Browse entries in the PDBbind-CN Database
HEADER 5EDL_COMPLEX COMPND 5EDL_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 197 SER TRP LYS VAL LYS GLU ILE VAL ILE MET SER VAL ILE SEQRES 2 A 197 SER ILE VAL PHE ALA VAL VAL TYR LEU LEU PHE THR HIS SEQRES 3 A 197 PHE GLY ASN VAL LEU ALA GLY MET PHE GLY PRO ILE ALA SEQRES 4 A 197 TYR GLU PRO ILE TYR GLY ILE TRP PHE ILE VAL SER VAL SEQRES 5 A 197 ILE ALA ALA TYR MET ILE ARG LYS PRO GLY ALA ALA LEU SEQRES 6 A 197 VAL SER GLU ILE ILE ALA ALA LEU VAL GLU CYS LEU LEU SEQRES 7 A 197 GLY ASN PRO SER GLY PRO MET VAL ILE VAL ILE GLY ILE SEQRES 8 A 197 VAL GLN GLY LEU GLY ALA GLU ALA VAL PHE LEU ALA THR SEQRES 9 A 197 ARG TRP LYS ALA TYR SER LEU PRO VAL LEU MET LEU ALA SEQRES 10 A 197 GLY MET GLY SER SER VAL ALA SER PHE ILE TYR ASP LEU SEQRES 11 A 197 PHE VAL SER GLY TYR ALA ALA TYR SER PRO GLY TYR LEU SEQRES 12 A 197 LEU ILE MET LEU VAL ILE ARG LEU ILE SER GLY ALA LEU SEQRES 13 A 197 LEU ALA GLY LEU LEU GLY LYS ALA VAL SER ASP SER LEU SEQRES 14 A 197 ALA TYR THR GLY VAL LEU ASN GLY MET ALA LEU GLY LYS SEQRES 15 A 197 GLU LEU LYS LYS LYS ARG LYS ARG ALA SER GLU HIS ALA SEQRES 16 A 197 SER LEU HET VIB A 272 35 ATOM 1 N SER A 3 -3.346 13.054 86.959 1.00 45.86 N ATOM 2 CA SER A 3 -4.644 13.192 86.301 1.00 45.31 C ATOM 3 C SER A 3 -4.808 14.576 85.677 1.00 37.15 C ATOM 4 O SER A 3 -4.764 15.583 86.380 1.00 34.21 O ATOM 5 CB SER A 3 -5.769 12.929 87.295 1.00 45.18 C ATOM 6 OG SER A 3 -7.037 13.074 86.687 1.00 41.03 O ATOM 7 HG SER A 3 -7.745 12.897 87.356 1.00 0.00 H ATOM 8 HN3 SER A 3 -3.262 13.768 87.711 1.00 0.00 H ATOM 9 HN2 SER A 3 -2.588 13.194 86.261 1.00 0.00 H ATOM 10 HN1 SER A 3 -3.267 12.103 87.372 1.00 0.00 H ATOM 11 N TRP A 4 -4.976 14.620 84.356 1.00 32.58 N ATOM 12 CA TRP A 4 -5.120 15.880 83.631 1.00 31.52 C ATOM 13 C TRP A 4 -6.335 16.707 84.060 1.00 34.15 C ATOM 14 O TRP A 4 -7.401 16.169 84.329 1.00 33.72 O ATOM 15 CB TRP A 4 -5.220 15.619 82.121 1.00 30.49 C ATOM 16 CG TRP A 4 -3.931 15.271 81.469 1.00 29.38 C ATOM 17 CD1 TRP A 4 -3.248 14.095 81.573 1.00 29.82 C ATOM 18 CD2 TRP A 4 -3.170 16.102 80.581 1.00 28.03 C ATOM 19 NE1 TRP A 4 -2.100 14.149 80.812 1.00 28.81 N ATOM 20 CE2 TRP A 4 -2.032 15.369 80.193 1.00 27.60 C ATOM 21 CE3 TRP A 4 -3.342 17.402 80.080 1.00 30.50 C ATOM 22 CZ2 TRP A 4 -1.066 15.888 79.318 1.00 27.98 C ATOM 23 CZ3 TRP A 4 -2.385 17.919 79.214 1.00 26.41 C ATOM 24 CH2 TRP A 4 -1.257 17.161 78.845 1.00 27.37 C ATOM 25 HE1 TRP A 4 -1.399 13.386 80.722 1.00 0.00 H ATOM 26 H TRP A 4 -5.006 13.727 83.823 1.00 0.00 H ATOM 27 N LYS A 5 -6.160 18.024 84.079 1.00 34.26 N ATOM 28 CA LYS A 5 -7.251 18.957 84.318 1.00 33.83 C ATOM 29 C LYS A 5 -7.665 19.587 82.998 1.00 37.71 C ATOM 30 O LYS A 5 -6.866 19.663 82.070 1.00 31.96 O ATOM 31 CB LYS A 5 -6.840 20.047 85.307 1.00 34.96 C ATOM 32 CG LYS A 5 -6.276 19.527 86.618 1.00 35.74 C ATOM 33 CD LYS A 5 -5.868 20.672 87.533 1.00 49.11 C ATOM 34 CE LYS A 5 -5.479 20.166 88.918 1.00 50.90 C ATOM 35 NZ LYS A 5 -4.586 21.126 89.619 1.00 54.51 N ATOM 36 HZ1 LYS A 5 -3.718 21.261 89.062 1.00 0.00 H ATOM 37 HZ2 LYS A 5 -5.075 22.037 89.727 1.00 0.00 H ATOM 38 HZ3 LYS A 5 -4.342 20.749 90.557 1.00 0.00 H ATOM 39 H LYS A 5 -5.205 18.403 83.917 1.00 0.00 H ATOM 40 N VAL A 6 -8.912 20.039 82.935 1.00 35.02 N ATOM 41 CA VAL A 6 -9.455 20.679 81.745 1.00 41.57 C ATOM 42 C VAL A 6 -8.550 21.809 81.307 1.00 41.56 C ATOM 43 O VAL A 6 -8.141 21.872 80.147 1.00 39.99 O ATOM 44 CB VAL A 6 -10.877 21.225 81.993 1.00 42.70 C ATOM 45 CG1 VAL A 6 -11.321 22.102 80.831 1.00 40.13 C ATOM 46 CG2 VAL A 6 -11.843 20.079 82.226 1.00 42.93 C ATOM 47 H VAL A 6 -9.525 19.932 83.768 1.00 0.00 H ATOM 48 N LYS A 7 -8.200 22.673 82.256 1.00 41.53 N ATOM 49 CA LYS A 7 -7.341 23.817 81.967 1.00 42.13 C ATOM 50 C LYS A 7 -5.992 23.402 81.368 1.00 43.00 C ATOM 51 O LYS A 7 -5.441 24.117 80.541 1.00 42.82 O ATOM 52 CB LYS A 7 -7.118 24.653 83.227 1.00 44.16 C ATOM 53 CG LYS A 7 -6.417 23.934 84.368 1.00 49.54 C ATOM 54 CD LYS A 7 -6.367 24.818 85.616 1.00 57.47 C ATOM 55 CE LYS A 7 -5.605 24.163 86.755 1.00 60.05 C ATOM 56 NZ LYS A 7 -5.674 24.971 88.028 1.00 62.52 N ATOM 57 HZ1 LYS A 7 -5.263 25.912 87.863 1.00 0.00 H ATOM 58 HZ2 LYS A 7 -6.667 25.072 88.320 1.00 0.00 H ATOM 59 HZ3 LYS A 7 -5.140 24.484 88.776 1.00 0.00 H ATOM 60 H LYS A 7 -8.546 22.530 83.226 1.00 0.00 H ATOM 61 N GLU A 8 -5.464 22.252 81.777 1.00 32.22 N ATOM 62 CA GLU A 8 -4.179 21.794 81.240 1.00 32.74 C ATOM 63 C GLU A 8 -4.340 21.330 79.792 1.00 33.92 C ATOM 64 O GLU A 8 -3.503 21.625 78.939 1.00 32.76 O ATOM 65 CB GLU A 8 -3.598 20.677 82.103 1.00 30.07 C ATOM 66 CG GLU A 8 -3.140 21.153 83.491 1.00 31.61 C ATOM 67 CD GLU A 8 -2.926 20.006 84.463 1.00 31.95 C ATOM 68 OE1 GLU A 8 -3.564 18.949 84.286 1.00 31.49 O ATOM 69 OE2 GLU A 8 -2.114 20.153 85.392 1.00 33.08 O ATOM 70 H GLU A 8 -5.965 21.674 82.482 1.00 0.00 H ATOM 71 N ILE A 9 -5.417 20.599 79.526 1.00 32.44 N ATOM 72 CA ILE A 9 -5.722 20.173 78.171 1.00 32.17 C ATOM 73 C ILE A 9 -5.861 21.430 77.304 1.00 32.62 C ATOM 74 O ILE A 9 -5.265 21.522 76.227 1.00 35.96 O ATOM 75 CB ILE A 9 -6.999 19.285 78.122 1.00 32.17 C ATOM 76 CG1 ILE A 9 -6.742 17.954 78.840 1.00 31.45 C ATOM 77 CG2 ILE A 9 -7.414 19.011 76.687 1.00 35.09 C ATOM 78 CD1 ILE A 9 -7.997 17.117 79.082 1.00 35.44 C ATOM 79 H ILE A 9 -6.053 20.327 80.302 1.00 0.00 H ATOM 80 N VAL A 10 -6.590 22.418 77.807 1.00 32.86 N ATOM 81 CA VAL A 10 -6.782 23.675 77.093 1.00 37.40 C ATOM 82 C VAL A 10 -5.491 24.463 76.855 1.00 34.69 C ATOM 83 O VAL A 10 -5.262 24.936 75.740 1.00 33.14 O ATOM 84 CB VAL A 10 -7.774 24.593 77.829 1.00 45.44 C ATOM 85 CG1 VAL A 10 -7.871 25.937 77.124 1.00 47.01 C ATOM 86 CG2 VAL A 10 -9.147 23.938 77.917 1.00 48.40 C ATOM 87 H VAL A 10 -7.037 22.292 78.737 1.00 0.00 H ATOM 88 N ILE A 11 -4.659 24.626 77.885 1.00 33.63 N ATOM 89 CA ILE A 11 -3.412 25.384 77.722 1.00 33.14 C ATOM 90 C ILE A 11 -2.452 24.669 76.767 1.00 30.99 C ATOM 91 O ILE A 11 -1.712 25.304 76.002 1.00 28.88 O ATOM 92 CB ILE A 11 -2.687 25.622 79.061 1.00 37.88 C ATOM 93 CG1 ILE A 11 -1.383 26.372 78.819 1.00 40.78 C ATOM 94 CG2 ILE A 11 -2.351 24.313 79.741 1.00 41.25 C ATOM 95 CD1 ILE A 11 -0.500 26.440 80.023 1.00 50.37 C ATOM 96 H ILE A 11 -4.895 24.213 78.810 1.00 0.00 H ATOM 97 N MET A 12 -2.464 23.343 76.821 1.00 29.61 N ATOM 98 CA MET A 12 -1.626 22.560 75.934 1.00 29.85 C ATOM 99 C MET A 12 -2.011 22.829 74.478 1.00 30.41 C ATOM 100 O MET A 12 -1.153 22.981 73.618 1.00 28.09 O ATOM 101 CB MET A 12 -1.726 21.068 76.248 1.00 29.55 C ATOM 102 CG MET A 12 -0.864 20.244 75.306 1.00 28.55 C ATOM 103 SD MET A 12 -0.982 18.468 75.481 1.00 39.95 S ATOM 104 CE MET A 12 -2.747 18.182 75.338 1.00 28.41 C ATOM 105 H MET A 12 -3.080 22.861 77.506 1.00 0.00 H ATOM 106 N SER A 13 -3.310 22.919 74.222 1.00 33.44 N ATOM 107 CA SER A 13 -3.812 23.193 72.883 1.00 32.88 C ATOM 108 C SER A 13 -3.420 24.580 72.381 1.00 35.11 C ATOM 109 O SER A 13 -3.021 24.734 71.226 1.00 32.74 O ATOM 110 CB SER A 13 -5.334 23.047 72.850 1.00 33.99 C ATOM 111 OG SER A 13 -5.719 21.714 73.118 1.00 38.04 O ATOM 112 HG SER A 13 -5.393 21.452 74.015 1.00 0.00 H ATOM 113 H SER A 13 -3.988 22.790 75.000 1.00 0.00 H ATOM 114 N VAL A 14 -3.545 25.597 73.229 1.00 35.62 N ATOM 115 CA VAL A 14 -3.189 26.939 72.788 1.00 37.99 C ATOM 116 C VAL A 14 -1.712 27.004 72.410 1.00 30.73 C ATOM 117 O VAL A 14 -1.363 27.592 71.394 1.00 31.91 O ATOM 118 CB VAL A 14 -3.511 28.014 73.851 1.00 45.43 C ATOM 119 CG1 VAL A 14 -4.961 27.893 74.295 1.00 45.30 C ATOM 120 CG2 VAL A 14 -2.571 27.915 75.029 1.00 57.88 C ATOM 121 H VAL A 14 -3.893 25.436 74.196 1.00 0.00 H ATOM 122 N ILE A 15 -0.852 26.383 73.212 1.00 28.52 N ATOM 123 CA ILE A 15 0.576 26.339 72.908 1.00 32.33 C ATOM 124 C ILE A 15 0.853 25.618 71.579 1.00 28.99 C ATOM 125 O ILE A 15 1.685 26.062 70.791 1.00 32.76 O ATOM 126 CB ILE A 15 1.372 25.651 74.035 1.00 35.37 C ATOM 127 CG1 ILE A 15 1.289 26.475 75.322 1.00 53.07 C ATOM 128 CG2 ILE A 15 2.833 25.459 73.627 1.00 28.76 C ATOM 129 CD1 ILE A 15 1.910 27.854 75.206 1.00 60.48 C ATOM 130 H ILE A 15 -1.204 25.919 74.074 1.00 0.00 H ATOM 131 N SER A 16 0.143 24.518 71.337 1.00 29.33 N ATOM 132 CA SER A 16 0.306 23.738 70.109 1.00 32.37 C ATOM 133 C SER A 16 -0.057 24.554 68.887 1.00 29.52 C ATOM 134 O SER A 16 0.624 24.511 67.854 1.00 26.33 O ATOM 135 CB SER A 16 -0.558 22.473 70.149 1.00 31.01 C ATOM 136 OG SER A 16 -0.128 21.606 71.171 1.00 29.10 O ATOM 137 HG SER A 16 -0.196 22.068 72.044 1.00 0.00 H ATOM 138 H SER A 16 -0.551 24.202 72.044 1.00 0.00 H ATOM 139 N ILE A 17 -1.146 25.300 69.025 1.00 26.90 N ATOM 140 CA ILE A 17 -1.669 26.134 67.960 1.00 37.17 C ATOM 141 C ILE A 17 -0.720 27.276 67.631 1.00 37.47 C ATOM 142 O ILE A 17 -0.420 27.520 66.463 1.00 31.97 O ATOM 143 CB ILE A 17 -3.047 26.700 68.334 1.00 31.05 C ATOM 144 CG1 ILE A 17 -4.072 25.567 68.404 1.00 31.01 C ATOM 145 CG2 ILE A 17 -3.485 27.747 67.321 1.00 34.71 C ATOM 146 CD1 ILE A 17 -5.383 25.966 69.031 1.00 33.32 C ATOM 147 H ILE A 17 -1.646 25.286 69.937 1.00 0.00 H ATOM 148 N VAL A 18 -0.258 27.974 68.664 1.00 29.76 N ATOM 149 CA VAL A 18 0.676 29.080 68.485 1.00 32.27 C ATOM 150 C VAL A 18 1.952 28.605 67.803 1.00 30.24 C ATOM 151 O VAL A 18 2.438 29.226 66.851 1.00 29.84 O ATOM 152 CB VAL A 18 1.040 29.740 69.833 1.00 33.62 C ATOM 153 CG1 VAL A 18 2.212 30.687 69.655 1.00 33.85 C ATOM 154 CG2 VAL A 18 -0.171 30.455 70.419 1.00 34.56 C ATOM 155 H VAL A 18 -0.571 27.725 69.624 1.00 0.00 H ATOM 156 N PHE A 19 2.497 27.496 68.281 1.00 27.00 N ATOM 157 CA PHE A 19 3.746 27.009 67.716 1.00 25.68 C ATOM 158 C PHE A 19 3.567 26.319 66.365 1.00 24.85 C ATOM 159 O PHE A 19 4.537 26.154 65.631 1.00 27.45 O ATOM 160 CB PHE A 19 4.457 26.079 68.706 1.00 27.45 C ATOM 161 CG PHE A 19 5.367 26.815 69.626 1.00 30.67 C ATOM 162 CD1 PHE A 19 4.887 27.353 70.809 1.00 26.85 C ATOM 163 CD2 PHE A 19 6.690 27.035 69.277 1.00 28.83 C ATOM 164 CE1 PHE A 19 5.709 28.084 71.632 1.00 35.88 C ATOM 165 CE2 PHE A 19 7.522 27.756 70.111 1.00 32.91 C ATOM 166 CZ PHE A 19 7.035 28.281 71.285 1.00 33.40 C ATOM 167 H PHE A 19 2.035 26.977 69.055 1.00 0.00 H ATOM 168 N ALA A 20 2.335 25.938 66.030 1.00 26.68 N ATOM 169 CA ALA A 20 2.040 25.456 64.684 1.00 25.24 C ATOM 170 C ALA A 20 2.379 26.538 63.662 1.00 26.55 C ATOM 171 O ALA A 20 2.878 26.237 62.577 1.00 26.79 O ATOM 172 CB ALA A 20 0.595 25.043 64.554 1.00 26.22 C ATOM 173 H ALA A 20 1.573 25.985 66.737 1.00 0.00 H ATOM 174 N VAL A 21 2.107 27.790 64.015 1.00 28.29 N ATOM 175 CA VAL A 21 2.451 28.916 63.165 1.00 30.06 C ATOM 176 C VAL A 21 3.968 29.032 62.995 1.00 29.50 C ATOM 177 O VAL A 21 4.459 29.218 61.885 1.00 29.53 O ATOM 178 CB VAL A 21 1.887 30.236 63.723 1.00 32.71 C ATOM 179 CG1 VAL A 21 2.377 31.417 62.892 1.00 34.94 C ATOM 180 CG2 VAL A 21 0.359 30.198 63.747 1.00 34.23 C ATOM 181 H VAL A 21 1.635 27.968 64.924 1.00 0.00 H ATOM 182 N VAL A 22 4.705 28.886 64.092 1.00 28.22 N ATOM 183 CA VAL A 22 6.166 28.899 64.030 1.00 31.16 C ATOM 184 C VAL A 22 6.706 27.750 63.179 1.00 29.85 C ATOM 185 O VAL A 22 7.582 27.950 62.330 1.00 30.24 O ATOM 186 CB VAL A 22 6.800 28.799 65.435 1.00 34.01 C ATOM 187 CG1 VAL A 22 8.339 28.805 65.328 1.00 30.55 C ATOM 188 CG2 VAL A 22 6.301 29.908 66.332 1.00 29.57 C ATOM 189 H VAL A 22 4.234 28.760 65.011 1.00 0.00 H ATOM 190 N TYR A 23 6.196 26.545 63.431 1.00 24.53 N ATOM 191 CA TYR A 23 6.555 25.358 62.657 1.00 23.42 C ATOM 192 C TYR A 23 6.397 25.607 61.147 1.00 24.68 C ATOM 193 O TYR A 23 7.252 25.234 60.353 1.00 24.02 O ATOM 194 CB TYR A 23 5.686 24.155 63.051 1.00 22.62 C ATOM 195 CG TYR A 23 6.016 23.502 64.382 1.00 21.77 C ATOM 196 CD1 TYR A 23 6.885 24.098 65.288 1.00 22.42 C ATOM 197 CD2 TYR A 23 5.462 22.276 64.716 1.00 21.98 C ATOM 198 CE1 TYR A 23 7.192 23.486 66.492 1.00 24.35 C ATOM 199 CE2 TYR A 23 5.760 21.657 65.906 1.00 20.81 C ATOM 200 CZ TYR A 23 6.624 22.262 66.785 1.00 20.93 C ATOM 201 OH TYR A 23 6.906 21.633 67.953 1.00 22.08 O ATOM 202 HH TYR A 23 7.315 20.752 67.762 1.00 0.00 H ATOM 203 H TYR A 23 5.515 26.445 64.210 1.00 0.00 H ATOM 204 N LEU A 24 5.284 26.216 60.763 1.00 25.56 N ATOM 205 CA LEU A 24 4.989 26.422 59.347 1.00 28.00 C ATOM 206 C LEU A 24 6.003 27.369 58.698 1.00 29.99 C ATOM 207 O LEU A 24 6.441 27.149 57.566 1.00 27.96 O ATOM 208 CB LEU A 24 3.570 26.969 59.170 1.00 28.72 C ATOM 209 CG LEU A 24 3.112 27.218 57.727 1.00 30.74 C ATOM 210 CD1 LEU A 24 3.217 25.946 56.889 1.00 30.71 C ATOM 211 CD2 LEU A 24 1.687 27.760 57.706 1.00 34.20 C ATOM 212 H LEU A 24 4.611 26.552 61.481 1.00 0.00 H ATOM 213 N LEU A 25 6.351 28.427 59.421 1.00 28.38 N ATOM 214 CA LEU A 25 7.347 29.389 58.967 1.00 34.99 C ATOM 215 C LEU A 25 8.693 28.701 58.733 1.00 31.17 C ATOM 216 O LEU A 25 9.320 28.874 57.685 1.00 28.89 O ATOM 217 CB LEU A 25 7.496 30.525 59.986 1.00 31.00 C ATOM 218 CG LEU A 25 8.755 31.392 59.897 1.00 38.43 C ATOM 219 CD1 LEU A 25 8.872 32.054 58.536 1.00 44.40 C ATOM 220 CD2 LEU A 25 8.760 32.453 61.004 1.00 35.90 C ATOM 221 H LEU A 25 5.896 28.574 60.345 1.00 0.00 H ATOM 222 N PHE A 26 9.119 27.898 59.704 1.00 29.21 N ATOM 223 CA PHE A 26 10.388 27.181 59.588 1.00 25.89 C ATOM 224 C PHE A 26 10.355 26.109 58.515 1.00 26.75 C ATOM 225 O PHE A 26 11.373 25.825 57.889 1.00 25.39 O ATOM 226 CB PHE A 26 10.783 26.571 60.932 1.00 24.98 C ATOM 227 CG PHE A 26 11.512 27.530 61.818 1.00 27.61 C ATOM 228 CD1 PHE A 26 12.894 27.596 