Browse entries in the PDBbind-CN Database
HEADER 1OPI_COMPLEX COMPND 1OPI_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 104 GLY HIS PRO THR GLU VAL LEU CYS LEU MET ASN MET VAL SEQRES 2 A 104 LEU PRO GLU GLU LEU LEU ASP ASP GLU GLU TYR GLU GLU SEQRES 3 A 104 ILE VAL GLU ASP VAL ARG ASP GLU CYS SER LYS TYR GLY SEQRES 4 A 104 LEU VAL LYS SER ILE GLU ILE PRO ARG PRO VAL ASP GLY SEQRES 5 A 104 VAL GLU VAL PRO GLY CYS GLY LYS ILE PHE VAL GLU PHE SEQRES 6 A 104 THR SER VAL PHE ASP CYS GLN LYS ALA MET GLN GLY LEU SEQRES 7 A 104 THR GLY ARG LYS PHE ALA ASN ARG VAL VAL VAL THR LYS SEQRES 8 A 104 TYR CYS ASP PRO ASP SER TYR HIS ARG ARG ASP PHE TRP HET PRO A 105 244 ATOM 1 N GLY A 372 2.764 9.084 -13.568 1.00 0.00 N ATOM 2 CA GLY A 372 1.388 8.924 -13.132 1.00 0.00 C ATOM 3 C GLY A 372 0.720 10.249 -12.829 1.00 0.00 C ATOM 4 O GLY A 372 0.471 11.046 -13.734 1.00 0.00 O ATOM 5 HA3 GLY A 372 1.375 8.311 -12.231 1.00 0.00 H ATOM 6 HA2 GLY A 372 0.827 8.421 -13.920 1.00 0.00 H ATOM 7 HN3 GLY A 372 3.311 9.556 -12.820 1.00 0.00 H ATOM 8 HN2 GLY A 372 2.787 9.661 -14.433 1.00 0.00 H ATOM 9 HN1 GLY A 372 3.176 8.149 -13.762 1.00 0.00 H ATOM 10 N HIS A 373 0.435 10.485 -11.551 1.00 0.00 N ATOM 11 CA HIS A 373 -0.210 11.719 -11.125 1.00 0.00 C ATOM 12 C HIS A 373 -0.278 11.785 -9.593 1.00 0.00 C ATOM 13 O HIS A 373 -0.955 10.973 -8.961 1.00 0.00 O ATOM 14 CB HIS A 373 -1.614 11.819 -11.746 1.00 0.00 C ATOM 15 CG HIS A 373 -2.682 12.300 -10.809 1.00 0.00 C ATOM 16 ND1 HIS A 373 -2.827 13.622 -10.443 1.00 0.00 N ATOM 17 CD2 HIS A 373 -3.662 11.624 -10.168 1.00 0.00 C ATOM 18 CE1 HIS A 373 -3.849 13.737 -9.614 1.00 0.00 C ATOM 19 NE2 HIS A 373 -4.374 12.539 -9.432 1.00 0.00 N ATOM 20 HA HIS A 373 0.380 12.568 -11.471 1.00 0.00 H ATOM 21 HB2 HIS A 373 -1.565 12.510 -12.588 1.00 0.00 H ATOM 22 HB3 HIS A 373 -1.898 10.830 -12.105 1.00 0.00 H ATOM 23 HD2 HIS A 373 -3.852 10.552 -10.225 1.00 0.00 H ATOM 24 HE1 HIS A 373 -4.199 14.663 -9.158 1.00 0.00 H ATOM 25 H HIS A 373 0.679 9.769 -10.837 1.00 0.00 H ATOM 26 N PRO A 374 0.446 12.737 -8.974 1.00 0.00 N ATOM 27 CA PRO A 374 0.456 12.901 -7.517 1.00 0.00 C ATOM 28 C PRO A 374 -0.879 13.411 -6.988 1.00 0.00 C ATOM 29 O PRO A 374 -1.455 14.352 -7.537 1.00 0.00 O ATOM 30 CB PRO A 374 1.557 13.943 -7.271 1.00 0.00 C ATOM 31 CG PRO A 374 2.314 14.026 -8.546 1.00 0.00 C ATOM 32 CD PRO A 374 1.325 13.717 -9.628 1.00 0.00 C ATOM 33 HA PRO A 374 0.630 11.954 -7.006 1.00 0.00 H ATOM 34 HD3 PRO A 374 0.772 14.608 -9.925 1.00 0.00 H ATOM 35 HD2 PRO A 374 1.816 13.288 -10.502 1.00 0.00 H ATOM 36 HG3 PRO A 374 3.126 13.299 -8.554 1.00 0.00 H ATOM 37 HG2 PRO A 374 2.724 15.027 -8.680 1.00 0.00 H ATOM 38 HB2 PRO A 374 1.119 14.910 -7.024 1.00 0.00 H ATOM 39 HB3 PRO A 374 2.210 13.623 -6.459 1.00 0.00 H ATOM 40 N THR A 375 -1.367 12.788 -5.922 1.00 0.00 N ATOM 41 CA THR A 375 -2.634 13.186 -5.320 1.00 0.00 C ATOM 42 C THR A 375 -2.426 13.735 -3.913 1.00 0.00 C ATOM 43 O THR A 375 -2.562 14.938 -3.689 1.00 0.00 O ATOM 44 CB THR A 375 -3.638 12.017 -5.273 1.00 0.00 C ATOM 45 OG1 THR A 375 -4.323 12.010 -4.019 1.00 0.00 O ATOM 46 CG2 THR A 375 -2.936 10.685 -5.478 1.00 0.00 C ATOM 47 HA THR A 375 -3.048 13.971 -5.952 1.00 0.00 H ATOM 48 HB THR A 375 -4.357 12.157 -6.081 1.00 0.00 H ATOM 49 HG1 THR A 375 -4.965 11.256 -3.999 1.00 0.00 H ATOM 50 HG23 THR A 375 -2.415 10.694 -6.435 1.00 0.00 H ATOM 51 HG21 THR A 375 -2.218 10.527 -4.673 1.00 0.00 H ATOM 52 HG22 THR A 375 -3.673 9.882 -5.472 1.00 0.00 H ATOM 53 H THR A 375 -0.833 11.998 -5.507 1.00 0.00 H ATOM 54 N GLU A 376 -2.092 12.855 -2.966 1.00 0.00 N ATOM 55 CA GLU A 376 -1.861 13.276 -1.587 1.00 0.00 C ATOM 56 C GLU A 376 -1.418 12.117 -0.699 1.00 0.00 C ATOM 57 O GLU A 376 -0.468 12.255 0.072 1.00 0.00 O ATOM 58 CB GLU A 376 -3.120 13.920 -1.005 1.00 0.00 C ATOM 59 CG GLU A 376 -2.855 14.758 0.235 1.00 0.00 C ATOM 60 CD GLU A 376 -2.308 16.133 -0.097 1.00 0.00 C ATOM 61 OE1 GLU A 376 -1.113 16.226 -0.449 1.00 0.00 O ATOM 62 OE2 GLU A 376 -3.074 17.115 -0.005 1.00 0.00 O ATOM 63 HA GLU A 376 -1.054 14.008 -1.608 1.00 0.00 H ATOM 64 HB2 GLU A 376 -3.563 14.561 -1.767 1.00 0.00 H ATOM 65 HB3 GLU A 376 -3.823 13.129 -0.743 1.00 0.00 H ATOM 66 HG2 GLU A 376 -3.790 14.877 0.783 1.00 0.00 H ATOM 67 HG3 GLU A 376 -2.132 14.236 0.862 1.00 0.00 H ATOM 68 H GLU A 376 -1.994 11.850 -3.215 1.00 0.00 H ATOM 69 N VAL A 377 -2.097 10.974 -0.801 1.00 0.00 N ATOM 70 CA VAL A 377 -1.744 9.821 0.024 1.00 0.00 C ATOM 71 C VAL A 377 -1.027 8.751 -0.793 1.00 0.00 C ATOM 72 O VAL A 377 -1.249 8.622 -1.997 1.00 0.00 O ATOM 73 CB VAL A 377 -2.981 9.218 0.730 1.00 0.00 C ATOM 74 CG1 VAL A 377 -3.790 10.314 1.406 1.00 0.00 C ATOM 75 CG2 VAL A 377 -3.852 8.438 -0.243 1.00 0.00 C ATOM 76 HA VAL A 377 -1.061 10.182 0.793 1.00 0.00 H ATOM 77 HB VAL A 377 -2.626 8.521 1.489 1.00 0.00 H ATOM 78 HG11 VAL A 377 -3.169 10.819 2.146 1.00 0.00 H ATOM 79 HG12 VAL A 377 -4.122 11.033 0.657 1.00 0.00 H ATOM 80 HG13 VAL A 377 -4.657 9.873 1.898 1.00 0.00 H ATOM 81 HG21 VAL A 377 -4.196 9.104 -1.035 1.00 0.00 H ATOM 82 HG22 VAL A 377 -3.271 7.625 -0.677 1.00 0.00 H ATOM 83 HG23 VAL A 377 -4.711 8.029 0.288 1.00 0.00 H ATOM 84 H VAL A 377 -2.886 10.902 -1.475 1.00 0.00 H ATOM 85 N LEU A 378 -0.162 7.985 -0.130 1.00 0.00 N ATOM 86 CA LEU A 378 0.605 6.937 -0.796 1.00 0.00 C ATOM 87 C LEU A 378 -0.133 5.606 -0.760 1.00 0.00 C ATOM 88 O LEU A 378 -0.923 5.351 0.146 1.00 0.00 O ATOM 89 CB LEU A 378 1.978 6.786 -0.136 1.00 0.00 C ATOM 90 CG LEU A 378 3.170 6.840 -1.093 1.00 0.00 C ATOM 91 CD1 LEU A 378 4.372 7.471 -0.409 1.00 0.00 C ATOM 92 CD2 LEU A 378 3.513 5.445 -1.594 1.00 0.00 C ATOM 93 HA LEU A 378 0.735 7.229 -1.838 1.00 0.00 H ATOM 94 HB2 LEU A 378 2.093 7.589 0.592 1.00 0.00 H ATOM 95 HB3 LEU A 378 2.001 5.825 0.378 1.00 0.00 H ATOM 96 HG LEU A 378 2.898 7.457 -1.950 1.00 0.00 H ATOM 97 HD21 LEU A 378 3.766 4.808 -0.747 1.00 0.00 H ATOM 98 HD22 LEU A 378 2.654 5.028 -2.120 1.00 0.00 H ATOM 99 HD23 LEU A 378 4.363 5.503 -2.274 1.00 0.00 H ATOM 100 HD11 LEU A 378 4.120 8.485 -0.097 1.00 0.00 H ATOM 101 HD12 LEU A 378 4.644 6.878 0.464 1.00 0.00 H ATOM 102 HD13 LEU A 378 5.210 7.501 -1.105 1.00 0.00 H ATOM 103 H LEU A 378 -0.030 8.138 0.890 1.00 0.00 H ATOM 104 N CYS A 379 0.135 4.761 -1.752 1.00 0.00 N ATOM 105 CA CYS A 379 -0.495 3.449 -1.840 1.00 0.00 C ATOM 106 C CYS A 379 0.544 2.343 -1.699 1.00 0.00 C ATOM 107 O CYS A 379 1.664 2.464 -2.196 1.00 0.00 O ATOM 108 CB CYS A 379 -1.237 3.304 -3.171 1.00 0.00 C ATOM 109 SG CYS A 379 -2.001 1.684 -3.417 1.00 0.00 S ATOM 110 HA CYS A 379 -1.212 3.359 -1.024 1.00 0.00 H ATOM 111 HB2 CYS A 379 -0.526 3.474 -3.980 1.00 0.00 H ATOM 112 HB3 CYS A 379 -2.020 4.062 -3.211 1.00 0.00 H ATOM 113 HG CYS A 379 -2.640 1.659 -4.640 1.00 0.00 H ATOM 114 H CYS A 379 0.814 5.045 -2.487 1.00 0.00 H ATOM 115 N LEU A 380 0.167 1.263 -1.021 1.00 0.00 N ATOM 116 CA LEU A 380 1.071 0.137 -0.812 1.00 0.00 C ATOM 117 C LEU A 380 0.380 -1.187 -1.127 1.00 0.00 C ATOM 118 O LEU A 380 -0.406 -1.697 -0.328 1.00 0.00 O ATOM 119 CB LEU A 380 1.581 0.131 0.631 1.00 0.00 C ATOM 120 CG LEU A 380 1.958 1.503 1.192 1.00 0.00 C ATOM 121 CD1 LEU A 380 1.915 1.486 2.712 1.00 0.00 C ATOM 122 CD2 LEU A 380 3.338 1.917 0.700 1.00 0.00 C ATOM 123 HA LEU A 380 1.916 0.251 -1.491 1.00 0.00 H ATOM 124 HB2 LEU A 380 0.800 -0.290 1.264 1.00 0.00 H ATOM 125 HB3 LEU A 380 2.464 -0.506 0.675 1.00 0.00 H ATOM 126 HG LEU A 380 1.232 2.234 0.836 1.00 0.00 H ATOM 127 HD21 LEU A 380 4.075 1.184 1.029 1.00 0.00 H ATOM 128 HD22 LEU A 380 3.334 1.967 -0.389 1.00 0.00 H ATOM 129 HD23 LEU A 380 3.590 2.895 1.109 1.00 0.00 H ATOM 130 HD11 LEU A 380 0.908 1.232 3.043 1.00 0.00 H ATOM 131 HD12 LEU A 380 2.620 0.744 3.086 1.00 0.00 H ATOM 132 HD13 LEU A 380 2.186 2.471 3.093 1.00 0.00 H ATOM 133 H LEU A 380 -0.796 1.220 -0.630 1.00 0.00 H ATOM 134 N MET A 381 0.684 -1.739 -2.299 1.00 0.00 N ATOM 135 CA MET A 381 0.095 -3.002 -2.726 1.00 0.00 C ATOM 136 C MET A 381 1.161 -4.079 -2.895 1.00 0.00 C ATOM 137 O MET A 381 2.358 -3.788 -2.899 1.00 0.00 O ATOM 138 CB MET A 381 -0.656 -2.807 -4.042 1.00 0.00 C ATOM 139 CG MET A 381 -2.144 -3.088 -3.938 1.00 0.00 C ATOM 140 SD MET A 381 -3.152 -1.657 -4.371 1.00 0.00 S ATOM 141 CE MET A 381 -2.854 -1.553 -6.134 1.00 0.00 C ATOM 142 HA MET A 381 -0.601 -3.329 -1.953 1.00 0.00 H ATOM 143 HB2 MET A 381 -0.521 -1.775 -4.367 1.00 0.00 H ATOM 144 HB3 MET A 381 -0.229 -3.479 -4.786 1.00 0.00 H ATOM 145 HG2 MET A 381 -2.374 -3.380 -2.913 1.00 0.00 H ATOM 146 HG3 MET A 381 -2.393 -3.907 -4.612 1.00 0.00 H ATOM 147 HE1 MET A 381 -1.789 -1.406 -6.313 1.00 0.00 H ATOM 148 HE2 MET A 381 -3.180 -2.477 -6.611 1.00 0.00 H ATOM 149 HE3 MET A 381 -3.412 -0.713 -6.547 1.00 0.00 H ATOM 150 H MET A 381 1.359 -1.257 -2.926 1.00 0.00 H ATOM 151 N ASN A 382 0.713 -5.324 -3.031 1.00 0.00 N ATOM 152 CA ASN A 382 1.616 -6.457 -3.211 1.00 0.00 C ATOM 153 C ASN A 382 2.624 -6.552 -2.067 1.00 0.00 C ATOM 154 O ASN A 382 3.831 -6.649 -2.297 1.00 0.00 O ATOM 155 CB ASN A 382 2.348 -6.343 -4.550 1.00 0.00 C ATOM 156 CG ASN A 382 2.589 -7.695 -5.194 1.00 0.00 C ATOM 157 OD1 ASN A 382 1.922 -8.679 -4.874 1.00 0.00 O ATOM 158 ND2 ASN A 382 3.549 -7.750 -6.111 1.00 0.00 N ATOM 159 HA ASN A 382 1.016 -7.367 -3.208 1.00 0.00 H ATOM 160 HB2 ASN A 382 1.748 -5.735 -5.227 1.00 0.00 H ATOM 161 HB3 ASN A 382 3.310 -5.858 -4.383 1.00 0.00 H ATOM 162 HD22 ASN A 382 4.088 -6.894 -6.351 1.00 0.00 H ATOM 163 HD21 ASN A 382 3.761 -8.649 -6.589 1.00 0.00 H ATOM 164 H ASN A 382 -0.312 -5.496 -3.008 1.00 0.00 H ATOM 165 N MET A 383 2.123 -6.527 -0.834 1.00 0.00 N ATOM 166 CA MET A 383 2.984 -6.619 0.342 1.00 0.00 C ATOM 167 C MET A 383 2.175 -6.940 1.597 1.00 0.00 C ATOM 168 O MET A 383 2.671 -6.802 2.715 1.00 0.00 O ATOM 169 CB MET A 383 3.764 -5.318 0.541 1.00 0.00 C ATOM 170 CG MET A 383 2.921 -4.065 0.369 1.00 0.00 C ATOM 171 SD MET A 383 3.456 -2.719 1.444 1.00 0.00 S ATOM 172 CE MET A 383 2.908 -3.318 3.041 1.00 0.00 C ATOM 173 HA MET A 383 3.689 -7.433 0.172 1.00 0.00 H ATOM 174 HB2 MET A 383 4.180 -5.317 1.548 1.00 0.00 H ATOM 175 HB3 MET A 383 4.576 -5.289 -0.186 1.00 0.00 H ATOM 176 HG2 MET A 383 1.884 -4.307 0.601 1.00 0.00 H ATOM 177 HG3 MET A 383 2.993 -3.735 -0.667 1.00 0.00 H ATOM 178 HE1 MET A 383 1.827 -3.458 3.024 1.00 0.00 H ATOM 179 HE2 MET A 383 3.395 -4.268 3.258 1.00 0.00 H ATOM 180 HE3 MET A 383 3.169 -2.591 3.810 1.00 0.00 H ATOM 181 H MET A 383 1.095 -6.440 -0.705 1.00 0.00 H ATOM 182 N VAL A 384 0.930 -7.372 1.408 1.00 0.00 N ATOM 183 CA VAL A 384 0.061 -7.713 2.530 1.00 0.00 C ATOM 184 C VAL A 384 -0.971 -8.763 2.133 1.00 0.00 C ATOM 185 O VAL A 384 -1.720 -8.580 1.172 1.00 0.00 O ATOM 186 CB VAL A 384 -0.681 -6.478 3.078 1.00 0.00 C ATOM 187 CG1 VAL A 384 0.175 -5.744 4.098 1.00 0.00 C ATOM 188 CG2 VAL A 384 -1.089 -5.548 1.946 1.00 0.00 C ATOM 189 HA VAL A 384 0.711 -8.113 3.308 1.00 0.00 H ATOM 190 HB VAL A 384 -1.587 -6.820 3.579 1.00 0.00 H ATOM 191 HG11 VAL A 384 0.405 -6.414 4.927 1.00 0.00 H ATOM 192 HG12 VAL A 384 1.101 -5.418 3.625 1.00 0.00 H ATOM 193 HG13 VAL A 384 -0.370 -4.876 4.470 1.00 0.00 H ATOM 194 HG21 VAL A 384 -0.199 -5.216 1.412 1.00 0.00 H ATOM 195 HG22 VAL A 384 -1.749 -6.080 1.260 1.00 0.00 H ATOM 196 HG23 VAL A 384 -1.611 -4.684 2.357 1.00 0.00 H ATOM 197 H VAL A 384 0.568 -7.469 0.438 1.00 0.00 H ATOM 198 N LEU A 385 -1.006 -9.860 2.881 1.00 0.00 N ATOM 199 CA LEU A 385 -1.953 -10.937 2.617 1.00 0.00 C ATOM 200 C LEU A 385 -3.001 -11.008 3.727 1.00 0.00 C ATOM 201 O LEU A 385 -2.726 -10.634 4.866 1.00 0.00 O ATOM 202 CB LEU A 385 -1.218 -12.275 2.501 1.00 0.00 C ATOM 203 CG LEU A 385 -0.613 -12.569 1.126 1.00 0.00 C ATOM 204 CD1 LEU A 385 0.319 -13.769 1.199 1.00 0.00 C ATOM 205 CD2 LEU A 385 -1.710 -12.809 0.099 1.00 0.00 C ATOM 206 HA LEU A 385 -2.457 -10.731 1.673 1.00 0.00 H ATOM 207 HB2 LEU A 385 -0.411 -12.281 3.233 1.00 0.00 H ATOM 208 HB3 LEU A 385 -1.926 -13.070 2.735 1.00 0.00 H ATOM 209 HG LEU A 385 -0.033 -11.700 0.814 1.00 0.00 H ATOM 210 HD21 LEU A 385 -2.316 -13.661 0.409 1.00 0.00 H ATOM 211 HD22 LEU A 385 -2.339 -11.922 0.027 1.00 0.00 H ATOM 212 HD23 LEU A 385 -1.259 -13.016 -0.871 1.00 0.00 H ATOM 213 HD11 LEU A 385 1.124 -13.560 1.903 1.00 0.00 H ATOM 214 HD12 LEU A 385 -0.241 -14.642 1.534 1.00 0.00 H ATOM 215 HD13 LEU A 385 0.739 -13.962 0.212 1.00 0.00 H ATOM 216 H LEU A 385 -0.341 -9.953 3.675 1.00 0.00 H ATOM 217 N PRO A 386 -4.220 -11.488 3.414 1.00 0.00 N ATOM 218 CA PRO A 386 -5.299 -11.593 4.403 1.00 0.00 C ATOM 219 C PRO A 386 -4.957 -12.559 5.532 1.00 0.00 C ATOM 220 O PRO A 386 -5.508 -12.466 6.630 1.00 0.00 O ATOM 221 CB PRO A 386 -6.490 -12.113 3.593 1.00 0.00 C ATOM 222 CG PRO A 386 -5.892 -12.746 2.385 1.00 0.00 C ATOM 223 CD PRO A 386 -4.643 -11.967 2.085 1.00 0.00 C ATOM 224 HA PRO A 386 -5.492 -10.638 4.893 1.00 0.00 H ATOM 225 HD3 PRO A 386 -3.881 -12.606 1.638 1.00 0.00 H ATOM 226 HD2 PRO A 386 -4.853 -11.132 1.417 1.00 0.00 H ATOM 227 HG3 PRO A 386 -6.585 -12.690 1.545 1.00 0.00 H ATOM 228 HG2 PRO A 386 -5.649 -13.790 2.585 1.00 0.00 H ATOM 229 HB2 PRO A 386 -7.054 -12.846 4.170 1.00 0.00 H ATOM 230 HB3 PRO A 386 -7.148 -11.292 3.309 1.00 0.00 H ATOM 231 N GLU A 387 -4.046 -13.487 5.256 1.00 0.00 N ATOM 232 CA GLU A 387 -3.626 -14.465 6.253 1.00 0.00 C ATOM 233 C GLU A 387 -2.631 -13.843 7.225 1.00 0.00 C ATOM 234 O GLU A 387 -2.227 -14.470 8.205 1.00 0.00 O ATOM 235 CB GLU A 387 -3.002 -15.685 5.573 1.00 0.00 C ATOM 236 CG GLU A 387 -3.855 -16.939 5.666 1.00 0.00 C ATOM 237 CD GLU A 387 -4.797 -17.093 4.488 1.00 0.00 C ATOM 238 OE1 GLU A 387 -4.369 -17.647 3.454 1.00 0.00 O ATOM 239 OE2 GLU A 387 -5.963 -16.658 4.599 1.00 0.00 O ATOM 240 HA GLU A 387 -4.506 -14.785 6.811 1.00 0.00 H ATOM 241 HB2 GLU A 387 -2.848 -15.451 4.520 1.00 0.00 H ATOM 242 HB3 GLU A 387 -2.040 -15.887 6.044 1.00 0.00 H ATOM 243 HG2 GLU A 387 -3.197 -17.807 5.703 1.00 0.00 H ATOM 244 HG3 GLU A 387 -4.445 -16.893 6.581 1.00 0.00 H ATOM 245 H GLU A 387 -3.623 -13.516 4.306 1.00 0.00 H ATOM 246 N GLU A 388 -2.239 -12.603 6.945 1.00 0.00 N ATOM 247 CA GLU A 388 -1.291 -11.886 