Browse entries in the PDBbind-CN Database
HEADER 6NVG_COMPLEX COMPND 6NVG_COMPLEX REMARK GENERATED BY SYBYL (TRIPOS, INC.) 15-AUG-21 SEQRES 1 A 172 ASP LEU PRO LEU ASP PRO LEU TRP GLU PHE PRO ARG ASP SEQRES 2 A 172 ARG LEU VAL LEU GLY LYS PRO LEU GLY GLU GLY CYS PHE SEQRES 3 A 172 GLY GLN VAL VAL ARG ALA GLU ALA PHE GLY MET ASP PRO SEQRES 4 A 172 ALA ARG PRO ASP GLN ALA SER THR VAL ALA VAL LYS MET SEQRES 5 A 172 LEU LYS ASP ASN ALA SER ASP LYS ASP LEU ALA ASP LEU SEQRES 6 A 172 VAL SER GLU MET GLU VAL MET LYS LEU ILE GLY ARG HIS SEQRES 7 A 172 LYS ASN ILE ILE ASN LEU LEU GLY VAL CYS THR GLN GLU SEQRES 8 A 172 GLY PRO LEU TYR VAL ILE VAL GLU CYS ALA ALA LYS GLY SEQRES 9 A 172 ASN LEU ARG GLU PHE LEU ARG ALA ARG ARG PRO PRO GLY SEQRES 10 A 172 SER SER GLU GLY PRO LEU SER PHE PRO VAL LEU VAL SER SEQRES 11 A 172 CYS ALA TYR GLN VAL ALA ARG GLY MET GLN TYR LEU GLU SEQRES 12 A 172 SER ARG LYS CYS ILE HIS ARG ASP LEU ALA ALA ARG ASN SEQRES 13 A 172 VAL LEU VAL THR GLU ASP ASN VAL MET LYS ILE ALA ASP SEQRES 14 A 172 PHE GLY LEU SEQRES 1 A 100 PRO VAL LYS TRP MET ALA PRO GLU ALA LEU PHE ASP ARG SEQRES 2 A 100 VAL TYR THR HIS GLN SER ASP VAL TRP SER PHE GLY ILE SEQRES 3 A 100 LEU LEU TRP GLU ILE PHE THR LEU GLY GLY SER PRO TYR SEQRES 4 A 100 PRO GLY ILE PRO VAL GLU GLU LEU PHE SER LEU LEU ARG SEQRES 5 A 100 GLU GLY HIS ARG MET ASP ARG PRO PRO HIS CYS PRO PRO SEQRES 6 A 100 GLU LEU TYR GLY LEU MET ARG GLU CYS TRP HIS ALA ALA SEQRES 7 A 100 PRO SER GLN ARG PRO THR PHE LYS GLN LEU VAL GLU ALA SEQRES 8 A 100 LEU ASP LYS VAL LEU LEU ALA VAL SER HET XL A 8 54 ATOM 1 N ASP A 453 23.376 15.227 -18.626 1.00 91.03 N ATOM 2 CA ASP A 453 24.669 15.758 -19.158 1.00 89.57 C ATOM 3 C ASP A 453 25.833 14.805 -18.828 1.00 90.06 C ATOM 4 O ASP A 453 26.941 15.244 -18.517 1.00 87.95 O ATOM 5 CB ASP A 453 24.938 17.160 -18.590 1.00 78.98 C ATOM 6 HN3 ASP A 453 23.443 15.126 -17.593 1.00 0.00 H ATOM 7 HN2 ASP A 453 23.181 14.300 -19.055 1.00 0.00 H ATOM 8 HN1 ASP A 453 22.608 15.888 -18.862 1.00 0.00 H ATOM 9 N LEU A 454 25.584 13.501 -18.953 1.00 81.84 N ATOM 10 CA LEU A 454 26.528 12.475 -18.500 1.00 73.29 C ATOM 11 C LEU A 454 27.393 11.981 -19.651 1.00 59.04 C ATOM 12 O LEU A 454 26.902 11.779 -20.749 1.00 54.28 O ATOM 13 CB LEU A 454 25.775 11.275 -17.898 1.00 69.89 C ATOM 14 CG LEU A 454 25.182 11.507 -16.512 1.00 73.23 C ATOM 15 CD1 LEU A 454 24.058 10.521 -16.225 1.00 72.42 C ATOM 16 CD2 LEU A 454 26.277 11.420 -15.456 1.00 79.58 C ATOM 17 H LEU A 454 24.688 13.201 -19.387 1.00 0.00 H ATOM 18 N PRO A 455 28.664 11.689 -19.374 1.00 57.58 N ATOM 19 CA PRO A 455 29.526 11.135 -20.423 1.00 58.59 C ATOM 20 C PRO A 455 29.166 9.711 -20.824 1.00 58.54 C ATOM 21 O PRO A 455 28.565 8.958 -20.048 1.00 56.21 O ATOM 22 CB PRO A 455 30.923 11.170 -19.791 1.00 63.11 C ATOM 23 CG PRO A 455 30.682 11.118 -18.318 1.00 61.38 C ATOM 24 CD PRO A 455 29.358 11.801 -18.077 1.00 62.92 C ATOM 25 N LEU A 456 29.553 9.357 -22.040 1.00 54.24 N ATOM 26 CA LEU A 456 