61.795 1.00 31.36 C ATOM 229 CD2 PHE A 26 10.822 28.388 62.647 1.00 29.04 C ATOM 230 CE1 PHE A 26 13.569 28.489 62.591 1.00 31.19 C ATOM 231 CE2 PHE A 26 11.497 29.277 63.451 1.00 34.84 C ATOM 232 CZ PHE A 26 12.877 29.331 63.411 1.00 33.28 C ATOM 233 H PHE A 26 8.540 27.778 60.560 1.00 0.00 H ATOM 234 N THR A 27 9.186 25.524 58.289 1.00 24.92 N ATOM 235 CA THR A 27 9.049 24.567 57.202 1.00 25.01 C ATOM 236 C THR A 27 9.317 25.245 55.857 1.00 26.56 C ATOM 237 O THR A 27 10.016 24.692 54.995 1.00 26.63 O ATOM 238 CB THR A 27 7.663 23.919 57.198 1.00 25.13 C ATOM 239 OG1 THR A 27 7.614 22.949 58.245 1.00 23.98 O ATOM 240 CG2 THR A 27 7.383 23.232 55.857 1.00 28.90 C ATOM 241 HG1 THR A 27 6.722 22.521 58.255 1.00 0.00 H ATOM 242 H THR A 27 8.367 25.750 58.889 1.00 0.00 H ATOM 243 N HIS A 28 8.773 26.444 55.686 1.00 28.75 N ATOM 244 CA HIS A 28 9.006 27.197 54.453 1.00 29.33 C ATOM 245 C HIS A 28 10.509 27.474 54.261 1.00 29.30 C ATOM 246 O HIS A 28 11.045 27.233 53.183 1.00 29.91 O ATOM 247 CB HIS A 28 8.193 28.492 54.462 1.00 37.28 C ATOM 248 CG HIS A 28 6.772 28.305 54.023 1.00 51.24 C ATOM 249 ND1 HIS A 28 6.437 27.889 52.752 1.00 61.61 N ATOM 250 CD2 HIS A 28 5.601 28.467 54.687 1.00 56.07 C ATOM 251 CE1 HIS A 28 5.121 27.804 52.651 1.00 66.80 C ATOM 252 NE2 HIS A 28 4.591 28.149 53.811 1.00 61.99 N ATOM 253 H HIS A 28 8.177 26.851 56.434 1.00 0.00 H ATOM 254 N PHE A 29 11.177 27.947 55.318 1.00 28.92 N ATOM 255 CA PHE A 29 12.647 28.082 55.342 1.00 34.56 C ATOM 256 C PHE A 29 13.368 26.797 54.939 1.00 32.12 C ATOM 257 O PHE A 29 14.303 26.812 54.137 1.00 34.18 O ATOM 258 CB PHE A 29 13.151 28.466 56.742 1.00 36.20 C ATOM 259 CG PHE A 29 12.759 29.842 57.193 1.00 46.23 C ATOM 260 CD1 PHE A 29 12.322 30.795 56.291 1.00 48.96 C ATOM 261 CD2 PHE A 29 12.845 30.186 58.538 1.00 54.79 C ATOM 262 CE1 PHE A 29 11.965 32.071 56.721 1.00 53.25 C ATOM 263 CE2 PHE A 29 12.491 31.457 58.975 1.00 58.67 C ATOM 264 CZ PHE A 29 12.050 32.400 58.064 1.00 55.38 C ATOM 265 H PHE A 29 10.638 28.232 56.160 1.00 0.00 H ATOM 266 N GLY A 30 12.950 25.691 55.542 1.00 31.56 N ATOM 267 CA GLY A 30 13.572 24.409 55.298 1.00 32.18 C ATOM 268 C GLY A 30 13.473 23.961 53.856 1.00 29.46 C ATOM 269 O GLY A 30 14.431 23.411 53.315 1.00 27.92 O ATOM 270 H GLY A 30 12.153 25.748 56.208 1.00 0.00 H ATOM 271 N ASN A 31 12.314 24.186 53.237 1.00 27.79 N ATOM 272 CA ASN A 31 12.142 23.854 51.825 1.00 29.12 C ATOM 273 C ASN A 31 13.089 24.665 50.942 1.00 30.29 C ATOM 274 O ASN A 31 13.706 24.124 50.014 1.00 31.19 O ATOM 275 CB ASN A 31 10.693 24.080 51.383 1.00 29.99 C ATOM 276 CG ASN A 31 9.744 23.024 51.924 1.00 32.65 C ATOM 277 OD1 ASN A 31 10.150 21.901 52.206 1.00 31.72 O ATOM 278 ND2 ASN A 31 8.472 23.379 52.058 1.00 35.92 N ATOM 279 HD22 ASN A 31 8.172 24.342 51.807 1.00 0.00 H ATOM 280 HD21 ASN A 31 7.776 22.694 52.414 1.00 0.00 H ATOM 281 H ASN A 31 11.522 24.603 53.766 1.00 0.00 H ATOM 282 N VAL A 32 13.198 25.960 51.222 1.00 30.63 N ATOM 283 CA VAL A 32 14.067 26.811 50.434 1.00 32.08 C ATOM 284 C VAL A 32 15.517 26.370 50.620 1.00 31.87 C ATOM 285 O VAL A 32 16.274 26.258 49.651 1.00 33.00 O ATOM 286 CB VAL A 32 13.899 28.305 50.802 1.00 35.24 C ATOM 287 CG1 VAL A 32 14.945 29.138 50.094 1.00 34.81 C ATOM 288 CG2 VAL A 32 12.494 28.789 50.429 1.00 34.06 C ATOM 289 H VAL A 32 12.656 26.365 52.012 1.00 0.00 H ATOM 290 N LEU A 33 15.881 26.080 51.866 1.00 30.75 N ATOM 291 CA LEU A 33 17.222 25.621 52.195 1.00 30.99 C ATOM 292 C LEU A 33 17.563 24.290 51.509 1.00 31.19 C ATOM 293 O LEU A 33 18.614 24.170 50.894 1.00 32.43 O ATOM 294 CB LEU A 33 17.383 25.493 53.721 1.00 35.63 C ATOM 295 CG LEU A 33 17.597 26.814 54.474 1.00 30.85 C ATOM 296 CD1 LEU A 33 17.532 26.627 55.986 1.00 30.14 C ATOM 297 CD2 LEU A 33 18.927 27.467 54.061 1.00 33.42 C ATOM 298 H LEU A 33 15.184 26.185 52.631 1.00 0.00 H ATOM 299 N ALA A 34 16.676 23.304 51.629 1.00 30.36 N ATOM 300 CA ALA A 34 16.837 22.004 50.969 1.00 34.02 C ATOM 301 C ALA A 34 17.034 22.145 49.460 1.00 32.71 C ATOM 302 O ALA A 34 17.922 21.514 48.873 1.00 34.03 O ATOM 303 CB ALA A 34 15.634 21.122 51.246 1.00 30.48 C ATOM 304 H ALA A 34 15.832 23.463 52.216 1.00 0.00 H ATOM 305 N GLY A 35 16.181 22.957 48.843 1.00 32.93 N ATOM 306 CA GLY A 35 16.274 23.229 47.420 1.00 34.70 C ATOM 307 C GLY A 35 17.619 23.813 47.021 1.00 35.68 C ATOM 308 O GLY A 35 18.187 23.444 45.990 1.00 50.82 O ATOM 309 H GLY A 35 15.426 23.410 49.396 1.00 0.00 H ATOM 310 N MET A 36 18.135 24.726 47.834 1.00 35.11 N ATOM 311 CA MET A 36 19.405 25.380 47.531 1.00 36.42 C ATOM 312 C MET A 36 20.624 24.492 47.786 1.00 36.94 C ATOM 313 O MET A 36 21.542 24.456 46.970 1.00 38.61 O ATOM 314 CB MET A 36 19.559 26.665 48.350 1.00 36.36 C ATOM 315 CG MET A 36 18.640 27.792 47.930 1.00 43.40 C ATOM 316 SD MET A 36 18.831 29.230 49.010 1.00 53.32 S ATOM 317 CE MET A 36 20.555 29.618 48.787 1.00 41.49 C ATOM 318 H MET A 36 17.625 24.981 48.704 1.00 0.00 H ATOM 319 N PHE A 37 20.643 23.799 48.926 1.00 35.84 N ATOM 320 CA PHE A 37 21.883 23.188 49.407 1.00 36.83 C ATOM 321 C PHE A 37 21.777 21.719 49.792 1.00 36.69 C ATOM 322 O PHE A 37 22.770 21.117 50.203 1.00 37.96 O ATOM 323 CB PHE A 37 22.420 23.967 50.608 1.00 37.83 C ATOM 324 CG PHE A 37 22.689 25.412 50.324 1.00 37.65 C ATOM 325 CD1 PHE A 37 23.568 25.783 49.311 1.00 39.61 C ATOM 326 CD2 PHE A 37 22.078 26.403 51.076 1.00 38.35 C ATOM 327 CE1 PHE A 37 23.822 27.118 49.042 1.00 40.88 C ATOM 328 CE2 PHE A 37 22.333 27.747 50.813 1.00 42.34 C ATOM 329 CZ PHE A 37 23.203 28.102 49.794 1.00 40.38 C ATOM 330 H PHE A 37 19.768 23.692 49.478 1.00 0.00 H ATOM 331 N GLY A 38 20.588 21.146 49.649 1.00 34.15 N ATOM 332 CA GLY A 38 20.356 19.771 50.038 1.00 33.01 C ATOM 333 C GLY A 38 19.869 19.675 51.479 1.00 35.49 C ATOM 334 O GLY A 38 19.832 20.677 52.203 1.00 30.80 O ATOM 335 H GLY A 38 19.804 21.699 49.248 1.00 0.00 H ATOM 336 N PRO A 39 19.503 18.462 51.905 1.00 30.59 N ATOM 337 CA PRO A 39 18.861 18.265 53.214 1.00 29.31 C ATOM 338 C PRO A 39 19.703 18.736 54.404 1.00 32.89 C ATOM 339 O PRO A 39 19.131 19.223 55.376 1.00 27.03 O ATOM 340 CB PRO A 39 18.630 16.745 53.279 1.00 29.31 C ATOM 341 CG PRO A 39 19.475 16.149 52.201 1.00 30.19 C ATOM 342 CD PRO A 39 19.595 17.211 51.132 1.00 31.36 C ATOM 343 N ILE A 40 21.023 18.600 54.337 1.00 30.01 N ATOM 344 CA ILE A 40 21.859 18.962 55.476 1.00 28.38 C ATOM 345 C ILE A 40 21.611 20.415 55.893 1.00 27.64 C ATOM 346 O ILE A 40 21.762 20.763 57.058 1.00 27.18 O ATOM 347 CB ILE A 40 23.361 18.752 55.174 1.00 26.16 C ATOM 348 CG1 ILE A 40 24.198 18.930 56.447 1.00 25.39 C ATOM 349 CG2 ILE A 40 23.850 19.690 54.056 1.00 27.28 C ATOM 350 CD1 ILE A 40 25.645 18.514 56.272 1.00 36.40 C ATOM 351 H ILE A 40 21.462 18.234 53.468 1.00 0.00 H ATOM 352 N ALA A 41 21.213 21.255 54.940 1.00 27.60 N ATOM 353 CA ALA A 41 21.023 22.678 55.219 1.00 28.24 C ATOM 354 C ALA A 41 19.911 22.978 56.241 1.00 29.70 C ATOM 355 O ALA A 41 19.981 23.997 56.926 1.00 29.04 O ATOM 356 CB ALA A 41 20.748 23.436 53.925 1.00 30.22 C ATOM 357 H ALA A 41 21.034 20.893 53.981 1.00 0.00 H ATOM 358 N TYR A 42 18.891 22.128 56.359 1.00 27.29 N ATOM 359 CA TYR A 42 17.881 22.392 57.394 1.00 26.74 C ATOM 360 C TYR A 42 18.134 21.637 58.697 1.00 25.17 C ATOM 361 O TYR A 42 17.394 21.802 59.666 1.00 24.65 O ATOM 362 CB TYR A 42 16.462 22.088 56.892 1.00 27.59 C ATOM 363 CG TYR A 42 16.222 20.677 56.390 1.00 27.65 C ATOM 364 CD1 TYR A 42 16.414 19.569 57.217 1.00 26.42 C ATOM 365 CD2 TYR A 42 15.748 20.463 55.110 1.00 29.35 C ATOM 366 CE1 TYR A 42 16.177 18.281 56.758 1.00 26.87 C ATOM 367 CE2 TYR A 42 15.511 19.188 54.639 1.00 30.68 C ATOM 368 CZ TYR A 42 15.722 18.101 55.461 1.00 28.54 C ATOM 369 OH TYR A 42 15.482 16.845 54.967 1.00 32.33 O ATOM 370 HH TYR A 42 15.677 16.173 55.668 1.00 0.00 H ATOM 371 H TYR A 42 18.812 21.300 55.735 1.00 0.00 H ATOM 372 N GLU A 43 19.176 20.820 58.742 1.00 26.74 N ATOM 373 CA GLU A 43 19.417 20.042 59.955 1.00 23.64 C ATOM 374 C GLU A 43 19.691 20.922 61.198 1.00 23.26 C ATOM 375 O GLU A 43 19.205 20.617 62.282 1.00 22.70 O ATOM 376 CB GLU A 43 20.557 19.046 59.727 1.00 23.56 C ATOM 377 CG GLU A 43 20.204 17.934 58.724 1.00 24.04 C ATOM 378 CD GLU A 43 19.128 16.964 59.236 1.00 23.98 C ATOM 379 OE1 GLU A 43 18.651 17.122 60.383 1.00 24.29 O ATOM 380 OE2 GLU A 43 18.772 16.025 58.494 1.00 29.13 O ATOM 381 H GLU A 43 19.814 20.734 57.925 1.00 0.00 H ATOM 382 N PRO A 44 20.449 22.019 61.046 1.00 23.82 N ATOM 383 CA PRO A 44 20.712 22.881 62.208 1.00 23.87 C ATOM 384 C PRO A 44 19.458 23.450 62.881 1.00 23.90 C ATOM 385 O PRO A 44 19.490 23.700 64.092 1.00 24.74 O ATOM 386 CB PRO A 44 21.559 24.013 61.607 1.00 25.03 C ATOM 387 CG PRO A 44 22.308 23.340 60.510 1.00 28.43 C ATOM 388 CD PRO A 44 21.261 22.423 59.886 1.00 25.14 C ATOM 389 N ILE A 45 18.380 23.659 62.126 1.00 25.23 N ATOM 390 CA ILE A 45 17.170 24.239 62.705 1.00 24.06 C ATOM 391 C ILE A 45 16.144 23.168 63.070 1.00 23.26 C ATOM 392 O ILE A 45 15.060 23.498 63.548 1.00 23.27 O ATOM 393 CB ILE A 45 16.483 25.257 61.754 1.00 30.37 C ATOM 394 CG1 ILE A 45 15.903 24.548 60.518 1.00 25.89 C ATOM 395 CG2 ILE A 45 17.437 26.408 61.399 1.00 31.80 C ATOM 396 CD1 ILE A 45 15.144 25.445 59.561 1.00 30.95 C ATOM 397 H ILE A 45 18.400 23.407 61.117 1.00 0.00 H ATOM 398 N TYR A 46 16.486 21.898 62.861 1.00 22.81 N ATOM 399 CA TYR A 46 15.483 20.829 62.940 1.00 22.59 C ATOM 400 C TYR A 46 14.780 20.764 64.303 1.00 22.10 C ATOM 401 O TYR A 46 13.575 20.541 64.372 1.00 22.16 O ATOM 402 CB TYR A 46 16.099 19.459 62.621 1.00 22.50 C ATOM 403 CG TYR A 46 15.125 18.564 61.876 1.00 23.54 C ATOM 404 CD1 TYR A 46 14.035 18.001 62.528 1.00 23.18 C ATOM 405 CD2 TYR A 46 15.270 18.325 60.503 1.00 24.03 C ATOM 406 CE1 TYR A 46 13.119 17.202 61.847 1.00 24.31 C ATOM 407 CE2 TYR A 46 14.361 17.524 59.810 1.00 25.06 C ATOM 408 CZ TYR A 46 13.289 16.973 60.485 1.00 25.19 C ATOM 409 OH TYR A 46 12.381 16.195 59.810 1.00 26.58 O ATOM 410 HH TYR A 46 12.845 15.414 59.417 1.00 0.00 H ATOM 411 H TYR A 46 17.474 21.661 62.639 1.00 0.00 H ATOM 412 N GLY A 47 15.534 20.973 65.378 1.00 21.58 N ATOM 413 CA GLY A 47 14.988 20.841 66.718 1.00 21.21 C ATOM 414 C GLY A 47 13.829 21.779 67.028 1.00 23.88 C ATOM 415 O GLY A 47 13.066 21.531 67.967 1.00 23.98 O ATOM 416 H GLY A 47 16.533 21.236 65.257 1.00 0.00 H ATOM 417 N ILE A 48 13.693 22.861 66.263 1.00 21.81 N ATOM 418 CA ILE A 48 12.568 23.769 66.464 1.00 22.18 C ATOM 419 C ILE A 48 11.248 23.025 66.279 1.00 23.77 C ATOM 420 O ILE A 48 10.267 23.336 66.958 1.00 23.82 O ATOM 421 CB ILE A 48 12.591 24.982 65.500 1.00 23.33 C ATOM 422 CG1 ILE A 48 11.769 26.138 66.072 1.00 39.24 C ATOM 423 CG2 ILE A 48 12.040 24.605 64.141 1.00 29.89 C ATOM 424 CD1 ILE A 48 12.344 26.729 67.370 1.00 42.07 C ATOM 425 H ILE A 48 14.392 23.060 65.519 1.00 0.00 H ATOM 426 N TRP A 49 11.218 22.044 65.376 1.00 22.46 N ATOM 427 CA TRP A 49 9.972 21.307 65.126 1.00 22.96 C ATOM 428 C TRP A 49 9.598 20.349 66.257 1.00 22.38 C ATOM 429 O TRP A 49 8.536 19.714 66.192 1.00 24.26 O ATOM 430 CB TRP A 49 10.043 20.534 63.792 1.00 23.85 C ATOM 431 CG TRP A 49 10.021 21.455 62.597 1.00 24.99 C ATOM 432 CD1 TRP A 49 9.040 22.346 62.255 1.00 26.15 C ATOM 433 CD2 TRP A 49 11.025 21.557 61.582 1.00 25.38 C ATOM 434 NE1 TRP A 49 9.381 23.007 61.092 1.00 27.41 N ATOM 435 CE2 TRP A 49 10.600 22.542 60.666 1.00 26.88 C ATOM 436 CE3 TRP A 49 12.250 20.908 61.362 1.00 24.79 C ATOM 437 CZ2 TRP A 49 11.355 22.892 59.544 1.00 27.80 C ATOM 438 CZ3 TRP A 49 13.000 21.265 60.257 1.00 25.50 C ATOM 439 CH2 TRP A 49 12.552 22.251 59.364 1.00 26.99 C ATOM 440 HE1 TRP A 49 8.810 23.735 60.618 1.00 0.00 H ATOM 441 H TRP A 49 12.080 21.800 64.847 1.00 0.00 H ATOM 442 N PHE A 50 10.461 20.234 67.268 1.00 21.57 N ATOM 443 CA PHE A 50 10.151 19.410 68.453 1.00 21.33 C ATOM 444 C PHE A 50 9.814 20.229 69.709 1.00 21.50 C ATOM 445 O PHE A 50 9.455 19.659 70.746 1.00 20.88 O ATOM 446 CB PHE A 50 11.317 18.494 68.850 1.00 21.24 C ATOM 447 CG PHE A 50 12.023 17.827 67.709 1.00 21.97 C ATOM 448 CD1 PHE A 50 11.348 17.433 66.566 1.00 22.25 C ATOM 449 CD2 PHE A 50 13.385 17.580 67.802 1.00 21.49 C ATOM 450 CE1 PHE A 50 12.028 16.807 65.525 1.00 22.71 C ATOM 451 CE2 PHE A 50 14.075 16.958 66.775 1.00 21.85 C ATOM 452 CZ PHE A 50 13.395 16.568 65.626 1.00 22.41 C ATOM 453 H PHE A 50 11.371 20.735 67.220 1.00 0.00 H ATOM 454 N ILE A 51 9.971 21.543 69.639 1.00 20.85 N ATOM 455 CA ILE A 51 9.966 22.351 70.859 1.00 22.15 C ATOM 456 C ILE A 51 8.644 22.246 71.638 1.00 21.10 C ATOM 457 O ILE A 51 8.649 22.272 72.857 1.00 26.41 O ATOM 458 CB ILE A 51 10.272 23.847 70.554 1.00 21.02 C ATOM 459 CG1 ILE A 51 10.583 24.588 71.863 1.00 23.30 C ATOM 460 CG2 ILE A 51 9.118 24.499 69.802 1.00 21.60 C ATOM 461 CD1 ILE A 51 11.205 25.951 71.660 1.00 22.97 C ATOM 462 H ILE A 51 10.098 22.001 68.714 1.00 0.00 H ATOM 463 N VAL A 52 7.529 22.076 70.927 1.00 23.47 N ATOM 464 CA VAL A 52 6.222 21.954 71.563 1.00 23.33 C ATOM 465 C VAL A 52 6.199 20.790 72.559 1.00 21.01 C ATOM 466 O VAL A 52 5.641 20.914 73.640 1.00 21.09 O ATOM 467 CB VAL A 52 5.101 21.774 70.506 1.00 32.46 C ATOM 468 CG1 VAL A 52 3.830 21.242 71.133 1.00 33.28 C ATOM 469 CG2 VAL A 52 4.839 23.086 69.804 1.00 35.66 C ATOM 470 H VAL A 52 7.593 22.029 69.890 1.00 0.00 H ATOM 471 N SER A 53 6.835 19.679 72.205 1.00 21.18 N ATOM 472 CA SER A 53 6.843 18.513 73.077 1.00 24.63 C ATOM 473 C SER A 53 7.513 18.828 