7.789 1.00 0.00 C ATOM 248 C GLU A 388 -1.981 -10.747 8.533 1.00 0.00 C ATOM 249 O GLU A 388 -1.659 -10.464 9.688 1.00 0.00 O ATOM 250 CB GLU A 388 -0.136 -11.341 6.949 1.00 0.00 C ATOM 251 CG GLU A 388 0.644 -12.419 6.216 1.00 0.00 C ATOM 252 CD GLU A 388 2.037 -11.967 5.824 1.00 0.00 C ATOM 253 OE1 GLU A 388 2.956 -12.078 6.663 1.00 0.00 O ATOM 254 OE2 GLU A 388 2.208 -11.500 4.678 1.00 0.00 O ATOM 255 HA GLU A 388 -0.893 -12.587 8.523 1.00 0.00 H ATOM 256 HB2 GLU A 388 -0.542 -10.648 6.212 1.00 0.00 H ATOM 257 HB3 GLU A 388 0.549 -10.808 7.609 1.00 0.00 H ATOM 258 HG2 GLU A 388 0.729 -13.291 6.865 1.00 0.00 H ATOM 259 HG3 GLU A 388 0.098 -12.692 5.313 1.00 0.00 H ATOM 260 H GLU A 388 -2.620 -12.132 6.100 1.00 0.00 H ATOM 261 N LEU A 389 -2.929 -10.094 7.868 1.00 0.00 N ATOM 262 CA LEU A 389 -3.664 -8.989 8.476 1.00 0.00 C ATOM 263 C LEU A 389 -4.810 -9.513 9.335 1.00 0.00 C ATOM 264 O LEU A 389 -5.874 -8.898 9.415 1.00 0.00 O ATOM 265 CB LEU A 389 -4.207 -8.039 7.402 1.00 0.00 C ATOM 266 CG LEU A 389 -3.271 -7.772 6.218 1.00 0.00 C ATOM 267 CD1 LEU A 389 -3.805 -6.630 5.368 1.00 0.00 C ATOM 268 CD2 LEU A 389 -1.862 -7.457 6.698 1.00 0.00 C ATOM 269 HA LEU A 389 -2.972 -8.437 9.112 1.00 0.00 H ATOM 270 HB2 LEU A 389 -5.129 -8.468 7.010 1.00 0.00 H ATOM 271 HB3 LEU A 389 -4.426 -7.084 7.879 1.00 0.00 H ATOM 272 HG LEU A 389 -3.230 -8.675 5.609 1.00 0.00 H ATOM 273 HD21 LEU A 389 -1.885 -6.571 7.333 1.00 0.00 H ATOM 274 HD22 LEU A 389 -1.476 -8.303 7.266 1.00 0.00 H ATOM 275 HD23 LEU A 389 -1.219 -7.272 5.837 1.00 0.00 H ATOM 276 HD11 LEU A 389 -4.793 -6.892 4.989 1.00 0.00 H ATOM 277 HD12 LEU A 389 -3.876 -5.728 5.976 1.00 0.00 H ATOM 278 HD13 LEU A 389 -3.128 -6.454 4.532 1.00 0.00 H ATOM 279 H LEU A 389 -3.152 -10.377 6.892 1.00 0.00 H ATOM 280 N LEU A 390 -4.581 -10.654 9.975 1.00 0.00 N ATOM 281 CA LEU A 390 -5.587 -11.272 10.830 1.00 0.00 C ATOM 282 C LEU A 390 -5.017 -11.549 12.216 1.00 0.00 C ATOM 283 O LEU A 390 -5.760 -11.795 13.167 1.00 0.00 O ATOM 284 CB LEU A 390 -6.087 -12.571 10.197 1.00 0.00 C ATOM 285 CG LEU A 390 -7.529 -12.536 9.702 1.00 0.00 C ATOM 286 CD1 LEU A 390 -7.753 -13.600 8.639 1.00 0.00 C ATOM 287 CD2 LEU A 390 -8.495 -12.723 10.861 1.00 0.00 C ATOM 288 HA LEU A 390 -6.424 -10.582 10.933 1.00 0.00 H ATOM 289 HB2 LEU A 390 -5.444 -12.803 9.348 1.00 0.00 H ATOM 290 HB3 LEU A 390 -6.004 -13.363 10.941 1.00 0.00 H ATOM 291 HG LEU A 390 -7.717 -11.560 9.254 1.00 0.00 H ATOM 292 HD21 LEU A 390 -8.307 -13.685 11.337 1.00 0.00 H ATOM 293 HD22 LEU A 390 -8.350 -11.922 11.586 1.00 0.00 H ATOM 294 HD23 LEU A 390 -9.519 -12.695 10.487 1.00 0.00 H ATOM 295 HD11 LEU A 390 -7.085 -13.418 7.798 1.00 0.00 H ATOM 296 HD12 LEU A 390 -7.547 -14.583 9.062 1.00 0.00 H ATOM 297 HD13 LEU A 390 -8.788 -13.559 8.298 1.00 0.00 H ATOM 298 H LEU A 390 -3.658 -11.120 9.863 1.00 0.00 H ATOM 299 N ASP A 391 -3.693 -11.507 12.321 1.00 0.00 N ATOM 300 CA ASP A 391 -3.014 -11.747 13.590 1.00 0.00 C ATOM 301 C ASP A 391 -2.649 -10.426 14.260 1.00 0.00 C ATOM 302 O ASP A 391 -2.382 -9.433 13.585 1.00 0.00 O ATOM 303 CB ASP A 391 -1.756 -12.589 13.367 1.00 0.00 C ATOM 304 CG ASP A 391 -2.065 -14.067 13.226 1.00 0.00 C ATOM 305 OD1 ASP A 391 -2.887 -14.580 14.015 1.00 0.00 O ATOM 306 OD2 ASP A 391 -1.486 -14.711 12.327 1.00 0.00 O ATOM 307 HA ASP A 391 -3.692 -12.293 14.246 1.00 0.00 H ATOM 308 HB2 ASP A 391 -1.262 -12.246 12.458 1.00 0.00 H ATOM 309 HB3 ASP A 391 -1.087 -12.451 14.216 1.00 0.00 H ATOM 310 H ASP A 391 -3.125 -11.297 11.475 1.00 0.00 H ATOM 311 N ASP A 392 -2.637 -10.422 15.590 1.00 0.00 N ATOM 312 CA ASP A 392 -2.309 -9.217 16.346 1.00 0.00 C ATOM 313 C ASP A 392 -0.815 -8.911 16.276 1.00 0.00 C ATOM 314 O ASP A 392 -0.408 -7.750 16.331 1.00 0.00 O ATOM 315 CB ASP A 392 -2.741 -9.371 17.805 1.00 0.00 C ATOM 316 CG ASP A 392 -4.168 -9.867 17.937 1.00 0.00 C ATOM 317 OD1 ASP A 392 -5.065 -9.270 17.304 1.00 0.00 O ATOM 318 OD2 ASP A 392 -4.388 -10.851 18.674 1.00 0.00 O ATOM 319 HA ASP A 392 -2.850 -8.384 15.898 1.00 0.00 H ATOM 320 HB2 ASP A 392 -2.076 -10.083 18.294 1.00 0.00 H ATOM 321 HB3 ASP A 392 -2.660 -8.402 18.298 1.00 0.00 H ATOM 322 H ASP A 392 -2.866 -11.297 16.103 1.00 0.00 H ATOM 323 N GLU A 393 -0.005 -9.958 16.150 1.00 0.00 N ATOM 324 CA GLU A 393 1.441 -9.800 16.077 1.00 0.00 C ATOM 325 C GLU A 393 1.858 -9.283 14.706 1.00 0.00 C ATOM 326 O GLU A 393 2.644 -8.341 14.595 1.00 0.00 O ATOM 327 CB GLU A 393 2.136 -11.131 16.367 1.00 0.00 C ATOM 328 CG GLU A 393 1.981 -11.599 17.804 1.00 0.00 C ATOM 329 CD GLU A 393 2.936 -10.897 18.750 1.00 0.00 C ATOM 330 OE1 GLU A 393 4.163 -11.061 18.583 1.00 0.00 O ATOM 331 OE2 GLU A 393 2.457 -10.184 19.657 1.00 0.00 O ATOM 332 HA GLU A 393 1.743 -9.071 16.829 1.00 0.00 H ATOM 333 HB2 GLU A 393 1.714 -11.891 15.710 1.00 0.00 H ATOM 334 HB3 GLU A 393 3.199 -11.018 16.154 1.00 0.00 H ATOM 335 HG2 GLU A 393 0.959 -11.401 18.128 1.00 0.00 H ATOM 336 HG3 GLU A 393 2.173 -12.671 17.845 1.00 0.00 H ATOM 337 H GLU A 393 -0.414 -10.913 16.102 1.00 0.00 H ATOM 338 N GLU A 394 1.321 -9.906 13.663 1.00 0.00 N ATOM 339 CA GLU A 394 1.632 -9.513 12.295 1.00 0.00 C ATOM 340 C GLU A 394 1.132 -8.101 12.010 1.00 0.00 C ATOM 341 O GLU A 394 1.841 -7.291 11.410 1.00 0.00 O ATOM 342 CB GLU A 394 1.010 -10.499 11.305 1.00 0.00 C ATOM 343 CG GLU A 394 1.818 -10.671 10.028 1.00 0.00 C ATOM 344 CD GLU A 394 3.205 -11.226 10.285 1.00 0.00 C ATOM 345 OE1 GLU A 394 3.319 -12.442 10.549 1.00 0.00 O ATOM 346 OE2 GLU A 394 4.178 -10.444 10.223 1.00 0.00 O ATOM 347 HA GLU A 394 2.715 -9.526 12.175 1.00 0.00 H ATOM 348 HB2 GLU A 394 0.925 -11.470 11.793 1.00 0.00 H ATOM 349 HB3 GLU A 394 0.016 -10.139 11.038 1.00 0.00 H ATOM 350 HG2 GLU A 394 1.285 -11.355 9.367 1.00 0.00 H ATOM 351 HG3 GLU A 394 1.915 -9.700 9.543 1.00 0.00 H ATOM 352 H GLU A 394 0.662 -10.694 13.827 1.00 0.00 H ATOM 353 N TYR A 395 -0.093 -7.812 12.443 1.00 0.00 N ATOM 354 CA TYR A 395 -0.690 -6.498 12.241 1.00 0.00 C ATOM 355 C TYR A 395 0.187 -5.397 12.827 1.00 0.00 C ATOM 356 O TYR A 395 0.626 -4.496 12.112 1.00 0.00 O ATOM 357 CB TYR A 395 -2.076 -6.449 12.881 1.00 0.00 C ATOM 358 CG TYR A 395 -2.938 -5.331 12.355 1.00 0.00 C ATOM 359 CD1 TYR A 395 -3.430 -5.364 11.058 1.00 0.00 C ATOM 360 CD2 TYR A 395 -3.259 -4.241 13.151 1.00 0.00 C ATOM 361 CE1 TYR A 395 -4.216 -4.343 10.568 1.00 0.00 C ATOM 362 CE2 TYR A 395 -4.047 -3.215 12.670 1.00 0.00 C ATOM 363 CZ TYR A 395 -4.524 -3.269 11.377 1.00 0.00 C ATOM 364 OH TYR A 395 -5.307 -2.246 10.895 1.00 0.00 O ATOM 365 HA TYR A 395 -0.778 -6.330 11.168 1.00 0.00 H ATOM 366 HB3 TYR A 395 -1.956 -6.317 13.956 1.00 0.00 H ATOM 367 HB2 TYR A 395 -2.580 -7.396 12.687 1.00 0.00 H ATOM 368 HD2 TYR A 395 -2.883 -4.194 14.173 1.00 0.00 H ATOM 369 HE2 TYR A 395 -4.291 -2.366 13.309 1.00 0.00 H ATOM 370 HE1 TYR A 395 -4.592 -4.384 9.546 1.00 0.00 H ATOM 371 HD1 TYR A 395 -3.191 -6.212 10.416 1.00 0.00 H ATOM 372 HH TYR A 395 -5.562 -2.441 9.958 1.00 0.00 H ATOM 373 H TYR A 395 -0.639 -8.544 12.939 1.00 0.00 H ATOM 374 N GLU A 396 0.437 -5.476 14.132 1.00 0.00 N ATOM 375 CA GLU A 396 1.256 -4.480 14.815 1.00 0.00 C ATOM 376 C GLU A 396 2.640 -4.374 14.180 1.00 0.00 C ATOM 377 O GLU A 396 3.279 -3.324 14.236 1.00 0.00 O ATOM 378 CB GLU A 396 1.389 -4.829 16.298 1.00 0.00 C ATOM 379 CG GLU A 396 0.536 -3.959 17.206 1.00 0.00 C ATOM 380 CD GLU A 396 1.282 -2.738 17.711 1.00 0.00 C ATOM 381 OE1 GLU A 396 1.791 -1.965 16.872 1.00 0.00 O ATOM 382 OE2 GLU A 396 1.354 -2.554 18.944 1.00 0.00 O ATOM 383 HA GLU A 396 0.760 -3.514 14.717 1.00 0.00 H ATOM 384 HB2 GLU A 396 1.091 -5.868 16.436 1.00 0.00 H ATOM 385 HB3 GLU A 396 2.433 -4.711 16.588 1.00 0.00 H ATOM 386 HG2 GLU A 396 -0.341 -3.628 16.650 1.00 0.00 H ATOM 387 HG3 GLU A 396 0.218 -4.554 18.062 1.00 0.00 H ATOM 388 H GLU A 396 0.039 -6.267 14.678 1.00 0.00 H ATOM 389 N GLU A 397 3.095 -5.465 13.572 1.00 0.00 N ATOM 390 CA GLU A 397 4.405 -5.494 12.931 1.00 0.00 C ATOM 391 C GLU A 397 4.414 -4.675 11.642 1.00 0.00 C ATOM 392 O GLU A 397 5.374 -3.958 11.360 1.00 0.00 O ATOM 393 CB GLU A 397 4.816 -6.934 12.630 1.00 0.00 C ATOM 394 CG GLU A 397 6.317 -7.119 12.498 1.00 0.00 C ATOM 395 CD GLU A 397 6.947 -7.695 13.751 1.00 0.00 C ATOM 396 OE1 GLU A 397 6.583 -8.827 14.132 1.00 0.00 O ATOM 397 OE2 GLU A 397 7.806 -7.014 14.350 1.00 0.00 O ATOM 398 HA GLU A 397 5.121 -5.050 13.622 1.00 0.00 H ATOM 399 HB2 GLU A 397 4.459 -7.571 13.439 1.00 0.00 H ATOM 400 HB3 GLU A 397 4.347 -7.239 11.695 1.00 0.00 H ATOM 401 HG2 GLU A 397 6.514 -7.795 11.666 1.00 0.00 H ATOM 402 HG3 GLU A 397 6.772 -6.150 12.292 1.00 0.00 H ATOM 403 H GLU A 397 2.502 -6.319 13.553 1.00 0.00 H ATOM 404 N ILE A 398 3.341 -4.784 10.864 1.00 0.00 N ATOM 405 CA ILE A 398 3.236 -4.056 9.603 1.00 0.00 C ATOM 406 C ILE A 398 2.946 -2.576 9.832 1.00 0.00 C ATOM 407 O ILE A 398 3.657 -1.714 9.323 1.00 0.00 O ATOM 408 CB ILE A 398 2.135 -4.655 8.702 1.00 0.00 C ATOM 409 CG1 ILE A 398 2.516 -6.076 8.280 1.00 0.00 C ATOM 410 CG2 ILE A 398 1.900 -3.774 7.481 1.00 0.00 C ATOM 411 CD1 ILE A 398 1.483 -6.746 7.399 1.00 0.00 C ATOM 412 HA ILE A 398 4.200 -4.153 9.104 1.00 0.00 H ATOM 413 HB ILE A 398 1.205 -4.698 9.270 1.00 0.00 H ATOM 414 HG12 ILE A 398 3.458 -6.032 7.734 1.00 0.00 H ATOM 415 HG13 ILE A 398 2.646 -6.679 9.179 1.00 0.00 H ATOM 416 HD11 ILE A 398 0.536 -6.809 7.935 1.00 0.00 H ATOM 417 HD12 ILE A 398 1.349 -6.161 6.489 1.00 0.00 H ATOM 418 HD13 ILE A 398 1.823 -7.749 7.141 1.00 0.00 H ATOM 419 HG21 ILE A 398 1.589 -2.781 7.805 1.00 0.00 H ATOM 420 HG22 ILE A 398 2.823 -3.697 6.907 1.00 0.00 H ATOM 421 HG23 ILE A 398 1.120 -4.216 6.861 1.00 0.00 H ATOM 422 H ILE A 398 2.559 -5.402 11.161 1.00 0.00 H ATOM 423 N VAL A 399 1.896 -2.290 10.592 1.00 0.00 N ATOM 424 CA VAL A 399 1.513 -0.911 10.881 1.00 0.00 C ATOM 425 C VAL A 399 2.681 -0.106 11.449 1.00 0.00 C ATOM 426 O VAL A 399 2.943 1.013 11.010 1.00 0.00 O ATOM 427 CB VAL A 399 0.335 -0.854 11.873 1.00 0.00 C ATOM 428 CG1 VAL A 399 -0.068 0.588 12.145 1.00 0.00 C ATOM 429 CG2 VAL A 399 -0.846 -1.652 11.343 1.00 0.00 C ATOM 430 HA VAL A 399 1.209 -0.469 9.932 1.00 0.00 H ATOM 431 HB VAL A 399 0.656 -1.300 12.814 1.00 0.00 H ATOM 432 HG11 VAL A 399 0.779 1.126 12.571 1.00 0.00 H ATOM 433 HG12 VAL A 399 -0.369 1.062 11.211 1.00 0.00 H ATOM 434 HG13 VAL A 399 -0.901 0.605 12.848 1.00 0.00 H ATOM 435 HG21 VAL A 399 -1.166 -1.235 10.388 1.00 0.00 H ATOM 436 HG22 VAL A 399 -0.548 -2.691 11.205 1.00 0.00 H ATOM 437 HG23 VAL A 399 -1.668 -1.600 12.057 1.00 0.00 H ATOM 438 H VAL A 399 1.332 -3.067 10.991 1.00 0.00 H ATOM 439 N GLU A 400 3.380 -0.680 12.424 1.00 0.00 N ATOM 440 CA GLU A 400 4.511 -0.004 13.055 1.00 0.00 C ATOM 441 C GLU A 400 5.649 0.229 12.063 1.00 0.00 C ATOM 442 O GLU A 400 6.045 1.369 11.819 1.00 0.00 O ATOM 443 CB GLU A 400 5.020 -0.820 14.245 1.00 0.00 C ATOM 444 CG GLU A 400 5.804 0.003 15.255 1.00 0.00 C ATOM 445 CD GLU A 400 5.616 -0.483 16.680 1.00 0.00 C ATOM 446 OE1 GLU A 400 4.787 -1.393 16.894 1.00 0.00 O ATOM 447 OE2 GLU A 400 6.297 0.047 17.582 1.00 0.00 O ATOM 448 HA GLU A 400 4.161 0.967 13.405 1.00 0.00 H ATOM 449 HB2 GLU A 400 4.163 -1.263 14.752 1.00 0.00 H ATOM 450 HB3 GLU A 400 5.667 -1.612 13.869 1.00 0.00 H ATOM 451 HG2 GLU A 400 6.863 -0.054 15.004 1.00 0.00 H ATOM 452 HG3 GLU A 400 5.472 1.039 15.193 1.00 0.00 H ATOM 453 H GLU A 400 3.115 -1.633 12.745 1.00 0.00 H ATOM 454 N ASP A 401 6.173 -0.856 11.502 1.00 0.00 N ATOM 455 CA ASP A 401 7.273 -0.774 10.543 1.00 0.00 C ATOM 456 C ASP A 401 6.940 0.178 9.394 1.00 0.00 C ATOM 457 O ASP A 401 7.667 1.137 9.142 1.00 0.00 O ATOM 458 CB ASP A 401 7.598 -2.163 9.993 1.00 0.00 C ATOM 459 CG ASP A 401 8.855 -2.172 9.147 1.00 0.00 C ATOM 460 OD1 ASP A 401 8.775 -1.792 7.960 1.00 0.00 O ATOM 461 OD2 ASP A 401 9.920 -2.561 9.672 1.00 0.00 O ATOM 462 HA ASP A 401 8.144 -0.381 11.066 1.00 0.00 H ATOM 463 HB2 ASP A 401 7.735 -2.848 10.830 1.00 0.00 H ATOM 464 HB3 ASP A 401 6.762 -2.502 9.381 1.00 0.00 H ATOM 465 H ASP A 401 5.790 -1.790 11.752 1.00 0.00 H ATOM 466 N VAL A 402 5.840 -0.103 8.702 1.00 0.00 N ATOM 467 CA VAL A 402 5.402 0.720 7.577 1.00 0.00 C ATOM 468 C VAL A 402 5.319 2.196 7.965 1.00 0.00 C ATOM 469 O VAL A 402 5.570 3.077 7.142 1.00 0.00 O ATOM 470 CB VAL A 402 4.030 0.244 7.044 1.00 0.00 C ATOM 471 CG1 VAL A 402 3.382 1.302 6.161 1.00 0.00 C ATOM 472 CG2 VAL A 402 4.183 -1.064 6.283 1.00 0.00 C ATOM 473 HA VAL A 402 6.147 0.610 6.789 1.00 0.00 H ATOM 474 HB VAL A 402 3.376 0.078 7.900 1.00 0.00 H ATOM 475 HG11 VAL A 402 3.233 2.214 6.739 1.00 0.00 H ATOM 476 HG12 VAL A 402 4.031 1.511 5.311 1.00 0.00 H ATOM 477 HG13 VAL A 402 2.420 0.935 5.803 1.00 0.00 H ATOM 478 HG21 VAL A 402 4.860 -0.916 5.442 1.00 0.00 H ATOM 479 HG22 VAL A 402 4.590 -1.825 6.949 1.00 0.00 H ATOM 480 HG23 VAL A 402 3.209 -1.385 5.915 1.00 0.00 H ATOM 481 H VAL A 402 5.274 -0.934 8.970 1.00 0.00 H ATOM 482 N ARG A 403 4.974 2.462 9.222 1.00 0.00 N ATOM 483 CA ARG A 403 4.862 3.835 9.709 1.00 0.00 C ATOM 484 C ARG A 403 6.235 4.486 9.839 1.00 0.00 C ATOM 485 O ARG A 403 6.496 5.530 9.241 1.00 0.00 O ATOM 486 CB ARG A 403 4.144 3.866 11.059 1.00 0.00 C ATOM 487 CG ARG A 403 3.764 5.266 11.512 1.00 0.00 C ATOM 488 CD ARG A 403 2.982 5.236 12.815 1.00 0.00 C ATOM 489 NE ARG A 403 1.709 5.942 12.706 1.00 0.00 N ATOM 490 CZ ARG A 403 1.322 6.902 13.541 1.00 0.00 C ATOM 491 NH1 ARG A 403 2.107 7.270 14.544 1.00 0.00 N ATOM 492 NH2 ARG A 403 0.148 7.495 13.371 1.00 0.00 N ATOM 493 HA ARG A 403 4.280 4.400 8.981 1.00 0.00 H ATOM 494 HB2 ARG A 403 3.235 3.270 10.980 1.00 0.00 H ATOM 495 HB3 ARG A 403 4.801 3.427 11.810 1.00 0.00 H ATOM 496 HG2 ARG A 403 4.672 5.851 11.657 1.00 0.00 H ATOM 497 HG3 ARG A 403 3.151 5.734 10.741 1.00 0.00 H ATOM 498 HD2 ARG A 403 3.580 5.707 13.595 1.00 0.00 H ATOM 499 HD3 ARG A 403 2.787 4.198 13.085 1.00 0.00 H ATOM 500 HE ARG A 403 1.068 5.679 11.931 1.00 0.00 H ATOM 501 HH12 ARG A 403 1.801 8.021 15.195 1.00 0.00 H ATOM 502 HH11 ARG A 403 3.029 6.808 14.680 1.00 0.00 H ATOM 503 HH22 ARG A 403 -0.155 8.246 14.024 1.00 0.00 H ATOM 504 HH21 ARG A 403 -0.470 7.209 12.585 