29.275 8.060 -22.612 1.00 54.88 C ATOM 27 C LEU A 456 30.498 7.185 -22.365 1.00 58.66 C ATOM 28 O LEU A 456 31.579 7.438 -22.901 1.00 58.19 O ATOM 29 CB LEU A 456 28.993 8.182 -24.107 1.00 57.81 C ATOM 30 CG LEU A 456 29.295 6.998 -25.032 1.00 65.83 C ATOM 31 CD1 LEU A 456 28.569 5.729 -24.625 1.00 67.42 C ATOM 32 CD2 LEU A 456 28.913 7.386 -26.453 1.00 65.96 C ATOM 33 H LEU A 456 30.083 10.046 -22.611 1.00 0.00 H ATOM 34 N ASP A 457 30.314 6.166 -21.532 1.00 47.87 N ATOM 35 CA ASP A 457 31.362 5.239 -21.194 1.00 44.41 C ATOM 36 C ASP A 457 31.292 4.053 -22.142 1.00 41.79 C ATOM 37 O ASP A 457 30.470 3.154 -21.972 1.00 46.89 O ATOM 38 CB ASP A 457 31.278 4.796 -19.713 1.00 45.83 C ATOM 39 CG ASP A 457 32.519 3.989 -19.269 1.00 47.29 C ATOM 40 OD1 ASP A 457 33.222 3.460 -20.160 1.00 49.08 O ATOM 41 OD2 ASP A 457 32.770 3.851 -18.040 1.00 46.55 O ATOM 42 H ASP A 457 29.374 6.033 -21.107 1.00 0.00 H ATOM 43 N PRO A 458 32.227 3.999 -23.099 1.00 47.27 N ATOM 44 CA PRO A 458 32.258 2.875 -24.039 1.00 43.81 C ATOM 45 C PRO A 458 32.358 1.494 -23.399 1.00 40.11 C ATOM 46 O PRO A 458 32.014 0.502 -24.040 1.00 42.16 O ATOM 47 CB PRO A 458 33.511 3.154 -24.884 1.00 49.08 C ATOM 48 CG PRO A 458 34.363 4.042 -24.056 1.00 51.58 C ATOM 49 CD PRO A 458 33.438 4.853 -23.198 1.00 48.11 C ATOM 50 N LEU A 459 32.850 1.394 -22.171 1.00 41.59 N ATOM 51 CA LEU A 459 32.989 0.065 -21.560 1.00 45.58 C ATOM 52 C LEU A 459 31.648 -0.487 -21.032 1.00 38.93 C ATOM 53 O LEU A 459 31.510 -1.686 -20.751 1.00 40.63 O ATOM 54 CB LEU A 459 34.024 0.105 -20.432 1.00 46.33 C ATOM 55 CG LEU A 459 35.445 0.543 -20.810 1.00 41.24 C ATOM 56 CD1 LEU A 459 36.365 0.716 -19.605 1.00 40.48 C ATOM 57 CD2 LEU A 459 36.006 -0.483 -21.768 1.00 41.79 C ATOM 58 H LEU A 459 33.134 2.246 -21.647 1.00 0.00 H ATOM 59 N TRP A 460 30.685 0.401 -20.862 1.00 37.86 N ATOM 60 CA TRP A 460 29.471 0.096 -20.094 1.00 39.20 C ATOM 61 C TRP A 460 28.162 0.463 -20.757 1.00 37.17 C ATOM 62 O TRP A 460 27.146 -0.126 -20.421 1.00 38.49 O ATOM 63 CB TRP A 460 29.543 0.764 -18.718 1.00 33.06 C ATOM 64 CG TRP A 460 30.542 0.096 -17.854 1.00 35.78 C ATOM 65 CD1 TRP A 460 31.789 0.541 -17.569 1.00 33.57 C ATOM 66 CD2 TRP A 460 30.433 -1.202 -17.258 1.00 34.51 C ATOM 67 NE1 TRP A 460 32.467 -0.393 -16.866 1.00 38.53 N ATOM 68 CE2 TRP A 460 31.652 -1.468 -16.634 1.00 37.45 C ATOM 69 CE3 TRP A 460 29.398 -2.131 -17.142 1.00 38.23 C ATOM 70 CZ2 TRP A 460 31.866 -2.610 -15.849 1.00 40.35 C ATOM 71 CZ3 TRP A 460 29.632 -3.301 -16.441 1.00 38.66 C ATOM 72 CH2 TRP A 460 30.859 -3.529 -15.788 1.00 41.99 C ATOM 73 HE1 TRP A 460 33.454 -0.308 -16.550 1.00 0.00 H ATOM 74 H TRP A 460 30.790 1.345 -21.285 1.00 0.00 H ATOM 75 N GLU A 461 28.165 1.390 -21.711 1.00 39.40 N ATOM 76 CA GLU A 461 26.912 1.850 -22.311 1.00 38.30 C ATOM 77 C GLU A 461 26.229 0.718 -23.094 1.00 37.03 C ATOM 78 O GLU A 461 26.874 -0.037 -23.833 1.00 39.33 O ATOM 79 CB GLU A 461 27.141 3.065 -23.199 1.00 43.73 C ATOM 80 CG GLU A 