74.403 1.00 22.21 C ATOM 474 O SER A 53 7.028 18.443 75.451 1.00 21.66 O ATOM 475 CB SER A 53 7.548 17.332 72.412 1.00 22.06 C ATOM 476 OG SER A 53 6.727 16.758 71.417 1.00 22.80 O ATOM 477 HG SER A 53 5.885 16.439 71.829 1.00 0.00 H ATOM 478 H SER A 53 7.334 19.641 71.293 1.00 0.00 H ATOM 479 N VAL A 54 8.630 19.535 74.337 1.00 22.18 N ATOM 480 CA VAL A 54 9.391 19.838 75.531 1.00 22.45 C ATOM 481 C VAL A 54 8.620 20.842 76.401 1.00 21.03 C ATOM 482 O VAL A 54 8.539 20.673 77.605 1.00 21.48 O ATOM 483 CB VAL A 54 10.795 20.377 75.174 1.00 25.63 C ATOM 484 CG1 VAL A 54 11.465 21.017 76.396 1.00 21.73 C ATOM 485 CG2 VAL A 54 11.659 19.246 74.617 1.00 24.10 C ATOM 486 H VAL A 54 8.966 19.878 73.414 1.00 0.00 H ATOM 487 N ILE A 55 8.043 21.858 75.765 1.00 22.57 N ATOM 488 CA ILE A 55 7.290 22.903 76.456 1.00 23.11 C ATOM 489 C ILE A 55 6.110 22.300 77.219 1.00 20.76 C ATOM 490 O ILE A 55 5.984 22.491 78.425 1.00 21.02 O ATOM 491 CB ILE A 55 6.791 23.989 75.454 1.00 21.79 C ATOM 492 CG1 ILE A 55 7.997 24.751 74.865 1.00 20.87 C ATOM 493 CG2 ILE A 55 5.757 24.929 76.126 1.00 24.31 C ATOM 494 CD1 ILE A 55 7.660 25.754 73.760 1.00 22.56 C ATOM 495 H ILE A 55 8.132 21.911 74.730 1.00 0.00 H ATOM 496 N ALA A 56 5.278 21.533 76.524 1.00 20.80 N ATOM 497 CA ALA A 56 4.094 20.950 77.149 1.00 26.17 C ATOM 498 C ALA A 56 4.463 20.026 78.305 1.00 24.08 C ATOM 499 O ALA A 56 3.820 20.074 79.341 1.00 21.92 O ATOM 500 CB ALA A 56 3.252 20.199 76.129 1.00 21.56 C ATOM 501 H ALA A 56 5.473 21.345 75.520 1.00 0.00 H ATOM 502 N ALA A 57 5.489 19.193 78.122 1.00 23.76 N ATOM 503 CA ALA A 57 5.881 18.243 79.165 1.00 27.28 C ATOM 504 C ALA A 57 6.458 18.974 80.378 1.00 23.16 C ATOM 505 O ALA A 57 6.083 18.706 81.515 1.00 23.96 O ATOM 506 CB ALA A 57 6.890 17.230 78.631 1.00 23.49 C ATOM 507 H ALA A 57 6.017 19.219 77.227 1.00 0.00 H ATOM 508 N TYR A 58 7.384 19.887 80.115 1.00 22.75 N ATOM 509 CA TYR A 58 8.047 20.632 81.181 1.00 32.40 C ATOM 510 C TYR A 58 7.040 21.500 81.962 1.00 23.23 C ATOM 511 O TYR A 58 7.135 21.625 83.184 1.00 24.17 O ATOM 512 CB TYR A 58 9.181 21.469 80.576 1.00 23.16 C ATOM 513 CG TYR A 58 9.990 22.331 81.527 1.00 24.16 C ATOM 514 CD1 TYR A 58 10.825 21.772 82.485 1.00 25.67 C ATOM 515 CD2 TYR A 58 9.946 23.707 81.424 1.00 24.00 C ATOM 516 CE1 TYR A 58 11.573 22.577 83.344 1.00 30.41 C ATOM 517 CE2 TYR A 58 10.686 24.516 82.259 1.00 25.28 C ATOM 518 CZ TYR A 58 11.490 23.955 83.221 1.00 26.78 C ATOM 519 OH TYR A 58 12.213 24.789 84.019 1.00 28.40 O ATOM 520 HH TYR A 58 12.743 24.253 84.661 1.00 0.00 H ATOM 521 H TYR A 58 7.644 20.076 79.126 1.00 0.00 H ATOM 522 N MET A 59 6.050 22.052 81.267 1.00 23.53 N ATOM 523 CA MET A 59 5.036 22.881 81.922 1.00 23.44 C ATOM 524 C MET A 59 4.044 22.056 82.726 1.00 26.64 C ATOM 525 O MET A 59 3.733 22.398 83.857 1.00 23.43 O ATOM 526 CB MET A 59 4.249 23.716 80.908 1.00 21.57 C ATOM 527 CG MET A 59 4.989 24.904 80.310 1.00 36.14 C ATOM 528 SD MET A 59 3.851 25.850 79.251 1.00 45.46 S ATOM 529 CE MET A 59 2.279 25.272 79.917 1.00 21.33 C ATOM 530 H MET A 59 5.995 21.892 80.241 1.00 0.00 H ATOM 531 N ILE A 60 3.543 20.978 82.126 1.00 26.21 N ATOM 532 CA ILE A 60 2.386 20.276 82.666 1.00 25.30 C ATOM 533 C ILE A 60 2.791 19.056 83.487 1.00 24.44 C ATOM 534 O ILE A 60 2.190 18.770 84.520 1.00 25.28 O ATOM 535 CB ILE A 60 1.427 19.858 81.532 1.00 26.85 C ATOM 536 CG1 ILE A 60 0.859 21.110 80.859 1.00 22.30 C ATOM 537 CG2 ILE A 60 0.330 18.946 82.068 1.00 23.87 C ATOM 538 CD1 ILE A 60 0.069 20.834 79.594 1.00 23.82 C ATOM 539 H ILE A 60 3.987 20.629 81.253 1.00 0.00 H ATOM 540 N ARG A 61 3.817 18.354 83.011 1.00 26.25 N ATOM 541 CA ARG A 61 4.472 17.283 83.754 1.00 26.66 C ATOM 542 C ARG A 61 3.539 16.102 84.022 1.00 29.51 C ATOM 543 O ARG A 61 3.553 15.523 85.098 1.00 28.70 O ATOM 544 CB ARG A 61 5.055 17.838 85.068 1.00 28.14 C ATOM 545 CG ARG A 61 6.061 18.965 84.809 1.00 27.72 C ATOM 546 CD ARG A 61 6.889 19.388 86.024 1.00 32.85 C ATOM 547 NE ARG A 61 7.892 20.361 85.598 1.00 28.86 N ATOM 548 CZ ARG A 61 8.802 20.921 86.378 1.00 30.11 C ATOM 549 NH1 ARG A 61 8.852 20.634 87.670 1.00 31.87 N ATOM 550 NH2 ARG A 61 9.661 21.787 85.859 1.00 29.84 N ATOM 551 HE ARG A 61 7.891 20.637 84.595 1.00 0.00 H ATOM 552 HH12 ARG A 61 9.571 21.080 88.274 1.00 0.00 H ATOM 553 HH11 ARG A 61 8.172 19.963 88.080 1.00 0.00 H ATOM 554 HH22 ARG A 61 10.380 22.232 86.464 1.00 0.00 H ATOM 555 HH21 ARG A 61 9.616 22.021 84.847 1.00 0.00 H ATOM 556 H ARG A 61 4.170 18.581 82.060 1.00 0.00 H ATOM 557 N LYS A 62 2.740 15.744 83.020 1.00 26.64 N ATOM 558 CA LYS A 62 1.863 14.593 83.113 1.00 27.40 C ATOM 559 C LYS A 62 2.004 13.754 81.832 1.00 26.10 C ATOM 560 O LYS A 62 2.414 14.266 80.801 1.00 24.81 O ATOM 561 CB LYS A 62 0.418 15.036 83.341 1.00 29.10 C ATOM 562 CG LYS A 62 0.239 15.817 84.644 1.00 31.75 C ATOM 563 CD LYS A 62 -1.194 16.171 84.940 1.00 32.09 C ATOM 564 CE LYS A 62 -1.301 16.857 86.316 1.00 34.22 C ATOM 565 NZ LYS A 62 -2.659 17.384 86.579 1.00 36.10 N ATOM 566 HZ1 LYS A 62 -2.905 18.084 85.850 1.00 0.00 H ATOM 567 HZ2 LYS A 62 -3.344 16.602 86.555 1.00 0.00 H ATOM 568 HZ3 LYS A 62 -2.679 17.835 87.516 1.00 0.00 H ATOM 569 H LYS A 62 2.745 16.306 82.145 1.00 0.00 H ATOM 570 N PRO A 63 1.699 12.458 81.922 1.00 26.76 N ATOM 571 CA PRO A 63 1.949 11.548 80.803 1.00 31.16 C ATOM 572 C PRO A 63 1.148 11.944 79.570 1.00 25.29 C ATOM 573 O PRO A 63 -0.006 12.339 79.676 1.00 26.08 O ATOM 574 CB PRO A 63 1.497 10.185 81.343 1.00 28.16 C ATOM 575 CG PRO A 63 1.550 10.332 82.858 1.00 31.59 C ATOM 576 CD PRO A 63 1.175 11.761 83.114 1.00 28.64 C ATOM 577 N GLY A 64 1.780 11.846 78.414 1.00 24.10 N ATOM 578 CA GLY A 64 1.118 12.147 77.161 1.00 31.36 C ATOM 579 C GLY A 64 1.282 13.574 76.680 1.00 24.74 C ATOM 580 O GLY A 64 0.903 13.884 75.553 1.00 24.02 O ATOM 581 H GLY A 64 2.776 11.546 78.403 1.00 0.00 H ATOM 582 N ALA A 65 1.842 14.450 77.513 1.00 22.62 N ATOM 583 CA ALA A 65 1.982 15.860 77.128 1.00 22.06 C ATOM 584 C ALA A 65 2.834 16.037 75.875 1.00 20.98 C ATOM 585 O ALA A 65 2.463 16.777 74.964 1.00 21.06 O ATOM 586 CB ALA A 65 2.582 16.684 78.277 1.00 22.40 C ATOM 587 H ALA A 65 2.183 14.133 78.443 1.00 0.00 H ATOM 588 N ALA A 66 3.977 15.364 75.846 1.00 22.01 N ATOM 589 CA ALA A 66 4.933 15.527 74.760 1.00 22.63 C ATOM 590 C ALA A 66 4.324 15.003 73.468 1.00 22.77 C ATOM 591 O ALA A 66 4.502 15.592 72.421 1.00 19.57 O ATOM 592 CB ALA A 66 6.238 14.801 75.059 1.00 19.84 C ATOM 593 H ALA A 66 4.196 14.703 76.619 1.00 0.00 H ATOM 594 N LEU A 67 3.599 13.896 73.573 1.00 23.25 N ATOM 595 CA LEU A 67 3.050 13.232 72.398 1.00 23.98 C ATOM 596 C LEU A 67 1.880 14.022 71.822 1.00 24.81 C ATOM 597 O LEU A 67 1.861 14.331 70.632 1.00 21.85 O ATOM 598 CB LEU A 67 2.597 11.807 72.738 1.00 21.63 C ATOM 599 CG LEU A 67 1.784 11.091 71.654 1.00 22.41 C ATOM 600 CD1 LEU A 67 2.602 11.024 70.356 1.00 22.18 C ATOM 601 CD2 LEU A 67 1.394 9.688 72.125 1.00 26.02 C ATOM 602 H LEU A 67 3.419 13.494 74.515 1.00 0.00 H ATOM 603 N VAL A 68 0.910 14.344 72.672 1.00 24.18 N ATOM 604 CA VAL A 68 -0.315 14.973 72.206 1.00 21.94 C ATOM 605 C VAL A 68 -0.099 16.408 71.746 1.00 21.42 C ATOM 606 O VAL A 68 -0.630 16.812 70.721 1.00 24.42 O ATOM 607 CB VAL A 68 -1.416 14.958 73.282 1.00 26.92 C ATOM 608 CG1 VAL A 68 -2.669 15.645 72.744 1.00 27.41 C ATOM 609 CG2 VAL A 68 -1.738 13.522 73.685 1.00 31.35 C ATOM 610 H VAL A 68 1.029 14.143 73.685 1.00 0.00 H ATOM 611 N SER A 69 0.688 17.175 72.482 1.00 25.13 N ATOM 612 CA SER A 69 0.965 18.548 72.072 1.00 25.44 C ATOM 613 C SER A 69 1.575 18.606 70.651 1.00 24.04 C ATOM 614 O SER A 69 1.202 19.455 69.855 1.00 20.48 O ATOM 615 CB SER A 69 1.893 19.223 73.078 1.00 24.37 C ATOM 616 OG SER A 69 3.162 18.592 73.100 1.00 23.68 O ATOM 617 HG SER A 69 3.052 17.642 73.356 1.00 0.00 H ATOM 618 H SER A 69 1.110 16.799 73.355 1.00 0.00 H ATOM 619 N GLU A 70 2.509 17.705 70.345 1.00 22.00 N ATOM 620 CA GLU A 70 3.165 17.684 69.038 1.00 21.03 C ATOM 621 C GLU A 70 2.179 17.270 67.930 1.00 23.80 C ATOM 622 O GLU A 70 2.231 17.796 66.818 1.00 21.29 O ATOM 623 CB GLU A 70 4.380 16.738 69.072 1.00 19.65 C ATOM 624 CG GLU A 70 5.219 16.638 67.772 1.00 19.93 C ATOM 625 CD GLU A 70 6.096 17.864 67.488 1.00 20.27 C ATOM 626 OE1 GLU A 70 6.038 18.862 68.242 1.00 20.35 O ATOM 627 OE2 GLU A 70 6.835 17.836 66.486 1.00 20.32 O ATOM 628 H GLU A 70 2.779 16.996 71.057 1.00 0.00 H ATOM 629 N ILE A 71 1.305 16.313 68.231 1.00 20.94 N ATOM 630 CA ILE A 71 0.270 15.913 67.283 1.00 21.84 C ATOM 631 C ILE A 71 -0.624 17.104 66.929 1.00 22.19 C ATOM 632 O ILE A 71 -0.869 17.379 65.744 1.00 27.44 O ATOM 633 CB ILE A 71 -0.583 14.753 67.827 1.00 24.10 C ATOM 634 CG1 ILE A 71 0.251 13.469 67.872 1.00 22.59 C ATOM 635 CG2 ILE A 71 -1.871 14.553 66.974 1.00 23.89 C ATOM 636 CD1 ILE A 71 -0.408 12.349 68.629 1.00 23.36 C ATOM 637 H ILE A 71 1.360 15.842 69.157 1.00 0.00 H ATOM 638 N ILE A 72 -1.095 17.821 67.944 1.00 22.08 N ATOM 639 CA ILE A 72 -1.950 18.981 67.704 1.00 27.55 C ATOM 640 C ILE A 72 -1.218 20.065 66.894 1.00 22.34 C ATOM 641 O ILE A 72 -1.782 20.632 65.951 1.00 23.04 O ATOM 642 CB ILE A 72 -2.460 19.585 69.023 1.00 22.80 C ATOM 643 CG1 ILE A 72 -3.377 18.586 69.747 1.00 26.20 C ATOM 644 CG2 ILE A 72 -3.190 20.886 68.757 1.00 28.00 C ATOM 645 CD1 ILE A 72 -3.649 18.951 71.217 1.00 26.63 C ATOM 646 H ILE A 72 -0.852 17.554 68.919 1.00 0.00 H ATOM 647 N ALA A 73 0.028 20.352 67.268 1.00 21.55 N ATOM 648 CA ALA A 73 0.826 21.323 66.534 1.00 22.88 C ATOM 649 C ALA A 73 0.983 20.909 65.053 1.00 27.61 C ATOM 650 O ALA A 73 0.869 21.740 64.165 1.00 22.64 O ATOM 651 CB ALA A 73 2.212 21.502 67.196 1.00 20.83 C ATOM 652 H ALA A 73 0.437 19.875 68.097 1.00 0.00 H ATOM 653 N ALA A 74 1.255 19.627 64.805 1.00 26.40 N ATOM 654 CA ALA A 74 1.417 19.122 63.435 1.00 26.52 C ATOM 655 C ALA A 74 0.113 19.189 62.641 1.00 25.38 C ATOM 656 O ALA A 74 0.111 19.527 61.445 1.00 25.78 O ATOM 657 CB ALA A 74 1.940 17.693 63.448 1.00 25.56 C ATOM 658 H ALA A 74 1.355 18.967 65.603 1.00 0.00 H ATOM 659 N LEU A 75 -0.986 18.842 63.301 1.00 23.94 N ATOM 660 CA LEU A 75 -2.307 18.909 62.693 1.00 25.14 C ATOM 661 C LEU A 75 -2.577 20.326 62.220 1.00 25.56 C ATOM 662 O LEU A 75 -3.006 20.553 61.087 1.00 26.70 O ATOM 663 CB LEU A 75 -3.400 18.456 63.687 1.00 25.35 C ATOM 664 CG LEU A 75 -4.845 18.879 63.403 1.00 26.66 C ATOM 665 CD1 LEU A 75 -5.301 18.335 62.034 1.00 28.05 C ATOM 666 CD2 LEU A 75 -5.804 18.429 64.513 1.00 27.05 C ATOM 667 H LEU A 75 -0.900 18.512 64.283 1.00 0.00 H ATOM 668 N VAL A 76 -2.325 21.284 63.101 1.00 24.84 N ATOM 669 CA VAL A 76 -2.646 22.662 62.804 1.00 25.42 C ATOM 670 C VAL A 76 -1.704 23.211 61.730 1.00 25.70 C ATOM 671 O VAL A 76 -2.127 23.983 60.867 1.00 26.79 O ATOM 672 CB VAL A 76 -2.596 23.535 64.074 1.00 33.57 C ATOM 673 CG1 VAL A 76 -2.739 25.007 63.714 1.00 25.68 C ATOM 674 CG2 VAL A 76 -3.700 23.111 65.042 1.00 28.65 C ATOM 675 H VAL A 76 -1.892 21.042 64.015 1.00 0.00 H ATOM 676 N GLU A 77 -0.435 22.802 61.779 1.00 24.94 N ATOM 677 CA GLU A 77 0.504 23.190 60.732 1.00 25.51 C ATOM 678 C GLU A 77 0.023 22.679 59.358 1.00 26.85 C ATOM 679 O GLU A 77 0.097 23.391 58.362 1.00 27.99 O ATOM 680 CB GLU A 77 1.915 22.670 61.033 1.00 24.74 C ATOM 681 CG GLU A 77 2.961 23.272 60.104 1.00 28.89 C ATOM 682 CD GLU A 77 4.290 22.537 60.151 1.00 25.27 C ATOM 683 OE1 GLU A 77 4.514 21.772 61.113 1.00 29.30 O ATOM 684 OE2 GLU A 77 5.095 22.718 59.213 1.00 26.46 O ATOM 685 H GLU A 77 -0.114 22.204 62.567 1.00 0.00 H ATOM 686 N CYS A 78 -0.472 21.447 59.327 1.00 26.94 N ATOM 687 CA CYS A 78 -1.053 20.877 58.117 1.00 28.46 C ATOM 688 C CYS A 78 -2.225 21.729 57.631 1.00 29.60 C ATOM 689 O CYS A 78 -2.283 22.111 56.464 1.00 31.04 O ATOM 690 CB CYS A 78 -1.512 19.433 58.358 1.00 28.52 C ATOM 691 SG CYS A 78 -2.408 18.689 56.943 1.00 30.94 S ATOM 692 H CYS A 78 -0.444 20.871 60.192 1.00 0.00 H ATOM 693 N LEU A 79 -3.146 22.032 58.545 1.00 31.93 N ATOM 694 CA LEU A 79 -4.318 22.853 58.242 1.00 31.24 C ATOM 695 C LEU A 79 -3.948 24.221 57.675 1.00 30.93 C ATOM 696 O LEU A 79 -4.605 24.709 56.752 1.00 33.91 O ATOM 697 CB LEU A 79 -5.189 23.055 59.501 1.00 35.37 C ATOM 698 CG LEU A 79 -5.815 21.813 60.132 1.00 39.60 C ATOM 699 CD1 LEU A 79 -6.757 22.191 61.265 1.00 41.59 C ATOM 700 CD2 LEU A 79 -6.527 20.970 59.078 1.00 39.14 C ATOM 701 H LEU A 79 -3.027 21.670 59.513 1.00 0.00 H ATOM 702 N LEU A 80 -2.922 24.840 58.252 1.00 29.86 N ATOM 703 CA LEU A 80 -2.453 26.157 57.825 1.00 30.51 C ATOM 704 C LEU A 80 -1.751 26.142 56.470 1.00 31.69 C ATOM 705 O LEU A 80 -1.395 27.192 55.953 1.00 32.63 O ATOM 706 CB LEU A 80 -1.509 26.751 58.869 1.00 29.28 C ATOM 707 CG LEU A 80 -2.169 27.130 60.196 1.00 28.63 C ATOM 708 CD1 LEU A 80 -1.136 27.573 61.209 1.00 30.57 C ATOM 709 CD2 LEU A 80 -3.222 28.210 59.975 1.00 35.15 C ATOM 710 H LEU A 80 -2.433 24.368 59.039 1.00 0.00 H ATOM 711 N GLY A 81 -1.530 24.957 55.913 1.00 31.87 N ATOM 712 CA GLY A 81 -1.048 24.857 54.548 1.00 37.41 C ATOM 713 C GLY A 81 0.342 24.287 54.333 1.00 33.23 C ATOM 714 O GLY A 81 0.976 24.598 53.327 1.00 34.70 O ATOM 715 H GLY A 81 -1.704 24.091 56.461 1.00 0.00 H ATOM 716 N ASN A 82 0.817 23.453 55.250 1.00 31.65 N ATOM 717 CA ASN A 82 2.071 22.730 55.020 1.00 31.67 C ATOM 718 C ASN A 82 2.030 22.066 53.644 1.00 33.71 C ATOM 719 O ASN A 82 1.123 21.294 53.361 1.00 35.35 O ATOM 720 CB ASN A 82 2.319 21.682 56.106 1.00 30.03 C ATOM 721 CG ASN A 