1.00 0.00 H ATOM 505 H ARG A 403 4.780 1.675 9.873 1.00 0.00 H ATOM 506 N ASP A 404 7.106 3.864 10.628 1.00 0.00 N ATOM 507 CA ASP A 404 8.454 4.382 10.843 1.00 0.00 C ATOM 508 C ASP A 404 9.190 4.565 9.519 1.00 0.00 C ATOM 509 O ASP A 404 9.997 5.483 9.370 1.00 0.00 O ATOM 510 CB ASP A 404 9.246 3.438 11.749 1.00 0.00 C ATOM 511 CG ASP A 404 10.643 3.953 12.039 1.00 0.00 C ATOM 512 OD1 ASP A 404 10.809 4.700 13.026 1.00 0.00 O ATOM 513 OD2 ASP A 404 11.571 3.611 11.276 1.00 0.00 O ATOM 514 HA ASP A 404 8.366 5.355 11.326 1.00 0.00 H ATOM 515 HB2 ASP A 404 8.711 3.326 12.692 1.00 0.00 H ATOM 516 HB3 ASP A 404 9.325 2.467 11.260 1.00 0.00 H ATOM 517 H ASP A 404 6.819 2.985 11.105 1.00 0.00 H ATOM 518 N GLU A 405 8.907 3.687 8.563 1.00 0.00 N ATOM 519 CA GLU A 405 9.547 3.751 7.253 1.00 0.00 C ATOM 520 C GLU A 405 8.996 4.912 6.432 1.00 0.00 C ATOM 521 O GLU A 405 9.754 5.680 5.839 1.00 0.00 O ATOM 522 CB GLU A 405 9.339 2.435 6.499 1.00 0.00 C ATOM 523 CG GLU A 405 10.189 1.290 7.023 1.00 0.00 C ATOM 524 CD GLU A 405 11.674 1.592 6.970 1.00 0.00 C ATOM 525 OE1 GLU A 405 12.285 1.385 5.901 1.00 0.00 O ATOM 526 OE2 GLU A 405 12.225 2.036 7.999 1.00 0.00 O ATOM 527 HA GLU A 405 10.614 3.913 7.405 1.00 0.00 H ATOM 528 HB2 GLU A 405 8.290 2.152 6.583 1.00 0.00 H ATOM 529 HB3 GLU A 405 9.587 2.596 5.450 1.00 0.00 H ATOM 530 HG2 GLU A 405 9.910 1.093 8.058 1.00 0.00 H ATOM 531 HG3 GLU A 405 9.991 0.404 6.420 1.00 0.00 H ATOM 532 H GLU A 405 8.213 2.936 8.753 1.00 0.00 H ATOM 533 N CYS A 406 7.673 5.034 6.405 1.00 0.00 N ATOM 534 CA CYS A 406 7.016 6.101 5.658 1.00 0.00 C ATOM 535 C CYS A 406 7.376 7.471 6.224 1.00 0.00 C ATOM 536 O CYS A 406 7.310 8.480 5.523 1.00 0.00 O ATOM 537 CB CYS A 406 5.500 5.907 5.687 1.00 0.00 C ATOM 538 SG CYS A 406 4.864 4.858 4.359 1.00 0.00 S ATOM 539 HA CYS A 406 7.365 6.055 4.626 1.00 0.00 H ATOM 540 HB2 CYS A 406 5.028 6.886 5.606 1.00 0.00 H ATOM 541 HB3 CYS A 406 5.231 5.453 6.641 1.00 0.00 H ATOM 542 HG CYS A 406 3.493 4.749 4.477 1.00 0.00 H ATOM 543 H CYS A 406 7.091 4.351 6.930 1.00 0.00 H ATOM 544 N SER A 407 7.759 7.499 7.498 1.00 0.00 N ATOM 545 CA SER A 407 8.127 8.747 8.158 1.00 0.00 C ATOM 546 C SER A 407 9.620 9.027 8.002 1.00 0.00 C ATOM 547 O SER A 407 10.238 9.652 8.865 1.00 0.00 O ATOM 548 CB SER A 407 7.757 8.689 9.641 1.00 0.00 C ATOM 549 OG SER A 407 6.818 9.698 9.972 1.00 0.00 O ATOM 550 HA SER A 407 7.574 9.558 7.684 1.00 0.00 H ATOM 551 HB2 SER A 407 8.657 8.830 10.239 1.00 0.00 H ATOM 552 HB3 SER A 407 7.325 7.713 9.863 1.00 0.00 H ATOM 553 HG SER A 407 6.597 9.638 10.935 1.00 0.00 H ATOM 554 H SER A 407 7.797 6.610 8.036 1.00 0.00 H ATOM 555 N LYS A 408 10.191 8.566 6.894 1.00 0.00 N ATOM 556 CA LYS A 408 11.611 8.766 6.624 1.00 0.00 C ATOM 557 C LYS A 408 11.810 9.690 5.429 1.00 0.00 C ATOM 558 O LYS A 408 12.896 10.235 5.225 1.00 0.00 O ATOM 559 CB LYS A 408 12.298 7.424 6.363 1.00 0.00 C ATOM 560 CG LYS A 408 12.351 6.521 7.583 1.00 0.00 C ATOM 561 CD LYS A 408 13.600 5.655 7.579 1.00 0.00 C ATOM 562 CE LYS A 408 14.348 5.749 8.900 1.00 0.00 C ATOM 563 NZ LYS A 408 14.759 7.147 9.206 1.00 0.00 N ATOM 564 HA LYS A 408 12.060 9.231 7.502 1.00 0.00 H ATOM 565 HB2 LYS A 408 11.754 6.906 5.574 1.00 0.00 H ATOM 566 HB3 LYS A 408 13.318 7.617 6.032 1.00 0.00 H ATOM 567 HG2 LYS A 408 12.350 7.138 8.481 1.00 0.00 H ATOM 568 HG3 LYS A 408 11.472 5.876 7.586 1.00 0.00 H ATOM 569 HD2 LYS A 408 13.312 4.618 7.408 1.00 0.00 H ATOM 570 HD3 LYS A 408 14.258 5.985 6.775 1.00 0.00 H ATOM 571 HE2 LYS A 408 15.239 5.123 8.846 1.00 0.00 H ATOM 572 HE3 LYS A 408 13.700 5.389 9.699 1.00 0.00 H ATOM 573 HZ1 LYS A 408 15.384 7.496 8.451 1.00 0.00 H ATOM 574 HZ2 LYS A 408 13.914 7.750 9.265 1.00 0.00 H ATOM 575 HZ3 LYS A 408 15.266 7.167 10.114 1.00 0.00 H ATOM 576 H LYS A 408 9.611 8.050 6.202 1.00 0.00 H ATOM 577 N TYR A 409 10.754 9.862 4.642 1.00 0.00 N ATOM 578 CA TYR A 409 10.806 10.719 3.465 1.00 0.00 C ATOM 579 C TYR A 409 10.041 12.013 3.712 1.00 0.00 C ATOM 580 O TYR A 409 10.188 12.985 2.971 1.00 0.00 O ATOM 581 CB TYR A 409 10.226 9.994 2.249 1.00 0.00 C ATOM 582 CG TYR A 409 10.537 8.514 2.215 1.00 0.00 C ATOM 583 CD1 TYR A 409 9.694 7.593 2.825 1.00 0.00 C ATOM 584 CD2 TYR A 409 11.673 8.039 1.572 1.00 0.00 C ATOM 585 CE1 TYR A 409 9.975 6.240 2.795 1.00 0.00 C ATOM 586 CE2 TYR A 409 11.960 6.687 1.537 1.00 0.00 C ATOM 587 CZ TYR A 409 11.108 5.792 2.149 1.00 0.00 C ATOM 588 OH TYR A 409 11.391 4.447 2.116 1.00 0.00 O ATOM 589 HA TYR A 409 11.850 10.961 3.266 1.00 0.00 H ATOM 590 HB3 TYR A 409 10.635 10.452 1.348 1.00 0.00 H ATOM 591 HB2 TYR A 409 9.143 10.118 2.259 1.00 0.00 H ATOM 592 HD2 TYR A 409 12.349 8.743 1.087 1.00 0.00 H ATOM 593 HE2 TYR A 409 12.855 6.330 1.028 1.00 0.00 H ATOM 594 HE1 TYR A 409 9.304 5.531 3.280 1.00 0.00 H ATOM 595 HD1 TYR A 409 8.797 7.943 3.335 1.00 0.00 H ATOM 596 HH TYR A 409 10.684 3.950 2.599 1.00 0.00 H ATOM 597 H TYR A 409 9.866 9.372 4.872 1.00 0.00 H ATOM 598 N GLY A 410 9.222 12.014 4.759 1.00 0.00 N ATOM 599 CA GLY A 410 8.442 13.191 5.088 1.00 0.00 C ATOM 600 C GLY A 410 7.540 12.975 6.286 1.00 0.00 C ATOM 601 O GLY A 410 7.938 12.346 7.267 1.00 0.00 O ATOM 602 HA3 GLY A 410 7.825 13.453 4.229 1.00 0.00 H ATOM 603 HA2 GLY A 410 9.124 14.012 5.308 1.00 0.00 H ATOM 604 H GLY A 410 9.140 11.161 5.349 1.00 0.00 H ATOM 605 N LEU A 411 6.321 13.498 6.204 1.00 0.00 N ATOM 606 CA LEU A 411 5.354 13.366 7.288 1.00 0.00 C ATOM 607 C LEU A 411 4.162 12.516 6.859 1.00 0.00 C ATOM 608 O LEU A 411 3.595 12.723 5.786 1.00 0.00 O ATOM 609 CB LEU A 411 4.864 14.748 7.731 1.00 0.00 C ATOM 610 CG LEU A 411 5.475 15.281 9.028 1.00 0.00 C ATOM 611 CD1 LEU A 411 5.270 14.295 10.169 1.00 0.00 C ATOM 612 CD2 LEU A 411 6.952 15.577 8.833 1.00 0.00 C ATOM 613 HA LEU A 411 5.851 12.872 8.122 1.00 0.00 H ATOM 614 HB2 LEU A 411 5.094 15.457 6.935 1.00 0.00 H ATOM 615 HB3 LEU A 411 3.784 14.694 7.866 1.00 0.00 H ATOM 616 HG LEU A 411 4.967 16.209 9.290 1.00 0.00 H ATOM 617 HD21 LEU A 411 7.470 14.662 8.545 1.00 0.00 H ATOM 618 HD22 LEU A 411 7.071 16.325 8.049 1.00 0.00 H ATOM 619 HD23 LEU A 411 7.372 15.955 9.765 1.00 0.00 H ATOM 620 HD11 LEU A 411 4.203 14.136 10.323 1.00 0.00 H ATOM 621 HD12 LEU A 411 5.747 13.348 9.919 1.00 0.00 H ATOM 622 HD13 LEU A 411 5.714 14.698 11.080 1.00 0.00 H ATOM 623 H LEU A 411 6.049 14.015 5.344 1.00 0.00 H ATOM 624 N VAL A 412 3.785 11.559 7.704 1.00 0.00 N ATOM 625 CA VAL A 412 2.651 10.690 7.413 1.00 0.00 C ATOM 626 C VAL A 412 1.551 10.873 8.458 1.00 0.00 C ATOM 627 O VAL A 412 1.743 10.581 9.639 1.00 0.00 O ATOM 628 CB VAL A 412 3.068 9.203 7.344 1.00 0.00 C ATOM 629 CG1 VAL A 412 3.731 8.759 8.639 1.00 0.00 C ATOM 630 CG2 VAL A 412 1.868 8.324 7.028 1.00 0.00 C ATOM 631 HA VAL A 412 2.268 10.977 6.434 1.00 0.00 H ATOM 632 HB VAL A 412 3.796 9.096 6.540 1.00 0.00 H ATOM 633 HG11 VAL A 412 4.621 9.363 8.816 1.00 0.00 H ATOM 634 HG12 VAL A 412 3.033 8.888 9.466 1.00 0.00 H ATOM 635 HG13 VAL A 412 4.013 7.709 8.560 1.00 0.00 H ATOM 636 HG21 VAL A 412 1.116 8.444 7.808 1.00 0.00 H ATOM 637 HG22 VAL A 412 1.447 8.618 6.067 1.00 0.00 H ATOM 638 HG23 VAL A 412 2.184 7.282 6.984 1.00 0.00 H ATOM 639 H VAL A 412 4.311 11.428 8.592 1.00 0.00 H ATOM 640 N LYS A 413 0.402 11.370 8.013 1.00 0.00 N ATOM 641 CA LYS A 413 -0.731 11.605 8.902 1.00 0.00 C ATOM 642 C LYS A 413 -1.135 10.328 9.629 1.00 0.00 C ATOM 643 O LYS A 413 -1.076 10.257 10.857 1.00 0.00 O ATOM 644 CB LYS A 413 -1.921 12.151 8.114 1.00 0.00 C ATOM 645 CG LYS A 413 -1.783 13.618 7.744 1.00 0.00 C ATOM 646 CD LYS A 413 -2.482 13.932 6.433 1.00 0.00 C ATOM 647 CE LYS A 413 -3.455 15.091 6.582 1.00 0.00 C ATOM 648 NZ LYS A 413 -4.416 15.158 5.447 1.00 0.00 N ATOM 649 HA LYS A 413 -0.424 12.341 9.645 1.00 0.00 H ATOM 650 HB2 LYS A 413 -2.022 11.572 7.196 1.00 0.00 H ATOM 651 HB3 LYS A 413 -2.820 12.031 8.719 1.00 0.00 H ATOM 652 HG2 LYS A 413 -2.224 14.225 8.535 1.00 0.00 H ATOM 653 HG3 LYS A 413 -0.725 13.861 7.648 1.00 0.00 H ATOM 654 HD2 LYS A 413 -1.733 14.193 5.686 1.00 0.00 H ATOM 655 HD3 LYS A 413 -3.030 13.049 6.104 1.00 0.00 H ATOM 656 HE2 LYS A 413 -2.891 16.023 6.622 1.00 0.00 H ATOM 657 HE3 LYS A 413 -4.013 14.966 7.510 1.00 0.00 H ATOM 658 HZ1 LYS A 413 -3.892 15.284 4.558 1.00 0.00 H ATOM 659 HZ2 LYS A 413 -4.964 14.275 5.406 1.00 0.00 H ATOM 660 HZ3 LYS A 413 -5.061 15.962 5.588 1.00 0.00 H ATOM 661 H LYS A 413 0.307 11.598 7.003 1.00 0.00 H ATOM 662 N SER A 414 -1.545 9.320 8.867 1.00 0.00 N ATOM 663 CA SER A 414 -1.962 8.049 9.449 1.00 0.00 C ATOM 664 C SER A 414 -1.750 6.901 8.469 1.00 0.00 C ATOM 665 O SER A 414 -1.102 7.066 7.436 1.00 0.00 O ATOM 666 CB SER A 414 -3.433 8.116 9.863 1.00 0.00 C ATOM 667 OG SER A 414 -4.211 8.769 8.876 1.00 0.00 O ATOM 668 HA SER A 414 -1.348 7.864 10.331 1.00 0.00 H ATOM 669 HB2 SER A 414 -3.514 8.664 10.801 1.00 0.00 H ATOM 670 HB3 SER A 414 -3.811 7.103 10.002 1.00 0.00 H ATOM 671 HG SER A 414 -4.144 8.272 8.022 1.00 0.00 H ATOM 672 H SER A 414 -1.569 9.439 7.834 1.00 0.00 H ATOM 673 N ILE A 415 -2.295 5.735 8.806 1.00 0.00 N ATOM 674 CA ILE A 415 -2.174 4.554 7.958 1.00 0.00 C ATOM 675 C ILE A 415 -3.440 3.705 8.026 1.00 0.00 C ATOM 676 O ILE A 415 -3.914 3.368 9.112 1.00 0.00 O ATOM 677 CB ILE A 415 -0.967 3.682 8.365 1.00 0.00 C ATOM 678 CG1 ILE A 415 0.327 4.500 8.325 1.00 0.00 C ATOM 679 CG2 ILE A 415 -0.863 2.464 7.457 1.00 0.00 C ATOM 680 CD1 ILE A 415 1.566 3.695 8.658 1.00 0.00 C ATOM 681 HA ILE A 415 -2.024 4.911 6.939 1.00 0.00 H ATOM 682 HB ILE A 415 -1.119 3.337 9.388 1.00 0.00 H ATOM 683 HG12 ILE A 415 0.443 4.912 7.323 1.00 0.00 H ATOM 684 HG13 ILE A 415 0.242 5.315 9.044 1.00 0.00 H ATOM 685 HD11 ILE A 415 1.472 3.284 9.663 1.00 0.00 H ATOM 686 HD12 ILE A 415 1.673 2.882 7.940 1.00 0.00 H ATOM 687 HD13 ILE A 415 2.442 4.342 8.609 1.00 0.00 H ATOM 688 HG21 ILE A 415 -1.774 1.872 7.540 1.00 0.00 H ATOM 689 HG22 ILE A 415 -0.734 2.791 6.425 1.00 0.00 H ATOM 690 HG23 ILE A 415 -0.007 1.860 7.758 1.00 0.00 H ATOM 691 H ILE A 415 -2.822 5.663 9.700 1.00 0.00 H ATOM 692 N GLU A 416 -3.983 3.361 6.861 1.00 0.00 N ATOM 693 CA GLU A 416 -5.192 2.547 6.792 1.00 0.00 C ATOM 694 C GLU A 416 -4.879 1.163 6.239 1.00 0.00 C ATOM 695 O GLU A 416 -4.592 1.007 5.051 1.00 0.00 O ATOM 696 CB GLU A 416 -6.248 3.230 5.923 1.00 0.00 C ATOM 697 CG GLU A 416 -7.621 3.297 6.571 1.00 0.00 C ATOM 698 CD GLU A 416 -7.683 4.302 7.706 1.00 0.00 C ATOM 699 OE1 GLU A 416 -7.203 3.979 8.811 1.00 0.00 O ATOM 700 OE2 GLU A 416 -8.213 5.411 7.487 1.00 0.00 O ATOM 701 HA GLU A 416 -5.584 2.437 7.803 1.00 0.00 H ATOM 702 HB2 GLU A 416 -5.916 4.247 5.713 1.00 0.00 H ATOM 703 HB3 GLU A 416 -6.335 2.677 4.988 1.00 0.00 H ATOM 704 HG2 GLU A 416 -8.351 3.580 5.813 1.00 0.00 H ATOM 705 HG3 GLU A 416 -7.870 2.311 6.963 1.00 0.00 H ATOM 706 H GLU A 416 -3.535 3.680 5.978 1.00 0.00 H ATOM 707 N ILE A 417 -4.935 0.161 7.108 1.00 0.00 N ATOM 708 CA ILE A 417 -4.656 -1.214 6.717 1.00 0.00 C ATOM 709 C ILE A 417 -5.788 -2.144 7.164 1.00 0.00 C ATOM 710 O ILE A 417 -5.940 -2.406 8.356 1.00 0.00 O ATOM 711 CB ILE A 417 -3.317 -1.693 7.316 1.00 0.00 C ATOM 712 CG1 ILE A 417 -2.206 -0.716 6.932 1.00 0.00 C ATOM 713 CG2 ILE A 417 -2.978 -3.101 6.844 1.00 0.00 C ATOM 714 CD1 ILE A 417 -0.894 -0.967 7.641 1.00 0.00 C ATOM 715 HA ILE A 417 -4.584 -1.244 5.630 1.00 0.00 H ATOM 716 HB ILE A 417 -3.410 -1.722 8.402 1.00 0.00 H ATOM 717 HG12 ILE A 417 -2.036 -0.794 5.858 1.00 0.00 H ATOM 718 HG13 ILE A 417 -2.539 0.294 7.173 1.00 0.00 H ATOM 719 HD11 ILE A 417 -1.042 -0.880 8.717 1.00 0.00 H ATOM 720 HD12 ILE A 417 -0.539 -1.969 7.401 1.00 0.00 H ATOM 721 HD13 ILE A 417 -0.159 -0.232 7.313 1.00 0.00 H ATOM 722 HG21 ILE A 417 -3.766 -3.787 7.156 1.00 0.00 H ATOM 723 HG22 ILE A 417 -2.897 -3.109 5.757 1.00 0.00 H ATOM 724 HG23 ILE A 417 -2.030 -3.411 7.282 1.00 0.00 H ATOM 725 H ILE A 417 -5.185 0.364 8.097 1.00 0.00 H ATOM 726 N PRO A 418 -6.605 -2.654 6.214 1.00 0.00 N ATOM 727 CA PRO A 418 -7.730 -3.542 6.531 1.00 0.00 C ATOM 728 C PRO A 418 -7.341 -4.680 7.467 1.00 0.00 C ATOM 729 O PRO A 418 -6.213 -5.172 7.434 1.00 0.00 O ATOM 730 CB PRO A 418 -8.165 -4.098 5.165 1.00 0.00 C ATOM 731 CG PRO A 418 -7.117 -3.665 4.195 1.00 0.00 C ATOM 732 CD PRO A 418 -6.507 -2.420 4.767 1.00 0.00 C ATOM 733 HA PRO A 418 -8.520 -3.004 7.055 1.00 0.00 H ATOM 734 HD3 PRO A 418 -5.468 -2.310 4.455 1.00 0.00 H ATOM 735 HD2 PRO A 418 -7.069 -1.534 4.472 1.00 0.00 H ATOM 736 HG3 PRO A 418 -7.564 -3.455 3.223 1.00 0.00 H ATOM 737 HG2 PRO A 418 -6.360 -4.441 4.085 1.00 0.00 H ATOM 738 HB2 PRO A 418 -8.224 -5.186 5.199 1.00 0.00 H ATOM 739 HB3 PRO A 418 -9.136 -3.691 4.881 1.00 0.00 H ATOM 740 N ARG A 419 -8.291 -5.090 8.300 1.00 0.00 N ATOM 741 CA ARG A 419 -8.071 -6.170 9.253 1.00 0.00 C ATOM 742 C ARG A 419 -9.326 -7.033 9.367 1.00 0.00 C ATOM 743 O ARG A 419 -10.059 -6.948 10.353 1.00 0.00 O ATOM 744 CB ARG A 419 -7.695 -5.605 10.624 1.00 0.00 C ATOM 745 CG ARG A 419 -7.069 -6.630 11.556 1.00 0.00 C ATOM 746 CD ARG A 419 -8.035 -7.049 12.654 1.00 0.00 C ATOM 747 NE ARG A 419 -8.217 -8.498 12.700 1.00 0.00 N ATOM 748 CZ ARG A 419 -8.479 -9.174 13.815 1.00 0.00 C ATOM 749 NH1 ARG A 419 -8.586 -8.536 14.973 1.00 0.00 N ATOM 750 NH2 ARG A 419 -8.633 -10.490 13.773 1.00 0.00 N ATOM 751 HA ARG A 419 -7.248 -6.788 8.894 1.00 0.00 H ATOM 752 HB2 ARG A 419 -6.984 -4.792 10.478 1.00 0.00 H ATOM 753 HB3 ARG A 419 -8.597 -5.216 11.096 1.00 0.00 H ATOM 754 HG2 ARG A 419 -6.787 -7.510 10.977 1.00 0.00 H ATOM 755 HG3 ARG A 419 -6.179 -6.197 12.013 1.00 0.00 H ATOM 756 HD2 ARG A 419 -9.001 -6.578 12.472 1.00 0.00 H ATOM 757 HD3 ARG A 419 -7.644 -6.713 13.614 1.00 0.00 H ATOM 758 HE ARG A 419 -8.137 -9.031 11.811 1.00 0.00 H ATOM 759 HH12 ARG A 419 -8.791 -9.068 15.843 1.00 0.00 H ATOM 760 HH11 ARG A 419 -8.465 -7.504 15.011 1.00 0.00 H ATOM 761 HH22 ARG A 419 -8.838 -11.018 14.645 1.00 0.00 H ATOM 762 HH21 ARG A 419 -8.549 -10.995 12.868 1.00 0.00 H ATOM 763 H ARG A 419 -9.221 -4.626 8.271 1.00 0.00 H ATOM 764 N PRO A 420 -9.590 -7.871 8.347 1.00 0.00 N ATOM 765 CA PRO A 420 -10.764 -8.750 8.327 1.00 0.00 C ATOM 766 C PRO A 420 -10.951 -9.500 9.639 1.00 0.00 C ATOM 767 O PRO A 420 -10.102 -10.299 10.033 1.00 0.00 O ATOM 768 CB PRO A 420 -10.448 -9.724 7.194 1.00 0.00 C ATOM 769 CG PRO A 420 -9.580 -8.947 6.266 1.00 0.00 C ATOM 770 CD PRO A 420 -8.762 -8.030 7.134 1.00 0.00 C ATOM 771 HA PRO A 420 -11.691 -8.194 8.187 1.00 0.00 H ATOM 772 HD3 PRO A 420 -7.799 -8.479 7.376 1.00 0.00 H ATOM 773 HD2 PRO A 420 -8.601 -7.070 6.643 1.00 0.00 H ATOM 774 HG3 PRO A 420 -10.190 -8.368 5.572 1.00 0.00 H ATOM 775 HG2 PRO A 420 -8.930 -9.618 5.704 1.00 0.00 H ATOM 776 HB2 PRO A 420 -9.921 -10.599 7.574 1.00 0.00 H ATOM 777 HB3 PRO A 420 -11.362 -10.042 6.692 1.00 0.00 H ATOM 778 N VAL A 421 -12.066 -9.238 10.313 1.00 0.00 N ATOM 779 CA VAL A 421 -12.355 -9.888 11.583 1.00 0.00 C ATOM 780 C VAL A 421 -12.772 -11.338 11.378 1.00 0.00 C ATOM 781 O VAL A 421 -13.930 -11.626 11.074 1.00 0.00 O ATOM 782 CB VAL A 421 -13.449 -9.138 12.369 1.00 0.00 C ATOM 783 CG1 VAL A 421 -13.806 -9.883 13.648 1.00 0.00 C ATOM 784 CG2 VAL A 421 -12.997 -7.718 12.683 1.00 0.00 C ATOM 785 HA VAL A 421 -11.434 -9.865 12.166 1.00 0.00 H ATOM 786 HB VAL A 421 -14.343 -9.088 11.748 1.00 0.00 H ATOM 787 HG11 VAL A 421 -14.174 -10.878 13.397 1.00 0.00 H ATOM 788 HG12 VAL A 421 -12.919 -9.970 14.276 1.00 0.00 H ATOM 789 HG13 VAL A 421 -14.580 -9.333 14.184 1.00 0.00 H ATOM 790 HG21 VAL A 421 -12.088 -7.752 13.283 1.00 0.00 H ATOM 791 HG22 VAL A 421 -12.800 -7.187 11.752 1.00 0.00 H ATOM 792 HG23 VAL A 421 -13.781 -7.203 13.238 1.00 0.00 H ATOM 793 H VAL A 421 -12.747 -8.554 9.925 1.00 0.00 H ATOM 794 N ASP A 422 -11.813 -12.247 11.544 1.00 0.00 N ATOM 795 CA ASP A 422 -12.069 -13.670 11.367 1.00 0.00 C ATOM 796 C ASP A 422 -12.573 -13.917 9.957 1.00 0.00 C ATOM 797 O ASP A 422 -13.217 -14.927 9.671 1.00 0.00 O ATOM 798 CB ASP A 422 -13.090 -14.168 12.393 1.00 0.00 C ATOM 799 CG ASP A 422 -12.629 -15.427 13.102 1.00 0.00 C ATOM 800 OD1 ASP A 422 -12.180 -16.366 12.411 1.00 0.00 O ATOM 801 OD2 ASP A 422 -12.718 -15.473 14.346 1.00 0.00 O ATOM 802 HA ASP A 422 -11.141 -14.221 11.522 1.00 0.00 H ATOM 803 HB2 ASP A 422 -13.251 -13.386 13.136 1.00 0.00 H ATOM 804 HB3 ASP A 422 -14.028 -14.378 11.880 1.00 0.00 H ATOM 805 H ASP A 422 -10.857 -11.933 11.807 1.00 0.00 H ATOM 806 N GLY A 423 -12.261 -12.972 9.081 1.00 0.00 N ATOM 807 CA GLY A 423 -12.686 -13.052 7.704 1.00 0.00 C ATOM 808 C GLY A 423 -13.867 -12.145 7.439 1.00 0.00 C ATOM 809 O GLY A 423 -14.694 -12.423 6.570 1.00 0.00 O ATOM 810 HA3 GLY A 423 -12.970 -14.080 7.479 1.00 0.00 H ATOM 811 HA2 GLY A 423 -11.859 -12.756 7.059 1.00 0.00 H ATOM 812 H GLY A 423 -11.698 -12.155 9.393 1.00 0.00 H ATOM 813 N VAL A 424 -13.942 -11.054 8.198 1.00 0.00 N ATOM 814 CA VAL A 424 -15.034 -10.103 8.067 1.00 0.00 C ATOM 815 C VAL A 424 -14.867 -9.214 6.834 1.00 0.00 C ATOM 816 O VAL A 424 -15.845 -8.886 6.160 1.00 0.00 O ATOM 817 CB VAL A 424 -15.173 -9.225 9.333 1.00 0.00 C ATOM 818 CG1 VAL A 424 -15.524 -7.783 8.984 1.00 0.00 C ATOM 819 CG2 VAL A 424 -16.220 -9.816 10.265 1.00 0.00 C ATOM 820 HA VAL A 424 -15.945 -10.688 7.946 1.00 0.00 H ATOM 821 HB VAL A 424 -14.208 -9.213 9.839 1.00 0.00 H ATOM 822 HG11 VAL A 424 -14.738 -7.361 8.358 1.00 0.00 H ATOM 823 HG12 VAL A 424 -16.471 -7.761 8.445 1.00 0.00 H ATOM 824 HG13 VAL A 424 -15.612 -7.200 9.901 1.00 0.00 H ATOM 825 HG21 VAL A 424 -17.180 -9.858 9.751 1.00 0.00 H ATOM 826 HG22 VAL A 424 -15.918 -10.822 10.557 1.00 0.00 H ATOM 827 HG23 VAL A 424 -16.309 -9.190 11.153 1.00 0.00 H ATOM 828 H VAL A 424 -13.199 -10.877 8.904 1.00 0.00 H ATOM 829 N GLU A 425 -13.628 -8.832 6.540 1.00 0.00 N ATOM 830 CA GLU A 425 -13.348 -7.966 5.401 1.00 0.00 C ATOM 831 C GLU A 425 -12.359 -8.607 4.430 1.00 0.00 C ATOM 832 O GLU A 425 -11.527 -7.923 3.834 1.00 0.00 O ATOM 833 CB GLU A 425 -12.807 -6.622 5.892 1.00 0.00 C ATOM 834 CG GLU A 425 -13.874 -5.720 6.488 1.00 0.00 C ATOM 835 CD GLU A 425 -14.252 -4.574 5.571 1.00 0.00 C ATOM 836 OE1 GLU A 425 -13.344 -3.825 5.152 1.00 0.00 O ATOM 837 OE2 GLU A 425 -15.455 -4.424 5.271 1.00 0.00 O ATOM 838 HA GLU A 425 -14.283 -7.810 4.862 1.00 0.00 H ATOM 839 HB2 GLU A 425 -12.051 -6.812 6.654 1.00 0.00 H ATOM 840 HB3 GLU A 425 -12.350 -6.105 5.048 1.00 0.00 H ATOM 841 HG2 GLU A 425 -14.764 -6.317 6.686 1.00 0.00 H ATOM 842 HG3 GLU A 425 -13.499 -5.308 7.425 1.00 0.00 H ATOM 843 H GLU A 425 -12.841 -9.158 7.136 1.00 0.00 H ATOM 844 N VAL A 426 -12.460 -9.922 4.273 1.00 0.00 N ATOM 845 CA VAL A 426 -11.582 -10.654 3.364 1.00 0.00 C ATOM 846 C VAL A 426 -11.844 -10.290 1.903 1.00 0.00 C ATOM 847 O VAL A 426 -10.906 -10.089 1.134 1.00 0.00 O ATOM 848 CB VAL A 426 -11.714 -12.179 3.553 1.00 0.00 C ATOM 849 CG1 VAL A 426 -11.328 -12.932 2.285 1.00 0.00 C ATOM 850 CG2 VAL A 426 -10.863 -12.635 4.725 1.00 0.00 C ATOM 851 HA VAL A 426 -10.563 -10.358 3.614 1.00 0.00 H ATOM 852 HB VAL A 426 -12.759 -12.405 3.765 1.00 0.00 H ATOM 853 HG11 VAL A 426 -11.982 -12.626 1.469 1.00 0.00 H ATOM 854 HG12 VAL A 426 -10.294 -12.703 2.028 1.00 0.00 H ATOM 855 HG13 VAL A 426 -11.433 -14.004 2.454 1.00 0.00 H ATOM 856 HG21 VAL A 426 -9.819 -12.387 4.533 1.00 0.00 H ATOM 857 HG22 VAL A 426 -11.196 -12.131 5.632 1.00 0.00 H ATOM 858 HG23 VAL A 426 -10.965 -13.713 4.848 1.00 0.00 H ATOM 859 H VAL A 426 -13.182 -10.443 4.810 1.00 0.00 H ATOM 860 N PRO A 427 -13.123 -10.220 1.500 1.00 0.00 N ATOM 861 CA PRO A 427 -13.497 -9.870 0.132 1.00 0.00 C ATOM 862 C PRO A 427 -13.121 -8.430 -0.187 1.00 0.00 C ATOM 863 O PRO A 427 -13.967 -7.536 -0.206 1.00 0.00 O ATOM 864 CB PRO A 427 -15.017 -10.068 0.094 1.00 0.00 C ATOM 865 CG PRO A 427 -15.464 -10.073 1.519 1.00 0.00 C ATOM 866 CD PRO A 427 -14.284 -10.481 2.354 1.00 0.00 C ATOM 867 HA PRO A 427 -12.981 -10.480 -0.610 1.00 0.00 H ATOM 868 HD3 PRO A 427 -14.233 -9.887 3.266 1.00 0.00 H ATOM 869 HD2 PRO A 427 -14.342 -11.538 2.613 1.00 0.00 H ATOM 870 HG3 PRO A 427 -16.280 -10.784 1.652 1.00 0.00 H ATOM 871 HG2 PRO A 427 -15.800 -9.077 1.809 1.00 0.00 H ATOM 872 HB2 PRO A 427 -15.493 -9.252 -0.450 1.00 0.00 H ATOM 873 HB3 PRO A 427 -15.265 -11.015 -0.385 1.00 0.00 H ATOM 874 N GLY A 428 -11.834 -8.224 -0.435 1.00 0.00 N ATOM 875 CA GLY A 428 -11.323 -6.902 -0.729 1.00 0.00 C ATOM 876 C GLY A 428 -9.991 -6.661 -0.046 1.00 0.00 C ATOM 877 O GLY A 428 -9.267 -5.727 -0.390 1.00 0.00 O ATOM 878 HA3 GLY A 428 -12.040 -6.158 -0.381 1.00 0.00 H ATOM 879 HA2 GLY A 428 -11.193 -6.803 -1.807 1.00 0.00 H ATOM 880 H GLY A 428 -11.178 -9.030 -0.418 1.00 0.00 H ATOM 881 N CYS A 429 -9.673 -7.513 0.929 1.00 0.00 N ATOM 882 CA CYS A 429 -8.418 -7.403 1.665 1.00 0.00 C ATOM 883 C CYS A 429 -7.230 -7.714 0.760 1.00 0.00 C ATOM 884 O CYS A 429 -7.345 -8.506 -0.177 1.00 0.00 O ATOM 885 CB CYS A 429 -8.423 -8.356 2.863 1.00 0.00 C ATOM 886 SG CYS A 429 -6.876 -8.371 3.799 1.00 0.00 S ATOM 887 HA CYS A 429 -8.322 -6.378 2.023 1.00 0.00 H ATOM 888 HB2 CYS A 429 -8.612 -9.365 2.497 1.00 0.00 H ATOM 889 HB3 CYS A 429 -9.228 -8.058 3.535 1.00 0.00 H ATOM 890 HG CYS A 429 -6.985 -9.257 4.851 1.00 0.00 H ATOM 891 H CYS A 429 -10.337 -8.276 1.171 1.00 0.00 H ATOM 892 N GLY A 430 -6.091 -7.088 1.042 1.00 0.00 N ATOM 893 CA GLY A 430 -4.901 -7.318 0.242 1.00 0.00 C ATOM 894 C GLY A 430 -4.208 -6.033 -0.167 1.00 0.00 C ATOM 895 O GLY A 430 -3.062 -6.057 -0.618 1.00 0.00 O ATOM 896 HA3 GLY A 430 -5.187 -7.861 -0.659 1.00 0.00 H ATOM 897 HA2 GLY A 430 -4.202 -7.921 0.822 1.00 0.00 H ATOM 898 H GLY A 430 -6.052 -6.427 1.844 1.00 0.00 H ATOM 899 N LYS A 431 -4.900 -4.909 -0.013 1.00 0.00 N ATOM 900 CA LYS A 431 -4.338 -3.611 -0.374 1.00 0.00 C ATOM 901 C LYS A 431 -4.399 -2.641 0.802 1.00 0.00 C ATOM 902 O LYS A 431 -5.462 -2.421 1.383 1.00 0.00 O ATOM 903 CB LYS A 431 -5.087 -3.022 -1.571 1.00 0.00 C ATOM 904 CG LYS A 431 -5.279 -4.007 -2.712 1.00 0.00 C ATOM 905 CD LYS A 431 -6.751 -4.302 -2.950 1.00 0.00 C ATOM 906 CE LYS A 431 -7.000 -4.771 -4.374 1.00 0.00 C ATOM 907 NZ LYS A 431 -7.812 -3.792 -5.148 1.00 0.00 N ATOM 908 HA LYS A 431 -3.293 -3.761 -0.643 1.00 0.00 H ATOM 909 HB2 LYS A 431 -6.069 -2.689 -1.234 1.00 0.00 H ATOM 910 HB3 LYS A 431 -4.523 -2.167 -1.944 1.00 0.00 H ATOM 911 HG2 LYS A 431 -4.850 -3.585 -3.621 1.00 0.00 H ATOM 912 HG3 LYS A 431 -4.766 -4.937 -2.468 1.00 0.00 H ATOM 913 HD2 LYS A 431 -7.073 -5.081 -2.259 1.00 0.00 H ATOM 914 HD3 LYS A 431 -7.328 -3.395 -2.769 1.00 0.00 H ATOM 915 HE2 LYS A 431 -7.530 -5.723 -4.344 1.00 0.00 H ATOM 916 HE3 LYS A 431 -6.041 -4.906 -4.873 1.00 0.00 H ATOM 917 HZ1 LYS A 431 -8.733 -3.662 -4.682 1.00 0.00 H ATOM 918 HZ2 LYS A 431 -7.310 -2.882 -5.188 1.00 0.00 H ATOM 919 HZ3 LYS A 431 -7.958 -4.151 -6.113 1.00 0.00 H ATOM 920 H LYS A 431 -5.864 -4.955 0.374 1.00 0.00 H ATOM 921 N ILE A 432 -3.251 -2.065 1.149 1.00 0.00 N ATOM 922 CA ILE A 432 -3.176 -1.115 2.252 1.00 0.00 C ATOM 923 C ILE A 432 -2.426 0.139 1.819 1.00 0.00 C ATOM 924 O ILE A 432 -1.877 0.186 0.718 1.00 0.00 O ATOM 925 CB ILE A 432 -2.511 -1.742 3.500 1.00 0.00 C ATOM 926 CG1 ILE A 432 -0.985 -1.770 3.371 1.00 0.00 C ATOM 927 CG2 ILE A 432 -3.045 -3.149 3.706 1.00 0.00 C ATOM 928 CD1 ILE A 432 -0.253 -2.189 4.628 1.00 0.00 C ATOM 929 HA ILE A 432 -4.195 -0.841 2.526 1.00 0.00 H ATOM 930 HB ILE A 432 -2.757 -1.125 4.364 1.00 0.00 H ATOM 931 HG12 ILE A 432 -0.724 -2.469 2.576 1.00 0.00 H ATOM 932 HG13 ILE A 432 -0.648 -0.770 3.099 1.00 0.00 H ATOM 933 HD11 ILE A 432 -0.490 -1.494 5.434 1.00 0.00 H ATOM 934 HD12 ILE A 432 -0.565 -3.194 4.911 1.00 0.00 H ATOM 935 HD13 ILE A 432 0.821 -2.179 4.442 1.00 0.00 H ATOM 936 HG21 ILE A 432 -4.125 -3.109 3.851 1.00 0.00 H ATOM 937 HG22 ILE A 432 -2.817 -3.755 2.829 1.00 0.00 H ATOM 938 HG23 ILE A 432 -2.575 -3.589 4.586 1.00 0.00 H ATOM 939 H ILE A 432 -2.386 -2.298 0.620 1.00 0.00 H ATOM 940 N PHE A 433 -2.404 1.154 2.675 1.00 0.00 N ATOM 941 CA PHE A 433 -1.730 2.404 2.332 1.00 0.00 C ATOM 942 C PHE A 433 -1.581 3.320 3.540 1.00 0.00 C ATOM 943 O PHE A 433 -1.942 2.958 4.659 1.00 0.00 O ATOM 944 CB PHE A 433 -2.505 3.130 1.231 1.00 0.00 C ATOM 945 CG PHE A 433 -3.995 2.989 1.344 1.00 0.00 C ATOM 946 CD1 PHE A 433 -4.684 3.610 2.370 1.00 0.00 C ATOM 947 CD2 PHE A 433 -4.705 2.233 0.425 1.00 0.00 C ATOM 948 CE1 PHE A 433 -6.053 3.485 2.479 1.00 0.00 C ATOM 949 CE2 PHE A 433 -6.077 2.103 0.528 1.00 0.00 C ATOM 950 CZ PHE A 433 -6.752 2.729 1.557 1.00 0.00 C ATOM 951 HA PHE A 433 -0.731 2.151 1.978 1.00 0.00 H ATOM 952 HB2 PHE A 433 -2.256 4.190 1.277 1.00 0.00 H ATOM 953 HB3 PHE A 433 -2.194 2.726 0.268 1.00 0.00 H ATOM 954 HD2 PHE A 433 -4.176 1.736 -0.388 1.00 0.00 H ATOM 955 HE2 PHE A 433 -6.625 1.507 -0.202 1.00 0.00 H ATOM 956 HZ PHE A 433 -7.834 2.627 1.642 1.00 0.00 H ATOM 957 HE1 PHE A 433 -6.583 3.982 3.291 1.00 0.00 H ATOM 958 HD1 PHE A 433 -4.138 4.206 3.102 1.00 0.00 H ATOM 959 H PHE A 433 -2.871 1.058 3.599 1.00 0.00 H ATOM 960 N VAL A 434 -1.042 4.514 3.295 1.00 0.00 N ATOM 961 CA VAL A 434 -0.834 5.497 4.352 1.00 0.00 C ATOM 962 C VAL A 434 -1.264 6.892 3.902 1.00 0.00 C ATOM 963 O VAL A 434 -1.063 7.277 2.748 1.00 0.00 O ATOM 964 CB VAL A 434 0.644 5.543 4.799 1.00 0.00 C ATOM 965 CG1 VAL A 434 1.191 4.138 4.987 1.00 0.00 C ATOM 966 CG2 VAL A 434 1.495 6.315 3.801 1.00 0.00 C ATOM 967 HA VAL A 434 -1.450 5.186 5.196 1.00 0.00 H ATOM 968 HB VAL A 434 0.688 6.064 5.756 1.00 0.00 H ATOM 969 HG11 VAL A 434 0.607 3.621 5.749 1.00 0.00 H ATOM 970 HG12 VAL A 434 1.124 3.594 4.045 1.00 0.00 H ATOM 971 HG13 VAL A 434 2.233 4.194 5.302 1.00 0.00 H ATOM 972 HG21 VAL A 434 1.440 5.830 2.827 1.00 0.00 H ATOM 973 HG22 VAL A 434 1.123 7.336 3.721 1.00 0.00 H ATOM 974 HG23 VAL A 434 2.530 6.330 4.143 1.00 0.00 H ATOM 975 H VAL A 434 -0.762 4.752 2.322 1.00 0.00 H ATOM 976 N GLU A 435 -1.864 7.638 4.822 1.00 0.00 N ATOM 977 CA GLU A 435 -2.310 8.993 4.538 1.00 0.00 C ATOM 978 C GLU A 435 -1.157 9.964 4.723 1.00 0.00 C ATOM 979 O GLU A 435 -0.731 10.227 5.848 1.00 0.00 O ATOM 980 CB GLU A 435 -3.467 9.382 5.457 1.00 0.00 C ATOM 981 CG GLU A 435 -4.162 10.670 5.049 1.00 0.00 C ATOM 982 CD GLU A 435 -5.343 11.006 5.938 1.00 0.00 C ATOM 983 OE1 GLU A 435 -5.317 10.628 7.130 1.00 0.00 O ATOM 984 OE2 GLU A 435 -6.296 11.645 5.445 1.00 0.00 O ATOM 985 HA GLU A 435 -2.657 9.035 3.506 1.00 0.00 H ATOM 986 HB2 GLU A 435 -4.201 8.576 5.447 1.00 0.00 H ATOM 987 HB3 GLU A 435 -3.078 9.505 6.468 1.00 0.00 H ATOM 988 HG2 GLU A 435 -3.442 11.487 5.102 1.00 0.00 H ATOM 989 HG3 GLU A 435 -4.516 10.565 4.023 1.00 0.00 H ATOM 990 H GLU A 435 -2.019 7.243 5.771 1.00 0.00 H ATOM 991 N PHE A 436 -0.655 10.490 3.615 1.00 0.00 N ATOM 992 CA PHE A 436 0.459 11.423 3.657 1.00 0.00 C ATOM 993 C PHE A 436 -0.030 12.862 3.804 1.00 0.00 C ATOM 994 O PHE A 436 -1.219 13.142 3.656 1.00 0.00 O ATOM 995 CB PHE A 436 1.302 11.288 2.388 1.00 0.00 C ATOM 996 CG PHE A 436 2.716 10.850 2.637 1.00 0.00 C ATOM 997 CD1 PHE A 436 2.988 9.702 3.363 1.00 0.00 C ATOM 998 CD2 PHE A 436 3.776 11.585 2.133 1.00 0.00 C ATOM 999 CE1 PHE A 436 4.290 9.296 3.584 1.00 0.00 C ATOM 1000 CE2 PHE A 436 5.079 11.185 2.350 1.00 0.00 C ATOM 1001 CZ PHE A 436 5.338 10.039 3.076 1.00 0.00 C ATOM 1002 HA PHE A 436 1.070 11.181 4.527 1.00 0.00 H ATOM 1003 HB2 PHE A 436 0.826 10.555 1.736 1.00 0.00 H ATOM 1004 HB3 PHE A 436 1.326 12.256 1.888 1.00 0.00 H ATOM 1005 HD2 PHE A 436 3.579 12.490 1.558 1.00 0.00 H ATOM 1006 HE2 PHE A 436 5.904 11.774 1.948 1.00 0.00 H ATOM 1007 HZ PHE A 436 6.367 9.722 3.248 1.00 0.00 H ATOM 1008 HE1 PHE A 436 4.490 8.391 4.158 1.00 0.00 H ATOM 1009 HD1 PHE A 436 2.165 9.112 3.765 1.00 0.00 H ATOM 1010 H PHE A 436 -1.067 10.230 2.696 1.00 0.00 H ATOM 1011 N THR A 437 0.900 13.769 4.093 1.00 0.00 N ATOM 1012 CA THR A 437 0.569 15.180 4.266 1.00 0.00 C ATOM 1013 C THR A 437 0.772 15.965 2.974 1.00 0.00 C ATOM 1014 O THR A 437 -0.078 16.768 2.587 1.00 0.00 O ATOM 1015 CB THR A 437 1.420 15.827 5.376 1.00 0.00 C ATOM 1016 OG1 THR A 437 2.776 15.971 4.935 1.00 0.00 O ATOM 1017 CG2 THR A 437 1.384 14.992 6.647 1.00 0.00 C ATOM 1018 HA THR A 437 -0.483 15.217 4.549 1.00 0.00 H ATOM 1019 HB THR A 437 1.001 16.809 5.594 1.00 0.00 H ATOM 1020 HG1 THR A 437 3.313 16.387 5.655 1.00 0.00 H ATOM 1021 HG23 THR