461 25.844 3.732 -23.634 1.00 43.51 C ATOM 81 CD GLU A 461 25.201 4.604 -22.560 1.00 45.89 C ATOM 82 OE1 GLU A 461 24.027 5.001 -22.753 1.00 45.72 O ATOM 83 OE2 GLU A 461 25.873 4.992 -21.579 1.00 44.08 O ATOM 84 H GLU A 461 29.068 1.792 -22.034 1.00 0.00 H ATOM 85 N PHE A 462 24.932 0.564 -22.841 1.00 40.76 N ATOM 86 CA PHE A 462 24.101 -0.497 -23.424 1.00 43.24 C ATOM 87 C PHE A 462 22.929 0.197 -24.150 1.00 42.02 C ATOM 88 O PHE A 462 22.436 1.209 -23.658 1.00 43.78 O ATOM 89 CB PHE A 462 23.583 -1.411 -22.289 1.00 42.99 C ATOM 90 CG PHE A 462 22.728 -2.561 -22.760 1.00 39.16 C ATOM 91 CD1 PHE A 462 23.299 -3.689 -23.297 1.00 44.76 C ATOM 92 CD2 PHE A 462 21.341 -2.484 -22.703 1.00 39.98 C ATOM 93 CE1 PHE A 462 22.513 -4.746 -23.754 1.00 43.89 C ATOM 94 CE2 PHE A 462 20.553 -3.537 -23.156 1.00 42.40 C ATOM 95 CZ PHE A 462 21.146 -4.661 -23.688 1.00 41.42 C ATOM 96 H PHE A 462 24.479 1.237 -22.190 1.00 0.00 H ATOM 97 N PRO A 463 22.476 -0.335 -25.316 1.00 43.13 N ATOM 98 CA PRO A 463 21.467 0.437 -26.102 1.00 45.74 C ATOM 99 C PRO A 463 20.091 0.438 -25.445 1.00 41.75 C ATOM 100 O PRO A 463 19.584 -0.600 -25.040 1.00 44.82 O ATOM 101 CB PRO A 463 21.427 -0.273 -27.473 1.00 44.15 C ATOM 102 CG PRO A 463 22.553 -1.274 -27.457 1.00 46.16 C ATOM 103 CD PRO A 463 22.870 -1.572 -26.013 1.00 46.00 C ATOM 104 N ARG A 464 19.542 1.629 -25.276 1.00 46.46 N ATOM 105 CA ARG A 464 18.308 1.841 -24.537 1.00 52.34 C ATOM 106 C ARG A 464 17.158 1.093 -25.222 1.00 57.35 C ATOM 107 O ARG A 464 16.240 0.620 -24.558 1.00 56.97 O ATOM 108 CB ARG A 464 18.046 3.347 -24.480 1.00 54.58 C ATOM 109 CG ARG A 464 16.919 3.800 -23.577 1.00 61.94 C ATOM 110 CD ARG A 464 16.791 5.305 -23.665 1.00 59.37 C ATOM 111 NE ARG A 464 17.898 5.969 -22.990 1.00 63.35 N ATOM 112 CZ ARG A 464 17.986 6.147 -21.674 1.00 61.68 C ATOM 113 NH1 ARG A 464 17.003 5.742 -20.871 1.00 63.45 N ATOM 114 NH2 ARG A 464 19.055 6.756 -21.155 1.00 59.19 N ATOM 115 HE ARG A 464 18.676 6.330 -23.579 1.00 0.00 H ATOM 116 HH12 ARG A 464 17.079 5.884 -19.844 1.00 0.00 H ATOM 117 HH11 ARG A 464 16.160 5.283 -21.272 1.00 0.00 H ATOM 118 HH22 ARG A 464 19.126 6.896 -20.127 1.00 0.00 H ATOM 119 HH21 ARG A 464 19.817 7.090 -21.779 1.00 0.00 H ATOM 120 H ARG A 464 20.017 2.455 -25.692 1.00 0.00 H ATOM 121 N ASP A 465 17.278 0.912 -26.540 1.00 55.99 N ATOM 122 CA ASP A 465 16.268 0.241 -27.352 1.00 58.23 C ATOM 123 C ASP A 465 16.338 -1.263 -27.244 1.00 58.54 C ATOM 124 O ASP A 465 15.503 -1.943 -27.811 1.00 58.40 O ATOM 125 CB ASP A 465 16.370 0.662 -28.837 1.00 72.54 C ATOM 126 CG ASP A 465 17.733 0.317 -29.480 1.00 84.44 C ATOM 127 OD1 ASP A 465 18.663 1.149 -29.407 1.00 93.65 O ATOM 128 OD2 ASP A 465 17.864 -0.762 -30.100 1.00 91.35 O ATOM 129 H ASP A 465 18.134 1.267 -27.011 1.00 0.00 H ATOM 130 N ARG A 466 17.336 -1.804 -26.547 1.00 51.81 N ATOM 131 CA ARG A 466 17.398 -3.253 -26.338 1.00 44.97 C ATOM 132 C ARG A 466 17.070 -3.668 -24.889 1.00 43.60 C ATOM 133 O ARG A 466 17.261 -4.810 -24.499 1.00 44.26 O ATOM 134 CB ARG A 466 18.736 -3.788 -26.846 1.00 50.67 C ATOM 135 CG ARG A 466 18.717 -3.957 -28.366 1.00 65.88 C ATOM 136 CD ARG A 466 20.089 -4.002 -29.006 1.00 72.08 C ATOM 137 NE ARG A 466 20.584 -5.367 -29.216 1.00 87.84 N ATOM 138 CZ ARG A 466 21.682 -5.679 -29.916 1.00 91.91 C ATOM 139 NH1 ARG A 466 22.418 -4.734 -30.513 1.00 95.56 N ATOM 140 NH2 ARG A 466 22.058 -6.949 -30.019 1.00 86.60 N ATOM 141 HE ARG A 466 20.044 -6.148 -28.791 1.00 0.00 H ATOM 142 HH12 ARG A 466 23.267 -4.999 -31.052 1.00 0.00 H ATOM 143 HH11 ARG A 466 22.141 -3.734 -30.438 1.00 0.00 H ATOM 144 HH22 ARG A 466 22.910 -7.197 -30.562 1.00 0.00 H ATOM 145 HH21 ARG A 466 21.500 -7.696 -29.557 1.00 0.00 H ATOM 146 H ARG A 466 18.077 -1.193 -26.148 1.00 0.00 H ATOM 147 N LEU A 467 16.513 -2.741 -24.117 1.00 46.61 N ATOM 148 CA LEU A 467 16.061 -3.026 -22.754 1.00 52.14 C ATOM 149 C LEU A 467 14.552 -2.830 -22.669 1.00 52.05 C ATOM 150 O LEU A 467 14.069 -1.726 -22.850 1.00 52.91 O ATOM 151 CB LEU A 467 16.760 -2.051 -21.794 1.00 52.27 C ATOM 152 CG LEU A 467 16.561 -2.196 -20.290 1.00 51.23 C ATOM 153 CD1 LEU A 467 17.227 -3.470 -19.787 1.00 46.31 C ATOM 154 CD2 LEU A 467 17.100 -0.960 -19.561 1.00 50.33 C ATOM 155 H LEU A 467 16.394 -1.779 -24.494 1.00 0.00 H ATOM 156 N VAL A 468 13.819 -3.906 -22.415 1.00 58.07 N ATOM 157 CA VAL A 468 12.358 -3.843 -22.291 1.00 57.39 C ATOM 158 C VAL A 468 11.989 -3.848 -20.811 1.00 47.63 C ATOM 159 O VAL A 468 12.075 -4.866 -20.132 1.00 42.97 O ATOM 160 CB VAL A 468 11.662 -5.032 -23.009 1.00 62.19 C ATOM 161 CG1 VAL A 468 10.151 -4.969 -22.829 1.00 61.35 C ATOM 162 CG2 VAL A 468 12.015 -5.050 -24.490 1.00 65.57 C ATOM 163 H VAL A 468 14.295 -4.824 -22.300 1.00 0.00 H ATOM 164 N LEU A 469 11.613 -2.684 -20.310 1.00 43.81 N ATOM 165 CA LEU A 469 11.243 -2.549 -18.925 1.00 48.73 C ATOM 166 C LEU A 469 10.009 -3.392 -18.616 1.00 57.56 C ATOM 167 O LEU A 469 9.139 -3.555 -19.469 1.00 58.55 O ATOM 168 CB LEU A 469 10.968 -1.082 -18.608 1.00 50.65 C ATOM 169 CG LEU A 469 12.141 -0.112 -18.750 1.00 54.39 C ATOM 170 CD1 LEU A 469 11.755 1.205 -18.101 1.00 56.90 C ATOM 171 CD2 LEU A 469 13.406 -0.671 -18.114 1.00 58.67 C ATOM 172 H LEU A 469 11.584 -1.849 -20.929 1.00 0.00 H ATOM 173 N GLY A 470 9.937 -3.921 -17.397 1.00 54.38 N ATOM 174 CA GLY A 470 8.822 -4.783 -16.986 1.00 53.16 C ATOM 175 C GLY A 470 8.308 -4.371 -15.621 1.00 51.02 C ATOM 176 O GLY A 470 8.281 -3.174 -15.307 1.00 55.47 O ATOM 177 H GLY A 470 10.694 -3.717 -16.714 1.00 0.00 H ATOM 178 N LYS A 471 7.962 -5.368 -14.797 1.00 53.08 N ATOM 179 CA LYS A 471 7.276 -5.153 -13.509 1.00 60.81 C ATOM 180 C LYS A 471 8.215 -4.504 -12.483 1.00 62.97 C ATOM 181 O LYS A 471 9.339 -4.972 -12.291 1.00 61.84 O ATOM 182 CB LYS A 471 6.773 -6.498 -12.934 1.00 53.15 C ATOM 183 H LYS A 471 8.188 -6.343 -15.079 1.00 0.00 H ATOM 184 N PRO A 472 7.734 -3.479 -11.769 1.00 61.64 N ATOM 185 CA PRO A 472 8.442 -2.897 -10.625 1.00 60.33 C ATOM 186 