82 3.655 20.963 55.938 1.00 30.17 C ATOM 722 OD1 ASN A 82 3.800 20.080 55.090 1.00 31.44 O ATOM 723 ND2 ASN A 82 4.633 21.340 56.745 1.00 33.84 N ATOM 724 HD22 ASN A 82 4.468 22.089 57.447 1.00 0.00 H ATOM 725 HD21 ASN A 82 5.567 20.887 56.678 1.00 0.00 H ATOM 726 H ASN A 82 0.295 23.312 56.138 1.00 0.00 H ATOM 727 N PRO A 83 3.004 22.386 52.779 1.00 35.10 N ATOM 728 CA PRO A 83 3.002 21.944 51.374 1.00 44.90 C ATOM 729 C PRO A 83 3.060 20.419 51.211 1.00 37.93 C ATOM 730 O PRO A 83 2.645 19.893 50.172 1.00 39.99 O ATOM 731 CB PRO A 83 4.269 22.597 50.790 1.00 46.35 C ATOM 732 CG PRO A 83 4.663 23.653 51.775 1.00 46.18 C ATOM 733 CD PRO A 83 4.199 23.176 53.112 1.00 41.06 C ATOM 734 N SER A 84 3.563 19.720 52.221 1.00 38.55 N ATOM 735 CA SER A 84 3.653 18.266 52.151 1.00 42.72 C ATOM 736 C SER A 84 2.348 17.600 52.582 1.00 44.51 C ATOM 737 O SER A 84 2.247 16.376 52.607 1.00 48.38 O ATOM 738 CB SER A 84 4.814 17.757 53.014 1.00 35.36 C ATOM 739 OG SER A 84 4.425 17.595 54.367 1.00 36.63 O ATOM 740 HG SER A 84 4.124 18.466 54.729 1.00 0.00 H ATOM 741 H SER A 84 3.897 20.215 53.072 1.00 0.00 H ATOM 742 N GLY A 85 1.350 18.405 52.929 1.00 39.79 N ATOM 743 CA GLY A 85 0.074 17.871 53.367 1.00 37.12 C ATOM 744 C GLY A 85 0.139 17.047 54.645 1.00 33.37 C ATOM 745 O GLY A 85 0.946 17.327 55.539 1.00 35.44 O ATOM 746 H GLY A 85 1.486 19.435 52.886 1.00 0.00 H ATOM 747 N PRO A 86 -0.701 16.000 54.727 1.00 33.99 N ATOM 748 CA PRO A 86 -0.871 15.191 55.940 1.00 32.68 C ATOM 749 C PRO A 86 0.349 14.380 56.379 1.00 32.02 C ATOM 750 O PRO A 86 0.351 13.932 57.539 1.00 30.70 O ATOM 751 CB PRO A 86 -2.023 14.248 55.580 1.00 36.58 C ATOM 752 CG PRO A 86 -2.008 14.174 54.079 1.00 40.03 C ATOM 753 CD PRO A 86 -1.538 15.521 53.610 1.00 38.31 C ATOM 754 N MET A 87 1.356 14.195 55.530 1.00 33.06 N ATOM 755 CA MET A 87 2.531 13.446 55.986 1.00 32.59 C ATOM 756 C MET A 87 3.247 14.202 57.130 1.00 31.08 C ATOM 757 O MET A 87 3.965 13.594 57.923 1.00 29.59 O ATOM 758 CB MET A 87 3.498 13.128 54.825 1.00 46.35 C ATOM 759 CG MET A 87 3.965 14.291 53.957 1.00 47.81 C ATOM 760 SD MET A 87 4.892 13.767 52.463 1.00 51.56 S ATOM 761 CE MET A 87 3.640 12.879 51.545 1.00 67.76 C ATOM 762 H MET A 87 1.311 14.574 54.563 1.00 0.00 H ATOM 763 N VAL A 88 3.017 15.508 57.254 1.00 29.59 N ATOM 764 CA VAL A 88 3.611 16.239 58.366 1.00 27.79 C ATOM 765 C VAL A 88 2.956 15.791 59.689 1.00 26.47 C ATOM 766 O VAL A 88 3.581 15.836 60.739 1.00 25.24 O ATOM 767 CB VAL A 88 3.487 17.775 58.207 1.00 27.54 C ATOM 768 CG1 VAL A 88 2.051 18.250 58.483 1.00 27.31 C ATOM 769 CG2 VAL A 88 4.473 18.480 59.158 1.00 26.23 C ATOM 770 H VAL A 88 2.418 16.002 56.562 1.00 0.00 H ATOM 771 N ILE A 89 1.704 15.344 59.629 1.00 28.64 N ATOM 772 CA ILE A 89 1.035 14.834 60.822 1.00 26.20 C ATOM 773 C ILE A 89 1.670 13.502 61.248 1.00 26.25 C ATOM 774 O ILE A 89 1.801 13.228 62.436 1.00 25.26 O ATOM 775 CB ILE A 89 -0.482 14.660 60.611 1.00 27.15 C ATOM 776 CG1 ILE A 89 -1.133 16.033 60.376 1.00 27.11 C ATOM 777 CG2 ILE A 89 -1.109 13.953 61.817 1.00 26.73 C ATOM 778 CD1 ILE A 89 -2.573 15.987 59.906 1.00 28.45 C ATOM 779 H ILE A 89 1.196 15.358 58.722 1.00 0.00 H ATOM 780 N VAL A 90 2.093 12.700 60.272 1.00 34.12 N ATOM 781 CA VAL A 90 2.796 11.459 60.569 1.00 27.96 C ATOM 782 C VAL A 90 4.144 11.737 61.239 1.00 26.80 C ATOM 783 O VAL A 90 4.470 11.141 62.269 1.00 26.14 O ATOM 784 CB VAL A 90 3.046 10.608 59.309 1.00 33.58 C ATOM 785 CG1 VAL A 90 3.670 9.269 59.706 1.00 30.61 C ATOM 786 CG2 VAL A 90 1.748 10.399 58.507 1.00 31.56 C ATOM 787 H VAL A 90 1.918 12.964 59.281 1.00 0.00 H ATOM 788 N ILE A 91 4.938 12.643 60.673 1.00 28.33 N ATOM 789 CA ILE A 91 6.234 12.896 61.297 1.00 27.53 C ATOM 790 C ILE A 91 6.016 13.555 62.657 1.00 24.23 C ATOM 791 O ILE A 91 6.806 13.367 63.586 1.00 24.04 O ATOM 792 CB ILE A 91 7.182 13.754 60.405 1.00 26.58 C ATOM 793 CG1 ILE A 91 8.649 13.469 60.797 1.00 26.61 C ATOM 794 CG2 ILE A 91 6.817 15.239 60.474 1.00 25.78 C ATOM 795 CD1 ILE A 91 9.714 14.059 59.870 1.00 27.80 C ATOM 796 H ILE A 91 4.645 13.153 59.815 1.00 0.00 H ATOM 797 N GLY A 92 4.916 14.291 62.791 1.00 26.64 N ATOM 798 CA GLY A 92 4.555 14.873 64.077 1.00 22.53 C ATOM 799 C GLY A 92 4.289 13.796 65.120 1.00 25.99 C ATOM 800 O GLY A 92 4.807 13.858 66.235 1.00 26.70 O ATOM 801 H GLY A 92 4.305 14.453 61.966 1.00 0.00 H ATOM 802 N ILE A 93 3.485 12.802 64.752 1.00 26.10 N ATOM 803 CA ILE A 93 3.217 11.665 65.626 1.00 25.45 C ATOM 804 C ILE A 93 4.542 10.981 65.993 1.00 26.20 C ATOM 805 O ILE A 93 4.812 10.738 67.166 1.00 22.76 O ATOM 806 CB ILE A 93 2.257 10.647 64.968 1.00 29.19 C ATOM 807 CG1 ILE A 93 0.847 11.253 64.809 1.00 25.09 C ATOM 808 CG2 ILE A 93 2.220 9.335 65.765 1.00 25.37 C ATOM 809 CD1 ILE A 93 -0.059 10.460 63.866 1.00 26.82 C ATOM 810 H ILE A 93 3.035 12.836 63.815 1.00 0.00 H ATOM 811 N VAL A 94 5.381 10.714 64.994 1.00 26.72 N ATOM 812 CA VAL A 94 6.665 10.048 65.236 1.00 24.30 C ATOM 813 C VAL A 94 7.552 10.862 66.195 1.00 23.10 C ATOM 814 O VAL A 94 8.107 10.328 67.144 1.00 22.94 O ATOM 815 CB VAL A 94 7.419 9.788 63.897 1.00 27.01 C ATOM 816 CG1 VAL A 94 8.862 9.370 64.148 1.00 26.85 C ATOM 817 CG2 VAL A 94 6.691 8.729 63.074 1.00 27.22 C ATOM 818 H VAL A 94 5.121 10.983 64.024 1.00 0.00 H ATOM 819 N GLN A 95 7.667 12.159 65.947 1.00 22.49 N ATOM 820 CA GLN A 95 8.453 13.031 66.810 1.00 23.22 C ATOM 821 C GLN A 95 7.888 13.072 68.234 1.00 20.82 C ATOM 822 O GLN A 95 8.655 13.026 69.181 1.00 21.42 O ATOM 823 CB GLN A 95 8.544 14.438 66.202 1.00 21.43 C ATOM 824 CG GLN A 95 9.437 14.423 64.948 1.00 22.51 C ATOM 825 CD GLN A 95 9.253 15.600 63.995 1.00 22.82 C ATOM 826 OE1 GLN A 95 9.921 15.665 62.955 1.00 23.93 O ATOM 827 NE2 GLN A 95 8.351 16.508 64.321 1.00 22.10 N ATOM 828 HE22 GLN A 95 7.813 16.412 65.206 1.00 0.00 H ATOM 829 HE21 GLN A 95 8.179 17.319 63.693 1.00 0.00 H ATOM 830 H GLN A 95 7.186 12.563 65.118 1.00 0.00 H ATOM 831 N GLY A 96 6.566 13.118 68.369 1.00 20.70 N ATOM 832 CA GLY A 96 5.924 13.125 69.677 1.00 20.80 C ATOM 833 C GLY A 96 6.194 11.848 70.475 1.00 24.45 C ATOM 834 O GLY A 96 6.394 11.899 71.691 1.00 21.40 O ATOM 835 H GLY A 96 5.973 13.150 67.516 1.00 0.00 H ATOM 836 N LEU A 97 6.203 10.708 69.785 1.00 21.71 N ATOM 837 CA LEU A 97 6.497 9.411 70.399 1.00 22.24 C ATOM 838 C LEU A 97 7.943 9.332 70.850 1.00 27.37 C ATOM 839 O LEU A 97 8.245 8.775 71.913 1.00 22.35 O ATOM 840 CB LEU A 97 6.212 8.264 69.418 1.00 23.47 C ATOM 841 CG LEU A 97 4.739 8.032 69.048 1.00 29.21 C ATOM 842 CD1 LEU A 97 4.635 7.067 67.863 1.00 27.34 C ATOM 843 CD2 LEU A 97 3.929 7.508 70.239 1.00 24.41 C ATOM 844 H LEU A 97 5.992 10.741 68.767 1.00 0.00 H ATOM 845 N GLY A 98 8.838 9.867 70.018 1.00 22.32 N ATOM 846 CA GLY A 98 10.253 9.934 70.356 1.00 22.55 C ATOM 847 C GLY A 98 10.539 10.741 71.619 1.00 21.42 C ATOM 848 O GLY A 98 11.348 10.330 72.468 1.00 21.75 O ATOM 849 H GLY A 98 8.517 10.246 69.104 1.00 0.00 H ATOM 850 N ALA A 99 9.889 11.894 71.745 1.00 22.02 N ATOM 851 CA ALA A 99 10.014 12.717 72.962 1.00 20.94 C ATOM 852 C ALA A 99 9.325 12.055 74.163 1.00 22.26 C ATOM 853 O ALA A 99 9.886 11.985 75.252 1.00 21.84 O ATOM 854 CB ALA A 99 9.443 14.093 72.719 1.00 19.70 C ATOM 855 H ALA A 99 9.280 12.222 70.969 1.00 0.00 H ATOM 856 N GLU A 100 8.112 11.568 73.948 1.00 20.90 N ATOM 857 CA GLU A 100 7.340 10.932 75.005 1.00 21.11 C ATOM 858 C GLU A 100 8.082 9.727 75.588 1.00 24.38 C ATOM 859 O GLU A 100 7.987 9.468 76.779 1.00 22.37 O ATOM 860 CB GLU A 100 5.971 10.500 74.479 1.00 21.45 C ATOM 861 CG GLU A 100 4.992 10.058 75.569 1.00 26.54 C ATOM 862 CD GLU A 100 4.452 11.229 76.384 1.00 23.28 C ATOM 863 OE1 GLU A 100 4.005 12.232 75.791 1.00 23.02 O ATOM 864 OE2 GLU A 100 4.482 11.140 77.625 1.00 25.80 O ATOM 865 H GLU A 100 7.699 11.642 72.996 1.00 0.00 H ATOM 866 N ALA A 101 8.806 8.988 74.747 1.00 22.19 N ATOM 867 CA ALA A 101 9.524 7.801 75.210 1.00 27.84 C ATOM 868 C ALA A 101 10.537 8.144 76.320 1.00 23.20 C ATOM 869 O ALA A 101 10.764 7.355 77.230 1.00 27.74 O ATOM 870 CB ALA A 101 10.227 7.114 74.035 1.00 27.57 C ATOM 871 H ALA A 101 8.861 9.260 73.745 1.00 0.00 H ATOM 872 N VAL A 102 11.144 9.317 76.229 1.00 22.51 N ATOM 873 CA VAL A 102 12.124 9.748 77.230 1.00 22.78 C ATOM 874 C VAL A 102 11.420 10.112 78.554 1.00 22.93 C ATOM 875 O VAL A 102 11.941 9.845 79.642 1.00 23.72 O ATOM 876 CB VAL A 102 12.959 10.939 76.701 1.00 26.84 C ATOM 877 CG1 VAL A 102 13.678 11.673 77.837 1.00 25.81 C ATOM 878 CG2 VAL A 102 13.948 10.461 75.639 1.00 24.86 C ATOM 879 H VAL A 102 10.921 9.945 75.431 1.00 0.00 H ATOM 880 N PHE A 103 10.231 10.709 78.466 1.00 24.48 N ATOM 881 CA PHE A 103 9.490 11.033 79.693 1.00 22.90 C ATOM 882 C PHE A 103 8.899 9.763 80.271 1.00 23.89 C ATOM 883 O PHE A 103 8.863 9.600 81.483 1.00 27.14 O ATOM 884 CB PHE A 103 8.417 12.100 79.430 1.00 22.35 C ATOM 885 CG PHE A 103 8.999 13.434 79.058 1.00 24.76 C ATOM 886 CD1 PHE A 103 9.675 14.192 80.007 1.00 25.45 C ATOM 887 CD2 PHE A 103 8.916 13.915 77.761 1.00 22.41 C ATOM 888 CE1 PHE A 103 10.237 15.408 79.675 1.00 27.49 C ATOM 889 CE2 PHE A 103 9.471 15.140 77.422 1.00 20.57 C ATOM 890 CZ PHE A 103 10.139 15.883 78.373 1.00 21.08 C ATOM 891 H PHE A 103 9.831 10.944 77.535 1.00 0.00 H ATOM 892 N LEU A 104 8.473 8.843 79.404 1.00 23.91 N ATOM 893 CA LEU A 104 8.072 7.517 79.857 1.00 26.66 C ATOM 894 C LEU A 104 9.220 6.842 80.615 1.00 28.37 C ATOM 895 O LEU A 104 9.034 6.323 81.720 1.00 28.39 O ATOM 896 CB LEU A 104 7.623 6.648 78.670 1.00 25.22 C ATOM 897 CG LEU A 104 7.508 5.127 78.858 1.00 26.69 C ATOM 898 CD1 LEU A 104 6.450 4.761 79.899 1.00 33.67 C ATOM 899 CD2 LEU A 104 7.217 4.430 77.530 1.00 34.89 C ATOM 900 H LEU A 104 8.426 9.075 78.391 1.00 0.00 H ATOM 901 N ALA A 105 10.411 6.870 80.027 1.00 25.61 N ATOM 902 CA ALA A 105 11.561 6.184 80.601 1.00 28.49 C ATOM 903 C ALA A 105 11.906 6.722 82.002 1.00 30.20 C ATOM 904 O ALA A 105 12.451 6.000 82.836 1.00 28.43 O ATOM 905 CB ALA A 105 12.754 6.310 79.681 1.00 26.24 C ATOM 906 H ALA A 105 10.525 7.394 79.136 1.00 0.00 H ATOM 907 N THR A 106 11.597 7.992 82.242 1.00 26.44 N ATOM 908 CA THR A 106 11.896 8.627 83.526 1.00 27.35 C ATOM 909 C THR A 106 10.612 8.846 84.341 1.00 29.41 C ATOM 910 O THR A 106 10.576 9.675 85.253 1.00 25.54 O ATOM 911 CB THR A 106 12.631 9.974 83.320 1.00 25.70 C ATOM 912 OG1 THR A 106 11.865 10.813 82.451 1.00 22.43 O ATOM 913 CG2 THR A 106 14.027 9.751 82.710 1.00 26.31 C ATOM 914 HG1 THR A 106 10.977 10.981 82.855 1.00 0.00 H ATOM 915 H THR A 106 11.131 8.549 81.498 1.00 0.00 H ATOM 916 N ARG A 107 9.552 8.139 83.944 1.00 29.46 N ATOM 917 CA ARG A 107 8.303 8.032 84.701 1.00 26.97 C ATOM 918 C ARG A 107 7.582 9.357 84.891 1.00 26.16 C ATOM 919 O ARG A 107 6.845 9.538 85.872 1.00 26.41 O ATOM 920 CB ARG A 107 8.576 7.390 86.077 1.00 29.26 C ATOM 921 CG ARG A 107 8.995 5.921 85.993 1.00 38.90 C ATOM 922 CD ARG A 107 9.577 5.424 87.323 1.00 50.36 C ATOM 923 NE ARG A 107 8.613 5.527 88.417 1.00 61.02 N ATOM 924 CZ ARG A 107 8.936 5.607 89.705 1.00 71.86 C ATOM 925 NH1 ARG A 107 10.211 5.606 90.085 1.00 77.94 N ATOM 926 NH2 ARG A 107 7.978 5.698 90.618 1.00 75.66 N ATOM 927 HE ARG A 107 7.603 5.539 88.171 1.00 0.00 H ATOM 928 HH12 ARG A 107 10.453 5.669 91.095 1.00 0.00 H ATOM 929 HH11 ARG A 107 10.966 5.542 89.373 1.00 0.00 H ATOM 930 HH22 ARG A 107 8.225 5.761 91.626 1.00 0.00 H ATOM 931 HH21 ARG A 107 6.980 5.707 90.325 1.00 0.00 H ATOM 932 H ARG A 107 9.617 7.631 83.039 1.00 0.00 H ATOM 933 N TRP A 108 7.807 10.278 83.960 1.00 26.32 N ATOM 934 CA TRP A 108 7.187 11.596 83.979 1.00 28.13 C ATOM 935 C TRP A 108 7.456 12.329 85.294 1.00 26.33 C ATOM 936 O TRP A 108 6.687 13.200 85.688 1.00 25.12 O ATOM 937 CB TRP A 108 5.677 11.483 83.724 1.00 28.26 C ATOM 938 CG TRP A 108 5.361 10.799 82.421 1.00 22.58 C ATOM 939 CD1 TRP A 108 5.389 11.358 81.160 1.00 19.82 C ATOM 940 CD2 TRP A 108 4.996 9.426 82.237 1.00 24.24 C ATOM 941 NE1 TRP A 108 5.067 10.421 80.227 1.00 25.97 N ATOM 942 CE2 TRP A 108 4.815 9.227 80.853 1.00 26.75 C ATOM 943 CE3 TRP A 108 4.789 8.350 83.107 1.00 35.28 C ATOM 944 CZ2 TRP A 108 4.440 7.996 80.319 1.00 27.93 C ATOM 945 CZ3 TRP A 108 4.416 7.126 82.572 1.00 38.05 C ATOM 946 CH2 TRP A 108 4.244 6.963 81.191 1.00 31.51 C ATOM 947 HE1 TRP A 108 5.020 10.585 79.201 1.00 0.00 H ATOM 948 H TRP A 108 8.456 10.047 83.181 1.00 0.00 H ATOM 949 N LYS A 109 8.569 11.987 85.943 1.00 26.09 N ATOM 950 CA LYS A 109 8.972 12.616 87.204 1.00 28.58 C ATOM 951 C LYS A 109 10.256 13.438 87.101 1.00 30.71 C ATOM 952 O LYS A 109 10.704 13.989 88.098 1.00 31.22 O ATOM 953 CB LYS A 109 9.179 11.552 88.290 1.00 30.85 C ATOM 954 CG LYS A 109 7.928 10.838 88.744 1.00 40.16 C ATOM 955 CD LYS A 109 8.288 9.637 89.620 1.00 47.05 C ATOM 956 CE LYS A 109 9.238 10.032 90.737 1.00 60.77 C ATOM 957 NZ LYS A 109 9.533 8.899 91.664 1.00 75.75 N ATOM 958 HZ1 LYS A 109 8.648 8.568 92.098 1.00 0.00 H ATOM 959 HZ2 LYS A 109 9.971 8.121 91.130 1.00 0.00 H ATOM 960 HZ3 LYS A 109 10.185 9.222 92.407 1.00 0.00 H ATOM 961 H LYS A 109 9.175 11.245 85.539 1.00 0.00 H ATOM 962 N ALA A 110 10.870 13.481 85.922 1.00 29.37 N ATOM 963 CA ALA A 110 12.162 14.151 85.757 1.00 29.75 C ATOM 964 C ALA A 110 12.125 15.234 84.679 1.00 28.21 C ATOM 965 O ALA A 110 11.853 14.952 83.504 1.00 24.73 O ATOM 966 CB ALA A 110 13.239 13.137 85.427 1.00 29.12 C ATOM 967 H ALA A 110 10.423 13.029 85.099 1.00 0.00 H ATOM 968 N TYR A 111 12.424 16.469 