272 18935 611 1 . 1 1 130 130 LEU N N 130 117.726 117.726 118.349 -0.623 18935 612 1 . 1 1 130 130 LEU C C 130 179.432 179.432 179.543 -0.111 18935 613 1 . 1 1 130 130 LEU CA C 130 57.176 57.176 57.896 -0.720 18935 614 1 . 1 1 130 130 LEU CB C 130 40.566 40.566 41.829 -1.263 18935 615 1 . 1 1 130 130 LEU H H 130 8.114 8.114 8.122 -0.008 18935 616 1 . 1 1 131 131 LYS N N 131 124.115 124.115 120.956 3.159 18935 617 1 . 1 1 131 131 LYS C C 131 181.452 181.452 179.384 2.068 18935 618 1 . 1 1 131 131 LYS CA C 131 58.886 58.886 58.874 0.012 18935 619 1 . 1 1 131 131 LYS CB C 131 32.198 32.198 31.859 0.339 18935 620 1 . 1 1 131 131 LYS H H 131 8.849 8.849 8.056 0.793 18935 621 1 . 1 1 132 132 LYS N N 132 119.447 119.447 118.225 1.222 18935 622 1 . 1 1 132 132 LYS C C 132 177.607 177.607 177.910 -0.303 18935 623 1 . 1 1 132 132 LYS CA C 132 57.952 57.952 58.390 -0.438 18935 624 1 . 1 1 132 132 LYS CB C 132 31.425 31.425 31.835 -0.410 18935 625 1 . 1 1 132 132 LYS H H 132 7.778 7.778 8.060 -0.282 18935 626 1 . 1 1 133 133 LYS N N 133 116.638 116.638 115.769 0.869 18935 627 1 . 1 1 133 133 LYS C C 133 174.681 174.681 175.832 -1.151 18935 628 1 . 1 1 133 133 LYS CA C 133 55.078 55.078 55.441 -0.363 18935 629 1 . 1 1 133 133 LYS CB C 133 31.640 31.640 32.596 -0.956 18935 630 1 . 1 1 133 133 LYS H H 133 7.617 7.617 7.701 -0.084 18935 631 1 . 1 1 134 134 ASN N N 134 110.792 110.792 116.447 -5.655 18935 632 1 . 1 1 134 134 ASN C C 134 174.034 174.034 173.282 0.751 18935 633 1 . 1 1 134 134 ASN CA C 134 54.615 54.615 54.065 0.550 18935 634 1 . 1 1 134 134 ASN CB C 134 36.052 36.052 37.089 -1.037 18935 635 1 . 1 1 134 134 ASN H H 134 8.123 8.123 8.432 -0.309 18935 636 1 . 1 1 135 135 TYR N N 135 115.867 115.867 117.054 -1.187 18935 637 1 . 1 1 135 135 TYR C C 135 175.122 175.122 174.145 0.977 18935 638 1 . 1 1 135 135 TYR CA C 135 56.752 56.752 56.887 -0.135 18935 639 1 . 1 1 135 135 TYR CB C 135 41.916 41.916 43.210 -1.294 18935 640 1 . 1 1 135 135 TYR H H 135 8.133 8.133 7.843 0.290 18935 641 1 . 1 1 136 136 LYS N N 136 119.870 119.870 122.875 -3.005 18935 642 1 . 1 1 136 136 LYS C C 136 174.324 174.324 174.558 -0.234 18935 643 1 . 1 1 136 136 LYS CA C 136 55.181 55.181 54.916 0.265 18935 644 1 . 1 1 136 136 LYS CB C 136 34.073 34.073 35.713 -1.640 18935 645 1 . 1 1 136 136 LYS H H 136 9.234 9.234 8.814 0.420 18935 646 1 . 1 1 137 137 LEU N N 137 129.708 129.708 126.992 2.716 18935 647 1 . 1 1 137 137 LEU C C 137 173.798 173.798 174.984 -1.186 18935 648 1 . 1 1 137 137 LEU CA C 137 52.834 52.834 54.676 -1.842 18935 649 1 . 1 1 137 137 LEU CB C 137 44.983 44.983 43.227 1.756 18935 650 1 . 