C PRO A 472 8.870 -3.926 -9.594 1.00 58.19 C ATOM 187 O PRO A 472 8.085 -4.800 -9.261 1.00 59.75 O ATOM 188 CB PRO A 472 7.401 -1.968 -10.004 1.00 68.14 C ATOM 189 CG PRO A 472 6.480 -1.620 -11.113 1.00 63.57 C ATOM 190 CD PRO A 472 6.484 -2.766 -12.072 1.00 60.94 C ATOM 191 N LEU A 473 10.108 -3.847 -9.104 1.00 52.18 N ATOM 192 CA LEU A 473 10.559 -4.736 -8.024 1.00 47.89 C ATOM 193 C LEU A 473 10.528 -4.026 -6.671 1.00 48.02 C ATOM 194 O LEU A 473 10.416 -4.662 -5.636 1.00 53.08 O ATOM 195 CB LEU A 473 11.960 -5.276 -8.327 1.00 52.07 C ATOM 196 CG LEU A 473 12.039 -6.409 -9.362 1.00 55.04 C ATOM 197 CD1 LEU A 473 13.476 -6.651 -9.764 1.00 56.60 C ATOM 198 CD2 LEU A 473 11.435 -7.702 -8.833 1.00 62.57 C ATOM 199 H LEU A 473 10.767 -3.143 -9.494 1.00 0.00 H ATOM 200 N GLY A 474 10.681 -2.711 -6.671 1.00 55.07 N ATOM 201 CA GLY A 474 10.627 -1.946 -5.432 1.00 53.95 C ATOM 202 C GLY A 474 10.689 -0.458 -5.687 1.00 53.23 C ATOM 203 O GLY A 474 11.187 -0.017 -6.731 1.00 52.46 O ATOM 204 H GLY A 474 10.843 -2.215 -7.571 1.00 0.00 H ATOM 205 N GLU A 475 10.147 0.317 -4.756 1.00 58.66 N ATOM 206 CA GLU A 475 10.085 1.784 -4.882 1.00 67.62 C ATOM 207 C GLU A 475 10.561 2.429 -3.575 1.00 74.75 C ATOM 208 O GLU A 475 10.082 2.085 -2.499 1.00 80.38 O ATOM 209 CB GLU A 475 8.661 2.244 -5.221 1.00 63.29 C ATOM 210 H GLU A 475 9.750 -0.128 -3.904 1.00 0.00 H ATOM 211 N GLY A 476 11.573 3.286 -3.667 1.00 76.43 N ATOM 212 CA GLY A 476 12.030 4.084 -2.529 1.00 70.54 C ATOM 213 C GLY A 476 11.307 5.416 -2.572 1.00 73.36 C ATOM 214 O GLY A 476 10.284 5.534 -3.253 1.00 69.09 O ATOM 215 H GLY A 476 12.057 3.393 -4.581 1.00 0.00 H ATOM 216 N CYS A 477 11.831 6.419 -1.867 1.00 69.84 N ATOM 217 CA CYS A 477 11.245 7.764 -1.918 1.00 80.53 C ATOM 218 C CYS A 477 11.341 8.326 -3.339 1.00 84.84 C ATOM 219 O CYS A 477 10.333 8.422 -4.037 1.00 79.45 O ATOM 220 CB CYS A 477 11.932 8.709 -0.925 1.00 75.12 C ATOM 221 H CYS A 477 12.667 6.246 -1.273 1.00 0.00 H ATOM 222 N PHE A 478 12.571 8.585 -3.788 1.00 92.56 N ATOM 223 CA PHE A 478 12.827 9.279 -5.053 1.00 80.50 C ATOM 224 C PHE A 478 13.393 8.386 -6.187 1.00 76.66 C ATOM 225 O PHE A 478 13.873 8.909 -7.195 1.00 65.74 O ATOM 226 CB PHE A 478 13.788 10.445 -4.793 1.00 80.99 C ATOM 227 H PHE A 478 13.384 8.281 -3.215 1.00 0.00 H ATOM 228 N GLY A 479 13.326 7.059 -6.049 1.00 71.95 N ATOM 229 CA GLY A 479 13.837 6.142 -7.096 1.00 63.81 C ATOM 230 C GLY A 479 13.218 4.751 -7.073 1.00 69.74 C ATOM 231 O GLY A 479 12.558 4.366 -6.088 1.00 65.77 O ATOM 232 H GLY A 479 12.905 6.659 -5.186 1.00 0.00 H ATOM 233 N GLN A 480 13.444 3.971 -8.133 1.00 50.64 N ATOM 234 CA GLN A 480 12.877 2.632 -8.179 1.00 52.29 C ATOM 235 C GLN A 480 13.728 1.591 -8.891 1.00 46.15 C ATOM 236 O GLN A 480 14.641 1.926 -9.627 1.00 44.28 O ATOM 237 CB GLN A 480 11.493 2.686 -8.824 1.00 53.50 C ATOM 238 CG GLN A 480 11.437 3.517 -10.093 1.00 61.60 C ATOM 239 CD GLN A 480 10.158 3.296 -10.882 1.00 72.19 C ATOM 240 OE1 GLN A 480 9.239 