85.068 1.00 25.36 N ATOM 969 CA TYR A 111 12.344 17.575 84.121 1.00 28.83 C ATOM 970 C TYR A 111 13.580 18.470 84.158 1.00 27.02 C ATOM 971 O TYR A 111 13.541 19.614 83.719 1.00 28.06 O ATOM 972 CB TYR A 111 11.051 18.363 84.372 1.00 30.42 C ATOM 973 CG TYR A 111 9.855 17.471 84.141 1.00 26.95 C ATOM 974 CD1 TYR A 111 9.357 17.267 82.863 1.00 22.88 C ATOM 975 CD2 TYR A 111 9.278 16.764 85.189 1.00 30.19 C ATOM 976 CE1 TYR A 111 8.298 16.427 82.638 1.00 31.71 C ATOM 977 CE2 TYR A 111 8.220 15.906 84.974 1.00 22.51 C ATOM 978 CZ TYR A 111 7.725 15.749 83.694 1.00 28.56 C ATOM 979 OH TYR A 111 6.667 14.904 83.458 1.00 26.43 O ATOM 980 HH TYR A 111 6.447 14.915 82.493 1.00 0.00 H ATOM 981 H TYR A 111 12.716 16.647 86.050 1.00 0.00 H ATOM 982 N SER A 112 14.692 17.911 84.632 1.00 27.89 N ATOM 983 CA SER A 112 15.977 18.592 84.563 1.00 30.00 C ATOM 984 C SER A 112 16.386 18.782 83.088 1.00 33.91 C ATOM 985 O SER A 112 15.893 18.084 82.199 1.00 29.61 O ATOM 986 CB SER A 112 17.054 17.808 85.327 1.00 31.30 C ATOM 987 OG SER A 112 17.419 16.630 84.620 1.00 31.40 O ATOM 988 HG SER A 112 16.622 16.053 84.509 1.00 0.00 H ATOM 989 H SER A 112 14.641 16.965 85.062 1.00 0.00 H ATOM 990 N LEU A 113 17.282 19.733 82.844 1.00 31.28 N ATOM 991 CA LEU A 113 17.687 20.086 81.486 1.00 30.53 C ATOM 992 C LEU A 113 18.204 18.893 80.667 1.00 26.92 C ATOM 993 O LEU A 113 17.845 18.752 79.503 1.00 25.84 O ATOM 994 CB LEU A 113 18.753 21.178 81.515 1.00 32.92 C ATOM 995 CG LEU A 113 19.239 21.643 80.136 1.00 27.83 C ATOM 996 CD1 LEU A 113 18.075 22.178 79.314 1.00 26.54 C ATOM 997 CD2 LEU A 113 20.341 22.709 80.283 1.00 34.28 C ATOM 998 H LEU A 113 17.708 20.242 83.645 1.00 0.00 H ATOM 999 N PRO A 114 19.053 18.048 81.268 1.00 28.04 N ATOM 1000 CA PRO A 114 19.545 16.862 80.555 1.00 33.13 C ATOM 1001 C PRO A 114 18.409 15.953 80.073 1.00 35.80 C ATOM 1002 O PRO A 114 18.522 15.384 78.984 1.00 26.16 O ATOM 1003 CB PRO A 114 20.401 16.150 81.607 1.00 29.68 C ATOM 1004 CG PRO A 114 20.815 17.242 82.554 1.00 37.56 C ATOM 1005 CD PRO A 114 19.644 18.167 82.615 1.00 29.71 C ATOM 1006 N VAL A 115 17.340 15.824 80.859 1.00 26.73 N ATOM 1007 CA VAL A 115 16.206 15.021 80.430 1.00 25.98 C ATOM 1008 C VAL A 115 15.434 15.717 79.294 1.00 24.67 C ATOM 1009 O VAL A 115 15.013 15.061 78.349 1.00 24.07 O ATOM 1010 CB VAL A 115 15.254 14.696 81.593 1.00 29.65 C ATOM 1011 CG1 VAL A 115 14.011 13.966 81.063 1.00 26.03 C ATOM 1012 CG2 VAL A 115 15.985 13.843 82.661 1.00 28.16 C ATOM 1013 H VAL A 115 17.317 16.300 81.783 1.00 0.00 H ATOM 1014 N LEU A 116 15.271 17.037 79.382 1.00 24.87 N ATOM 1015 CA LEU A 116 14.631 17.792 78.305 1.00 26.93 C ATOM 1016 C LEU A 116 15.438 17.655 77.006 1.00 26.93 C ATOM 1017 O LEU A 116 14.874 17.476 75.921 1.00 22.49 O ATOM 1018 CB LEU A 116 14.484 19.270 78.687 1.00 23.73 C ATOM 1019 CG LEU A 116 13.703 19.570 79.978 1.00 24.26 C ATOM 1020 CD1 LEU A 116 13.517 21.074 80.142 1.00 24.49 C ATOM 1021 CD2 LEU A 116 12.357 18.857 79.989 1.00 24.00 C ATOM 1022 H LEU A 116 15.604 17.538 80.230 1.00 0.00 H ATOM 1023 N MET A 117 16.759 17.727 77.126 1.00 24.33 N ATOM 1024 CA MET A 117 17.625 17.612 75.956 1.00 24.88 C ATOM 1025 C MET A 117 17.546 16.214 75.343 1.00 25.20 C ATOM 1026 O MET A 117 17.434 16.085 74.121 1.00 26.98 O ATOM 1027 CB MET A 117 19.066 17.969 76.311 1.00 27.41 C ATOM 1028 CG MET A 117 19.285 19.465 76.545 1.00 25.23 C ATOM 1029 SD MET A 117 21.030 19.821 76.836 1.00 36.83 S ATOM 1030 CE MET A 117 21.029 21.608 76.776 1.00 51.50 C ATOM 1031 H MET A 117 17.182 17.867 78.066 1.00 0.00 H ATOM 1032 N LEU A 118 17.570 15.182 76.190 1.00 26.46 N ATOM 1033 CA LEU A 118 17.345 13.810 75.745 1.00 27.33 C ATOM 1034 C LEU A 118 16.011 13.644 75.018 1.00 23.01 C ATOM 1035 O LEU A 118 15.911 12.902 74.058 1.00 22.80 O ATOM 1036 CB LEU A 118 17.374 12.854 76.933 1.00 29.39 C ATOM 1037 CG LEU A 118 18.295 11.645 76.922 1.00 39.65 C ATOM 1038 CD1 LEU A 118 19.594 11.907 76.171 1.00 34.68 C ATOM 1039 CD2 LEU A 118 18.572 11.231 78.369 1.00 40.87 C ATOM 1040 H LEU A 118 17.755 15.361 77.198 1.00 0.00 H ATOM 1041 N ALA A 119 14.982 14.297 75.530 1.00 22.77 N ATOM 1042 CA ALA A 119 13.661 14.228 74.926 1.00 25.67 C ATOM 1043 C ALA A 119 13.710 14.811 73.503 1.00 25.54 C ATOM 1044 O ALA A 119 13.195 14.206 72.561 1.00 22.59 O ATOM 1045 CB ALA A 119 12.645 14.973 75.798 1.00 22.42 C ATOM 1046 H ALA A 119 15.120 14.873 76.385 1.00 0.00 H ATOM 1047 N GLY A 120 14.338 15.981 73.368 1.00 22.15 N ATOM 1048 CA GLY A 120 14.622 16.569 72.069 1.00 23.10 C ATOM 1049 C GLY A 120 15.337 15.586 71.150 1.00 22.76 C ATOM 1050 O GLY A 120 14.938 15.404 69.994 1.00 23.55 O ATOM 1051 H GLY A 120 14.635 16.491 74.224 1.00 0.00 H ATOM 1052 N MET A 121 16.380 14.939 71.670 1.00 23.57 N ATOM 1053 CA MET A 121 17.152 13.959 70.900 1.00 22.00 C ATOM 1054 C MET A 121 16.331 12.722 70.530 1.00 23.64 C ATOM 1055 O MET A 121 16.571 12.099 69.489 1.00 22.38 O ATOM 1056 CB MET A 121 18.399 13.547 71.682 1.00 22.80 C ATOM 1057 CG MET A 121 19.414 14.683 71.806 1.00 23.24 C ATOM 1058 SD MET A 121 20.714 14.421 73.038 1.00 33.50 S ATOM 1059 CE MET A 121 21.422 12.895 72.430 1.00 26.25 C ATOM 1060 H MET A 121 16.655 15.136 72.654 1.00 0.00 H ATOM 1061 N GLY A 122 15.371 12.367 71.382 1.00 22.01 N ATOM 1062 CA GLY A 122 14.455 11.279 71.082 1.00 22.24 C ATOM 1063 C GLY A 122 13.662 11.597 69.823 1.00 23.89 C ATOM 1064 O GLY A 122 13.474 10.742 68.956 1.00 23.71 O ATOM 1065 H GLY A 122 15.275 12.879 72.282 1.00 0.00 H ATOM 1066 N SER A 123 13.207 12.840 69.712 1.00 24.53 N ATOM 1067 CA SER A 123 12.492 13.261 68.515 1.00 24.23 C ATOM 1068 C SER A 123 13.436 13.257 67.308 1.00 21.44 C ATOM 1069 O SER A 123 13.035 12.888 66.217 1.00 21.70 O ATOM 1070 CB SER A 123 11.873 14.652 68.693 1.00 22.69 C ATOM 1071 OG SER A 123 10.842 14.636 69.668 1.00 23.73 O ATOM 1072 HG SER A 123 10.131 14.008 69.385 1.00 0.00 H ATOM 1073 H SER A 123 13.362 13.518 70.486 1.00 0.00 H ATOM 1074 N SER A 124 14.677 13.682 67.526 1.00 21.31 N ATOM 1075 CA SER A 124 15.690 13.673 66.480 1.00 21.47 C ATOM 1076 C SER A 124 15.847 12.261 65.899 1.00 21.79 C ATOM 1077 O SER A 124 15.814 12.072 64.688 1.00 22.01 O ATOM 1078 CB SER A 124 17.031 14.170 67.018 1.00 21.64 C ATOM 1079 OG SER A 124 16.957 15.526 67.408 1.00 21.72 O ATOM 1080 HG SER A 124 17.839 15.818 67.751 1.00 0.00 H ATOM 1081 H SER A 124 14.932 14.031 68.472 1.00 0.00 H ATOM 1082 N VAL A 125 16.009 11.278 66.775 1.00 22.10 N ATOM 1083 CA VAL A 125 16.183 9.902 66.348 1.00 22.54 C ATOM 1084 C VAL A 125 14.941 9.355 65.632 1.00 24.89 C ATOM 1085 O VAL A 125 15.052 8.732 64.562 1.00 23.17 O ATOM 1086 CB VAL A 125 16.530 8.993 67.544 1.00 23.03 C ATOM 1087 CG1 VAL A 125 16.487 7.529 67.134 1.00 30.97 C ATOM 1088 CG2 VAL A 125 17.903 9.353 68.110 1.00 23.72 C ATOM 1089 H VAL A 125 16.011 11.499 67.791 1.00 0.00 H ATOM 1090 N ALA A 126 13.766 9.579 66.217 1.00 22.70 N ATOM 1091 CA ALA A 126 12.519 9.075 65.641 1.00 26.39 C ATOM 1092 C ALA A 126 12.251 9.671 64.247 1.00 25.31 C ATOM 1093 O ALA A 126 11.828 8.964 63.332 1.00 24.04 O ATOM 1094 CB ALA A 126 11.350 9.367 66.568 1.00 23.38 C ATOM 1095 H ALA A 126 13.734 10.124 67.102 1.00 0.00 H ATOM 1096 N SER A 127 12.483 10.974 64.103 1.00 22.79 N ATOM 1097 CA SER A 127 12.258 11.622 62.826 1.00 23.08 C ATOM 1098 C SER A 127 13.297 11.139 61.825 1.00 23.28 C ATOM 1099 O SER A 127 13.010 11.061 60.648 1.00 23.90 O ATOM 1100 CB SER A 127 12.289 13.155 62.948 1.00 22.72 C ATOM 1101 OG SER A 127 13.535 13.615 63.433 1.00 22.20 O ATOM 1102 HG SER A 127 13.703 13.227 64.328 1.00 0.00 H ATOM 1103 H SER A 127 12.828 11.530 64.911 1.00 0.00 H ATOM 1104 N PHE A 128 14.499 10.805 62.287 1.00 22.98 N ATOM 1105 CA PHE A 128 15.523 10.325 61.353 1.00 23.36 C ATOM 1106 C PHE A 128 15.115 8.949 60.800 1.00 24.17 C ATOM 1107 O PHE A 128 15.254 8.674 59.610 1.00 24.66 O ATOM 1108 CB PHE A 128 16.900 10.271 62.024 1.00 23.20 C ATOM 1109 CG PHE A 128 18.038 10.529 61.081 1.00 25.14 C ATOM 1110 CD1 PHE A 128 18.459 11.826 60.816 1.00 26.25 C ATOM 1111 CD2 PHE A 128 18.674 9.481 60.438 1.00 24.26 C ATOM 1112 CE1 PHE A 128 19.501 12.069 59.948 1.00 24.21 C ATOM 1113 CE2 PHE A 128 19.724 9.722 59.555 1.00 27.84 C ATOM 1114 CZ PHE A 128 20.139 11.016 59.314 1.00 24.83 C ATOM 1115 H PHE A 128 14.711 10.884 63.302 1.00 0.00 H ATOM 1116 N ILE A 129 14.573 8.103 61.669 1.00 24.20 N ATOM 1117 CA ILE A 129 14.032 6.824 61.229 1.00 27.41 C ATOM 1118 C ILE A 129 12.949 7.037 60.176 1.00 25.75 C ATOM 1119 O ILE A 129 12.978 6.402 59.112 1.00 26.59 O ATOM 1120 CB ILE A 129 13.444 6.029 62.404 1.00 29.04 C ATOM 1121 CG1 ILE A 129 14.564 5.614 63.364 1.00 25.26 C ATOM 1122 CG2 ILE A 129 12.653 4.834 61.876 1.00 26.70 C ATOM 1123 CD1 ILE A 129 14.068 4.932 64.632 1.00 25.69 C ATOM 1124 H ILE A 129 14.534 8.357 62.677 1.00 0.00 H ATOM 1125 N TYR A 130 12.012 7.940 60.475 1.00 25.52 N ATOM 1126 CA TYR A 130 10.946 8.291 59.544 1.00 26.35 C ATOM 1127 C TYR A 130 11.515 8.687 58.170 1.00 26.96 C ATOM 1128 O TYR A 130 11.044 8.216 57.133 1.00 27.81 O ATOM 1129 CB TYR A 130 10.093 9.436 60.108 1.00 26.07 C ATOM 1130 CG TYR A 130 9.096 10.019 59.125 1.00 27.12 C ATOM 1131 CD1 TYR A 130 9.456 11.056 58.269 1.00 27.12 C ATOM 1132 CD2 TYR A 130 7.802 9.536 59.051 1.00 28.40 C ATOM 1133 CE1 TYR A 130 8.545 11.596 57.359 1.00 28.38 C ATOM 1134 CE2 TYR A 130 6.879 10.072 58.151 1.00 34.44 C ATOM 1135 CZ TYR A 130 7.261 11.103 57.307 1.00 34.59 C ATOM 1136 OH TYR A 130 6.358 11.635 56.409 1.00 31.23 O ATOM 1137 HH TYR A 130 6.050 10.924 55.793 1.00 0.00 H ATOM 1138 H TYR A 130 12.044 8.409 61.403 1.00 0.00 H ATOM 1139 N ASP A 131 12.534 9.542 58.178 1.00 25.85 N ATOM 1140 CA ASP A 131 13.110 10.036 56.930 1.00 30.89 C ATOM 1141 C ASP A 131 13.781 8.949 56.089 1.00 28.33 C ATOM 1142 O ASP A 131 13.770 9.013 54.857 1.00 27.86 O ATOM 1143 CB ASP A 131 14.113 11.151 57.226 1.00 25.54 C ATOM 1144 CG ASP A 131 13.433 12.444 57.653 1.00 25.28 C ATOM 1145 OD1 ASP A 131 12.239 12.649 57.314 1.00 25.95 O ATOM 1146 OD2 ASP A 131 14.104 13.254 58.314 1.00 25.57 O ATOM 1147 H ASP A 131 12.926 9.863 59.086 1.00 0.00 H ATOM 1148 N LEU A 132 14.377 7.962 56.752 1.00 26.67 N ATOM 1149 CA LEU A 132 14.966 6.827 56.043 1.00 27.47 C ATOM 1150 C LEU A 132 13.890 6.002 55.322 1.00 28.71 C ATOM 1151 O LEU A 132 14.159 5.382 54.309 1.00 29.68 O ATOM 1152 CB LEU A 132 15.764 5.945 57.010 1.00 27.17 C ATOM 1153 CG LEU A 132 17.098 6.539 57.473 1.00 26.50 C ATOM 1154 CD1 LEU A 132 17.620 5.821 58.716 1.00 29.81 C ATOM 1155 CD2 LEU A 132 18.132 6.490 56.320 1.00 27.18 C ATOM 1156 H LEU A 132 14.425 7.998 57.790 1.00 0.00 H ATOM 1157 N PHE A 133 12.671 6.002 55.854 1.00 28.88 N ATOM 1158 CA PHE A 133 11.563 5.321 55.193 1.00 34.85 C ATOM 1159 C PHE A 133 10.936 6.154 54.081 1.00 31.20 C ATOM 1160 O PHE A 133 10.607 5.634 53.015 1.00 32.66 O ATOM 1161 CB PHE A 133 10.474 4.950 56.205 1.00 35.09 C ATOM 1162 CG PHE A 133 10.789 3.723 57.000 1.00 33.64 C ATOM 1163 CD1 PHE A 133 10.598 2.461 56.451 1.00 38.98 C ATOM 1164 CD2 PHE A 133 11.285 3.824 58.287 1.00 29.63 C ATOM 1165 CE1 PHE A 133 10.896 1.323 57.181 1.00 42.77 C ATOM 1166 CE2 PHE A 133 11.582 2.688 59.024 1.00 30.05 C ATOM 1167 CZ PHE A 133 11.394 1.441 58.473 1.00 31.59 C ATOM 1168 H PHE A 133 12.505 6.495 56.755 1.00 0.00 H ATOM 1169 N VAL A 134 10.780 7.446 54.339 1.00 30.47 N ATOM 1170 CA VAL A 134 9.862 8.255 53.564 1.00 31.53 C ATOM 1171 C VAL A 134 10.526 9.355 52.748 1.00 31.45 C ATOM 1172 O VAL A 134 10.082 9.644 51.646 1.00 32.87 O ATOM 1173 CB VAL A 134 8.801 8.911 54.487 1.00 35.99 C ATOM 1174 CG1 VAL A 134 7.964 9.911 53.704 1.00 38.29 C ATOM 1175 CG2 VAL A 134 7.910 7.840 55.101 1.00 38.93 C ATOM 1176 H VAL A 134 11.325 7.884 55.109 1.00 0.00 H ATOM 1177 N SER A 135 11.589 9.949 53.291 1.00 30.06 N ATOM 1178 CA SER A 135 12.094 11.225 52.784 1.00 33.89 C ATOM 1179 C SER A 135 13.334 11.107 51.899 1.00 30.35 C ATOM 1180 O SER A 135 14.022 12.100 51.657 1.00 30.28 O ATOM 1181 CB SER A 135 12.399 12.160 53.956 1.00 28.71 C ATOM 1182 OG SER A 135 11.378 12.078 54.933 1.00 28.36 O ATOM 1183 HG SER A 135 11.591 12.688 55.683 1.00 0.00 H ATOM 1184 H SER A 135 12.070 9.495 54.093 1.00 0.00 H ATOM 1185 N GLY A 136 13.605 9.897 51.420 1.00 30.86 N ATOM 1186 CA GLY A 136 14.710 9.662 50.506 1.00 34.58 C ATOM 1187 C GLY A 136 16.082 9.618 51.158 1.00 33.79 C ATOM 1188 O GLY A 136 17.092 9.622 50.456 1.00 33.06 O ATOM 1189 H GLY A 136 13.009 9.095 51.708 1.00 0.00 H ATOM 1190 N TYR A 137 16.131 9.561 52.492 1.00 29.10 N ATOM 1191 CA TYR A 137 17.411 9.526 53.197 1.00 28.37 C ATOM 1192 C TYR A 137 18.172 8.234 52.942 1.00 28.86 C ATOM 1193 O TYR A 137 19.385 8.190 53.071 1.00 29.06 O ATOM 1194 CB TYR A 137 17.207 9.715 54.709 1.00 27.15 C ATOM 1195 CG TYR A 137 17.195 11.160 55.129 1.00 26.64 C ATOM 1196 CD1 TYR A 137 16.599 12.132 54.323 1.00 27.24 C ATOM 1197 CD2 TYR A 137 17.775 11.560 56.326 1.00 29.40 C ATOM 1198 CE1 TYR A 137 16.584 13.463 54.703 1.00 26.99 C ATOM 1199 CE2 TYR A 137 17.762 12.891 56.720 1.00 27.75 C ATOM 1200 CZ TYR A 137 17.167 13.837 55.907 1.00 27.28 C ATOM 1201 OH TYR A 137 17.166 15.161 56.297 1.00 26.01 O ATOM 1202 HH TYR A 137 16.705 15.706 55.611 1.00 0.00 H ATOM 1203 H TYR A 137 15.245 9.541 53.037 1.00 0.00 H ATOM 1204 N ALA A 138 17.455 7.182 52.571 1.00 29.49 N ATOM 1205 CA ALA A 138 18.082 5.889 52.363 1.00 30.14 C ATOM 1206 C ALA A 138 19.014 5.900 51.142 1.00 31.17 C