1 1 137 137 LEU H H 137 8.959 8.959 8.633 0.326 18935 651 1 . 1 1 140 140 TYR N N 140 120.580 120.580 113.396 7.184 18935 652 1 . 1 1 140 140 TYR C C 140 174.705 174.705 175.897 -1.192 18935 653 1 . 1 1 140 140 TYR CA C 140 56.452 56.452 57.828 -1.376 18935 654 1 . 1 1 140 140 TYR CB C 140 38.301 38.301 38.835 -0.534 18935 655 1 . 1 1 140 140 TYR H H 140 8.962 8.962 7.368 1.594 18935 656 1 . 1 1 141 141 GLY N N 141 104.986 104.986 105.657 -0.671 18935 657 1 . 1 1 141 141 GLY C C 141 181.854 181.854 172.199 9.655 18935 658 1 . 1 1 141 141 GLY CA C 141 44.122 44.122 44.632 -0.510 18935 659 1 . 1 1 141 141 GLY H H 141 7.555 7.555 7.503 0.052 18935 660 1 . 1 1 142 142 LEU N N 142 118.269 118.269 121.501 -3.232 18935 661 1 . 1 1 142 142 LEU C C 142 174.067 174.067 175.780 -1.713 18935 662 1 . 1 1 142 142 LEU CA C 142 52.502 52.502 53.412 -0.910 18935 663 1 . 1 1 142 142 LEU CB C 142 44.542 44.542 43.152 1.390 18935 664 1 . 1 1 142 142 LEU H H 142 7.794 7.794 8.340 -0.546 18935 665 1 . 1 1 143 143 PHE N N 143 122.076 122.076 125.234 -3.158 18935 666 1 . 1 1 143 143 PHE C C 143 175.199 175.199 175.246 -0.047 18935 667 1 . 1 1 143 143 PHE CA C 143 56.032 56.032 57.498 -1.466 18935 668 1 . 1 1 143 143 PHE CB C 143 42.070 42.070 39.932 2.138 18935 669 1 . 1 1 143 143 PHE H H 143 9.522 9.522 9.368 0.154 18935 670 1 . 1 1 144 144 LYS N N 144 121.305 121.305 125.044 -3.739 18935 671 1 . 1 1 144 144 LYS C C 144 176.917 176.917 176.370 0.547 18935 672 1 . 1 1 144 144 LYS CA C 144 55.356 55.356 54.385 0.971 18935 673 1 . 1 1 144 144 LYS CB C 144 33.679 33.679 33.165 0.514 18935 674 1 . 1 1 144 144 LYS H H 144 9.076 9.076 9.100 -0.024 18935 675 1 . 1 1 145 145 ASN N N 145 126.834 126.834 124.624 2.210 18935 676 1 . 1 1 145 145 ASN C C 145 175.070 175.070 175.072 -0.002 18935 677 1 . 1 1 145 145 ASN CA C 145 54.764 54.764 54.252 0.512 18935 678 1 . 1 1 145 145 ASN CB C 145 36.430 36.430 37.822 -1.391 18935 679 1 . 1 1 145 145 ASN H H 145 9.618 9.618 9.164 0.454 18935 680 1 . 1 1 146 146 GLN N N 146 110.112 110.112 110.914 -0.802 18935 681 1 . 1 1 146 146 GLN C C 146 175.198 175.198 175.003 0.195 18935 682 1 . 1 1 146 146 GLN CA C 146 56.896 56.896 57.556 -0.660 18935 683 1 . 1 1 146 146 GLN CB C 146 26.368 26.368 27.730 -1.362 18935 684 1 . 1 1 146 146 GLN H H 146 9.140 9.140 8.784 0.356 18935 685 1 . 1 1 147 147 THR N N 147 116.003 116.003 116.340 -0.337 18935 686 1 . 1 1 147 147 THR C C 147 173.224 173.224 173.386 -0.162 18935 687 1 . 1 1 147 147 THR CA C 147 61.450 61.450 61.594 -0.144 18935 688 1 . 1 1 147 147 THR CB C 147 70.285 70.285 69.879 0.406 18935 689 1 . 1 1 147 147 THR H H 147 8.069 8.069 7.621 0.448 18935 690 1 . 