A 437 0.352 14.884 6.980 1.00 0.00 H ATOM 1022 HG21 THR A 437 1.807 14.008 6.446 1.00 0.00 H ATOM 1023 HG22 THR A 437 1.968 15.488 7.423 1.00 0.00 H ATOM 1024 H THR A 437 1.889 13.464 4.198 1.00 0.00 H ATOM 1025 N SER A 438 1.901 15.729 2.312 1.00 0.00 N ATOM 1026 CA SER A 438 2.215 16.425 1.068 1.00 0.00 C ATOM 1027 C SER A 438 2.672 15.449 -0.011 1.00 0.00 C ATOM 1028 O SER A 438 3.317 14.439 0.279 1.00 0.00 O ATOM 1029 CB SER A 438 3.299 17.476 1.311 1.00 0.00 C ATOM 1030 OG SER A 438 3.037 18.659 0.577 1.00 0.00 O ATOM 1031 HA SER A 438 1.307 16.917 0.720 1.00 0.00 H ATOM 1032 HB2 SER A 438 4.263 17.071 1.002 1.00 0.00 H ATOM 1033 HB3 SER A 438 3.331 17.716 2.374 1.00 0.00 H ATOM 1034 HG SER A 438 3.753 19.320 0.753 1.00 0.00 H ATOM 1035 H SER A 438 2.575 15.033 2.689 1.00 0.00 H ATOM 1036 N VAL A 439 2.337 15.762 -1.259 1.00 0.00 N ATOM 1037 CA VAL A 439 2.708 14.916 -2.387 1.00 0.00 C ATOM 1038 C VAL A 439 4.201 15.011 -2.680 1.00 0.00 C ATOM 1039 O VAL A 439 4.746 14.208 -3.438 1.00 0.00 O ATOM 1040 CB VAL A 439 1.929 15.296 -3.657 1.00 0.00 C ATOM 1041 CG1 VAL A 439 0.440 15.107 -3.440 1.00 0.00 C ATOM 1042 CG2 VAL A 439 2.239 16.726 -4.071 1.00 0.00 C ATOM 1043 HA VAL A 439 2.457 13.893 -2.106 1.00 0.00 H ATOM 1044 HB VAL A 439 2.244 14.636 -4.466 1.00 0.00 H ATOM 1045 HG11 VAL A 439 0.239 14.063 -3.198 1.00 0.00 H ATOM 1046 HG12 VAL A 439 0.111 15.742 -2.617 1.00 0.00 H ATOM 1047 HG13 VAL A 439 -0.096 15.381 -4.349 1.00 0.00 H ATOM 1048 HG21 VAL A 439 1.956 17.405 -3.267 1.00 0.00 H ATOM 1049 HG22 VAL A 439 3.306 16.822 -4.270 1.00 0.00 H ATOM 1050 HG23 VAL A 439 1.677 16.972 -4.972 1.00 0.00 H ATOM 1051 H VAL A 439 1.796 16.633 -1.435 1.00 0.00 H ATOM 1052 N PHE A 440 4.856 15.998 -2.078 1.00 0.00 N ATOM 1053 CA PHE A 440 6.285 16.199 -2.280 1.00 0.00 C ATOM 1054 C PHE A 440 7.061 15.015 -1.727 1.00 0.00 C ATOM 1055 O PHE A 440 7.852 14.386 -2.432 1.00 0.00 O ATOM 1056 CB PHE A 440 6.745 17.491 -1.603 1.00 0.00 C ATOM 1057 CG PHE A 440 7.349 18.484 -2.554 1.00 0.00 C ATOM 1058 CD1 PHE A 440 8.674 18.370 -2.944 1.00 0.00 C ATOM 1059 CD2 PHE A 440 6.594 19.531 -3.058 1.00 0.00 C ATOM 1060 CE1 PHE A 440 9.234 19.280 -3.819 1.00 0.00 C ATOM 1061 CE2 PHE A 440 7.148 20.444 -3.934 1.00 0.00 C ATOM 1062 CZ PHE A 440 8.470 20.319 -4.315 1.00 0.00 C ATOM 1063 HA PHE A 440 6.477 16.281 -3.350 1.00 0.00 H ATOM 1064 HB2 PHE A 440 5.884 17.954 -1.121 1.00 0.00 H ATOM 1065 HB3 PHE A 440 7.490 17.239 -0.848 1.00 0.00 H ATOM 1066 HD2 PHE A 440 5.551 19.635 -2.760 1.00 0.00 H ATOM 1067 HE2 PHE A 440 6.543 21.262 -4.324 1.00 0.00 H ATOM 1068 HZ PHE A 440 8.910 21.039 -5.006 1.00 0.00 H ATOM 1069 HE1 PHE A 440 10.277 19.179 -4.118 1.00 0.00 H ATOM 1070 HD1 PHE A 440 9.281 17.552 -2.556 1.00 0.00 H ATOM 1071 H PHE A 440 4.337 16.642 -1.448 1.00 0.00 H ATOM 1072 N ASP A 441 6.823 14.716 -0.457 1.00 0.00 N ATOM 1073 CA ASP A 441 7.483 13.600 0.197 1.00 0.00 C ATOM 1074 C ASP A 441 6.866 12.288 -0.273 1.00 0.00 C ATOM 1075 O ASP A 441 7.533 11.255 -0.316 1.00 0.00 O ATOM 1076 CB ASP A 441 7.372 13.731 1.716 1.00 0.00 C ATOM 1077 CG ASP A 441 7.904 15.057 2.222 1.00 0.00 C ATOM 1078 OD1 ASP A 441 9.006 15.458 1.791 1.00 0.00 O ATOM 1079 OD2 ASP A 441 7.220 15.695 3.049 1.00 0.00 O ATOM 1080 HA ASP A 441 8.540 13.608 -0.069 1.00 0.00 H ATOM 1081 HB2 ASP A 441 6.323 13.643 2.000 1.00 0.00 H ATOM 1082 HB3 ASP A 441 7.941 12.925 2.180 1.00 0.00 H ATOM 1083 H ASP A 441 6.148 15.294 0.083 1.00 0.00 H ATOM 1084 N CYS A 442 5.582 12.342 -0.627 1.00 0.00 N ATOM 1085 CA CYS A 442 4.868 11.166 -1.113 1.00 0.00 C ATOM 1086 C CYS A 442 5.503 10.659 -2.402 1.00 0.00 C ATOM 1087 O CYS A 442 5.501 9.461 -2.683 1.00 0.00 O ATOM 1088 CB CYS A 442 3.395 11.500 -1.355 1.00 0.00 C ATOM 1089 SG CYS A 442 2.246 10.227 -0.784 1.00 0.00 S ATOM 1090 HA CYS A 442 4.932 10.385 -0.355 1.00 0.00 H ATOM 1091 HB2 CYS A 442 3.247 11.640 -2.426 1.00 0.00 H ATOM 1092 HB3 CYS A 442 3.164 12.429 -0.833 1.00 0.00 H ATOM 1093 HG CYS A 442 0.952 10.626 -1.049 1.00 0.00 H ATOM 1094 H CYS A 442 5.075 13.247 -0.555 1.00 0.00 H ATOM 1095 N GLN A 443 6.046 11.590 -3.180 1.00 0.00 N ATOM 1096 CA GLN A 443 6.692 11.258 -4.443 1.00 0.00 C ATOM 1097 C GLN A 443 8.092 10.708 -4.204 1.00 0.00 C ATOM 1098 O GLN A 443 8.468 9.676 -4.761 1.00 0.00 O ATOM 1099 CB GLN A 443 6.760 12.498 -5.335 1.00 0.00 C ATOM 1100 CG GLN A 443 7.007 12.185 -6.801 1.00 0.00 C ATOM 1101 CD GLN A 443 7.235 13.432 -7.634 1.00 0.00 C ATOM 1102 OE1 GLN A 443 6.920 13.464 -8.822 1.00 0.00 O ATOM 1103 NE2 GLN A 443 7.789 14.468 -7.012 1.00 0.00 N ATOM 1104 HA GLN A 443 6.102 10.489 -4.942 1.00 0.00 H ATOM 1105 HB2 GLN A 443 5.814 13.034 -5.252 1.00 0.00 H ATOM 1106 HB3 GLN A 443 7.569 13.135 -4.978 1.00 0.00 H ATOM 1107 HG2 GLN A 443 7.888 11.547 -6.878 1.00 0.00 H ATOM 1108 HG3 GLN A 443 6.140 11.655 -7.196 1.00 0.00 H ATOM 1109 HE22 GLN A 443 8.040 14.397 -6.005 1.00 0.00 H ATOM 1110 HE21 GLN A 443 7.972 15.350 -7.532 1.00 0.00 H ATOM 1111 H GLN A 443 6.009 12.585 -2.878 1.00 0.00 H ATOM 1112 N LYS A 444 8.860 11.406 -3.372 1.00 0.00 N ATOM 1113 CA LYS A 444 10.221 10.985 -3.054 1.00 0.00 C ATOM 1114 C LYS A 444 10.214 9.689 -2.251 1.00 0.00 C ATOM 1115 O LYS A 444 11.253 9.052 -2.072 1.00 0.00 O ATOM 1116 CB LYS A 444 10.943 12.083 -2.270 1.00 0.00 C ATOM 1117 CG LYS A 444 12.457 12.017 -2.386 1.00 0.00 C ATOM 1118 CD LYS A 444 13.027 13.300 -2.969 1.00 0.00 C ATOM 1119 CE LYS A 444 13.250 14.350 -1.893 1.00 0.00 C ATOM 1120 NZ LYS A 444 13.423 15.710 -2.473 1.00 0.00 N ATOM 1121 HA LYS A 444 10.751 10.807 -3.990 1.00 0.00 H ATOM 1122 HB2 LYS A 444 10.610 13.051 -2.645 1.00 0.00 H ATOM 1123 HB3 LYS A 444 10.673 11.990 -1.218 1.00 0.00 H ATOM 1124 HG2 LYS A 444 12.882 11.858 -1.395 1.00 0.00 H ATOM 1125 HG3 LYS A 444 12.727 11.183 -3.033 1.00 0.00 H ATOM 1126 HD2 LYS A 444 13.979 13.078 -3.451 1.00 0.00 H ATOM 1127 HD3 LYS A 444 12.330 13.693 -3.709 1.00 0.00 H ATOM 1128 HE2 LYS A 444 14.145 14.091 -1.327 1.00 0.00 H ATOM 1129 HE3 LYS A 444 12.389 14.358 -1.224 1.00 0.00 H ATOM 1130 HZ1 LYS A 444 14.247 15.713 -3.108 1.00 0.00 H ATOM 1131 HZ2 LYS A 444 12.570 15.968 -3.009 1.00 0.00 H ATOM 1132 HZ3 LYS A 444 13.572 16.396 -1.706 1.00 0.00 H ATOM 1133 H LYS A 444 8.482 12.272 -2.938 1.00 0.00 H ATOM 1134 N ALA A 445 9.037 9.304 -1.768 1.00 0.00 N ATOM 1135 CA ALA A 445 8.892 8.084 -0.985 1.00 0.00 C ATOM 1136 C ALA A 445 8.619 6.887 -1.887 1.00 0.00 C ATOM 1137 O ALA A 445 9.345 5.894 -1.855 1.00 0.00 O ATOM 1138 CB ALA A 445 7.777 8.240 0.038 1.00 0.00 C ATOM 1139 HA ALA A 445 9.829 7.906 -0.458 1.00 0.00 H ATOM 1140 HB1 ALA A 445 8.013 9.067 0.708 1.00 0.00 H ATOM 1141 HB2 ALA A 445 6.839 8.445 -0.477 1.00 0.00 H ATOM 1142 HB3 ALA A 445 7.683 7.319 0.614 1.00 0.00 H ATOM 1143 H ALA A 445 8.198 9.889 -1.954 1.00 0.00 H ATOM 1144 N MET A 446 7.567 6.989 -2.692 1.00 0.00 N ATOM 1145 CA MET A 446 7.196 5.916 -3.605 1.00 0.00 C ATOM 1146 C MET A 446 8.298 5.666 -4.630 1.00 0.00 C ATOM 1147 O MET A 446 8.469 4.546 -5.111 1.00 0.00 O ATOM 1148 CB MET A 446 5.882 6.252 -4.315 1.00 0.00 C ATOM 1149 CG MET A 446 5.993 7.406 -5.298 1.00 0.00 C ATOM 1150 SD MET A 446 6.024 6.856 -7.015 1.00 0.00 S ATOM 1151 CE MET A 446 4.382 6.159 -7.177 1.00 0.00 C ATOM 1152 HA MET A 446 7.060 5.006 -3.020 1.00 0.00 H ATOM 1153 HB2 MET A 446 5.549 5.368 -4.859 1.00 0.00 H ATOM 1154 HB3 MET A 446 5.140 6.513 -3.560 1.00 0.00 H ATOM 1155 HG2 MET A 446 6.912 7.954 -5.090 1.00 0.00 H ATOM 1156 HG3 MET A 446 5.138 8.067 -5.159 1.00 0.00 H ATOM 1157 HE1 MET A 446 4.261 5.346 -6.461 1.00 0.00 H ATOM 1158 HE2 MET A 446 3.639 6.932 -6.980 1.00 0.00 H ATOM 1159 HE3 MET A 446 4.250 5.776 -8.189 1.00 0.00 H ATOM 1160 H MET A 446 6.994 7.857 -2.670 1.00 0.00 H ATOM 1161 N GLN A 447 9.047 6.715 -4.959 1.00 0.00 N ATOM 1162 CA GLN A 447 10.136 6.606 -5.925 1.00 0.00 C ATOM 1163 C GLN A 447 11.270 5.754 -5.365 1.00 0.00 C ATOM 1164 O GLN A 447 12.137 5.292 -6.107 1.00 0.00 O ATOM 1165 CB GLN A 447 10.660 7.993 -6.297 1.00 0.00 C ATOM 1166 CG GLN A 447 11.386 8.031 -7.631 1.00 0.00 C ATOM 1167 CD GLN A 447 12.759 8.668 -7.531 1.00 0.00 C ATOM 1168 OE1 GLN A 447 13.013 9.490 -6.651 1.00 0.00 O ATOM 1169 NE2 GLN A 447 13.654 8.289 -8.437 1.00 0.00 N ATOM 1170 HA GLN A 447 9.748 6.123 -6.822 1.00 0.00 H ATOM 1171 HB2 GLN A 447 9.815 8.680 -6.345 1.00 0.00 H ATOM 1172 HB3 GLN A 447 11.350 8.321 -5.519 1.00 0.00 H ATOM 1173 HG2 GLN A 447 11.500 7.010 -7.996 1.00 0.00 H ATOM 1174 HG3 GLN A 447 10.786 8.603 -8.339 1.00 0.00 H ATOM 1175 HE22 GLN A 447 13.395 7.591 -9.163 1.00 0.00 H ATOM 1176 HE21 GLN A 447 14.613 8.690 -8.420 1.00 0.00 H ATOM 1177 H GLN A 447 8.852 7.636 -4.517 1.00 0.00 H ATOM 1178 N GLY A 448 11.254 5.554 -4.051 1.00 0.00 N ATOM 1179 CA GLY A 448 12.283 4.757 -3.409 1.00 0.00 C ATOM 1180 C GLY A 448 11.747 3.446 -2.868 1.00 0.00 C ATOM 1181 O GLY A 448 12.515 2.586 -2.436 1.00 0.00 O ATOM 1182 HA3 GLY A 448 12.705 5.330 -2.583 1.00 0.00 H ATOM 1183 HA2 GLY A 448 13.065 4.542 -4.138 1.00 0.00 H ATOM 1184 H GLY A 448 10.495 5.973 -3.476 1.00 0.00 H ATOM 1185 N LEU A 449 10.425 3.293 -2.893 1.00 0.00 N ATOM 1186 CA LEU A 449 9.787 2.076 -2.401 1.00 0.00 C ATOM 1187 C LEU A 449 9.511 1.105 -3.545 1.00 0.00 C ATOM 1188 O LEU A 449 9.339 -0.094 -3.325 1.00 0.00 O ATOM 1189 CB LEU A 449 8.482 2.413 -1.675 1.00 0.00 C ATOM 1190 CG LEU A 449 8.646 3.189 -0.365 1.00 0.00 C ATOM 1191 CD1 LEU A 449 7.289 3.597 0.185 1.00 0.00 C ATOM 1192 CD2 LEU A 449 9.408 2.359 0.657 1.00 0.00 C ATOM 1193 HA LEU A 449 10.470 1.598 -1.699 1.00 0.00 H ATOM 1194 HB2 LEU A 449 7.867 3.011 -2.347 1.00 0.00 H ATOM 1195 HB3 LEU A 449 7.969 1.478 -1.451 1.00 0.00 H ATOM 1196 HG LEU A 449 9.221 4.092 -0.570 1.00 0.00 H ATOM 1197 HD21 LEU A 449 8.860 1.439 0.857 1.00 0.00 H ATOM 1198 HD22 LEU A 449 10.395 2.117 0.263 1.00 0.00 H ATOM 1199 HD23 LEU A 449 9.513 2.929 1.580 1.00 0.00 H ATOM 1200 HD11 LEU A 449 6.780 4.230 -0.541 1.00 0.00 H ATOM 1201 HD12 LEU A 449 6.692 2.705 0.373 1.00 0.00 H ATOM 1202 HD13 LEU A 449 7.426 4.147 1.116 1.00 0.00 H ATOM 1203 H LEU A 449 9.832 4.059 -3.272 1.00 0.00 H ATOM 1204 N THR A 450 9.469 1.632 -4.765 1.00 0.00 N ATOM 1205 CA THR A 450 9.215 0.812 -5.943 1.00 0.00 C ATOM 1206 C THR A 450 10.460 0.028 -6.345 1.00 0.00 C ATOM 1207 O THR A 450 11.525 0.607 -6.562 1.00 0.00 O ATOM 1208 CB THR A 450 8.757 1.671 -7.138 1.00 0.00 C ATOM 1209 OG1 THR A 450 7.734 2.583 -6.723 1.00 0.00 O ATOM 1210 CG2 THR A 450 8.233 0.794 -8.266 1.00 0.00 C ATOM 1211 HA THR A 450 8.419 0.116 -5.678 1.00 0.00 H ATOM 1212 HB THR A 450 9.617 2.232 -7.504 1.00 0.00 H ATOM 1213 HG1 THR A 450 8.089 3.175 -6.013 1.00 0.00 H ATOM 1214 HG23 THR A 450 9.014 0.101 -8.579 1.00 0.00 H ATOM 1215 HG21 THR A 450 7.367 0.232 -7.916 1.00 0.00 H ATOM 1216 HG22 THR A 450 7.944 1.422 -9.108 1.00 0.00 H ATOM 1217 H THR A 450 9.621 2.654 -4.882 1.00 0.00 H ATOM 1218 N GLY A 451 10.317 -1.290 -6.441 1.00 0.00 N ATOM 1219 CA GLY A 451 11.438 -2.132 -6.817 1.00 0.00 C ATOM 1220 C GLY A 451 12.027 -2.878 -5.637 1.00 0.00 C ATOM 1221 O GLY A 451 12.812 -3.810 -5.812 1.00 0.00 O ATOM 1222 HA3 GLY A 451 12.214 -1.505 -7.257 1.00 0.00 H ATOM 1223 HA2 GLY A 451 11.098 -2.858 -7.555 1.00 0.00 H ATOM 1224 H GLY A 451 9.392 -1.723 -6.245 1.00 0.00 H ATOM 1225 N ARG A 452 11.648 -2.467 -4.430 1.00 0.00 N ATOM 1226 CA ARG A 452 12.142 -3.104 -3.216 1.00 0.00 C ATOM 1227 C ARG A 452 11.467 -4.460 -3.008 1.00 0.00 C ATOM 1228 O ARG A 452 11.056 -5.107 -3.971 1.00 0.00 O ATOM 1229 CB ARG A 452 11.901 -2.197 -2.007 1.00 0.00 C ATOM 1230 CG ARG A 452 12.253 -0.738 -2.261 1.00 0.00 C ATOM 1231 CD ARG A 452 13.758 -0.520 -2.271 1.00 0.00 C ATOM 1232 NE ARG A 452 14.360 -0.798 -0.970 1.00 0.00 N ATOM 1233 CZ ARG A 452 15.329 -0.061 -0.433 1.00 0.00 C ATOM 1234 NH1 ARG A 452 15.800 0.996 -1.081 1.00 0.00 N ATOM 1235 NH2 ARG A 452 15.826 -0.382 0.753 1.00 0.00 N ATOM 1236 HA ARG A 452 13.214 -3.267 -3.322 1.00 0.00 H ATOM 1237 HB2 ARG A 452 10.847 -2.256 -1.736 1.00 0.00 H ATOM 1238 HB3 ARG A 452 12.508 -2.559 -1.177 1.00 0.00 H ATOM 1239 HG2 ARG A 452 11.845 -0.438 -3.226 1.00 0.00 H ATOM 1240 HG3 ARG A 452 11.811 -0.125 -1.475 1.00 0.00 H ATOM 1241 HD2 ARG A 452 13.962 0.517 -2.539 1.00 0.00 H ATOM 1242 HD3 ARG A 452 14.205 -1.181 -3.014 1.00 0.00 H ATOM 1243 HE ARG A 452 14.012 -1.618 -0.433 1.00 0.00 H ATOM 1244 HH12 ARG A 452 16.557 1.570 -0.659 1.00 0.00 H ATOM 1245 HH11 ARG A 452 15.412 1.251 -2.012 1.00 0.00 H ATOM 1246 HH22 ARG A 452 16.583 0.194 1.173 1.00 0.00 H ATOM 1247 HH21 ARG A 452 15.459 -1.210 1.264 1.00 0.00 H ATOM 1248 H ARG A 452 10.983 -1.672 -4.351 1.00 0.00 H ATOM 1249 N LYS A 453 11.356 -4.886 -1.752 1.00 0.00 N ATOM 1250 CA LYS A 453 10.731 -6.168 -1.438 1.00 0.00 C ATOM 1251 C LYS A 453 10.298 -6.229 0.023 1.00 0.00 C ATOM 1252 O LYS A 453 11.127 -6.164 0.931 1.00 0.00 O ATOM 1253 CB LYS A 453 11.697 -7.314 -1.745 1.00 0.00 C ATOM 1254 CG LYS A 453 11.090 -8.409 -2.606 1.00 0.00 C ATOM 1255 CD LYS A 453 12.160 -9.234 -3.299 1.00 0.00 C ATOM 1256 CE LYS A 453 11.821 -9.468 -4.761 1.00 0.00 C ATOM 1257 NZ LYS A 453 11.391 -10.871 -5.015 1.00 0.00 N ATOM 1258 HA LYS A 453 9.842 -6.270 -2.060 1.00 0.00 H ATOM 1259 HB2 LYS A 453 12.562 -6.905 -2.267 1.00 0.00 H ATOM 1260 HB3 LYS A 453 12.019 -7.756 -0.802 1.00 0.00 H ATOM 1261 HG2 LYS A 453 10.491 -9.065 -1.974 1.00 0.00 H ATOM 1262 HG3 LYS A 453 10.451 -7.952 -3.361 1.00 0.00 H ATOM 1263 HD2 LYS A 453 13.112 -8.706 -3.236 1.00 0.00 H ATOM 1264 HD3 LYS A 453 12.246 -10.197 -2.796 1.00 0.00 H ATOM 1265 HE2 LYS A 453 12.702 -9.255 -5.366 1.00 0.00 H ATOM 1266 HE3 LYS A 453 11.013 -8.794 -5.048 1.00 0.00 H ATOM 1267 HZ1 LYS A 453 12.159 -11.521 -4.750 1.00 0.00 H ATOM 1268 HZ2 LYS A 453 10.546 -11.081 -4.447 1.00 0.00 H ATOM 1269 HZ3 LYS A 453 11.169 -10.987 -6.024 1.00 0.00 H ATOM 1270 H LYS A 453 11.722 -4.294 -0.979 1.00 0.00 H ATOM 1271 N PHE A 454 8.991 -6.357 0.243 1.00 0.00 N ATOM 1272 CA PHE A 454 8.443 -6.433 1.593 1.00 0.00 C ATOM 1273 C PHE A 454 9.031 -7.623 2.345 1.00 0.00 C ATOM 1274 O PHE A 454 9.277 -7.550 3.549 1.00 0.00 O ATOM 1275 CB PHE