ATOM 1207 O ALA A 138 19.826 4.997 50.969 1.00 35.90 O ATOM 1208 CB ALA A 138 17.020 4.810 52.218 1.00 37.18 C ATOM 1209 H ALA A 138 16.430 7.284 52.427 1.00 0.00 H ATOM 1210 N ALA A 139 18.899 6.936 50.316 1.00 34.04 N ATOM 1211 CA ALA A 139 19.740 7.094 49.136 1.00 34.28 C ATOM 1212 C ALA A 139 21.123 7.678 49.447 1.00 33.66 C ATOM 1213 O ALA A 139 22.005 7.672 48.581 1.00 34.97 O ATOM 1214 CB ALA A 139 19.027 7.978 48.100 1.00 34.38 C ATOM 1215 H ALA A 139 18.182 7.661 50.520 1.00 0.00 H ATOM 1216 N TYR A 140 21.311 8.169 50.675 1.00 31.33 N ATOM 1217 CA TYR A 140 22.518 8.922 51.035 1.00 31.35 C ATOM 1218 C TYR A 140 23.623 8.030 51.608 1.00 35.01 C ATOM 1219 O TYR A 140 23.370 6.906 52.050 1.00 33.84 O ATOM 1220 CB TYR A 140 22.168 10.033 52.036 1.00 30.26 C ATOM 1221 CG TYR A 140 21.137 11.007 51.510 1.00 30.29 C ATOM 1222 CD1 TYR A 140 21.161 11.417 50.177 1.00 32.65 C ATOM 1223 CD2 TYR A 140 20.124 11.494 52.331 1.00 29.28 C ATOM 1224 CE1 TYR A 140 20.212 12.300 49.680 1.00 31.91 C ATOM 1225 CE2 TYR A 140 19.168 12.375 51.842 1.00 29.57 C ATOM 1226 CZ TYR A 140 19.216 12.776 50.517 1.00 30.93 C ATOM 1227 OH TYR A 140 18.280 13.653 50.010 1.00 31.54 O ATOM 1228 HH TYR A 140 17.377 13.259 50.101 1.00 0.00 H ATOM 1229 H TYR A 140 20.580 8.013 51.398 1.00 0.00 H ATOM 1230 N SER A 141 24.847 8.547 51.594 1.00 32.27 N ATOM 1231 CA SER A 141 26.009 7.813 52.099 1.00 38.13 C ATOM 1232 C SER A 141 26.047 7.772 53.630 1.00 31.95 C ATOM 1233 O SER A 141 25.431 8.610 54.298 1.00 30.89 O ATOM 1234 CB SER A 141 27.299 8.448 51.583 1.00 34.30 C ATOM 1235 OG SER A 141 27.554 9.660 52.280 1.00 38.10 O ATOM 1236 HG SER A 141 27.647 9.470 53.247 1.00 0.00 H ATOM 1237 H SER A 141 24.984 9.504 51.212 1.00 0.00 H ATOM 1238 N PRO A 142 26.787 6.801 54.190 1.00 32.54 N ATOM 1239 CA PRO A 142 26.948 6.739 55.646 1.00 32.22 C ATOM 1240 C PRO A 142 27.526 8.033 56.222 1.00 32.01 C ATOM 1241 O PRO A 142 27.049 8.493 57.256 1.00 31.01 O ATOM 1242 CB PRO A 142 27.908 5.560 55.843 1.00 33.35 C ATOM 1243 CG PRO A 142 27.648 4.672 54.652 1.00 33.95 C ATOM 1244 CD PRO A 142 27.404 5.643 53.514 1.00 33.86 C ATOM 1245 N GLY A 143 28.520 8.615 55.558 1.00 33.27 N ATOM 1246 CA GLY A 143 29.110 9.858 56.029 1.00 33.63 C ATOM 1247 C GLY A 143 28.124 11.026 56.096 1.00 32.40 C ATOM 1248 O GLY A 143 28.049 11.744 57.086 1.00 31.91 O ATOM 1249 H GLY A 143 28.881 8.174 54.688 1.00 0.00 H ATOM 1250 N TYR A 144 27.373 11.216 55.023 1.00 32.12 N ATOM 1251 CA TYR A 144 26.378 12.273 54.962 1.00 31.38 C ATOM 1252 C TYR A 144 25.285 12.065 56.004 1.00 29.63 C ATOM 1253 O TYR A 144 24.864 13.009 56.672 1.00 29.00 O ATOM 1254 CB TYR A 144 25.754 12.323 53.572 1.00 31.56 C ATOM 1255 CG TYR A 144 24.950 13.560 53.252 1.00 31.35 C ATOM 1256 CD1 TYR A 144 25.550 14.820 53.205 1.00 32.24 C ATOM 1257 CD2 TYR A 144 23.601 13.466 52.922 1.00 30.60 C ATOM 1258 CE1 TYR A 144 24.818 15.954 52.869 1.00 32.33 C ATOM 1259 CE2 TYR A 144 22.868 14.583 52.580 1.00 30.72 C ATOM 1260 CZ TYR A 144 23.480 15.825 52.557 1.00 33.77 C ATOM 1261 OH TYR A 144 22.741 16.935 52.225 1.00 31.89 O ATOM 1262 HH TYR A 144 23.321 17.737 52.255 1.00 0.00 H ATOM 1263 H TYR A 144 27.498 10.592 54.201 1.00 0.00 H ATOM 1264 N LEU A 145 24.813 10.827 56.104 1.00 29.16 N ATOM 1265 CA LEU A 145 23.756 10.496 57.057 1.00 27.91 C ATOM 1266 C LEU A 145 24.237 10.694 58.489 1.00 27.64 C ATOM 1267 O LEU A 145 23.512 11.233 59.324 1.00 26.73 O ATOM 1268 CB LEU A 145 23.272 9.064 56.857 1.00 27.89 C ATOM 1269 CG LEU A 145 22.391 8.881 55.613 1.00 28.06 C ATOM 1270 CD1 LEU A 145 22.124 7.407 55.338 1.00 28.47 C ATOM 1271 CD2 LEU A 145 21.086 9.658 55.808 1.00 27.19 C ATOM 1272 H LEU A 145 25.203 10.081 55.493 1.00 0.00 H ATOM 1273 N LEU A 146 25.460 10.254 58.758 1.00 28.64 N ATOM 1274 CA LEU A 146 26.041 10.375 60.083 1.00 28.82 C ATOM 1275 C LEU A 146 26.168 11.842 60.478 1.00 28.74 C ATOM 1276 O LEU A 146 25.835 12.224 61.601 1.00 29.51 O ATOM 1277 CB LEU A 146 27.409 9.679 60.137 1.00 30.38 C ATOM 1278 CG LEU A 146 27.350 8.145 60.158 1.00 41.21 C ATOM 1279 CD1 LEU A 146 28.741 7.503 60.029 1.00 40.58 C ATOM 1280 CD2 LEU A 146 26.647 7.661 61.420 1.00 47.02 C ATOM 1281 H LEU A 146 26.017 9.811 58.000 1.00 0.00 H ATOM 1282 N ILE A 147 26.644 12.667 59.554 1.00 29.51 N ATOM 1283 CA ILE A 147 26.780 14.088 59.831 1.00 29.74 C ATOM 1284 C ILE A 147 25.407 14.728 60.092 1.00 28.32 C ATOM 1285 O ILE A 147 25.248 15.519 61.026 1.00 28.04 O ATOM 1286 CB ILE A 147 27.500 14.815 58.682 1.00 31.11 C ATOM 1287 CG1 ILE A 147 28.964 14.368 58.623 1.00 38.23 C ATOM 1288 CG2 ILE A 147 27.434 16.311 58.890 1.00 31.42 C ATOM 1289 CD1 ILE A 147 29.698 14.794 57.365 1.00 38.59 C ATOM 1290 H ILE A 147 26.922 12.294 58.624 1.00 0.00 H ATOM 1291 N MET A 148 24.408 14.360 59.296 1.00 27.60 N ATOM 1292 CA MET A 148 23.074 14.937 59.465 1.00 27.81 C ATOM 1293 C MET A 148 22.437 14.514 60.799 1.00 26.40 C ATOM 1294 O MET A 148 21.822 15.334 61.471 1.00 25.00 O ATOM 1295 CB MET A 148 22.154 14.561 58.300 1.00 26.40 C ATOM 1296 CG MET A 148 22.478 15.323 56.990 1.00 30.02 C ATOM 1297 SD MET A 148 21.138 15.282 55.757 1.00 29.44 S ATOM 1298 CE MET A 148 21.139 13.534 55.379 1.00 27.43 C ATOM 1299 H MET A 148 24.576 13.657 58.548 1.00 0.00 H ATOM 1300 N LEU A 149 22.583 13.243 61.167 1.00 25.76 N ATOM 1301 CA LEU A 149 22.056 12.766 62.443 1.00 24.72 C ATOM 1302 C LEU A 149 22.691 13.499 63.624 1.00 24.96 C ATOM 1303 O LEU A 149 21.998 13.887 64.568 1.00 24.33 O ATOM 1304 CB LEU A 149 22.278 11.265 62.609 1.00 24.99 C ATOM 1305 CG LEU A 149 21.758 10.675 63.924 1.00 24.59 C ATOM 1306 CD1 LEU A 149 20.280 10.977 64.129 1.00 23.64 C ATOM 1307 CD2 LEU A 149 22.028 9.159 63.972 1.00 25.21 C ATOM 1308 H LEU A 149 23.079 12.581 60.537 1.00 0.00 H ATOM 1309 N VAL A 150 24.008 13.666 63.574 1.00 26.08 N ATOM 1310 CA VAL A 150 24.711 14.357 64.639 1.00 32.45 C ATOM 1311 C VAL A 150 24.207 15.799 64.774 1.00 26.38 C ATOM 1312 O VAL A 150 23.895 16.255 65.881 1.00 26.10 O ATOM 1313 CB VAL A 150 26.230 14.348 64.412 1.00 28.37 C ATOM 1314 CG1 VAL A 150 26.900 15.354 65.314 1.00 29.31 C ATOM 1315 CG2 VAL A 150 26.790 12.944 64.658 1.00 28.97 C ATOM 1316 H VAL A 150 24.542 13.297 62.761 1.00 0.00 H ATOM 1317 N ILE A 151 24.128 16.509 63.648 1.00 26.59 N ATOM 1318 CA ILE A 151 23.576 17.860 63.643 1.00 26.49 C ATOM 1319 C ILE A 151 22.139 17.868 64.173 1.00 33.20 C ATOM 1320 O ILE A 151 21.776 18.719 64.983 1.00 25.03 O ATOM 1321 CB ILE A 151 23.591 18.493 62.237 1.00 27.10 C ATOM 1322 CG1 ILE A 151 25.029 18.576 61.699 1.00 28.70 C ATOM 1323 CG2 ILE A 151 22.945 19.875 62.281 1.00 27.19 C ATOM 1324 CD1 ILE A 151 25.130 19.045 60.233 1.00 29.56 C ATOM 1325 H ILE A 151 24.466 16.092 62.757 1.00 0.00 H ATOM 1326 N ARG A 152 21.319 16.921 63.729 1.00 24.38 N ATOM 1327 CA ARG A 152 19.936 16.900 64.194 1.00 28.62 C ATOM 1328 C ARG A 152 19.855 16.582 65.694 1.00 23.06 C ATOM 1329 O ARG A 152 18.983 17.105 66.390 1.00 23.19 O ATOM 1330 CB ARG A 152 19.080 15.901 63.414 1.00 23.01 C ATOM 1331 CG ARG A 152 17.565 16.132 63.635 1.00 22.44 C ATOM 1332 CD ARG A 152 16.683 15.133 62.868 1.00 22.38 C ATOM 1333 NE ARG A 152 16.856 15.238 61.414 1.00 22.97 N ATOM 1334 CZ ARG A 152 16.116 14.587 60.522 1.00 23.25 C ATOM 1335 NH1 ARG A 152 15.141 13.778 60.922 1.00 27.61 N ATOM 1336 NH2 ARG A 152 16.352 14.747 59.223 1.00 24.62 N ATOM 1337 HE ARG A 152 17.607 15.863 61.058 1.00 0.00 H ATOM 1338 HH12 ARG A 152 14.565 13.271 60.220 1.00 0.00 H ATOM 1339 HH11 ARG A 152 14.954 13.652 61.937 1.00 0.00 H ATOM 1340 HH22 ARG A 152 15.774 14.239 58.523 1.00 0.00 H ATOM 1341 HH21 ARG A 152 17.114 15.380 58.907 1.00 0.00 H ATOM 1342 H ARG A 152 21.659 16.203 63.058 1.00 0.00 H ATOM 1343 N LEU A 153 20.748 15.727 66.183 1.00 23.44 N ATOM 1344 CA LEU A 153 20.775 15.420 67.611 1.00 23.42 C ATOM 1345 C LEU A 153 21.120 16.674 68.427 1.00 23.84 C ATOM 1346 O LEU A 153 20.481 16.970 69.438 1.00 23.51 O ATOM 1347 CB LEU A 153 21.766 14.294 67.901 1.00 27.47 C ATOM 1348 CG LEU A 153 21.307 12.874 67.536 1.00 27.56 C ATOM 1349 CD1 LEU A 153 22.478 11.910 67.505 1.00 24.94 C ATOM 1350 CD2 LEU A 153 20.248 12.390 68.516 1.00 23.39 C ATOM 1351 H LEU A 153 21.432 15.274 65.544 1.00 0.00 H ATOM 1352 N ILE A 154 22.116 17.425 67.973 1.00 24.74 N ATOM 1353 CA ILE A 154 22.507 18.640 68.676 1.00 27.33 C ATOM 1354 C ILE A 154 21.388 19.680 68.648 1.00 24.84 C ATOM 1355 O ILE A 154 21.101 20.338 69.658 1.00 24.92 O ATOM 1356 CB ILE A 154 23.791 19.235 68.079 1.00 28.05 C ATOM 1357 CG1 ILE A 154 24.956 18.258 68.290 1.00 27.85 C ATOM 1358 CG2 ILE A 154 24.092 20.589 68.708 1.00 27.84 C ATOM 1359 CD1 ILE A 154 26.206 18.654 67.601 1.00 29.44 C ATOM 1360 H ILE A 154 22.621 17.144 67.109 1.00 0.00 H ATOM 1361 N SER A 155 20.756 19.811 67.487 1.00 24.41 N ATOM 1362 CA SER A 155 19.675 20.768 67.293 1.00 24.49 C ATOM 1363 C SER A 155 18.462 20.405 68.160 1.00 27.62 C ATOM 1364 O SER A 155 17.808 21.282 68.718 1.00 23.20 O ATOM 1365 CB SER A 155 19.267 20.840 65.806 1.00 27.94 C ATOM 1366 OG SER A 155 18.176 21.732 65.612 1.00 24.10 O ATOM 1367 HG SER A 155 18.435 22.639 65.912 1.00 0.00 H ATOM 1368 H SER A 155 21.043 19.209 66.689 1.00 0.00 H ATOM 1369 N GLY A 156 18.167 19.110 68.260 1.00 22.57 N ATOM 1370 CA GLY A 156 17.126 18.638 69.154 1.00 21.98 C ATOM 1371 C GLY A 156 17.456 18.973 70.610 1.00 25.43 C ATOM 1372 O GLY A 156 16.600 19.426 71.362 1.00 23.12 O ATOM 1373 H GLY A 156 18.694 18.422 67.685 1.00 0.00 H ATOM 1374 N ALA A 157 18.704 18.759 71.008 1.00 25.90 N ATOM 1375 CA ALA A 157 19.114 19.052 72.385 1.00 24.34 C ATOM 1376 C ALA A 157 18.982 20.559 72.667 1.00 25.70 C ATOM 1377 O ALA A 157 18.480 20.955 73.723 1.00 24.88 O ATOM 1378 CB ALA A 157 20.544 18.577 72.633 1.00 24.49 C ATOM 1379 H ALA A 157 19.400 18.379 70.335 1.00 0.00 H ATOM 1380 N LEU A 158 19.384 21.386 71.700 1.00 24.30 N ATOM 1381 CA LEU A 158 19.475 22.825 71.924 1.00 25.10 C ATOM 1382 C LEU A 158 18.198 23.617 71.594 1.00 26.28 C ATOM 1383 O LEU A 158 17.771 24.446 72.394 1.00 28.47 O ATOM 1384 CB LEU A 158 20.647 23.405 71.135 1.00 26.25 C ATOM 1385 CG LEU A 158 22.026 22.885 71.540 1.00 27.25 C ATOM 1386 CD1 LEU A 158 23.126 23.518 70.684 1.00 28.65 C ATOM 1387 CD2 LEU A 158 22.294 23.097 73.016 1.00 36.63 C ATOM 1388 H LEU A 158 19.637 20.998 70.769 1.00 0.00 H ATOM 1389 N LEU A 159 17.605 23.375 70.425 1.00 25.49 N ATOM 1390 CA LEU A 159 16.449 24.153 69.974 1.00 24.11 C ATOM 1391 C LEU A 159 15.123 23.619 70.496 1.00 23.32 C ATOM 1392 O LEU A 159 14.124 24.322 70.470 1.00 26.60 O ATOM 1393 CB LEU A 159 16.395 24.209 68.443 1.00 24.30 C ATOM 1394 CG LEU A 159 17.571 24.917 67.764 1.00 25.64 C ATOM 1395 CD1 LEU A 159 17.303 25.074 66.262 1.00 25.80 C ATOM 1396 CD2 LEU A 159 17.845 26.256 68.432 1.00 29.26 C ATOM 1397 H LEU A 159 17.972 22.615 69.818 1.00 0.00 H ATOM 1398 N ALA A 160 15.106 22.372 70.948 1.00 22.65 N ATOM 1399 CA ALA A 160 13.915 21.848 71.599 1.00 22.20 C ATOM 1400 C ALA A 160 14.117 21.808 73.114 1.00 24.81 C ATOM 1401 O ALA A 160 13.375 22.456 73.852 1.00 24.91 O ATOM 1402 CB ALA A 160 13.559 20.478 71.064 1.00 22.46 C ATOM 1403 H ALA A 160 15.945 21.768 70.837 1.00 0.00 H ATOM 1404 N GLY A 161 15.133 21.080 73.572 1.00 24.44 N ATOM 1405 CA GLY A 161 15.367 20.915 75.000 1.00 23.68 C ATOM 1406 C GLY A 161 15.699 22.214 75.733 1.00 30.42 C ATOM 1407 O GLY A 161 14.960 22.644 76.619 1.00 24.35 O ATOM 1408 H GLY A 161 15.774 20.619 72.895 1.00 0.00 H ATOM 1409 N LEU A 162 16.811 22.839 75.368 1.00 24.22 N ATOM 1410 CA LEU A 162 17.252 24.056 76.040 1.00 25.28 C ATOM 1411 C LEU A 162 16.344 25.260 75.744 1.00 25.81 C ATOM 1412 O LEU A 162 15.937 25.977 76.653 1.00 25.89 O ATOM 1413 CB LEU A 162 18.695 24.395 75.645 1.00 26.30 C ATOM 1414 CG LEU A 162 19.289 25.656 76.294 1.00 28.76 C ATOM 1415 CD1 LEU A 162 19.374 25.495 77.811 1.00 28.39 C ATOM 1416 CD2 LEU A 162 20.668 25.954 75.733 1.00 29.03 C ATOM 1417 H LEU A 162 17.379 22.453 74.587 1.00 0.00 H ATOM 1418 N LEU A 163 16.047 25.482 74.470 1.00 25.08 N ATOM 1419 CA LEU A 163 15.200 26.600 74.081 1.00 25.44 C ATOM 1420 C LEU A 163 13.768 26.420 74.601 1.00 24.93 C ATOM 1421 O LEU A 163 13.108 27.389 74.954 1.00 25.55 O ATOM 1422 CB LEU A 163 15.188 26.768 72.558 1.00 25.46 C ATOM 1423 CG LEU A 163 14.370 27.969 72.074 1.00 26.47 C ATOM 1424 CD1 LEU A 163 14.947 29.270 72.656 1.00 27.57 C ATOM 1425 CD2 LEU A 163 14.279 28.028 70.544 1.00 32.83 C ATOM 1426 H LEU A 163 16.425 24.847 73.738 1.00 0.00 H ATOM 1427 N GLY A 164 13.310 25.176 74.645 1.00 24.04 N ATOM 1428 CA GLY A 164 11.997 24.858 75.174 1.00 23.82 C ATOM 1429 C GLY A 164 11.903 25.176 76.659 1.00 24.25 C ATOM 1430 O GLY A 164 10.900 25.705 77.121 1.00 24.62 O ATOM 1431 H GLY A 164 13.910 24.405 74.289 1.00 0.00 H ATOM 1432 N LYS A 165 12.961 24.861 77.402 1.00 26.18 N ATOM 1433 CA LYS A 165 12.997 25.198 78.819 1.00 26.25 C ATOM 1434 C LYS A 165 13.008 26.717 79.014 1.00 29.79 C ATOM 1435 O LYS A 165 12.285 27.237 79.861 1.00 26.60 O ATOM 1436 CB LYS A 165 14.215 24.573 79.507 1.00 25.50 C ATOM 1437 CG LYS A 165 14.364 24.967 80.982 1.00 26.52 C ATOM 1438 CD LYS A 165 15.521 24.222 81.665 1.00 27.16 C ATOM 1439 CE LYS A 165 15.511 24.424 83.194 1.00 28.31 C ATOM 1440 NZ LYS A 165 15.733 25.834 83.574 1.00 29.37 N ATOM 1441 HZ1 LYS A 165 16.656 26.148 83.213 1.00 0.00 H ATOM 1442 HZ2 LYS A 165 14.981 26.424 83.165 1.00 0.00 H ATOM 1443 HZ3 LYS A 165 15.718 25.919 84.610 