2.605 -10.429 1.00 74.30 O ATOM 241 NE2 GLN A 480 10.103 3.865 -12.080 1.00 71.99 N ATOM 242 HE22 GLN A 480 10.901 4.439 -12.420 1.00 0.00 H ATOM 243 HE21 GLN A 480 9.262 3.737 -12.678 1.00 0.00 H ATOM 244 H GLN A 480 14.023 4.320 -8.923 1.00 0.00 H ATOM 245 N VAL A 481 13.300 0.340 -8.761 1.00 45.27 N ATOM 246 CA VAL A 481 13.916 -0.790 -9.416 1.00 46.06 C ATOM 247 C VAL A 481 12.866 -1.622 -10.128 1.00 46.98 C ATOM 248 O VAL A 481 11.928 -2.090 -9.496 1.00 45.72 O ATOM 249 CB VAL A 481 14.593 -1.738 -8.400 1.00 41.65 C ATOM 250 CG1 VAL A 481 15.254 -2.889 -9.137 1.00 41.99 C ATOM 251 CG2 VAL A 481 15.604 -0.986 -7.541 1.00 44.86 C ATOM 252 H VAL A 481 12.475 0.165 -8.153 1.00 0.00 H ATOM 253 N VAL A 482 13.119 -1.941 -11.390 1.00 45.25 N ATOM 254 CA VAL A 482 12.176 -2.661 -12.210 1.00 50.34 C ATOM 255 C VAL A 482 12.904 -3.821 -12.819 1.00 50.88 C ATOM 256 O VAL A 482 14.104 -3.738 -13.112 1.00 41.84 O ATOM 257 CB VAL A 482 11.553 -1.756 -13.300 1.00 57.18 C ATOM 258 CG1 VAL A 482 11.108 -0.429 -12.690 1.00 56.42 C ATOM 259 CG2 VAL A 482 12.530 -1.493 -14.435 1.00 64.46 C ATOM 260 H VAL A 482 14.031 -1.662 -11.804 1.00 0.00 H ATOM 261 N ARG A 483 12.196 -4.935 -12.913 1.00 45.56 N ATOM 262 CA ARG A 483 12.617 -6.050 -13.723 1.00 42.97 C ATOM 263 C ARG A 483 12.567 -5.625 -15.192 1.00 50.50 C ATOM 264 O ARG A 483 11.750 -4.762 -15.576 1.00 50.03 O ATOM 265 CB ARG A 483 11.679 -7.222 -13.460 1.00 53.80 C ATOM 266 CG ARG A 483 12.100 -8.560 -14.056 1.00 68.11 C ATOM 267 CD ARG A 483 11.085 -9.665 -13.761 1.00 71.91 C ATOM 268 NE ARG A 483 10.295 -9.348 -12.571 1.00 80.49 N ATOM 269 CZ ARG A 483 9.793 -10.238 -11.724 1.00 82.66 C ATOM 270 NH1 ARG A 483 9.903 -11.542 -11.956 1.00 79.15 N ATOM 271 NH2 ARG A 483 9.155 -9.805 -10.637 1.00 85.33 N ATOM 272 HE ARG A 483 10.112 -8.344 -12.373 1.00 0.00 H ATOM 273 HH12 ARG A 483 9.504 -12.226 -11.282 1.00 0.00 H ATOM 274 HH11 ARG A 483 10.388 -11.879 -12.812 1.00 0.00 H ATOM 275 HH22 ARG A 483 8.755 -10.488 -9.962 1.00 0.00 H ATOM 276 HH21 ARG A 483 9.057 -8.784 -10.464 1.00 0.00 H ATOM 277 H ARG A 483 11.304 -5.008 -12.383 1.00 0.00 H ATOM 278 N ALA A 484 13.458 -6.198 -16.005 1.00 43.04 N ATOM 279 CA ALA A 484 13.522 -5.867 -17.416 1.00 42.35 C ATOM 280 C ALA A 484 14.038 -7.039 -18.207 1.00 42.79 C ATOM 281 O ALA A 484 14.677 -7.937 -17.664 1.00 44.91 O ATOM 282 CB ALA A 484 14.396 -4.641 -17.633 1.00 44.32 C ATOM 283 H ALA A 484 14.122 -6.898 -15.617 1.00 0.00 H ATOM 284 N GLU A 485 13.723 -7.067 -19.494 1.00 48.42 N ATOM 285 CA GLU A 485 14.339 -8.029 -20.399 1.00 49.95 C ATOM 286 C GLU A 485 15.367 -7.255 -21.192 1.00 46.71 C ATOM 287 O GLU A 485 15.068 -6.183 -21.712 1.00 49.03 O ATOM 288 CB GLU A 485 13.318 -8.645 -21.374 1.00 56.26 C ATOM 289 CG GLU A 485 12.397 -9.691 -20.760 1.00 70.02 C ATOM 290 CD GLU A 485 13.137 -10.749 -19.957 1.00 83.35 C ATOM 291 OE1 GLU A 485 13.932 -11.512 -20.562 1.00 89.38 O ATOM 292 OE2 GLU A 485 12.916 -10.816 -18.717 1.00 90.20 O ATOM 