A 454 6.916 -6.546 1.539 1.00 0.00 C ATOM 1276 CG PHE A 454 6.266 -6.660 2.889 1.00 0.00 C ATOM 1277 CD1 PHE A 454 5.987 -5.527 3.639 1.00 0.00 C ATOM 1278 CD2 PHE A 454 5.929 -7.900 3.409 1.00 0.00 C ATOM 1279 CE1 PHE A 454 5.386 -5.630 4.878 1.00 0.00 C ATOM 1280 CE2 PHE A 454 5.329 -8.009 4.648 1.00 0.00 C ATOM 1281 CZ PHE A 454 5.056 -6.872 5.384 1.00 0.00 C ATOM 1282 HA PHE A 454 8.711 -5.520 2.125 1.00 0.00 H ATOM 1283 HB2 PHE A 454 6.523 -5.659 1.042 1.00 0.00 H ATOM 1284 HB3 PHE A 454 6.657 -7.431 0.957 1.00 0.00 H ATOM 1285 HD2 PHE A 454 6.140 -8.801 2.832 1.00 0.00 H ATOM 1286 HE2 PHE A 454 5.071 -8.991 5.045 1.00 0.00 H ATOM 1287 HZ PHE A 454 4.581 -6.955 6.362 1.00 0.00 H ATOM 1288 HE1 PHE A 454 5.172 -4.731 5.457 1.00 0.00 H ATOM 1289 HD1 PHE A 454 6.245 -4.544 3.246 1.00 0.00 H ATOM 1290 H PHE A 454 8.343 -6.404 -0.569 1.00 0.00 H ATOM 1291 N ALA A 455 9.254 -8.716 1.623 1.00 0.00 N ATOM 1292 CA ALA A 455 9.816 -9.925 2.213 1.00 0.00 C ATOM 1293 C ALA A 455 10.393 -10.837 1.136 1.00 0.00 C ATOM 1294 O ALA A 455 11.538 -11.281 1.231 1.00 0.00 O ATOM 1295 CB ALA A 455 8.757 -10.660 3.020 1.00 0.00 C ATOM 1296 HA ALA A 455 10.626 -9.634 2.882 1.00 0.00 H ATOM 1297 HB1 ALA A 455 8.393 -10.011 3.816 1.00 0.00 H ATOM 1298 HB2 ALA A 455 7.929 -10.934 2.366 1.00 0.00 H ATOM 1299 HB3 ALA A 455 9.192 -11.560 3.454 1.00 0.00 H ATOM 1300 H ALA A 455 9.021 -8.709 0.609 1.00 0.00 H ATOM 1301 N ASN A 456 9.591 -11.111 0.111 1.00 0.00 N ATOM 1302 CA ASN A 456 10.019 -11.969 -0.988 1.00 0.00 C ATOM 1303 C ASN A 456 9.201 -11.687 -2.244 1.00 0.00 C ATOM 1304 O ASN A 456 9.061 -12.547 -3.115 1.00 0.00 O ATOM 1305 CB ASN A 456 9.888 -13.443 -0.597 1.00 0.00 C ATOM 1306 CG ASN A 456 8.443 -13.888 -0.490 1.00 0.00 C ATOM 1307 OD1 ASN A 456 7.886 -14.458 -1.428 1.00 0.00 O ATOM 1308 ND2 ASN A 456 7.828 -13.628 0.658 1.00 0.00 N ATOM 1309 HA ASN A 456 11.066 -11.752 -1.200 1.00 0.00 H ATOM 1310 HB2 ASN A 456 10.387 -14.051 -1.352 1.00 0.00 H ATOM 1311 HB3 ASN A 456 10.373 -13.594 0.367 1.00 0.00 H ATOM 1312 HD22 ASN A 456 8.339 -13.144 1.424 1.00 0.00 H ATOM 1313 HD21 ASN A 456 6.836 -13.909 0.791 1.00 0.00 H ATOM 1314 H ASN A 456 8.634 -10.703 0.093 1.00 0.00 H ATOM 1315 N ARG A 457 8.664 -10.474 -2.331 1.00 0.00 N ATOM 1316 CA ARG A 457 7.859 -10.067 -3.476 1.00 0.00 C ATOM 1317 C ARG A 457 8.000 -8.570 -3.715 1.00 0.00 C ATOM 1318 O ARG A 457 7.930 -7.775 -2.778 1.00 0.00 O ATOM 1319 CB ARG A 457 6.384 -10.427 -3.263 1.00 0.00 C ATOM 1320 CG ARG A 457 6.041 -10.814 -1.831 1.00 0.00 C ATOM 1321 CD ARG A 457 5.950 -9.592 -0.932 1.00 0.00 C ATOM 1322 NE ARG A 457 4.637 -9.472 -0.301 1.00 0.00 N ATOM 1323 CZ ARG A 457 4.296 -10.101 0.819 1.00 0.00 C ATOM 1324 NH1 ARG A 457 5.165 -10.895 1.432 1.00 0.00 N ATOM 1325 NH2 ARG A 457 3.082 -9.936 1.330 1.00 0.00 N ATOM 1326 HA ARG A 457 8.221 -10.603 -4.353 1.00 0.00 H ATOM 1327 HB2 ARG A 457 5.777 -9.565 -3.540 1.00 0.00 H ATOM 1328 HB3 ARG A 457 6.139 -11.267 -3.913 1.00 0.00 H ATOM 1329 HG2 ARG A 457 5.082 -11.332 -1.824 1.00 0.00 H ATOM 1330 HG3 ARG A 457 6.815 -11.479 -1.448 1.00 0.00 H ATOM 1331 HD2 ARG A 457 6.136 -8.700 -1.530 1.00 0.00 H ATOM 1332 HD3 ARG A 457 6.709 -9.670 -0.154 1.00 0.00 H ATOM 1333 HE ARG A 457 3.929 -8.859 -0.754 1.00 0.00 H ATOM 1334 HH12 ARG A 457 4.893 -11.385 2.308 1.00 0.00 H ATOM 1335 HH11 ARG A 457 6.118 -11.027 1.036 1.00 0.00 H ATOM 1336 HH22 ARG A 457 2.815 -10.428 2.206 1.00 0.00 H ATOM 1337 HH21 ARG A 457 2.397 -9.314 0.854 1.00 0.00 H ATOM 1338 H ARG A 457 8.823 -9.795 -1.559 1.00 0.00 H ATOM 1339 N VAL A 458 8.203 -8.191 -4.971 1.00 0.00 N ATOM 1340 CA VAL A 458 8.363 -6.785 -5.324 1.00 0.00 C ATOM 1341 C VAL A 458 7.154 -5.969 -4.886 1.00 0.00 C ATOM 1342 O VAL A 458 6.016 -6.295 -5.222 1.00 0.00 O ATOM 1343 CB VAL A 458 8.579 -6.587 -6.837 1.00 0.00 C ATOM 1344 CG1 VAL A 458 9.426 -5.352 -7.086 1.00 0.00 C ATOM 1345 CG2 VAL A 458 9.226 -7.816 -7.460 1.00 0.00 C ATOM 1346 HA VAL A 458 9.252 -6.436 -4.798 1.00 0.00 H ATOM 1347 HB VAL A 458 7.606 -6.446 -7.308 1.00 0.00 H ATOM 1348 HG11 VAL A 458 8.919 -4.477 -6.679 1.00 0.00 H ATOM 1349 HG12 VAL A 458 10.394 -5.472 -6.599 1.00 0.00 H ATOM 1350 HG13 VAL A 458 9.571 -5.223 -8.159 1.00 0.00 H ATOM 1351 HG21 VAL A 458 10.192 -7.995 -6.988 1.00 0.00 H ATOM 1352 HG22 VAL A 458 8.581 -8.681 -7.308 1.00 0.00 H ATOM 1353 HG23 VAL A 458 9.367 -7.649 -8.528 1.00 0.00 H ATOM 1354 H VAL A 458 8.249 -8.912 -5.719 1.00 0.00 H ATOM 1355 N VAL A 459 7.411 -4.906 -4.132 1.00 0.00 N ATOM 1356 CA VAL A 459 6.345 -4.042 -3.641 1.00 0.00 C ATOM 1357 C VAL A 459 5.839 -3.116 -4.740 1.00 0.00 C ATOM 1358 O VAL A 459 6.625 -2.475 -5.438 1.00 0.00 O ATOM 1359 CB VAL A 459 6.812 -3.191 -2.444 1.00 0.00 C ATOM 1360 CG1 VAL A 459 5.622 -2.748 -1.609 1.00 0.00 C ATOM 1361 CG2 VAL A 459 7.811 -3.962 -1.594 1.00 0.00 C ATOM 1362 HA VAL A 459 5.535 -4.696 -3.316 1.00 0.00 H ATOM 1363 HB VAL A 459 7.310 -2.301 -2.828 1.00 0.00 H ATOM 1364 HG11 VAL A 459 4.948 -2.153 -2.226 1.00 0.00 H ATOM 1365 HG12 VAL A 459 5.095 -3.626 -1.236 1.00 0.00 H ATOM 1366 HG13 VAL A 459 5.972 -2.148 -0.769 1.00 0.00 H ATOM 1367 HG21 VAL A 459 7.341 -4.871 -1.219 1.00 0.00 H ATOM 1368 HG22 VAL A 459 8.678 -4.223 -2.201 1.00 0.00 H ATOM 1369 HG23 VAL A 459 8.127 -3.342 -0.755 1.00 0.00 H ATOM 1370 H VAL A 459 8.397 -4.685 -3.886 1.00 0.00 H ATOM 1371 N VAL A 460 4.520 -3.055 -4.890 1.00 0.00 N ATOM 1372 CA VAL A 460 3.903 -2.206 -5.902 1.00 0.00 C ATOM 1373 C VAL A 460 3.278 -0.966 -5.269 1.00 0.00 C ATOM 1374 O VAL A 460 2.107 -0.975 -4.887 1.00 0.00 O ATOM 1375 CB VAL A 460 2.824 -2.972 -6.693 1.00 0.00 C ATOM 1376 CG1 VAL A 460 2.193 -2.079 -7.750 1.00 0.00 C ATOM 1377 CG2 VAL A 460 3.416 -4.223 -7.325 1.00 0.00 C ATOM 1378 HA VAL A 460 4.693 -1.899 -6.588 1.00 0.00 H ATOM 1379 HB VAL A 460 2.041 -3.276 -5.999 1.00 0.00 H ATOM 1380 HG11 VAL A 460 1.731 -1.218 -7.267 1.00 0.00 H ATOM 1381 HG12 VAL A 460 2.963 -1.739 -8.443 1.00 0.00 H ATOM 1382 HG13 VAL A 460 1.435 -2.642 -8.294 1.00 0.00 H ATOM 1383 HG21 VAL A 460 4.220 -3.940 -8.004 1.00 0.00 H ATOM 1384 HG22 VAL A 460 3.811 -4.872 -6.543 1.00 0.00 H ATOM 1385 HG23 VAL A 460 2.640 -4.751 -7.879 1.00 0.00 H ATOM 1386 H VAL A 460 3.912 -3.627 -4.270 1.00 0.00 H ATOM 1387 N THR A 461 4.068 0.097 -5.158 1.00 0.00 N ATOM 1388 CA THR A 461 3.591 1.346 -4.574 1.00 0.00 C ATOM 1389 C THR A 461 2.997 2.257 -5.642 1.00 0.00 C ATOM 1390 O THR A 461 3.480 2.300 -6.774 1.00 0.00 O ATOM 1391 CB THR A 461 4.722 2.098 -3.848 1.00 0.00 C ATOM 1392 OG1 THR A 461 5.786 2.387 -4.762 1.00 0.00 O ATOM 1393 CG2 THR A 461 5.258 1.277 -2.684 1.00 0.00 C ATOM 1394 HA THR A 461 2.819 1.082 -3.851 1.00 0.00 H ATOM 1395 HB THR A 461 4.315 3.031 -3.459 1.00 0.00 H ATOM 1396 HG1 THR A 461 5.442 2.950 -5.500 1.00 0.00 H ATOM 1397 HG23 THR A 461 4.446 1.059 -1.990 1.00 0.00 H ATOM 1398 HG21 THR A 461 5.676 0.344 -3.061 1.00 0.00 H ATOM 1399 HG22 THR A 461 6.035 1.843 -2.169 1.00 0.00 H ATOM 1400 H THR A 461 5.050 0.037 -5.496 1.00 0.00 H ATOM 1401 N LYS A 462 1.947 2.984 -5.275 1.00 0.00 N ATOM 1402 CA LYS A 462 1.284 3.892 -6.204 1.00 0.00 C ATOM 1403 C LYS A 462 0.746 5.122 -5.476 1.00 0.00 C ATOM 1404 O LYS A 462 1.136 5.405 -4.345 1.00 0.00 O ATOM 1405 CB LYS A 462 0.143 3.167 -6.921 1.00 0.00 C ATOM 1406 CG LYS A 462 0.550 2.550 -8.248 1.00 0.00 C ATOM 1407 CD LYS A 462 0.159 3.438 -9.418 1.00 0.00 C ATOM 1408 CE LYS A 462 1.289 4.377 -9.805 1.00 0.00 C ATOM 1409 NZ LYS A 462 0.843 5.797 -9.839 1.00 0.00 N ATOM 1410 HA LYS A 462 2.017 4.224 -6.939 1.00 0.00 H ATOM 1411 HB2 LYS A 462 -0.224 2.373 -6.270 1.00 0.00 H ATOM 1412 HB3 LYS A 462 -0.658 3.883 -7.105 1.00 0.00 H ATOM 1413 HG2 LYS A 462 1.631 2.408 -8.256 1.00 0.00 H ATOM 1414 HG3 LYS A 462 0.057 1.584 -8.356 1.00 0.00 H ATOM 1415 HD2 LYS A 462 -0.088 2.809 -10.273 1.00 0.00 H ATOM 1416 HD3 LYS A 462 -0.713 4.029 -9.139 1.00 0.00 H ATOM 1417 HE2 LYS A 462 1.656 4.099 -10.793 1.00 0.00 H ATOM 1418 HE3 LYS A 462 2.095 4.278 -9.078 1.00 0.00 H ATOM 1419 HZ1 LYS A 462 0.078 5.902 -10.536 1.00 0.00 H ATOM 1420 HZ2 LYS A 462 0.497 6.073 -8.898 1.00 0.00 H ATOM 1421 HZ3 LYS A 462 1.644 6.404 -10.107 1.00 0.00 H ATOM 1422 H LYS A 462 1.589 2.904 -4.302 1.00 0.00 H ATOM 1423 N TYR A 463 -0.147 5.850 -6.139 1.00 0.00 N ATOM 1424 CA TYR A 463 -0.745 7.047 -5.560 1.00 0.00 C ATOM 1425 C TYR A 463 -2.236 6.838 -5.316 1.00 0.00 C ATOM 1426 O TYR A 463 -2.901 6.125 -6.068 1.00 0.00 O ATOM 1427 CB TYR A 463 -0.531 8.248 -6.483 1.00 0.00 C ATOM 1428 CG TYR A 463 0.581 9.169 -6.032 1.00 0.00 C ATOM 1429 CD1 TYR A 463 0.509 9.833 -4.813 1.00 0.00 C ATOM 1430 CD2 TYR A 463 1.702 9.376 -6.827 1.00 0.00 C ATOM 1431 CE1 TYR A 463 1.524 10.676 -4.400 1.00 0.00 C ATOM 1432 CE2 TYR A 463 2.719 10.216 -6.420 1.00 0.00 C ATOM 1433 CZ TYR A 463 2.625 10.864 -5.207 1.00 0.00 C ATOM 1434 OH TYR A 463 3.637 11.702 -4.798 1.00 0.00 O ATOM 1435 HA TYR A 463 -0.259 7.244 -4.604 1.00 0.00 H ATOM 1436 HB3 TYR A 463 -1.458 8.821 -6.524 1.00 0.00 H ATOM 1437 HB2 TYR A 463 -0.289 7.878 -7.480 1.00 0.00 H ATOM 1438 HD2 TYR A 463 1.779 8.867 -7.788 1.00 0.00 H ATOM 1439 HE2 TYR A 463 3.592 10.366 -7.055 1.00 0.00 H ATOM 1440 HE1 TYR A 463 1.454 11.189 -3.441 1.00 0.00 H ATOM 1441 HD1 TYR A 463 -0.361 9.687 -4.173 1.00 0.00 H ATOM 1442 HH TYR A 463 3.411 12.082 -3.912 1.00 0.00 H ATOM 1443 H TYR A 463 -0.427 5.558 -7.097 1.00 0.00 H ATOM 1444 N CYS A 464 -2.758 7.462 -4.262 1.00 0.00 N ATOM 1445 CA CYS A 464 -4.172 7.333 -3.926 1.00 0.00 C ATOM 1446 C CYS A 464 -4.774 8.681 -3.535 1.00 0.00 C ATOM 1447 O CYS A 464 -4.090 9.549 -2.983 1.00 0.00 O ATOM 1448 CB CYS A 464 -4.357 6.325 -2.790 1.00 0.00 C ATOM 1449 SG CYS A 464 -5.098 4.758 -3.308 1.00 0.00 S ATOM 1450 HA CYS A 464 -4.695 6.973 -4.812 1.00 0.00 H ATOM 1451 HB2 CYS A 464 -5.000 6.775 -2.034 1.00 0.00 H ATOM 1452 HB3 CYS A 464 -3.380 6.115 -2.356 1.00 0.00 H ATOM 1453 HG CYS A 464 -5.220 3.925 -2.215 1.00 0.00 H ATOM 1454 H CYS A 464 -2.145 8.054 -3.666 1.00 0.00 H ATOM 1455 N ASP A 465 -6.063 8.846 -3.824 1.00 0.00 N ATOM 1456 CA ASP A 465 -6.770 10.083 -3.516 1.00 0.00 C ATOM 1457 C ASP A 465 -7.211 10.119 -2.052 1.00 0.00 C ATOM 1458 O ASP A 465 -7.826 9.171 -1.565 1.00 0.00 O ATOM 1459 CB ASP A 465 -7.989 10.234 -4.428 1.00 0.00 C ATOM 1460 CG ASP A 465 -7.973 11.536 -5.207 1.00 0.00 C ATOM 1461 OD1 ASP A 465 -8.137 12.604 -4.580 1.00 0.00 O ATOM 1462 OD2 ASP A 465 -7.796 11.487 -6.441 1.00 0.00 O ATOM 1463 HA ASP A 465 -6.084 10.913 -3.687 1.00 0.00 H ATOM 1464 HB2 ASP A 465 -8.003 9.404 -5.134 1.00 0.00 H ATOM 1465 HB3 ASP A 465 -8.890 10.204 -3.816 1.00 0.00 H ATOM 1466 H ASP A 465 -6.581 8.070 -4.283 1.00 0.00 H ATOM 1467 N PRO A 466 -6.901 11.215 -1.328 1.00 0.00 N ATOM 1468 CA PRO A 466 -7.277 11.367 0.081 1.00 0.00 C ATOM 1469 C PRO A 466 -8.771 11.165 0.303 1.00 0.00 C ATOM 1470 O PRO A 466 -9.190 10.661 1.346 1.00 0.00 O ATOM 1471 CB PRO A 466 -6.878 12.811 0.421 1.00 0.00 C ATOM 1472 CG PRO A 466 -6.592 13.470 -0.883 1.00 0.00 C ATOM 1473 CD PRO A 466 -6.155 12.383 -1.815 1.00 0.00 C ATOM 1474 HA PRO A 466 -6.786 10.623 0.709 1.00 0.00 H ATOM 1475 HD3 PRO A 466 -6.422 12.618 -2.845 1.00 0.00 H ATOM 1476 HD2 PRO A 466 -5.080 12.218 -1.749 1.00 0.00 H ATOM 1477 HG3 PRO A 466 -5.800 14.210 -0.767 1.00 0.00 H ATOM 1478 HG2 PRO A 466 -7.489 13.957 -1.265 1.00 0.00 H ATOM 1479 HB2 PRO A 466 -7.694 13.320 0.933 1.00 0.00 H ATOM 1480 HB3 PRO A 466 -5.991 12.821 1.054 1.00 0.00 H ATOM 1481 N ASP A 467 -9.572 11.564 -0.680 1.00 0.00 N ATOM 1482 CA ASP A 467 -11.020 11.421 -0.591 1.00 0.00 C ATOM 1483 C ASP A 467 -11.407 9.951 -0.477 1.00 0.00 C ATOM 1484 O ASP A 467 -12.050 9.543 0.492 1.00 0.00 O ATOM 1485 CB ASP A 467 -11.696 12.047 -1.813 1.00 0.00 C ATOM 1486 CG ASP A 467 -11.907 13.540 -1.657 1.00 0.00 C ATOM 1487 OD1 ASP A 467 -10.902 14.275 -1.573 1.00 0.00 O ATOM 1488 OD2 ASP A 467 -13.078 13.973 -1.618 1.00 0.00 O ATOM 1489 HA ASP A 467 -11.360 11.942 0.304 1.00 0.00 H ATOM 1490 HB2 ASP A 467 -11.070 11.871 -2.688 1.00 0.00 H ATOM 1491 HB3 ASP A 467 -12.665 11.570 -1.960 1.00 0.00 H ATOM 1492 H ASP A 467 -9.156 11.988 -1.533 1.00 0.00 H ATOM 1493 N SER A 468 -11.010 9.161 -1.470 1.00 0.00 N ATOM 1494 CA SER A 468 -11.309 7.735 -1.478 1.00 0.00 C ATOM 1495 C SER A 468 -10.757 7.069 -0.222 1.00 0.00 C ATOM 1496 O SER A 468 -11.346 6.125 0.305 1.00 0.00 O ATOM 1497 CB SER A 468 -10.718 7.071 -2.723 1.00 0.00 C ATOM 1498 OG SER A 468 -9.539 7.736 -3.145 1.00 0.00 O ATOM 1499 HA SER A 468 -12.392 7.612 -1.495 1.00 0.00 H ATOM 1500 HB2 SER A 468 -11.453 7.104 -3.527 1.00 0.00 H ATOM 1501 HB3 SER A 468 -10.479 6.033 -2.493 1.00 0.00 H ATOM 1502 HG SER A 468 -8.866 7.705 -2.419 1.00 0.00 H ATOM 1503 H SER A 468 -10.473 9.571 -2.261 1.00 0.00 H ATOM 1504 N TYR A 469 -9.623 7.572 0.253 1.00 0.00 N ATOM 1505 CA TYR A 469 -8.992 7.039 1.445 1.00 0.00 C ATOM 1506 C TYR A 469 -9.934 7.158 2.637 1.00 0.00 C ATOM 1507 O TYR A 469 -10.174 6.186 3.355 1.00 0.00 O ATOM 1508 CB TYR A 469 -7.689 7.796 1.722 1.00 0.00 C ATOM 1509 CG TYR A 469 -7.154 7.595 3.119 1.00 0.00 C ATOM 1510 CD1 TYR A 469 -7.665 8.313 4.190 1.00 0.00 C ATOM 1511 CD2 TYR A 469 -6.147 6.678 3.365 1.00 0.00 C ATOM 1512 CE1 TYR A 469 -7.188 8.122 5.467 1.00 0.00 C ATOM 1513 CE2 TYR A 469 -5.663 6.478 4.640 1.00 0.00 C ATOM 1514 CZ TYR A 469 -6.187 7.201 5.690 1.00 0.00 C ATOM 1515 OH TYR A 469 -5.707 7.005 6.965 1.00 0.00 O ATOM 1516 HA TYR A 469 -8.764 5.985 1.287 1.00 0.00 H ATOM 1517 HB3 TYR A 469 -7.871 8.860 1.573 1.00 0.00 H ATOM 1518 HB2 TYR A 469 -6.935 7.455 1.012 1.00 0.00 H ATOM 1519 HD2 TYR A 469 -5.730 6.105 2.537 1.00 0.00 H ATOM 1520 HE2 TYR A 469 -4.870 5.752 4.817 1.00 0.00 H ATOM 1521 HE1 TYR A 469 -7.600 8.696 6.297 1.00 0.00 H ATOM 1522 HD1 TYR A 469 -8.458 9.041 4.018 1.00 0.00 H ATOM 1523 HH TYR A 469 -5.848 6.061 7.228 1.00 0.00 H ATOM 1524 H TYR A 469 -9.176 8.369 -0.243 1.00 0.00 H ATOM 1525 N HIS A 470 -10.455 8.363 2.839 1.00 0.00 N ATOM 1526 CA HIS A 470 -11.371 8.637 3.941 1.00 0.00 C ATOM 1527 C HIS A 470 -12.543 7.662 3.943 1.00 0.00 C ATOM 1528 O HIS A 470 -12.889 7.096 