1.00 0.00 H ATOM 1444 H LYS A 165 13.769 24.370 76.968 1.00 0.00 H ATOM 1445 N ALA A 166 13.821 27.412 78.223 1.00 26.51 N ATOM 1446 CA ALA A 166 13.908 28.868 78.290 1.00 28.05 C ATOM 1447 C ALA A 166 12.568 29.556 78.003 1.00 27.79 C ATOM 1448 O ALA A 166 12.163 30.466 78.717 1.00 28.71 O ATOM 1449 CB ALA A 166 14.971 29.378 77.326 1.00 28.32 C ATOM 1450 H ALA A 166 14.413 26.903 77.536 1.00 0.00 H ATOM 1451 N VAL A 167 11.896 29.133 76.941 1.00 31.28 N ATOM 1452 CA VAL A 167 10.587 29.677 76.629 1.00 27.40 C ATOM 1453 C VAL A 167 9.595 29.441 77.784 1.00 27.43 C ATOM 1454 O VAL A 167 8.877 30.350 78.202 1.00 28.37 O ATOM 1455 CB VAL A 167 10.028 29.054 75.339 1.00 30.34 C ATOM 1456 CG1 VAL A 167 8.570 29.472 75.135 1.00 27.37 C ATOM 1457 CG2 VAL A 167 10.914 29.440 74.136 1.00 27.95 C ATOM 1458 H VAL A 167 12.311 28.404 76.326 1.00 0.00 H ATOM 1459 N SER A 168 9.571 28.209 78.282 1.00 26.58 N ATOM 1460 CA SER A 168 8.654 27.803 79.347 1.00 27.98 C ATOM 1461 C SER A 168 8.888 28.610 80.615 1.00 28.58 C ATOM 1462 O SER A 168 7.939 29.114 81.219 1.00 28.38 O ATOM 1463 CB SER A 168 8.808 26.309 79.647 1.00 25.89 C ATOM 1464 OG SER A 168 8.512 25.527 78.500 1.00 25.18 O ATOM 1465 HG SER A 168 9.132 25.770 77.767 1.00 0.00 H ATOM 1466 H SER A 168 10.232 27.504 77.898 1.00 0.00 H ATOM 1467 N ASP A 169 10.159 28.733 80.995 1.00 27.84 N ATOM 1468 CA ASP A 169 10.554 29.508 82.168 1.00 28.97 C ATOM 1469 C ASP A 169 10.113 30.965 82.029 1.00 30.06 C ATOM 1470 O ASP A 169 9.576 31.556 82.981 1.00 30.99 O ATOM 1471 CB ASP A 169 12.075 29.438 82.389 1.00 29.31 C ATOM 1472 CG ASP A 169 12.536 28.085 82.928 1.00 31.06 C ATOM 1473 OD1 ASP A 169 11.676 27.296 83.364 1.00 28.33 O ATOM 1474 OD2 ASP A 169 13.763 27.821 82.927 1.00 29.05 O ATOM 1475 H ASP A 169 10.897 28.260 80.436 1.00 0.00 H ATOM 1476 N SER A 170 10.347 31.534 80.845 1.00 30.12 N ATOM 1477 CA SER A 170 9.934 32.907 80.557 1.00 31.37 C ATOM 1478 C SER A 170 8.433 33.085 80.747 1.00 31.65 C ATOM 1479 O SER A 170 7.993 34.055 81.339 1.00 32.91 O ATOM 1480 CB SER A 170 10.325 33.311 79.130 1.00 31.46 C ATOM 1481 OG SER A 170 11.731 33.353 78.981 1.00 38.34 O ATOM 1482 HG SER A 170 12.109 32.458 79.173 1.00 0.00 H ATOM 1483 H SER A 170 10.836 30.987 80.108 1.00 0.00 H ATOM 1484 N LEU A 171 7.652 32.136 80.245 1.00 30.68 N ATOM 1485 CA LEU A 171 6.206 32.161 80.451 1.00 31.15 C ATOM 1486 C LEU A 171 5.858 32.055 81.939 1.00 31.59 C ATOM 1487 O LEU A 171 5.024 32.807 82.441 1.00 32.78 O ATOM 1488 CB LEU A 171 5.529 31.034 79.670 1.00 30.22 C ATOM 1489 CG LEU A 171 5.399 31.259 78.156 1.00 39.73 C ATOM 1490 CD1 LEU A 171 5.076 29.955 77.424 1.00 33.83 C ATOM 1491 CD2 LEU A 171 4.337 32.325 77.863 1.00 38.51 C ATOM 1492 H LEU A 171 8.077 31.362 79.696 1.00 0.00 H ATOM 1493 N ALA A 172 6.502 31.118 82.636 1.00 33.24 N ATOM 1494 CA ALA A 172 6.271 30.939 84.072 1.00 31.39 C ATOM 1495 C ALA A 172 6.453 32.238 84.848 1.00 32.81 C ATOM 1496 O ALA A 172 5.692 32.522 85.763 1.00 33.75 O ATOM 1497 CB ALA A 172 7.184 29.872 84.631 1.00 30.67 C ATOM 1498 H ALA A 172 7.183 30.501 82.150 1.00 0.00 H ATOM 1499 N TYR A 173 7.452 33.022 84.460 1.00 34.13 N ATOM 1500 CA TYR A 173 7.726 34.306 85.094 1.00 39.01 C ATOM 1501 C TYR A 173 6.627 35.358 84.845 1.00 39.98 C ATOM 1502 O TYR A 173 6.575 36.360 85.545 1.00 37.80 O ATOM 1503 CB TYR A 173 9.081 34.858 84.618 1.00 42.60 C ATOM 1504 CG TYR A 173 10.303 34.063 85.063 1.00 38.09 C ATOM 1505 CD1 TYR A 173 10.443 33.632 86.374 1.00 38.17 C ATOM 1506 CD2 TYR A 173 11.320 33.755 84.165 1.00 37.07 C ATOM 1507 CE1 TYR A 173 11.557 32.917 86.779 1.00 38.19 C ATOM 1508 CE2 TYR A 173 12.433 33.029 84.558 1.00 39.55 C ATOM 1509 CZ TYR A 173 12.549 32.614 85.865 1.00 40.91 C ATOM 1510 OH TYR A 173 13.654 31.890 86.262 1.00 38.94 O ATOM 1511 HH TYR A 173 13.703 31.051 85.738 1.00 0.00 H ATOM 1512 H TYR A 173 8.060 32.709 83.677 1.00 0.00 H ATOM 1513 N THR A 174 5.755 35.150 83.859 1.00 40.96 N ATOM 1514 CA THR A 174 4.673 36.117 83.617 1.00 36.83 C ATOM 1515 C THR A 174 3.512 35.900 84.587 1.00 46.13 C ATOM 1516 O THR A 174 2.675 36.783 84.774 1.00 50.63 O ATOM 1517 CB THR A 174 4.125 36.055 82.158 1.00 40.76 C ATOM 1518 OG1 THR A 174 3.493 34.789 81.909 1.00 38.36 O ATOM 1519 CG2 THR A 174 5.245 36.270 81.141 1.00 39.60 C ATOM 1520 HG1 THR A 174 4.153 34.062 82.036 1.00 0.00 H ATOM 1521 H THR A 174 5.839 34.304 83.260 1.00 0.00 H ATOM 1522 N GLY A 175 3.470 34.722 85.202 1.00 44.88 N ATOM 1523 CA GLY A 175 2.389 34.363 86.101 1.00 48.49 C ATOM 1524 C GLY A 175 1.322 33.489 85.450 1.00 51.29 C ATOM 1525 O GLY A 175 0.452 32.945 86.127 1.00 49.77 O ATOM 1526 H GLY A 175 4.235 34.037 85.034 1.00 0.00 H ATOM 1527 N VAL A 176 1.388 33.338 84.133 1.00 43.60 N ATOM 1528 CA VAL A 176 0.280 32.724 83.411 1.00 43.63 C ATOM 1529 C VAL A 176 0.235 31.206 83.602 1.00 41.15 C ATOM 1530 O VAL A 176 -0.774 30.560 83.309 1.00 42.23 O ATOM 1531 CB VAL A 176 0.349 33.056 81.908 1.00 43.50 C ATOM 1532 CG1 VAL A 176 1.435 32.226 81.215 1.00 36.05 C ATOM 1533 CG2 VAL A 176 -1.012 32.846 81.256 1.00 49.65 C ATOM 1534 H VAL A 176 2.231 33.658 83.615 1.00 0.00 H ATOM 1535 N LEU A 177 1.329 30.645 84.102 1.00 38.49 N ATOM 1536 CA LEU A 177 1.418 29.210 84.333 1.00 36.63 C ATOM 1537 C LEU A 177 1.181 28.825 85.795 1.00 39.32 C ATOM 1538 O LEU A 177 1.548 27.736 86.208 1.00 38.09 O ATOM 1539 CB LEU A 177 2.791 28.689 83.885 1.00 32.56 C ATOM 1540 CG LEU A 177 3.174 28.976 82.430 1.00 29.75 C ATOM 1541 CD1 LEU A 177 4.391 28.150 82.023 1.00 31.86 C ATOM 1542 CD2 LEU A 177 2.012 28.699 81.512 1.00 31.15 C ATOM 1543 H LEU A 177 2.145 31.247 84.335 1.00 0.00 H ATOM 1544 N ASN A 178 0.575 29.718 86.577 1.00 43.51 N ATOM 1545 CA ASN A 178 0.420 29.477 88.008 1.00 46.60 C ATOM 1546 C ASN A 178 -0.461 28.280 88.326 1.00 47.15 C ATOM 1547 O ASN A 178 -0.342 27.695 89.395 1.00 48.44 O ATOM 1548 CB ASN A 178 -0.127 30.725 88.709 1.00 56.66 C ATOM 1549 CG ASN A 178 0.978 31.651 89.164 1.00 61.50 C ATOM 1550 OD1 ASN A 178 2.152 31.424 88.854 1.00 61.55 O ATOM 1551 ND2 ASN A 178 0.619 32.695 89.902 1.00 65.99 N ATOM 1552 HD22 ASN A 178 -0.383 32.845 90.138 1.00 0.00 H ATOM 1553 HD21 ASN A 178 1.340 33.362 90.244 1.00 0.00 H ATOM 1554 H ASN A 178 0.208 30.598 86.162 1.00 0.00 H ATOM 1555 N GLY A 179 -1.339 27.915 87.399 1.00 46.63 N ATOM 1556 CA GLY A 179 -2.146 26.721 87.562 1.00 47.95 C ATOM 1557 C GLY A 179 -1.421 25.421 87.238 1.00 47.04 C ATOM 1558 O GLY A 179 -1.929 24.339 87.538 1.00 44.46 O ATOM 1559 H GLY A 179 -1.450 28.495 86.543 1.00 0.00 H ATOM 1560 N MET A 180 -0.239 25.523 86.629 1.00 40.24 N ATOM 1561 CA MET A 180 0.495 24.353 86.136 1.00 37.40 C ATOM 1562 C MET A 180 1.617 23.904 87.076 1.00 36.95 C ATOM 1563 O MET A 180 2.061 24.662 87.932 1.00 38.22 O ATOM 1564 CB MET A 180 1.107 24.647 84.763 1.00 34.37 C ATOM 1565 CG MET A 180 0.178 25.323 83.757 1.00 50.26 C ATOM 1566 SD MET A 180 -0.934 24.188 82.912 1.00 39.69 S ATOM 1567 CE MET A 180 -2.286 24.117 84.077 1.00 43.28 C ATOM 1568 H MET A 180 0.178 26.467 86.499 1.00 0.00 H ATOM 1569 N ALA A 181 2.092 22.676 86.882 1.00 34.14 N ATOM 1570 CA ALA A 181 3.222 22.158 87.641 1.00 36.58 C ATOM 1571 C ALA A 181 4.436 23.105 87.614 1.00 35.85 C ATOM 1572 O ALA A 181 5.057 23.331 88.644 1.00 37.28 O ATOM 1573 CB ALA A 181 3.615 20.779 87.126 1.00 38.39 C ATOM 1574 H ALA A 181 1.643 22.068 86.167 1.00 0.00 H ATOM 1575 N LEU A 182 4.777 23.655 86.447 1.00 33.86 N ATOM 1576 CA LEU A 182 5.943 24.546 86.364 1.00 33.41 C ATOM 1577 C LEU A 182 5.721 25.825 87.180 1.00 32.47 C ATOM 1578 O LEU A 182 6.643 26.328 87.826 1.00 33.13 O ATOM 1579 CB LEU A 182 6.274 24.907 84.914 1.00 31.92 C ATOM 1580 CG LEU A 182 7.422 25.904 84.723 1.00 31.58 C ATOM 1581 CD1 LEU A 182 8.742 25.358 85.278 1.00 33.91 C ATOM 1582 CD2 LEU A 182 7.584 26.261 83.241 1.00 30.53 C ATOM 1583 H LEU A 182 4.217 23.453 85.595 1.00 0.00 H ATOM 1584 N GLY A 183 4.502 26.352 87.130 1.00 31.16 N ATOM 1585 CA GLY A 183 4.136 27.494 87.950 1.00 30.81 C ATOM 1586 C GLY A 183 4.208 27.192 89.440 1.00 33.03 C ATOM 1587 O GLY A 183 4.665 28.015 90.223 1.00 33.41 O ATOM 1588 H GLY A 183 3.795 25.938 86.490 1.00 0.00 H ATOM 1589 N LYS A 184 3.752 26.010 89.833 1.00 34.77 N ATOM 1590 CA LYS A 184 3.859 25.568 91.219 1.00 37.55 C ATOM 1591 C LYS A 184 5.320 25.477 91.653 1.00 38.81 C ATOM 1592 O LYS A 184 5.662 25.833 92.786 1.00 40.35 O ATOM 1593 CB LYS A 184 3.172 24.216 91.411 1.00 39.58 C ATOM 1594 CG LYS A 184 1.657 24.254 91.243 1.00 46.95 C ATOM 1595 CD LYS A 184 1.027 22.936 91.686 1.00 52.54 C ATOM 1596 CE LYS A 184 -0.494 22.965 91.579 1.00 55.78 C ATOM 1597 NZ LYS A 184 -0.963 22.859 90.165 1.00 50.25 N ATOM 1598 HZ1 LYS A 184 -0.585 23.657 89.615 1.00 0.00 H ATOM 1599 HZ2 LYS A 184 -0.627 21.964 89.756 1.00 0.00 H ATOM 1600 HZ3 LYS A 184 -2.002 22.883 90.143 1.00 0.00 H ATOM 1601 H LYS A 184 3.306 25.382 89.134 1.00 0.00 H ATOM 1602 N GLU A 185 6.176 24.997 90.748 1.00 38.42 N ATOM 1603 CA GLU A 185 7.603 24.905 91.028 1.00 39.76 C ATOM 1604 C GLU A 185 8.194 26.288 91.288 1.00 38.37 C ATOM 1605 O GLU A 185 8.936 26.477 92.244 1.00 39.87 O ATOM 1606 CB GLU A 185 8.358 24.224 89.881 1.00 39.80 C ATOM 1607 CG GLU A 185 9.875 24.229 90.083 1.00 41.31 C ATOM 1608 CD GLU A 185 10.657 23.676 88.890 1.00 49.63 C ATOM 1609 OE1 GLU A 185 10.038 23.102 87.972 1.00 51.94 O ATOM 1610 OE2 GLU A 185 11.901 23.814 88.872 1.00 55.69 O ATOM 1611 H GLU A 185 5.817 24.682 89.824 1.00 0.00 H ATOM 1612 N LEU A 186 7.865 27.246 90.430 1.00 35.74 N ATOM 1613 CA LEU A 186 8.333 28.617 90.609 1.00 34.55 C ATOM 1614 C LEU A 186 7.848 29.184 91.945 1.00 35.47 C ATOM 1615 O LEU A 186 8.591 29.867 92.636 1.00 35.93 O ATOM 1616 CB LEU A 186 7.863 29.509 89.463 1.00 32.12 C ATOM 1617 CG LEU A 186 8.207 30.995 89.560 1.00 31.11 C ATOM 1618 CD1 LEU A 186 9.707 31.188 89.721 1.00 32.20 C ATOM 1619 CD2 LEU A 186 7.696 31.744 88.334 1.00 30.65 C ATOM 1620 H LEU A 186 7.262 27.015 89.615 1.00 0.00 H ATOM 1621 N LYS A 187 6.608 28.877 92.304 1.00 35.99 N ATOM 1622 CA LYS A 187 6.048 29.322 93.587 1.00 38.31 C ATOM 1623 C LYS A 187 6.852 28.787 94.773 1.00 40.24 C ATOM 1624 O LYS A 187 7.234 29.540 95.669 1.00 41.02 O ATOM 1625 CB LYS A 187 4.588 28.892 93.708 1.00 44.24 C ATOM 1626 CG LYS A 187 3.605 29.876 93.101 1.00 53.69 C ATOM 1627 CD LYS A 187 2.167 29.448 93.376 1.00 59.52 C ATOM 1628 CE LYS A 187 1.973 29.088 94.840 1.00 67.25 C ATOM 1629 NZ LYS A 187 0.653 28.439 95.083 1.00 73.64 N ATOM 1630 HZ1 LYS A 187 -0.109 29.090 94.803 1.00 0.00 H ATOM 1631 HZ2 LYS A 187 0.589 27.566 94.521 1.00 0.00 H ATOM 1632 HZ3 LYS A 187 0.561 28.210 96.093 1.00 0.00 H ATOM 1633 H LYS A 187 6.019 28.308 91.662 1.00 0.00 H ATOM 1634 N LYS A 188 7.102 27.485 94.768 1.00 41.94 N ATOM 1635 CA LYS A 188 7.936 26.844 95.774 1.00 44.97 C ATOM 1636 C LYS A 188 9.310 27.509 95.865 1.00 45.72 C ATOM 1637 O LYS A 188 9.756 27.866 96.952 1.00 46.11 O ATOM 1638 CB LYS A 188 8.082 25.351 95.464 1.00 46.86 C ATOM 1639 CG LYS A 188 9.032 24.586 96.374 1.00 50.47 C ATOM 1640 CD LYS A 188 9.289 23.188 95.813 1.00 52.28 C ATOM 1641 CE LYS A 188 10.281 22.396 96.655 1.00 61.42 C ATOM 1642 NZ LYS A 188 10.644 21.100 96.004 1.00 58.37 N ATOM 1643 HZ1 LYS A 188 9.787 20.525 95.878 1.00 0.00 H ATOM 1644 HZ2 LYS A 188 11.076 21.288 95.077 1.00 0.00 H ATOM 1645 HZ3 LYS A 188 11.321 20.589 96.606 1.00 0.00 H ATOM 1646 H LYS A 188 6.686 26.899 94.016 1.00 0.00 H ATOM 1647 N LYS A 189 9.977 27.686 94.727 1.00 42.44 N ATOM 1648 CA LYS A 189 11.304 28.298 94.729 1.00 42.13 C ATOM 1649 C LYS A 189 11.287 29.729 95.273 1.00 40.93 C ATOM 1650 O LYS A 189 12.189 30.128 96.005 1.00 41.89 O ATOM 1651 CB LYS A 189 11.912 28.275 93.328 1.00 40.47 C ATOM 1652 CG LYS A 189 12.515 26.924 92.966 1.00 42.56 C ATOM 1653 CD LYS A 189 12.964 26.893 91.518 1.00 41.23 C ATOM 1654 CE LYS A 189 13.467 25.520 91.125 1.00 43.70 C ATOM 1655 NZ LYS A 189 14.790 25.235 91.737 1.00 51.00 N ATOM 1656 HZ1 LYS A 189 15.479 25.945 91.416 1.00 0.00 H ATOM 1657 HZ2 LYS A 189 14.707 25.274 92.773 1.00 0.00 H ATOM 1658 HZ3 LYS A 189 15.107 24.287 91.449 1.00 0.00 H ATOM 1659 H LYS A 189 9.550 27.386 93.828 1.00 0.00 H ATOM 1660 N ARG A 190 10.255 30.485 94.923 1.00 39.09 N ATOM 1661 CA ARG A 190 10.116 31.846 95.407 1.00 44.24 C ATOM 1662 C ARG A 190 9.843 31.904 96.915 1.00 40.76 C ATOM 1663 O ARG A 190 10.340 32.788 97.599 1.00 42.18 O ATOM 1664 CB ARG A 190 9.009 32.560 94.634 1.00 36.38 C ATOM 1665 CG ARG A 190 9.437 32.948 93.248 1.00 34.19 C ATOM 1666 CD ARG A 190 8.370 33.734 92.527 1.00 42.85 C ATOM 1667 NE ARG A 190 8.925 34.370 91.334 1.00 48.39 N ATOM 1668 CZ ARG A 190 8.194 34.852 90.334 1.00 47.52 C ATOM 1669 NH1 ARG A 190 6.870 34.763 90.376 1.00 43.88 N ATOM 1670 NH2 ARG A 190 8.790 35.414 89.290 1.00 48.24 N ATOM 1671 HE ARG A 190 9.959 34.451 91.263 1.00 0.00 H ATOM 1672 HH12 ARG A 190 6.298 35.140 89.593 1.00 0.00 H ATOM 1673 HH11 ARG A 190 6.404 34.316 91.192 1.00 0.00 H ATOM 1674 HH22 ARG A 190 8.220 35.792 88.507 1.00 0.00 H ATOM 1675 HH21 ARG A 190 9.828 35.477 89.255 1.00 0.00 H ATOM 1676 H ARG A 190 9.530 30.094 94.288 1.00 0.00 H ATOM 1677 N LYS A 191 9.058 30.969 97.434 1.00 42.73 N ATOM 1678 CA LYS A 191 8.835 30.913 98.876 1.00 45.73 C ATOM 1679 C LYS A 191 10.140 30.602 99.600 1.00 47.57 C ATOM 1680 O LYS A 191 10.446 31.199 100.639 1.00 49.02 O ATOM 1681 CB LYS A 191 7.777 29.872 99.242 1.00 47.98 C ATOM 1682 CG LYS A 191 7.577 29.732 