293 H GLU A 485 13.025 -6.391 -19.864 1.00 0.00 H ATOM 294 N ALA A 486 16.581 -7.783 -21.249 1.00 43.06 N ATOM 295 CA ALA A 486 17.661 -7.129 -21.996 1.00 46.92 C ATOM 296 C ALA A 486 18.039 -8.052 -23.146 1.00 42.66 C ATOM 297 O ALA A 486 18.144 -9.253 -22.947 1.00 47.37 O ATOM 298 CB ALA A 486 18.872 -6.876 -21.087 1.00 42.92 C ATOM 299 H ALA A 486 16.772 -8.678 -20.755 1.00 0.00 H ATOM 300 N PHE A 487 18.232 -7.491 -24.341 1.00 43.04 N ATOM 301 CA PHE A 487 18.674 -8.286 -25.491 1.00 51.03 C ATOM 302 C PHE A 487 20.106 -7.983 -25.859 1.00 42.42 C ATOM 303 O PHE A 487 20.452 -6.841 -26.140 1.00 50.01 O ATOM 304 CB PHE A 487 17.766 -8.026 -26.710 1.00 60.74 C ATOM 305 CG PHE A 487 16.340 -8.469 -26.503 1.00 59.83 C ATOM 306 CD1 PHE A 487 15.430 -7.636 -25.872 1.00 56.68 C ATOM 307 CD2 PHE A 487 15.932 -9.749 -26.878 1.00 64.63 C ATOM 308 CE1 PHE A 487 14.133 -8.065 -25.633 1.00 66.97 C ATOM 309 CE2 PHE A 487 14.638 -10.175 -26.652 1.00 61.08 C ATOM 310 CZ PHE A 487 13.734 -9.328 -26.033 1.00 59.19 C ATOM 311 H PHE A 487 18.066 -6.471 -24.459 1.00 0.00 H ATOM 312 N GLY A 488 20.938 -9.009 -25.834 1.00 52.56 N ATOM 313 CA GLY A 488 22.343 -8.863 -26.170 1.00 57.57 C ATOM 314 C GLY A 488 23.274 -8.513 -25.022 1.00 59.07 C ATOM 315 O GLY A 488 24.377 -8.076 -25.279 1.00 58.16 O ATOM 316 H GLY A 488 20.577 -9.947 -25.566 1.00 0.00 H ATOM 317 N MET A 489 22.878 -8.761 -23.768 1.00 54.74 N ATOM 318 CA MET A 489 23.800 -8.584 -22.637 1.00 56.42 C ATOM 319 C MET A 489 25.037 -9.474 -22.776 1.00 63.74 C ATOM 320 O MET A 489 26.075 -9.184 -22.192 1.00 73.15 O ATOM 321 CB MET A 489 23.146 -8.882 -21.277 1.00 50.54 C ATOM 322 CG MET A 489 22.587 -7.693 -20.499 1.00 59.06 C ATOM 323 SD MET A 489 23.533 -6.150 -20.378 1.00 52.92 S ATOM 324 CE MET A 489 25.185 -6.770 -20.442 1.00 68.97 C ATOM 325 H MET A 489 21.905 -9.083 -23.591 1.00 0.00 H ATOM 326 N ASP A 490 24.885 -10.600 -23.463 1.00 64.20 N ATOM 327 CA ASP A 490 26.013 -11.390 -23.956 1.00 64.04 C ATOM 328 C ASP A 490 26.381 -10.909 -25.358 1.00 67.07 C ATOM 329 O ASP A 490 25.674 -11.209 -26.329 1.00 63.78 O ATOM 330 CB ASP A 490 25.657 -12.881 -23.995 1.00 69.34 C ATOM 331 CG ASP A 490 26.767 -13.733 -24.593 1.00 77.55 C ATOM 332 OD1 ASP A 490 27.953 -13.484 -24.279 1.00 79.09 O ATOM 333 OD2 ASP A 490 26.452 -14.637 -25.402 1.00 84.22 O ATOM 334 H ASP A 490 23.920 -10.935 -23.659 1.00 0.00 H ATOM 335 N PRO A 491 27.465 -10.123 -25.469 1.00 60.50 N ATOM 336 CA PRO A 491 27.920 -9.654 -26.783 1.00 59.49 C ATOM 337 C PRO A 491 28.088 -10.788 -27.794 1.00 63.47 C ATOM 338 O PRO A 491 27.770 -10.608 -28.965 1.00 75.07 O ATOM 339 CB PRO A 491 29.281 -9.016 -26.483 1.00 66.04 C ATOM 340 CG PRO A 491 29.259 -8.681 -25.030 1.00 63.75 C ATOM 341 CD PRO A 491 28.370 -9.707 -24.382 1.00 60.46 C ATOM 342 N ALA A 492 28.562 -11.943 -27.334 1.00 65.58 N ATOM 343 CA ALA A 492 28.717 -13.134 -28.177 1.00 81.28 C ATOM 344 C ALA A 492 27.411 -13.568 -28.870 1.00 95.57 C ATOM 345 O ALA A 