1 1 148 148 LEU N N 148 129.281 129.281 130.141 -0.860 18935 691 1 . 1 1 148 148 LEU C C 148 176.703 176.703 175.478 1.225 18935 692 1 . 1 1 148 148 LEU CA C 148 55.466 55.466 55.253 0.213 18935 693 1 . 1 1 148 148 LEU CB C 148 41.725 41.725 42.782 -1.057 18935 694 1 . 1 1 148 148 LEU H H 148 8.831 8.831 8.837 -0.006 18935 695 1 . 1 1 149 149 VAL N N 149 130.189 130.189 127.333 2.856 18935 696 1 . 1 1 149 149 VAL C C 149 175.012 175.012 173.869 1.143 18935 697 1 . 1 1 149 149 VAL CA C 149 59.269 59.269 58.720 0.549 18935 698 1 . 1 1 149 149 VAL CB C 149 31.456 31.456 35.012 -3.556 18935 699 1 . 1 1 149 149 VAL H H 149 9.243 9.243 8.591 0.652 18935 700 1 . 1 1 151 151 LEU N N 151 123.481 123.481 116.480 7.001 18935 701 1 . 1 1 151 151 LEU C C 151 177.679 177.679 176.917 0.762 18935 702 1 . 1 1 151 151 LEU CA C 151 53.997 53.997 53.876 0.121 18935 703 1 . 1 1 151 151 LEU CB C 151 43.619 43.619 42.694 0.925 18935 704 1 . 1 1 151 151 LEU H H 151 8.080 8.080 8.107 -0.027 18935 705 1 . 1 1 152 152 LYS N N 152 126.381 126.381 121.517 4.864 18935 706 1 . 1 1 152 152 LYS C C 152 175.115 175.115 175.225 -0.110 18935 707 1 . 1 1 152 152 LYS CA C 152 54.596 54.596 56.243 -1.647 18935 708 1 . 1 1 152 152 LYS CB C 152 29.065 29.065 32.035 -2.970 18935 709 1 . 1 1 152 152 LYS H H 152 9.112 9.112 8.758 0.354 18935 710 1 . 1 1 153 153 ILE N N 153 113.737 113.737 116.004 -2.267 18935 711 1 . 1 1 153 153 ILE C C 153 175.748 175.748 173.787 1.961 18935 712 1 . 1 1 153 153 ILE CA C 153 58.389 58.389 59.385 -0.996 18935 713 1 . 1 1 153 153 ILE CB C 153 41.803 41.803 40.755 1.048 18935 714 1 . 1 1 153 153 ILE H H 153 7.304 7.304 7.496 -0.192 18935 715 1 . 1 1 154 154 THR N N 154 110.656 110.656 113.327 -2.671 18935 716 1 . 1 1 154 154 THR C C 154 174.864 174.864 173.508 1.356 18935 717 1 . 1 1 154 154 THR CA C 154 62.141 62.141 62.061 0.080 18935 718 1 . 1 1 154 154 THR CB C 154 70.413 70.413 70.343 0.071 18935 719 1 . 1 1 154 154 THR H H 154 9.382 9.382 8.678 0.704 18935 720 1 . 1 1 155 155 THR N N 155 110.746 110.746 116.743 -5.997 18935 721 1 . 1 1 155 155 THR C C 155 174.718 174.718 174.922 -0.204 18935 722 1 . 1 1 155 155 THR CA C 155 58.785 58.785 60.880 -2.095 18935 723 1 . 1 1 155 155 THR CB C 155 72.277 72.277 71.282 0.995 18935 724 1 . 1 1 155 155 THR H H 155 7.746 7.746 7.816 -0.070 18935 725 1 . 1 1 156 156 GLU N N 156 122.302 122.302 124.095 -1.793 18935 726 1 . 1 1 156 156 GLU C C 156 177.289 177.289 178.130 -0.841 18935 727 1 . 1 1 156 156 GLU CA C 156 58.824 58.824 60.872 -2.048 18935 728 1 . 1 1 156 156 GLU CB C 156 28.381 28.381 29.206 -0.825 18935 729 1 . 1 1 156 156 GLU H H 156 9.490 9.490 9.051 0.439 18935 730 1 . 