4.980 1.00 0.00 O ATOM 1529 CB HIS A 470 -11.891 10.072 3.854 1.00 0.00 C ATOM 1530 CG HIS A 470 -10.929 11.095 4.373 1.00 0.00 C ATOM 1531 ND1 HIS A 470 -10.339 12.049 3.570 1.00 0.00 N ATOM 1532 CD2 HIS A 470 -10.454 11.312 5.622 1.00 0.00 C ATOM 1533 CE1 HIS A 470 -9.544 12.808 4.303 1.00 0.00 C ATOM 1534 NE2 HIS A 470 -9.597 12.382 5.551 1.00 0.00 N ATOM 1535 HA HIS A 470 -10.819 8.509 4.872 1.00 0.00 H ATOM 1536 HB2 HIS A 470 -12.103 10.298 2.809 1.00 0.00 H ATOM 1537 HB3 HIS A 470 -12.812 10.140 4.434 1.00 0.00 H ATOM 1538 HD2 HIS A 470 -10.705 10.743 6.517 1.00 0.00 H ATOM 1539 HE1 HIS A 470 -8.946 13.644 3.939 1.00 0.00 H ATOM 1540 H HIS A 470 -10.202 9.136 2.191 1.00 0.00 H ATOM 1541 N ARG A 471 -13.150 7.469 2.776 1.00 0.00 N ATOM 1542 CA ARG A 471 -14.289 6.564 2.651 1.00 0.00 C ATOM 1543 C ARG A 471 -13.833 5.116 2.522 1.00 0.00 C ATOM 1544 O ARG A 471 -14.658 4.204 2.442 1.00 0.00 O ATOM 1545 CB ARG A 471 -15.154 6.940 1.445 1.00 0.00 C ATOM 1546 CG ARG A 471 -14.372 7.534 0.288 1.00 0.00 C ATOM 1547 CD ARG A 471 -15.209 7.605 -0.982 1.00 0.00 C ATOM 1548 NE ARG A 471 -16.626 7.363 -0.724 1.00 0.00 N ATOM 1549 CZ ARG A 471 -17.576 8.279 -0.892 1.00 0.00 C ATOM 1550 NH1 ARG A 471 -17.263 9.495 -1.321 1.00 0.00 N ATOM 1551 NH2 ARG A 471 -18.841 7.979 -0.630 1.00 0.00 N ATOM 1552 HA ARG A 471 -14.883 6.662 3.560 1.00 0.00 H ATOM 1553 HB2 ARG A 471 -15.660 6.042 1.092 1.00 0.00 H ATOM 1554 HB3 ARG A 471 -15.896 7.670 1.769 1.00 0.00 H ATOM 1555 HG2 ARG A 471 -14.053 8.541 0.557 1.00 0.00 H ATOM 1556 HG3 ARG A 471 -13.495 6.914 0.099 1.00 0.00 H ATOM 1557 HD2 ARG A 471 -14.847 6.854 -1.684 1.00 0.00 H ATOM 1558 HD3 ARG A 471 -15.096 8.596 -1.422 1.00 0.00 H ATOM 1559 HE ARG A 471 -16.909 6.420 -0.389 1.00 0.00 H ATOM 1560 HH12 ARG A 471 -18.008 10.208 -1.451 1.00 0.00 H ATOM 1561 HH11 ARG A 471 -16.272 9.735 -1.527 1.00 0.00 H ATOM 1562 HH22 ARG A 471 -19.583 8.695 -0.761 1.00 0.00 H ATOM 1563 HH21 ARG A 471 -19.091 7.027 -0.293 1.00 0.00 H ATOM 1564 H ARG A 471 -12.806 7.973 1.934 1.00 0.00 H ATOM 1565 N ARG A 472 -12.519 4.908 2.496 1.00 0.00 N ATOM 1566 CA ARG A 472 -11.962 3.567 2.369 1.00 0.00 C ATOM 1567 C ARG A 472 -12.443 2.913 1.078 1.00 0.00 C ATOM 1568 O ARG A 472 -12.426 1.690 0.943 1.00 0.00 O ATOM 1569 CB ARG A 472 -12.350 2.703 3.572 1.00 0.00 C ATOM 1570 CG ARG A 472 -12.010 3.336 4.912 1.00 0.00 C ATOM 1571 CD ARG A 472 -11.218 2.383 5.792 1.00 0.00 C ATOM 1572 NE ARG A 472 -11.469 2.610 7.212 1.00 0.00 N ATOM 1573 CZ ARG A 472 -11.300 1.680 8.149 1.00 0.00 C ATOM 1574 NH1 ARG A 472 -10.889 0.464 7.813 1.00 0.00 N ATOM 1575 NH2 ARG A 472 -11.546 1.964 9.421 1.00 0.00 N ATOM 1576 HA ARG A 472 -10.876 3.651 2.339 1.00 0.00 H ATOM 1577 HB2 ARG A 472 -13.425 2.526 3.537 1.00 0.00 H ATOM 1578 HB3 ARG A 472 -11.824 1.751 3.497 1.00 0.00 H ATOM 1579 HG2 ARG A 472 -11.418 4.235 4.740 1.00 0.00 H ATOM 1580 HG3 ARG A 472 -12.935 3.604 5.422 1.00 0.00 H ATOM 1581 HD2 ARG A 472 -10.155 2.524 5.596 1.00 0.00 H ATOM 1582 HD3 ARG A 472 -11.499 1.359 5.544 1.00 0.00 H ATOM 1583 HE ARG A 472 -11.798 3.551 7.508 1.00 0.00 H ATOM 1584 HH12 ARG A 472 -10.757 -0.262 8.546 1.00 0.00 H ATOM 1585 HH11 ARG A 472 -10.698 0.236 6.816 1.00 0.00 H ATOM 1586 HH22 ARG A 472 -11.413 1.236 10.151 1.00 0.00 H ATOM 1587 HH21 ARG A 472 -11.872 2.915 9.688 1.00 0.00 H ATOM 1588 H ARG A 472 -11.874 5.721 2.568 1.00 0.00 H ATOM 1589 N ASP A 473 -12.882 3.745 0.134 1.00 0.00 N ATOM 1590 CA ASP A 473 -13.368 3.262 -1.153 1.00 0.00 C ATOM 1591 C ASP A 473 -12.310 2.416 -1.857 1.00 0.00 C ATOM 1592 O ASP A 473 -12.624 1.649 -2.767 1.00 0.00 O ATOM 1593 CB ASP A 473 -13.765 4.442 -2.043 1.00 0.00 C ATOM 1594 CG ASP A 473 -15.144 4.271 -2.651 1.00 0.00 C ATOM 1595 OD1 ASP A 473 -16.137 4.338 -1.898 1.00 0.00 O ATOM 1596 OD2 ASP A 473 -15.229 4.073 -3.882 1.00 0.00 O ATOM 1597 HA ASP A 473 -14.242 2.637 -0.971 1.00 0.00 H ATOM 1598 HB2 ASP A 473 -13.757 5.352 -1.442 1.00 0.00 H ATOM 1599 HB3 ASP A 473 -13.036 4.534 -2.848 1.00 0.00 H ATOM 1600 H ASP A 473 -12.878 4.768 0.321 1.00 0.00 H ATOM 1601 N PHE A 474 -11.058 2.567 -1.428 1.00 0.00 N ATOM 1602 CA PHE A 474 -9.944 1.821 -2.008 1.00 0.00 C ATOM 1603 C PHE A 474 -9.748 2.183 -3.476 1.00 0.00 C ATOM 1604 O PHE A 474 -10.524 1.773 -4.338 1.00 0.00 O ATOM 1605 CB PHE A 474 -10.177 0.314 -1.865 1.00 0.00 C ATOM 1606 CG PHE A 474 -9.604 -0.269 -0.603 1.00 0.00 C ATOM 1607 CD1 PHE A 474 -9.687 0.420 0.597 1.00 0.00 C ATOM 1608 CD2 PHE A 474 -8.985 -1.508 -0.618 1.00 0.00 C ATOM 1609 CE1 PHE A 474 -9.162 -0.115 1.758 1.00 0.00 C ATOM 1610 CE2 PHE A 474 -8.459 -2.049 0.539 1.00 0.00 C ATOM 1611 CZ PHE A 474 -8.547 -1.352 1.728 1.00 0.00 C ATOM 1612 HA PHE A 474 -9.039 2.092 -1.464 1.00 0.00 H ATOM 1613 HB2 PHE A 474 -11.251 0.129 -1.873 1.00 0.00 H ATOM 1614 HB3 PHE A 474 -9.717 -0.188 -2.716 1.00 0.00 H ATOM 1615 HD2 PHE A 474 -8.912 -2.063 -1.554 1.00 0.00 H ATOM 1616 HE2 PHE A 474 -7.975 -3.025 0.514 1.00 0.00 H ATOM 1617 HZ PHE A 474 -8.132 -1.777 2.642 1.00 0.00 H ATOM 1618 HE1 PHE A 474 -9.233 0.437 2.695 1.00 0.00 H ATOM 1619 HD1 PHE A 474 -10.172 1.396 0.625 1.00 0.00 H ATOM 1620 H PHE A 474 -10.868 3.237 -0.656 1.00 0.00 H ATOM 1621 N TRP A 475 -8.700 2.952 -3.749 1.00 0.00 N ATOM 1622 CA TRP A 475 -8.397 3.377 -5.110 1.00 0.00 C ATOM 1623 C TRP A 475 -7.059 2.809 -5.574 1.00 0.00 C ATOM 1624 O TRP A 475 -6.448 2.035 -4.805 1.00 0.00 O ATOM 1625 CB TRP A 475 -8.371 4.904 -5.192 1.00 0.00 C ATOM 1626 CG TRP A 475 -9.004 5.446 -6.437 1.00 0.00 C ATOM 1627 CD1 TRP A 475 -8.369 5.796 -7.594 1.00 0.00 C ATOM 1628 CD2 TRP A 475 -10.397 5.703 -6.649 1.00 0.00 C ATOM 1629 NE1 TRP A 475 -9.281 6.254 -8.513 1.00 0.00 N ATOM 1630 CE2 TRP A 475 -10.533 6.207 -7.957 1.00 0.00 C ATOM 1631 CE3 TRP A 475 -11.543 5.555 -5.863 1.00 0.00 C ATOM 1632 CZ2 TRP A 475 -11.767 6.564 -8.494 1.00 0.00 C ATOM 1633 CZ3 TRP A 475 -12.767 5.909 -6.396 1.00 0.00 C ATOM 1634 CH2 TRP A 475 -12.871 6.408 -7.701 1.00 0.00 C ATOM 1635 HA TRP A 475 -9.179 2.996 -5.767 1.00 0.00 H ATOM 1636 OXT TRP A 475 -6.634 3.140 -6.700 1.00 0.00 O ATOM 1637 HB2 TRP A 475 -8.905 5.305 -4.330 1.00 0.00 H ATOM 1638 HB3 TRP A 475 -7.333 5.234 -5.161 1.00 0.00 H ATOM 1639 HE1 TRP A 475 -9.058 6.583 -9.474 1.00 0.00 H ATOM 1640 HD1 TRP A 475 -7.295 5.723 -7.764 1.00 0.00 H ATOM 1641 HZ2 TRP A 475 -11.850 6.953 -9.509 1.00 0.00 H ATOM 1642 HH2 TRP A 475 -13.852 6.678 -8.093 1.00 0.00 H ATOM 1643 HZ3 TRP A 475 -13.667 5.798 -5.791 1.00 0.00 H ATOM 1644 HE3 TRP A 475 -11.472 5.167 -4.847 1.00 0.00 H ATOM 1645 H TRP A 475 -8.080 3.259 -2.972 1.00 0.00 H TER 1646 TRP A 475 HETATM 1647 N PRO A 1 11.125 5.207 19.513 1.00 0.25 N HETATM 1648 CA PRO A 1 10.744 4.574 18.245 1.00 0.07 C HETATM 1649 C PRO A 1 11.648 3.399 17.889 1.00 0.23 C HETATM 1650 O PRO A 1 12.844 3.573 17.656 1.00 -0.39 O HETATM 1651 N PRO A 1 11.067 2.203 17.851 1.00 -0.26 N HETATM 1652 CA PRO A 1 11.819 0.997 17.522 1.00 0.15 C HETATM 1653 C PRO A 1 11.558 0.571 16.081 1.00 0.21 C HETATM 1654 O PRO A 1 10.999 1.332 15.291 1.00 -0.39 O HETATM 1655 N PRO A 1 11.965 -0.652 15.749 1.00 -0.26 N HETATM 1656 CA PRO A 1 11.777 -1.187 14.403 1.00 0.13 C HETATM 1657 C PRO A 1 12.394 -0.260 13.358 1.00 0.20 C HETATM 1658 O PRO A 1 11.738 0.126 12.390 1.00 -0.39 O HETATM 1659 N PRO A 1 13.661 0.091 13.561 1.00 -0.26 N HETATM 1660 CA PRO A 1 14.367 0.974 12.638 1.00 0.13 C HETATM 1661 C PRO A 1 15.555 0.260 11.998 1.00 0.20 C HETATM 1662 O PRO A 1 15.865 0.480 10.827 1.00 -0.39 O HETATM 1663 N PRO A 1 16.216 -0.593 12.773 1.00 -0.26 N HETATM 1664 CA PRO A 1 17.368 -1.339 12.282 1.00 0.13 C HETATM 1665 C PRO A 1 17.440 -2.716 12.933 1.00 0.20 C HETATM 1666 O PRO A 1 18.029 -2.880 14.001 1.00 -0.39 O HETATM 1667 N PRO A 1 16.833 -3.703 12.281 1.00 -0.26 N HETATM 1668 CA PRO A 1 16.826 -5.067 12.794 1.00 0.13 C HETATM 1669 C PRO A 1 16.429 -6.055 11.703 1.00 0.20 C HETATM 1670 O PRO A 1 17.148 -7.017 11.431 1.00 -0.39 O HETATM 1671 N PRO A 1 15.280 -5.809 11.081 1.00 -0.26 N HETATM 1672 CA PRO A 1 14.784 -6.677 10.021 1.00 0.13 C HETATM 1673 C PRO A 1 14.440 -5.872 8.772 1.00 0.20 C HETATM 1674 O PRO A 1 13.484 -5.095 8.767 1.00 -0.39 O HETATM 1675 N PRO A 1 15.226 -6.062 7.716 1.00 -0.26 N HETATM 1676 CA PRO A 1 15.000 -5.355 6.461 1.00 0.15 C HETATM 1677 C PRO A 1 13.661 -5.755 5.852 1.00 0.21 C HETATM 1678 O PRO A 1 13.389 -6.939 5.648 1.00 -0.39 O HETATM 1679 N PRO A 1 12.826 -4.760 5.565 1.00 -0.26 N HETATM 1680 CA PRO A 1 11.512 -5.009 4.983 1.00 0.13 C HETATM 1681 C PRO A 1 11.438 -4.476 3.556 1.00 0.20 C HETATM 1682 O PRO A 1 10.356 -4.374 2.979 1.00 -0.39 O HETATM 1683 N PRO A 1 12.593 -4.135 2.994 1.00 -0.26 N HETATM 1684 CA PRO A 1 12.657 -3.612 1.634 1.00 0.14 C HETATM 1685 C PRO A 1 13.888 -4.144 0.908 1.00 0.21 C HETATM 1686 O PRO A 1 14.683 -3.377 0.364 1.00 -0.39 O HETATM 1687 N PRO A 1 14.038 -5.465 0.905 1.00 -0.26 N HETATM 1688 CA PRO A 1 15.171 -6.108 0.246 1.00 0.15 C HETATM 1689 C PRO A 1 14.938 -6.212 -1.258 1.00 0.21 C HETATM 1690 O PRO A 1 14.165 -5.443 -1.830 1.00 -0.39 O HETATM 1691 N PRO A 1 15.616 -7.164 -1.894 1.00 -0.26 N HETATM 1692 CA PRO A 1 15.479 -7.372 -3.333 1.00 0.13 C HETATM 1693 C PRO A 1 16.150 -8.674 -3.761 1.00 0.20 C HETATM 1694 O PRO A 1 15.647 -9.385 -4.631 1.00 -0.39 O HETATM 1695 N PRO A 1 17.288 -8.981 -3.143 1.00 -0.27 N HETATM 1696 CA PRO A 1 18.028 -10.197 -3.458 1.00 0.11 C HETATM 1697 C PRO A 1 18.042 -11.147 -2.265 1.00 0.06 C HETATM 1698 O PRO A 1 18.514 -10.733 -1.186 1.00 -0.57 O HETATM 1699 OXT PRO A 1 17.581 -12.297 -2.421 1.00 -0.57 O HETATM 1700 CB PRO A 1 19.462 -9.855 -3.868 1.00 0.04 C HETATM 1701 CG PRO A 1 19.846 -10.470 -5.199 1.00 0.04 C HETATM 1702 OD1 PRO A 1 19.210 -10.126 -6.218 1.00 -0.57 O HETATM 1703 OD2 PRO A 1 20.781 -11.298 -5.223 1.00 -0.57 O HETATM 1704 H124 PRO A 1 20.149 -10.229 -3.095 1.00 0.05 H HETATM 1705 H125 PRO A 1 19.556 -8.762 -3.944 1.00 0.05 H HETATM 1706 H123 PRO A 1 17.531 -10.700 -4.301 1.00 0.07 H HETATM 1707 H122 PRO A 1 17.645 -8.361 -2.444 1.00 0.19 H HETATM 1708 CB PRO A 1 16.080 -6.194 -4.102 1.00 0.00 C HETATM 1709 CG PRO A 1 17.566 -5.989 -3.847 1.00 0.04 C HETATM 1710 CD PRO A 1 18.115 -4.771 -4.563 1.00 0.17 C HETATM 1711 OE1 PRO A 1 17.545 -4.304 -5.549 1.00 -0.40 O HETATM 1712 NE2 PRO A 1 19.230 -4.247 -4.067 1.00 -0.30 N HETATM 1713 H120 PRO A 1 19.639 -3.442 -4.498 1.00 0.18 H HETATM 1714 H121 PRO A 1 19.661 -4.657 -3.263 1.00 0.18 H HETATM 1715 H118 PRO A 1 18.110 -6.879 -4.197 1.00 0.05 H HETATM 1716 H119 PRO A 1 17.724 -5.864 -2.766 1.00 0.05 H HETATM 1717 H116 PRO A 1 15.548 -5.278 -3.805 1.00 0.03 H HETATM 1718 H117 PRO A 1 15.934 -6.371 -5.178 1.00 0.03 H HETATM 1719 H115 PRO A 1 14.408 -7.437 -3.574 1.00 0.08 H HETATM 1720 H114 PRO A 1 16.235 -7.752 -1.373 1.00 0.19 H HETATM 1721 CB PRO A 1 15.407 -7.499 0.839 1.00 0.08 C HETATM 1722 CG PRO A 1 16.843 -7.705 1.278 1.00 0.18 C HETATM 1723 OD1 PRO A 1 17.491 -8.677 0.889 1.00 -0.40 O HETATM 1724 ND2 PRO A 1 17.351 -6.786 2.092 1.00 -0.30 N HETATM 1725 H112 PRO A 1 18.294 -6.870 2.414 1.00 0.18 H HETATM 1726 H113 PRO A 1 16.791 -6.010 2.382 1.00 0.18 H HETATM 1727 H110 PRO A 1 15.159 -8.254 0.078 1.00 0.06 H HETATM 1728 H111 PRO A 1 14.749 -7.627 1.711 1.00 0.06 H HETATM 1729 H109 PRO A 1 16.068 -5.495 0.419 1.00 0.08 H HETATM 1730 H108 PRO A 1 13.357 -6.033 1.366 1.00 0.19 H HETATM 1731 CB PRO A 1 12.673 -2.081 1.653 1.00 0.00 C HETATM 1732 CG PRO A 1 11.518 -1.486 2.403 1.00 -0.04 C HETATM 1733 CD1 PRO A 1 11.517 -1.059 3.699 1.00 0.02 C HETATM 1734 NE1 PRO A 1 10.276 -0.578 4.036 1.00 -0.29 N HETATM 1735 CE2 PRO A 1 9.447 -0.687 2.950 1.00 0.06 C HETATM 1736 CD2 PRO A 1 10.196 -1.255 1.902 1.00 -0.02 C HETATM 1737 CE3 PRO A 1 9.572 -1.474 0.671 1.00 -0.07 C HETATM 1738 CZ3 PRO A 1 8.242 -1.123 0.526 1.00 -0.08 C HETATM 1739 CH2 PRO A 1 7.524 -0.559 1.587 1.00 -0.08 C HETATM 1740 CZ2 PRO A 1 8.108 -0.333 2.803 1.00 -0.04 C HETATM 1741 H105 PRO A 1 7.549 0.105 3.622 1.00 0.05 H HETATM 1742 H107 PRO A 1 6.483 -0.296 1.442 1.00 0.05 H HETATM 1743 H106 PRO A 1 7.748 -1.287 -0.425 1.00 0.05 H HETATM 1744 H104 PRO A 1 10.120 -1.911 -0.155 1.00 0.05 H HETATM 1745 H103 PRO A 1 10.011 -0.197 4.956 1.00 0.22 H HETATM 1746 H102 PRO A 1 12.375 -1.095 4.368 1.00 0.08 H HETATM 1747 H100 PRO A 1 12.640 -1.718 0.615 1.00 0.04 H HETATM 1748 H101 PRO A 1 13.607 -1.747 2.128 1.00 0.04 H HETATM 1749 H99 PRO A 1 11.761 -3.946 1.090 1.00 0.08 H HETATM 1750 H98 PRO A 1 13.439 -4.240 3.517 1.00 0.19 H HETATM 1751 CB PRO A 1 10.425 -4.359 5.838 1.00 -0.01 C HETATM 1752 CG PRO A 1 10.044 -5.179 7.060 1.00 -0.02 C HETATM 1753 CD PRO A 1 8.680 -5.828 6.892 1.00 0.06 C HETATM 1754 NE PRO A 1 8.519 -6.995 7.753 1.00 -0.27 N HETATM 1755 CZ PRO A 1 7.415 -7.252 8.447 1.00 0.29 C HETATM 1756 NH1 PRO A 1 6.378 -6.429 8.379 1.00 -0.28 N HETATM 1757 H94 PRO A 1 5.524 -6.631 8.918 1.00 0.26 H HETATM 1758 H95 PRO A 1 6.426 -5.588 7.787 1.00 0.26 H HETATM 1759 NH2 PRO A 1 7.346 -8.335 9.211 1.00 -0.28 N HETATM 1760 H96 PRO A 1 8.149 -8.978 9.267 1.00 0.26 H HETATM 1761 H97 PRO A 1 6.489 -8.533 9.748 1.00 0.26 H HETATM 1762 H93 PRO A 1 9.305 -7.657 7.827 1.00 0.26 H HETATM 1763 H91 PRO A 1 8.563 -6.141 5.844 1.00 0.07 H HETATM 1764 H92 PRO A 1 7.903 -5.091 7.144 1.00 0.07 H HETATM 1765 H89 PRO A 1 10.020 -4.519 7.940 1.00 0.03 H HETATM 1766 H90 PRO A 1 10.798 -5.966 7.212 1.00 0.03 H HETATM 1767 H87 PRO A 1 9.528 -4.223 5.216 1.00 0.03 H HETATM 1768 H88 PRO A 1 10.789 -3.378 6.177 1.00 0.03 H HETATM 1769 H86 PRO A 1 11.341 -6.095 4.960 1.00 0.08 H HETATM 1770 H85 PRO A 1 13.106 -3.818 5.753 1.00 0.19 H HETATM 1771 CB PRO A 1 16.130 -5.650 5.473 1.00 0.08 C HETATM 1772 OG PRO A 1 16.848 -6.811 5.850 1.00 -0.39 O HETATM 1773 H84 PRO A 1 17.542 -6.971 5.221 1.00 0.21 H HETATM 1774 H82 PRO A 1 16.820 -4.793 5.450 1.00 0.06 H HETATM 1775 H83 PRO A 1 15.701 -5.803 4.472 1.00 0.06 H HETATM 1776 H81 PRO A 1 14.984 -4.274 6.666 1.00 0.08 H HETATM 1777 H80 PRO A 1 15.989 -6.704 7.784 1.00 0.19 H HETATM 1778 CB PRO A 1 13.552 -7.447 10.501 1.00 -0.01 C HETATM 1779 CG PRO A 1 13.351 -8.776 9.794 1.00 -0.02 C HETATM 1780 CD PRO A 1 13.854 -9.937 10.638 1.00 0.06 C HETATM 1781 NE PRO A 1 13.567 -11.228 10.020 1.00 -0.27 N HETATM 1782 CZ PRO A 1 12.555 -12.010 10.383 1.00 0.29 C HETATM 1783 NH1 PRO A 1 11.738 -11.636 11.360 1.00 -0.28 N HETATM 1784 H76 PRO A 1 10.955 -12.245 11.638 1.00 0.26 H HETATM 1785 H77 PRO A 1 11.887 -10.737 11.840 1.00 0.26 H HETATM 1786 NH2 PRO A 1 12.358 -13.169 9.769 1.00 -0.28 N HETATM 1787 H78 PRO A 1 12.989 -13.464 9.010 1.00 0.26 H HETATM 1788 H79 PRO A 1 11.574 -13.774 10.051 1.00 0.26 H HETATM 1789 H75 PRO A 1 14.183 -11.551 9.260 1.00 0.26 H HETATM 1790 H73 PRO A 1 13.365 -9.898 11.623 1.00 0.07 H HETATM 1791 H74 PRO A 1 14.942 -9.838 10.765 1.00 0.07 H HETATM 1792 H71 PRO A 1 13.902 -8.761 8.842 1.00 0.03 H HETATM 1793 H72 PRO A 1 12.278 -8.917 9.595 1.00 0.03 H HETATM 1794 H69 PRO A 1 12.663 -6.823 10.328 1.00 0.03 H HETATM 1795 H70 PRO A 1 13.660 -7.639 11.579 1.00 0.03 H HETATM 1796 H68 PRO A 1 15.573 -7.399 9.765 1.00 0.08 H HETATM 1797 H67 PRO A 1 14.743 -5.008 11.347 1.00 0.19 H HETATM 1798 CB PRO A 1 15.861 -5.184 13.976 1.00 -0.01 C HETATM 1799 CG PRO A 1 16.113 -6.405 14.844 1.00 -0.04 C HETATM 1800 CD PRO A 1 17.182 -6.135 15.889 1.00 -0.01 C HETATM 1801 CE PRO A 1 16.677 -6.430 17.292 1.00 -0.04 C HETATM 1802 NZ PRO A 1 16.863 -7.861 17.659 1.00 0.22 N HETATM 1803 H64 PRO A 1 16.517 -8.016 18.593 1.00 0.20 H HETATM 1804 H65 PRO A 1 17.843 -8.093 17.621 1.00 0.20 H HETATM 1805 H66 PRO A 1 16.355 -8.443 17.012 1.00 0.20 H HETATM 1806 H62 PRO A 1 15.606 -6.186 17.343 1.00 0.08 H HETATM 1807 H63 PRO A 1 17.230 -5.804 18.008 1.00 0.08 H HETATM 1808 H60 PRO A 1 17.479 -5.077 15.831 1.00 0.03 H HETATM 1809 H61 PRO A 1 18.054 -6.773 15.681 1.00 0.03 H HETATM 1810 H58 PRO A 1 16.441 -7.237 14.204 1.00 0.03 H HETATM 1811 H59 PRO A 1 15.178 -6.681 15.353 1.00 0.03 H HETATM 1812 H56 PRO A 1 14.835 -5.241 13.584 1.00 0.03 H HETATM 1813 H57 PRO A 1 15.965 -4.285 14.601 1.00 0.03 H HETATM 1814 H55 PRO A 1 17.840 -5.315 13.140 1.00 0.08 H HETATM 1815 H54 PRO A 1 16.370 -3.505 11.417 1.00 0.19 H HETATM 1816 CB PRO A 1 18.659 -0.564 12.554 1.00 -0.01 C HETATM 1817 CG PRO A 1 19.036 0.399 11.439 1.00 -0.02 C HETATM 1818 CD PRO A 1 20.537 0.415 11.199 1.00 0.06 C HETATM 1819 NE PRO A 1 21.057 -0.917 10.896 1.00 -0.27 N HETATM 1820 CZ PRO A 1 22.258 -1.343 11.276 1.00 0.29 C HETATM 1821 NH1 PRO A 1 23.063 -0.545 11.965 1.00 -0.28 N HETATM 1822 H50 PRO A 1 23.992 -0.879 12.257 1.00 0.26 H HETATM 1823 H51 PRO A 1 22.759 0.409 12.208 1.00 0.26 H HETATM 1824 NH2 PRO A 1 22.656 -2.569 10.964 1.00 -0.28 N HETATM 1825 H52 PRO A 1 22.034 -3.192 10.429 1.00 0.26 H HETATM 1826 H53 PRO A 1 23.587 -2.898 11.257 1.00 0.26 H HETATM 1827 H49 PRO A 1 20.460 -1.562 10.358 1.00 0.26 H HETATM 1828 H47 PRO A 1 21.037 0.794 12.102 1.00 0.07 H HETATM 1829 H48 PRO A 1 20.754 1.082 10.352 1.00 0.07 H HETATM 1830 H45 PRO A 1 18.708 1.412 11.715 1.00 0.03 H HETATM 1831 H46 PRO A 1 18.529 0.089 10.513 1.00 0.03 H HETATM 1832 H43 PRO A 1 19.478 -1.287 12.681 1.00 0.03 H HETATM 1833 H44 PRO A 1 18.530 0.012 13.482 1.00 0.03 H HETATM 1834 H42 PRO A 1 17.260 -1.471 11.195 1.00 0.08 H HETATM 1835 H41 PRO A 1 15.915 -0.727 13.717 1.00 0.19 H HETATM 1836 CB PRO A 1 14.842 2.234 13.367 1.00 -0.01 C HETATM 1837 CG PRO A 1 15.833 1.956 14.486 1.00 -0.04 C HETATM 1838 CD PRO A 1 15.405 2.616 15.786 1.00 -0.01 C HETATM 1839 CE PRO A 1 15.569 1.676 16.969 1.00 -0.04 C HETATM 1840 NZ PRO A 1 16.982 1.239 17.140 1.00 0.22 N HETATM 1841 H38 PRO A 1 17.048 0.619 17.932 1.00 0.20 H HETATM 1842 H39 PRO A 1 17.567 2.045 17.294 1.00 0.20 H HETATM 1843 H40 PRO A 1 17.287 0.757 16.309 1.00 0.20 H HETATM 1844 H36 PRO A 1 14.940 0.788 16.808 1.00 0.08 H HETATM 1845 H37 PRO A 1 15.244 2.195 17.883 1.00 0.08 H HETATM 1846 H34 PRO A 1 14.348 2.909 15.707 1.00 0.03 H HETATM 1847 H35 PRO A 1 16.022 3.511 15.953 1.00 0.03 H HETATM 1848 H32 PRO A 1 16.819 2.346 14.195 1.00 0.03 H HETATM 1849 H33 PRO A 1 15.900 0.869 14.642 1.00 0.03 H HETATM 1850 H30 PRO A 1 13.964 2.738 13.798 1.00 0.03 H HETATM 1851 H31 PRO A 1 15.323 2.898 12.634 1.00 0.03 H HETATM 1852 H29 PRO A 1 13.670 1.272 11.841 1.00 0.08 H HETATM 1853 H28 PRO A 1 14.141 -0.259 14.365 1.00 0.19 H HETATM 1854 CB PRO A 1 10.287 -1.388 14.115 1.00 -0.01 C HETATM 1855 CG PRO A 1 9.771 -2.761 14.512 1.00 -0.04 C HETATM 1856 CD PRO A 1 8.951 -2.701 15.791 1.00 -0.01 C HETATM 1857 CE PRO A 1 7.923 -3.818 15.845 1.00 -0.04 C HETATM 1858 NZ PRO A 1 6.917 -3.596 16.919 1.00 0.22 N HETATM 1859 H25 PRO A 1 6.255 -4.356 16.922 1.00 0.20 H HETATM 1860 H26 PRO A 1 6.432 -2.729 16.751 1.00 0.20 H HETATM 1861 H27 PRO A 1 7.383 -3.553 17.812 1.00 0.20 H HETATM 1862 H23 PRO A 1 8.441 -4.769 16.035 1.00 0.08 H HETATM 1863 H24 PRO A 1 7.404 -3.870 14.877 1.00 0.08 H HETATM 1864 H21 PRO A 1 8.430 -1.733 15.837 1.00 0.03 H HETATM 1865 H22 PRO A 1 9.627 -2.795 16.654 1.00 0.03 H HETATM 1866 H19 PRO A 1 10.628 -3.433 14.668 1.00 0.03 H HETATM 1867 H20 PRO A 1 9.140 -3.154 13.701 1.00 0.03 H HETATM 1868 H17 PRO A 1 10.120 -1.252 13.036 1.00 0.03 H HETATM 1869 H18 PRO A 1 9.719 -0.628 14.673 1.00 0.03 H HETATM 1870 H16 PRO A 1 12.280 -2.163 14.343 1.00 0.08 H HETATM 1871 H15 PRO A 1 12.412 -1.220 16.440 1.00 0.19 H HETATM 1872 CB PRO A 1 11.445 -0.137 18.477 1.00 0.08 C HETATM 1873 OG PRO A 1 12.601 -0.791 18.970 1.00 -0.39 O HETATM 1874 H14 PRO A 1 12.341 -1.489 19.559 1.00 0.21 H HETATM 1875 H12 PRO A 1 10.820 -0.867 17.941 1.00 0.06 H HETATM 1876 H13 PRO A 1 10.879 0.278 19.324 1.00 0.06 H HETATM 1877 H11 PRO A 1 12.892 1.213 17.634 1.00 0.08 H HETATM 1878 H10 PRO A 1 10.090 2.129 18.053 1.00 0.19 H HETATM 1879 CB PRO A 1 10.898 5.696 17.215 1.00 0.01 C HETATM 1880 CG PRO A 1 10.815 6.956 17.994 1.00 -0.01 C HETATM 1881 CD PRO A 1 11.379 6.651 19.353 1.00 -0.03 C HETATM 1882 H8 PRO A 1 12.457 6.867 19.389 1.00 0.08 H HETATM 1883 H9 PRO A 1 10.862 7.230 20.133 1.00 0.08 H HETATM 1884 H6 PRO A 1 9.768 7.282 18.081 1.00 0.03 H HETATM 1885 H7 PRO A 1 11.405 7.745 17.505 1.00 0.03 H HETATM 1886 H4 PRO A 1 10.090 5.649 16.471 1.00 0.03 H HETATM 1887 H5 PRO A 1 11.870 5.621 16.706 1.00 0.03 H HETATM 1888 H3 PRO A 1 9.702 4.225 18.289 1.00 0.11 H HETATM 1889 H1 PRO A 1 11.962 4.765 19.859 1.00 0.20 H HETATM 1890 H2 PRO A 1 10.378 5.079 20.178 1.00 0.20 H CONECT 1 2 7 8 9 CONECT 7 1 CONECT 8 1 CONECT 9 1 CONECT 1647 1648 1881 1889 1890 CONECT 1648 1647 1649 1879 1888 CONECT 1649 1648 1650 1651 CONECT 1650 1649 CONECT 1651 1649 1652 1878 CONECT 1652 1651 1653 1872 1877 CONECT 1653 1652 1654 1655 CONECT 1654 1653 CONECT 1655 1653 1656 1871 CONECT 1656 1655 1657 1854 1870 CONECT 1657 1656 1658 1659 CONECT 1658 1657 CONECT 1659 1657 1660 1853 CONECT 1660 1659 1661 1836 1852 CONECT 1661 1660 1662 1663 CONECT 1662 1661 CONECT 1663 1661 1664 1835 CONECT 1664 1663 1665 1816 1834 CONECT 1665 1664 1666 1667 CONECT 1666 1665 CONECT 1667 1665 1668 1815 CONECT 1668 1667 1669 1798 1814 CONECT 1669 1668 1670 1671 CONECT 1670 1669 CONECT 1671 1669 1672 1797 CONECT 1672 1671 1673 1778 1796 CONECT 1673 1672 1674 1675 CONECT 1674 1673 CONECT 1675 1673 1676 1777 CONECT 1676 1675 1677 1771 1776 CONECT 1677 1676 1678 1679 CONECT 1678 1677 CONECT 1679 1677 1680 1770 CONECT 1680 1679 1681 1751 1769 CONECT 1681 1680 1682 1683 CONECT 1682 1681 CONECT 1683 1681 1684 1750 CONECT 1684 1683 1685 1731 1749 CONECT 1685 1684 1686 1687 CONECT 1686 1685 CONECT 1687 1685 1688 1730 CONECT 1688 1687 1689 1721 1729 CONECT 1689 1688 1690 1691 CONECT 1690 1689 CONECT 1691 1689 1692 1720 CONECT 1692 1691 1693 1708 1719 CONECT 1693 1692 1694 1695 CONECT 1694 1693 CONECT 1695 1693 1696 1707 CONECT 1696 1695 1697 1700 1706 CONECT 1697 1696 1698 1699 CONECT 1698 1697 CONECT 1699 1697 CONECT 1700 1696 1701 1704 1705 CONECT 1701 1700 1702 1703 CONECT 1702 1701 CONECT 1703 1701 CONECT 1704 1700 CONECT 1705 1700 CONECT 1706 1696 CONECT 1707 1695 CONECT 1708 1692 1709 1717 1718 CONECT 1709 1708 1710 1715 1716 CONECT 1710 1709 1711 1712 CONECT 1711 1710 CONECT 1712 1710 1713 1714 CONECT 1713 1712 CONECT 1714 1712 CONECT 1715 1709 CONECT 1716 1709 CONECT 1717 1708 CONECT 1718 1708 CONECT 1719 1692 CONECT 1720 1691 CONECT 1721 1688 1722 1727 1728 CONECT 1722 1721 1723 1724 CONECT 1723 1722 CONECT 1724 1722 1725 1726 CONECT 1725 1724 CONECT 1726 1724 CONECT 1727 1721 CONECT 1728 1721 CONECT 1729 1688 CONECT 1730 1687 CONECT 1731 1684 1732 1747 1748 CONECT 1732 1731 1733 1736 CONECT 1733 1732 1734 1746 CONECT 1734 1733 1735 1745 CONECT 1735 1734 1736 1740 CONECT 1736 1732 1735 1737 CONECT 1737 1736 1738 1744 CONECT 1738 1737 1739 1743 CONECT 1739 1738 1740 1742 CONECT 1740 1735 1739 1741 CONECT 1741 1740 CONECT 1742 1739 CONECT 1743 1738 CONECT 1744 1737 CONECT 1745 1734 CONECT 1746 1733 CONECT 1747 1731 CONECT 1748 1731 CONECT 1749 1684 CONECT 1750 1683 CONECT 1751 1680 1752 1767 1768 CONECT 1752 1751 1753 1765 1766 CONECT 1753 1752 1754 1763 1764 CONECT 1754 1753 1755 1762 CONECT 1755 1754 1756 1759 CONECT 1756 1755 1757 1758 CONECT 1757 1756 CONECT 1758 1756 CONECT 1759 1755 1760 1761 CONECT 1760 1759 CONECT 1761 1759 CONECT 1762 1754 CONECT 1763 1753 CONECT 1764 1753 CONECT 1765 1752 CONECT 1766 1752 CONECT 1767 1751 CONECT 1768 1751 CONECT 1769 1680 CONECT 1770 1679 CONECT 1771 1676 1772 1774 1775 CONECT 1772 1771 1773 CONECT 1773 1772 CONECT 1774 1771 CONECT 1775 1771 CONECT 1776 1676 CONECT 1777 1675 CONECT 1778 1672 1779 1794 1795 CONECT 1779 1778 1780 1792 1793 CONECT 1780 1779 1781 1790 1791 CONECT 1781 1780 1782 1789 CONECT 1782 1781 1783 1786 CONECT 1783 1782 1784 1785 CONECT 1784 1783 CONECT 1785 1783 CONECT 1786 1782 1787 1788 CONECT 1787 1786 CONECT 1788 1786 CONECT 1789 1781 CONECT 1790 1780 CONECT 1791 1780 CONECT 1792 1779 CONECT 1793 1779 CONECT 1794 1778 CONECT 1795 1778 CONECT 1796 1672 CONECT 1797 1671 CONECT 1798 1668 1799 1812 1813 CONECT 1799 1798 1800 1810 1811 CONECT 1800 1799 1801 1808 1809 CONECT 1801 1800 1802 1806 1807 CONECT 1802 1801 1803 1804 1805 CONECT 1803 1802 CONECT 1804 1802 CONECT 1805 1802 CONECT 1806 1801 CONECT 1807 1801 CONECT 1808 1800 CONECT 1809 1800 CONECT 1810 1799 CONECT 1811 1799 CONECT 1812 1798 CONECT 1813 1798 CONECT 1814 1668 CONECT 1815 1667 CONECT 1816 1664 1817 1832 1833 CONECT 1817 1816 1818 1830 1831 CONECT 1818 1817 1819 1828 1829 CONECT 1819 1818 1820 1827 CONECT 1820 1819 1821 1824 CONECT 1821 1820 1822 1823 CONECT 1822 1821 CONECT 1823 1821 CONECT 1824 1820 1825 1826 CONECT 1825 1824 CONECT 1826 1824 CONECT 1827 1819 CONECT 1828 1818 CONECT 1829 1818 CONECT 1830 1817 CONECT 1831 1817 CONECT 1832 1816 CONECT 1833 1816 CONECT 1834 1664 CONECT 1835 1663 CONECT 1836 1660 1837 1850 1851 CONECT 1837 1836 1838 1848 1849 CONECT 1838 1837 1839 1846 1847 CONECT 1839 1838 1840 1844 1845 CONECT 1840 1839 1841 1842 1843 CONECT 1841 1840 CONECT 1842 1840 CONECT 1843 1840 CONECT 1844 1839 CONECT 1845 1839 CONECT 1846 1838 CONECT 1847 1838 CONECT 1848 1837 CONECT 1849 1837 CONECT 1850 1836 CONECT 1851 1836 CONECT 1852 1660 CONECT 1853 1659 CONECT 1854 1656 1855 1868 1869 CONECT 1855 1854 1856 1866 1867 CONECT 1856 1855 1857 1864 1865 CONECT 1857 1856 1858 1862 1863 CONECT 1858 1857 1859 1860 1861 CONECT 1859 1858 CONECT 1860 1858 CONECT 1861 1858 CONECT 1862 1857 CONECT 1863 1857 CONECT 1864 1856 CONECT 1865 1856 CONECT 1866 1855 CONECT 1867 1855 CONECT 1868 1854 CONECT 1869 1854 CONECT 1870 1656 CONECT 1871 1655 CONECT 1872 1652 1873 1875 1876 CONECT 1873 1872 1874 CONECT 1874 1873 CONECT 1875 1872 CONECT 1876 1872 CONECT 1877 1652 CONECT 1878 1651 CONECT 1879 1648 1880 1886 1887 CONECT 1880 1879 1881 1884 1885 CONECT 1881 1647 1880 1882 1883 CONECT 1882 1881 CONECT 1883 1881 CONECT 1884 1880 CONECT 1885 1880 CONECT 1886 1879 CONECT 1887 1879 CONECT 1888 1648 CONECT 1889 1647 CONECT 1890 1647 MASTER 0 0 0 0 0 0 0 0 1889 1 248 8 END
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PDBbind
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Entry Information
PDB ID
1opi
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
the C-terminal RRM (RRM3) of human U2AF65
Ligand Name
13-mer
EC.Number
E.C.-.-.-.-
Resolution
NMR
Affinity (Kd/Ki/IC50)
Kd=50nM
Release Year
2004
Protein/NA Sequence
Check fasta file
Primary Reference
(2003) Mol.Cell Vol. 11: pp. 965-976
Ligand Properties
Formula
C
7
1
H
1
2
7
N
2
8
O
2
0
Molecular Weight
1692.940
Exact Mass
1691.980
No. of atoms
246
No. of bonds
248
Polar Surface Area
863.79
LOGP Value
-7.28 (
Computed with XLOGP3
)
-8.56 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 21
No. of Hydrogen Bond Acceptors: 20
No. of Rotatable Bonds: 72
No. of Nitrogen and Oxygen Atoms: 48
No. of Rings: 3
Canonical SMILES
[NH3+]CCCC[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(=O)O)CCC(=O)N)CC(=O)N)Cc1c[nH]c2c1cccc2)CCC[NH+]=C(N)N)CO)CCC[NH+]=C(N)N)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H]1[NH2+]CCC1)CO)CCCC[NH3+])CCCC[NH3+])CCC[NH+]=C(N)N
InChI String
InChI=1S/C71H120N28O20/c72-24-6-3-15-41(88-59(109)43(17-5-8-26-74)92-66(116)51(35-100)98-56(106)40-18-9-27-83-40)57(107)90-44(19-10-28-84-69(77)78)60(110)89-42(16-4-7-25-73)58(108)91-46(21-12-30-86-71(81)82)62(112)99-52(36-101)67(117)93-45(20-11-29-85-70(79)80)61(111)95-48(31-37-34-87-39-14-2-1-13-38(37)39)64(114)96-49(32-54(76)103)65(115)94-47(22-23-53(75)102)63(113)97-50(68(118)119)33-55(104)105/h1-2,13-14,34,40-52,83,87,100-101H,3-12,15-33,35-36,72-74H2,(H2,75,102)(H2,76,103)(H,88,109)(H,89,110)(H,90,107)(H,91,108)(H,92,116)(H,93,117)(H,94,115)(H,95,111)(H,96,114)(H,97,113)(H,98,106)(H,99,112)(H,104,105)(H,118,119)(H4,77,78,84)(H4,79,80,85)(H4,81,82,86)/p+7/t40-,41-,42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-/m0/s1
Links to External Databases
RCSB PDB
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PDBsum
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Pubchem
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UniProtKB AC
UniProt accession number (AC):
Q15637
P26368
Entrez Gene ID
NCBI Entrez Gene ID:
7536
11338
ASD
Information of known allosteric effects of PDB entries
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