100.761 1.00 51.81 C ATOM 1683 CD LYS A 191 6.413 28.822 101.090 1.00 54.27 C ATOM 1684 CE LYS A 191 6.185 28.717 102.592 1.00 62.13 C ATOM 1685 NZ LYS A 191 5.932 30.046 103.214 1.00 63.41 N ATOM 1686 HZ1 LYS A 191 6.752 30.665 103.053 1.00 0.00 H ATOM 1687 HZ2 LYS A 191 5.085 30.472 102.786 1.00 0.00 H ATOM 1688 HZ3 LYS A 191 5.782 29.926 104.236 1.00 0.00 H ATOM 1689 H LYS A 191 8.600 30.273 96.812 1.00 0.00 H ATOM 1690 N ARG A 192 10.908 29.669 99.048 1.00 47.78 N ATOM 1691 CA ARG A 192 12.205 29.326 99.611 1.00 49.71 C ATOM 1692 C ARG A 192 13.102 30.561 99.672 1.00 48.08 C ATOM 1693 O ARG A 192 13.718 30.840 100.696 1.00 53.97 O ATOM 1694 CB ARG A 192 12.881 28.228 98.791 1.00 50.13 C ATOM 1695 CG ARG A 192 14.217 27.767 99.355 1.00 63.97 C ATOM 1696 CD ARG A 192 15.112 27.223 98.252 1.00 67.94 C ATOM 1697 NE ARG A 192 14.435 26.220 97.431 1.00 73.51 N ATOM 1698 CZ ARG A 192 14.808 25.890 96.198 1.00 74.27 C ATOM 1699 NH1 ARG A 192 15.852 26.489 95.640 1.00 73.96 N ATOM 1700 NH2 ARG A 192 14.140 24.964 95.521 1.00 76.51 N ATOM 1701 HE ARG A 192 13.610 25.734 97.837 1.00 0.00 H ATOM 1702 HH12 ARG A 192 16.145 26.232 94.676 1.00 0.00 H ATOM 1703 HH11 ARG A 192 16.377 27.216 96.167 1.00 0.00 H ATOM 1704 HH22 ARG A 192 14.436 24.710 94.557 1.00 0.00 H ATOM 1705 HH21 ARG A 192 13.321 24.493 95.955 1.00 0.00 H ATOM 1706 H ARG A 192 10.575 29.174 98.196 1.00 0.00 H ATOM 1707 N ALA A 193 13.156 31.302 98.571 1.00 44.93 N ATOM 1708 CA ALA A 193 14.030 32.466 98.472 1.00 46.50 C ATOM 1709 C ALA A 193 13.572 33.608 99.379 1.00 43.54 C ATOM 1710 O ALA A 193 14.395 34.366 99.893 1.00 43.68 O ATOM 1711 CB ALA A 193 14.107 32.940 97.033 1.00 41.37 C ATOM 1712 H ALA A 193 12.560 31.046 97.758 1.00 0.00 H ATOM 1713 N SER A 194 12.259 33.722 99.564 1.00 43.69 N ATOM 1714 CA SER A 194 11.673 34.781 100.389 1.00 45.03 C ATOM 1715 C SER A 194 12.045 34.626 101.853 1.00 49.55 C ATOM 1716 O SER A 194 12.096 35.604 102.612 1.00 48.04 O ATOM 1717 CB SER A 194 10.151 34.781 100.255 1.00 44.39 C ATOM 1718 OG SER A 194 9.572 33.853 101.155 1.00 47.33 O ATOM 1719 HG SER A 194 9.912 32.945 100.955 1.00 0.00 H ATOM 1720 H SER A 194 11.627 33.035 99.107 1.00 0.00 H ATOM 1721 N GLU A 195 12.299 33.386 102.253 1.00 52.59 N ATOM 1722 CA GLU A 195 12.559 33.089 103.652 1.00 57.99 C ATOM 1723 C GLU A 195 13.941 33.564 104.076 1.00 59.10 C ATOM 1724 O GLU A 195 14.326 33.429 105.236 1.00 61.95 O ATOM 1725 CB GLU A 195 12.393 31.592 103.917 1.00 62.98 C ATOM 1726 CG GLU A 195 10.957 31.112 103.760 1.00 66.75 C ATOM 1727 CD GLU A 195 9.956 32.060 104.402 1.00 75.36 C ATOM 1728 OE1 GLU A 195 10.249 32.594 105.493 1.00 80.58 O ATOM 1729 OE2 GLU A 195 8.876 32.281 103.814 1.00 79.26 O ATOM 1730 H GLU A 195 12.312 32.615 101.555 1.00 0.00 H ATOM 1731 N HIS A 196 14.682 34.147 103.143 1.00 50.32 N ATOM 1732 CA HIS A 196 15.992 34.688 103.474 1.00 59.25 C ATOM 1733 C HIS A 196 15.909 36.161 103.891 1.00 55.19 C ATOM 1734 O HIS A 196 16.909 36.771 104.269 1.00 51.98 O ATOM 1735 CB HIS A 196 16.934 34.498 102.291 1.00 60.11 C ATOM 1736 CG HIS A 196 17.090 33.065 101.889 1.00 70.43 C ATOM 1737 ND1 HIS A 196 17.518 32.679 100.636 1.00 70.12 N ATOM 1738 CD2 HIS A 196 16.864 31.921 102.577 1.00 77.18 C ATOM 1739 CE1 HIS A 196 17.552 31.360 100.573 1.00 72.54 C ATOM 1740 NE2 HIS A 196 17.158 30.875 101.737 1.00 76.44 N ATOM 1741 H HIS A 196 14.325 34.218 102.169 1.00 0.00 H ATOM 1742 N ALA A 197 14.705 36.721 103.839 1.00 48.88 N ATOM 1743 CA ALA A 197 14.497 38.104 104.252 1.00 49.98 C ATOM 1744 C ALA A 197 14.566 38.244 105.777 1.00 53.55 C ATOM 1745 O ALA A 197 14.105 37.372 106.518 1.00 54.64 O ATOM 1746 CB ALA A 197 13.167 38.617 103.726 1.00 47.64 C ATOM 1747 H ALA A 197 13.897 36.163 103.498 1.00 0.00 H ATOM 1748 N SER A 198 15.150 39.346 106.236 1.00 54.56 N ATOM 1749 CA SER A 198 15.293 39.601 107.663 1.00 58.82 C ATOM 1750 C SER A 198 14.991 41.059 107.999 1.00 55.61 C ATOM 1751 O SER A 198 15.300 41.961 107.221 1.00 52.26 O ATOM 1752 CB SER A 198 16.703 39.235 108.134 1.00 64.82 C ATOM 1753 OG SER A 198 17.668 40.109 107.577 1.00 63.59 O ATOM 1754 HG SER A 198 17.471 41.038 107.857 1.00 0.00 H ATOM 1755 H SER A 198 15.515 40.045 105.558 1.00 0.00 H ATOM 1756 N LEU A 199 14.390 41.274 109.165 1.00 58.12 N ATOM 1757 CA LEU A 199 13.993 42.605 109.609 1.00 60.13 C ATOM 1758 C LEU A 199 15.103 43.332 110.379 1.00 59.62 C ATOM 1759 O LEU A 199 16.112 42.734 110.749 1.00 59.96 O ATOM 1760 CB LEU A 199 12.739 42.510 110.482 1.00 62.75 C ATOM 1761 CG LEU A 199 11.437 42.089 109.799 1.00 62.49 C ATOM 1762 CD1 LEU A 199 10.376 41.785 110.843 1.00 67.01 C ATOM 1763 CD2 LEU A 199 10.955 43.172 108.860 1.00 60.19 C ATOM 1764 H LEU A 199 14.195 40.462 109.784 1.00 0.00 H TER 1765 LEU A 199 HETATM 1766 O HOH 1 8.001 36.937 87.651 1.00 34.38 O HETATM 1767 O HOH 2 -2.607 21.657 87.167 1.00 48.55 O HETATM 1768 O HOH 3 15.478 28.846 81.613 1.00 47.85 O HETATM 1769 O HOH 4 4.451 25.572 94.958 1.00 46.69 O HETATM 1770 O HOH 5 12.794 24.056 86.388 1.00 32.86 O HETATM 1771 O HOH 6 15.493 31.158 84.652 1.00 44.80 O HETATM 1772 O HOH 7 -5.299 27.487 87.664 1.00 49.97 O HETATM 1773 O HOH 8 -1.844 28.417 84.910 1.00 40.53 O HETATM 1774 O HOH 9 9.838 13.904 53.915 1.00 32.46 O HETATM 1775 O HOH 10 0.660 20.534 85.721 1.00 30.98 O HETATM 1776 O HOH 11 10.821 22.235 55.490 1.00 32.01 O HETATM 1777 O HOH 12 10.202 12.726 83.192 1.00 23.76 O HETATM 1778 O HOH 13 12.572 9.874 86.993 1.00 22.44 O HETATM 1779 O HOH 14 8.360 8.217 50.213 1.00 45.93 O HETATM 1780 O HOH 15 15.939 13.959 51.402 1.00 20.65 O HETATM 1781 O HOH 16 -2.292 18.678 88.912 1.00 37.63 O HETATM 1782 O HOH 17 0.970 14.017 52.270 1.00 42.26 O HETATM 1783 O HOH 18 14.492 6.622 51.913 1.00 37.80 O HETATM 1784 O HOH 19 3.316 31.191 85.974 1.00 30.88 O HETATM 1785 O HOH 20 14.819 29.419 95.770 1.00 32.93 O HETATM 1786 O HOH 21 5.555 21.325 90.434 1.00 29.15 O HETATM 1787 O HOH 22 22.678 5.033 50.182 1.00 43.09 O HETATM 1788 O HOH 23 8.564 19.797 51.434 1.00 32.42 O HETATM 1789 O HOH 24 -1.436 20.734 54.233 1.00 35.74 O HETATM 1790 O HOH 25 6.741 19.554 56.636 1.00 29.06 O HETATM 1791 O HOH 26 12.727 17.364 87.687 1.00 38.30 O HETATM 1792 O HOH 27 4.215 9.967 55.643 1.00 25.45 O HETATM 1793 O HOH 28 -0.630 32.077 92.361 1.00 58.00 O HETATM 1794 O HOH 29 24.245 18.722 50.588 1.00 34.96 O HETATM 1795 O HOH 30 -9.783 15.712 85.813 1.00 34.54 O HETATM 1796 O HOH 31 12.254 7.100 51.216 1.00 39.33 O HETATM 1797 O HOH 32 -4.646 23.996 53.988 1.00 29.65 O HETATM 1798 O HOH 33 5.067 13.871 78.233 1.00 20.10 O HETATM 1799 O HOH 34 6.311 16.646 56.330 1.00 29.71 O HETATM 1800 O HOH 35 11.827 35.614 106.208 1.00 53.54 O HETATM 1801 O HOH 36 7.470 25.774 50.756 1.00 33.33 O HETATM 1802 O HOH 37 14.964 16.555 52.110 1.00 28.78 O HETATM 1803 O HOH 38 8.425 16.469 69.058 1.00 21.67 O HETATM 1804 O HOH 39 30.393 7.724 53.498 1.00 30.19 O HETATM 1805 O HOH 40 5.282 14.831 80.858 1.00 25.62 O HETATM 1806 O HOH 41 25.173 11.063 50.102 1.00 31.27 O HETATM 1807 O HOH 42 7.090 18.935 89.315 1.00 45.53 O HETATM 1808 O HOH 43 5.781 32.011 96.444 1.00 46.02 O HETATM 1809 O HOH 44 13.196 22.675 93.876 1.00 59.47 O HETATM 1810 O HOH 45 18.116 21.617 85.034 1.00 33.62 O HETATM 1811 O HOH 46 -10.544 19.984 85.529 1.00 39.18 O HETATM 1812 O HOH 47 15.682 14.923 86.490 1.00 47.87 O HETATM 1813 O HOH 48 -2.717 14.439 89.677 1.00 51.58 O HETATM 1814 O HOH 49 25.556 21.973 51.313 1.00 45.07 O HETATM 1815 O HOH 50 17.113 26.163 44.748 1.00 42.65 O HETATM 1816 O HOH 51 5.001 32.856 92.139 1.00 44.89 O HETATM 1817 O HOH 52 9.022 20.246 55.304 1.00 37.63 O HETATM 1818 O HOH 53 6.699 20.857 53.199 1.00 31.34 O HETATM 1819 O HOH 54 7.196 33.807 97.786 1.00 45.43 O HETATM 1820 O HOH 55 -9.651 22.538 85.272 1.00 34.91 O HETATM 1821 O HOH 56 15.809 9.105 47.261 1.00 41.38 O HETATM 1822 O HOH 57 16.466 30.180 97.952 1.00 61.17 O HETATM 1823 O HOH 58 21.996 27.011 56.924 1.00 53.83 O HETATM 1824 O HOH 59 2.098 10.245 54.913 1.00 40.26 O HETATM 1825 O HOH 60 31.159 9.481 51.496 1.00 67.77 O HETATM 1826 O HOH 61 25.906 5.663 49.525 1.00 42.56 O HETATM 1827 O HOH 62 0.318 19.732 88.338 1.00 43.96 O HETATM 1828 O HOH 63 25.097 3.592 51.482 1.00 35.07 O HETATM 1829 O HOH 64 20.428 27.395 58.982 1.00 51.73 O HETATM 1830 O HOH 65 9.212 26.144 49.210 1.00 62.62 O HETATM 1831 O HOH 66 14.906 16.004 88.332 1.00 48.26 O HETATM 1832 O HOH 67 32.322 7.414 54.481 1.00 62.89 O HETATM 1833 O HOH 68 -9.691 21.320 87.137 1.00 51.74 O HETATM 1834 O HOH 69 -11.734 16.964 85.750 1.00 53.83 O HETATM 1835 O HOH 70 5.520 8.762 50.118 1.00 57.87 O HETATM 1836 O HOH 71 2.239 35.944 77.440 1.00 55.46 O HETATM 1837 O HOH 72 4.811 33.626 94.720 1.00 44.88 O HETATM 1838 O HOH 73 0.000 35.357 77.796 1.00 61.81 O HETATM 1839 O HOH 74 -2.129 15.804 92.341 1.00 64.72 O HETATM 1840 CM2 VIB A 75 5.677 19.182 62.907 1.00 -0.00 C HETATM 1841 C2A VIB A 75 6.765 19.317 61.828 1.00 0.08 C HETATM 1842 N3A VIB A 75 7.851 18.502 61.927 1.00 -0.26 N HETATM 1843 C4A VIB A 75 8.823 18.582 61.016 1.00 0.12 C HETATM 1844 N4A VIB A 75 9.987 17.727 61.102 1.00 -0.32 N HETATM 1845 H4 VIB A 75 10.731 17.797 60.393 1.00 0.18 H HETATM 1846 H5 VIB A 75 10.072 17.048 61.872 1.00 0.18 H HETATM 1847 C5A VIB A 75 8.742 19.491 59.993 1.00 0.05 C HETATM 1848 C7A VIB A 75 9.695 19.811 58.827 1.00 0.08 C HETATM 1849 N3 VIB A 75 9.879 18.633 57.985 1.00 -0.30 N HETATM 1850 C2 VIB A 75 8.980 17.553 57.693 1.00 0.02 C HETATM 1851 S1 VIB A 75 9.681 16.565 56.701 1.00 -0.11 S HETATM 1852 C5 VIB A 75 11.076 17.182 56.424 1.00 0.01 C HETATM 1853 C6 VIB A 75 12.155 16.607 55.524 1.00 -0.00 C HETATM 1854 C7 VIB A 75 12.615 15.314 56.152 1.00 0.05 C HETATM 1855 O1 VIB A 75 13.367 15.629 57.307 1.00 -0.39 O HETATM 1856 H9 VIB A 75 13.666 14.826 57.717 1.00 0.21 H HETATM 1857 H10 VIB A 75 11.743 14.704 56.430 1.00 0.06 H HETATM 1858 H11 VIB A 75 13.241 14.756 55.440 1.00 0.06 H HETATM 1859 H12 VIB A 75 11.747 16.415 54.521 1.00 0.04 H HETATM 1860 H13 VIB A 75 12.997 17.310 55.448 1.00 0.04 H HETATM 1861 C4 VIB A 75 11.211 18.398 57.189 1.00 0.04 C HETATM 1862 CM4 VIB A 75 12.396 19.369 57.248 1.00 -0.02 C HETATM 1863 H6 VIB A 75 13.210 18.993 56.611 1.00 0.04 H HETATM 1864 H7 VIB A 75 12.751 19.451 58.286 1.00 0.04 H HETATM 1865 H8 VIB A 75 12.077 20.359 56.890 1.00 0.04 H HETATM 1866 H14 VIB A 75 7.975 17.439 58.096 1.00 0.03 H HETATM 1867 H15 VIB A 75 9.269 20.626 58.223 1.00 0.07 H HETATM 1868 H16 VIB A 75 10.669 20.125 59.230 1.00 0.07 H HETATM 1869 C6A VIB A 75 7.659 20.325 59.873 1.00 0.01 C HETATM 1870 N1A VIB A 75 6.678 20.228 60.807 1.00 -0.29 N HETATM 1871 H17 VIB A 75 7.589 21.038 59.059 1.00 0.08 H HETATM 1872 H1 VIB A 75 5.961 18.392 63.617 1.00 0.04 H HETATM 1873 H2 VIB A 75 4.720 18.921 62.432 1.00 0.04 H HETATM 1874 H3 VIB A 75 5.572 20.137 63.444 1.00 0.04 H CONECT 1 2 8 9 10 CONECT 8 1 CONECT 9 1 CONECT 10 1 CONECT 1840 1841 1872 1873 1874 CONECT 1841 1840 1842 1870 CONECT 1842 1841 1843 CONECT 1843 1842 1844 1847 CONECT 1844 1843 1845 1846 CONECT 1845 1844 CONECT 1846 1844 CONECT 1847 1843 1848 1869 CONECT 1848 1847 1849 1867 1868 CONECT 1849 1848 1850 1861 CONECT 1850 1849 1851 1866 CONECT 1851 1850 1852 CONECT 1852 1851 1853 1861 CONECT 1853 1852 1854 1859 1860 CONECT 1854 1853 1855 1857 1858 CONECT 1855 1854 1856 CONECT 1856 1855 CONECT 1857 1854 CONECT 1858 1854 CONECT 1859 1853 CONECT 1860 1853 CONECT 1861 1849 1852 1862 CONECT 1862 1861 1863 1864 1865 CONECT 1863 1862 CONECT 1864 1862 CONECT 1865 1862 CONECT 1866 1850 CONECT 1867 1848 CONECT 1868 1848 CONECT 1869 1847 1870 1871 CONECT 1870 1841 1869 CONECT 1871 1869 CONECT 1872 1840 CONECT 1873 1840 CONECT 1874 1840 MASTER 0 0 0 0 0 0 0 0 1873 1 39 16 END
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Structure:
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Protein
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Related entries of code: 5edl
Entries with 90% protein sequence similarity cutoff in PDBbind
PDB Code
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Protein Sequence Similarity
No similar entries are found!
Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
1sbr
RCSB PDB
PDBbind
VIB
2lh8
RCSB PDB
PDBbind
VIB
3rlb
RCSB PDB
PDBbind
VIB
Entry Information
PDB ID
5edl
Complex Type
Protein-Ligand
PDBbind Subset
refined set
Protein Name
Putative HMP/thiamine permease protein YkoE
Ligand Name
VIB
EC.Number
E.C.-.-.-.-
Resolution
1.95(Å)
Affinity (Kd/Ki/IC50)
Kd=4.5nM
Release Year
2016
Protein/NA Sequence
Check fasta file
Primary Reference
(2016) Cell Chem Biol Vol. 23: pp. 827-836
Ligand Properties
Formula
C
1
2
H
1
8
N
4
OS
Molecular Weight
266.363
Exact Mass
266.120
No. of atoms
36
No. of bonds
37
Polar Surface Area
100.57
LOGP Value
0.80 (
Computed with XLOGP3
)
2.01 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 5
No. of Nitrogen and Oxygen Atoms: 5
No. of Rings: 2
Canonical SMILES
OCCC1=C(C)N(CS1)Cc1cnc(nc1N)C
InChI String
InChI=1S/C12H18N4OS/c1-8-11(3-4-17)18-7-16(8)6-10-5-14-9(2)15-12(10)13/h5,17H,3-4,6-7H2,1-2H3,(H2,13,14,15)
Links to External Databases
RCSB PDB
The mother database
PDBsum
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Pubchem
Comprehensive collection of chemical and biological data
UniProtKB AC
UniProt accession number (AC):
O34738
Entrez Gene ID
NCBI Entrez Gene ID:
939829
ASD
Information of known allosteric effects of PDB entries
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