1 1 157 157 LYS N N 157 118.905 118.905 117.510 1.395 18935 731 1 . 1 1 157 157 LYS C C 157 178.241 178.241 179.053 -0.812 18935 732 1 . 1 1 157 157 LYS CA C 157 59.765 59.765 58.496 1.269 18935 733 1 . 1 1 157 157 LYS CB C 157 31.278 31.278 31.771 -0.493 18935 734 1 . 1 1 157 157 LYS H H 157 8.329 8.329 8.433 -0.104 18935 735 1 . 1 1 158 158 GLU N N 158 116.230 116.230 120.540 -4.310 18935 736 1 . 1 1 158 158 GLU C C 158 178.988 178.988 178.608 0.380 18935 737 1 . 1 1 158 158 GLU CA C 158 58.256 58.256 58.851 -0.595 18935 738 1 . 1 1 158 158 GLU CB C 158 29.058 29.058 29.256 -0.198 18935 739 1 . 1 1 158 158 GLU H H 158 7.611 7.611 7.805 -0.194 18935 740 1 . 1 1 159 159 LEU N N 159 118.978 118.978 121.172 -2.194 18935 741 1 . 1 1 159 159 LEU C C 159 176.347 176.347 178.415 -2.068 18935 742 1 . 1 1 159 159 LEU CA C 159 53.239 53.239 58.376 -5.137 18935 743 1 . 1 1 159 159 LEU CB C 159 39.543 39.543 41.860 -2.317 18935 744 1 . 1 1 159 159 LEU H H 159 7.704 7.704 8.238 -0.534 18935 745 1 . 1 1 160 160 ILE N N 160 117.227 117.227 114.801 2.426 18935 746 1 . 1 1 160 160 ILE C C 160 177.219 177.219 177.447 -0.228 18935 747 1 . 1 1 160 160 ILE CA C 160 65.615 65.615 65.032 0.583 18935 748 1 . 1 1 160 160 ILE CB C 160 37.557 37.557 37.119 0.438 18935 749 1 . 1 1 160 160 ILE H H 160 7.886 7.886 7.572 0.314 18935 750 1 . 1 1 161 161 LYS N N 161 115.912 115.912 119.666 -3.754 18935 751 1 . 1 1 161 161 LYS C C 161 180.990 180.990 178.980 2.010 18935 752 1 . 1 1 161 161 LYS CA C 161 58.631 58.631 58.560 0.071 18935 753 1 . 1 1 161 161 LYS CB C 161 30.748 30.748 31.985 -1.237 18935 754 1 . 1 1 161 161 LYS H H 161 7.536 7.536 7.644 -0.108 18935 755 1 . 1 1 162 162 GLU N N 162 120.852 120.852 120.047 0.805 18935 756 1 . 1 1 162 162 GLU C C 162 178.793 178.793 178.104 0.689 18935 757 1 . 1 1 162 162 GLU CA C 162 57.982 57.982 58.551 -0.569 18935 758 1 . 1 1 162 162 GLU CB C 162 27.792 27.792 29.497 -1.705 18935 759 1 . 1 1 162 162 GLU H H 162 8.392 8.392 7.948 0.444 18935 760 1 . 1 1 163 163 LEU N N 163 115.912 115.912 116.752 -0.840 18935 761 1 . 1 1 163 163 LEU C C 163 176.370 176.370 177.209 -0.839 18935 762 1 . 1 1 163 163 LEU CA C 163 55.094 55.094 55.649 -0.555 18935 763 1 . 1 1 163 163 LEU CB C 163 41.174 41.174 42.864 -1.690 18935 764 1 . 1 1 163 163 LEU H H 163 8.031 8.031 7.883 0.148 18935 765 1 . 1 1 164 164 GLY N N 164 103.160 103.160 104.510 -1.350 18935 766 1 . 1 1 164 164 GLY C C 164 174.240 174.240 174.007 0.233 18935 767 1 . 1 1 164 164 GLY CA C 164 44.302 44.302 44.770 -0.468 18935 768 1 . 1 1 164 164 GLY H H 164 7.625 7.625 7.749 -0.124 18935 769 1 . 1 1 165 165 PHE N N 165 117.952 117.952 118.462 -0.510 18935 770 1 . 1 1 165 165 PHE C C 165 174.556 174.556 174.692 -0.136 18935 771 1 . 1 1 165 165 PHE CA C 165 55.465 55.465 56.114 -0.649 18935 772 1 . 1 1 165 165 PHE CB C 165 40.762 40.762 41.717 -0.955 18935 773 1 . 1 1 165 165 PHE H H 165 7.283 7.283 8.127 -0.844 18935 774 1 . 1 1 166 166 THR N N 166 118.178 118.178 113.775 4.403 18935 775 1 . 1 1 166 166 THR C C 166 175.306 175.306 173.791 1.515 18935 776 1 . 1 1 166 166 THR CA C 166 63.466 63.466 60.544 2.922 18935 777 1 . 1 1 166 166 THR CB C 166 68.721 68.721 70.691 -1.970 18935 778 1 . 1 1 166 166 THR H H 166 9.678 9.678 8.588 1.090 18935 779 1 . 1 1 167 167 TYR N N 167 128.239 128.239 123.437 4.802 18935 780 1 . 1 1 167 167 TYR C C 167 173.297 173.297 175.367 -2.070 18935 781 1 . 1 1 167 167 TYR CA C 167 60.412 60.412 59.148 1.264 18935 782 1 . 1 1 167 167 TYR CB C 167 36.722 36.722 39.048 -2.326 18935 783 1 . 1 1 167 167 TYR H H 167 9.264 9.264 8.616 0.648 18935 784 1 . 1 1 168 168 ARG N N 168 126.789 126.789 126.140 0.649 18935 785 1 . 1 1 168 168 ARG C C 168 175.297 175.297 174.709 0.588 18935 786 1 . 1 1 168 168 ARG CA C 168 52.765 52.765 54.269 -1.504 18935 787 1 . 1 1 168 168 ARG CB C 168 31.326 31.326 32.756 -1.430 18935 788 1 . 1 1 168 168 ARG H H 168 7.030 7.030 8.348 -1.318 18935 789 1 . 1 1 169 169 ILE N N 169 119.221 119.221 117.004 2.217 18935 790 1 . 1 1 169 169 ILE C C 169 174.522 174.522 175.088 -0.566 18935 791 1 . 1 1 169 169 ILE CA C 169 60.279 60.279 57.346 2.933 18935 792 1 . 1 1 169 169 ILE CB C 169 34.647 34.647 39.460 -4.813 18935 793 1 . 1 1 169 169 ILE H H 169 8.349 8.349 8.295 0.054 18935 794 1 . 1 1 171 171 LYS N N 171 111.335 111.335 117.284 -5.949 18935 795 1 . 1 1 171 171 LYS C C 171 176.638 176.638 177.898 -1.260 18935 796 1 . 1 1 171 171 LYS CA C 171 57.538 57.538 59.036 -1.498 18935 797 1 . 1 1 171 171 LYS CB C 171 31.967 31.967 31.708 0.260 18935 798 1 . 1 1 171 171 LYS H H 171 8.198 8.198 8.506 -0.308 18935 799 1 . 1 1 172 172 LYS N N 172 116.411 116.411 116.712 -0.301 18935 800 1 . 1 1 172 172 LYS C C 172 175.331 175.331 175.902 -0.571 18935 801 1 . 1 1 172 172 LYS CA C 172 54.001 54.001 55.145 -1.144 18935 802 1 . 1 1 172 172 LYS CB C 172 31.818 31.818 33.192 -1.374 18935 803 1 . 1 1 172 172 LYS H H 172 7.843 7.843 7.507 0.336 18935 804 1 . 1 1 173 173 ARG N N 173 120.490 120.490 118.187 2.303 18935 805 1 . 1 1 173 173 ARG C C 173 172.830 172.830 174.989 -2.159 18935 806 1 . 1 1 173 173 ARG CA C 173 57.175 57.175 56.283 0.892 18935 807 1 . 1 1 173 173 ARG CB C 173 28.829 28.829 29.368 -0.539 18935 808 1 . 1 1 173 173 ARG H H 173 6.917 6.917 7.660 -0.743 18935 stop_ save_