492 27.361 -13.615 -30.098 1.00101.06 O ATOM 346 CB ALA A 492 29.293 -14.285 -27.360 1.00 81.80 C ATOM 347 H ALA A 492 28.835 -12.004 -26.332 1.00 0.00 H ATOM 348 N ARG A 493 26.380 -13.910 -28.091 1.00 91.13 N ATOM 349 CA ARG A 493 25.048 -14.239 -28.628 1.00 78.69 C ATOM 350 C ARG A 493 24.091 -13.045 -28.438 1.00 71.17 C ATOM 351 O ARG A 493 23.339 -12.995 -27.462 1.00 67.47 O ATOM 352 CB ARG A 493 24.497 -15.495 -27.939 1.00 81.27 C ATOM 353 H ARG A 493 26.524 -13.945 -27.062 1.00 0.00 H ATOM 354 N PRO A 494 24.125 -12.076 -29.369 1.00 68.01 N ATOM 355 CA PRO A 494 23.546 -10.737 -29.177 1.00 70.38 C ATOM 356 C PRO A 494 22.028 -10.610 -29.316 1.00 71.67 C ATOM 357 O PRO A 494 21.489 -9.497 -29.189 1.00 69.29 O ATOM 358 CB PRO A 494 24.222 -9.900 -30.285 1.00 70.44 C ATOM 359 CG PRO A 494 24.661 -10.876 -31.322 1.00 62.70 C ATOM 360 CD PRO A 494 24.538 -12.278 -30.770 1.00 70.92 C ATOM 361 N ASP A 495 21.363 -11.705 -29.667 1.00 76.17 N ATOM 362 CA ASP A 495 19.909 -11.725 -29.794 1.00 71.98 C ATOM 363 C ASP A 495 19.282 -12.322 -28.534 1.00 71.35 C ATOM 364 O ASP A 495 18.103 -12.076 -28.269 1.00 75.65 O ATOM 365 CB ASP A 495 19.496 -12.519 -31.047 1.00 68.91 C ATOM 366 H ASP A 495 21.896 -12.577 -29.858 1.00 0.00 H ATOM 367 N GLN A 496 20.076 -13.079 -27.760 1.00 70.01 N ATOM 368 CA GLN A 496 19.629 -13.712 -26.512 1.00 64.35 C ATOM 369 C GLN A 496 19.017 -12.699 -25.524 1.00 68.50 C ATOM 370 O GLN A 496 19.534 -11.601 -25.343 1.00 55.65 O ATOM 371 CB GLN A 496 20.780 -14.477 -25.843 1.00 56.37 C ATOM 372 H GLN A 496 21.061 -13.225 -28.060 1.00 0.00 H ATOM 373 N ALA A 497 17.856 -13.038 -24.975 1.00 61.94 N ATOM 374 CA ALA A 497 17.260 -12.266 -23.888 1.00 64.58 C ATOM 375 C ALA A 497 17.783 -12.725 -22.532 1.00 53.07 C ATOM 376 O ALA A 497 18.040 -13.890 -22.305 1.00 49.23 O ATOM 377 CB ALA A 497 15.753 -12.395 -23.911 1.00 64.73 C ATOM 378 H ALA A 497 17.356 -13.878 -25.330 1.00 0.00 H ATOM 379 N SER A 498 17.878 -11.801 -21.599 1.00 49.38 N ATOM 380 CA SER A 498 18.072 -12.189 -20.217 1.00 49.04 C ATOM 381 C SER A 498 17.245 -11.243 -19.324 1.00 40.63 C ATOM 382 O SER A 498 16.854 -10.144 -19.737 1.00 50.76 O ATOM 383 CB SER A 498 19.573 -12.151 -19.886 1.00 47.10 C ATOM 384 OG SER A 498 20.034 -10.820 -19.985 1.00 47.87 O ATOM 385 HG SER A 498 21.001 -10.790 -19.773 1.00 0.00 H ATOM 386 H SER A 498 17.814 -10.795 -21.854 1.00 0.00 H ATOM 387 N THR A 499 16.968 -11.689 -18.112 1.00 40.88 N ATOM 388 CA THR A 499 16.207 -10.903 -17.160 1.00 44.31 C ATOM 389 C THR A 499 17.205 -10.203 -16.245 1.00 41.39 C ATOM 390 O THR A 499 18.069 -10.841 -15.704 1.00 42.05 O ATOM 391 CB THR A 499 15.297 -11.828 -16.325 1.00 46.87 C ATOM 392 OG1 THR A 499 14.383 -12.475 -17.195 1.00 53.18 O ATOM 393 CG2 THR A 499 14.496 -11.063 -15.265 1.00 48.83 C ATOM 394 HG1 THR A 499 13.835 -11.795 -17.661 1.00 0.00 H ATOM 395 H THR A 499 17.306 -12.632 -17.832 1.00 0.00 H ATOM 396 N VAL A 500 17.054 -8.893 -16.082 1.00 44.89 N ATOM 397 CA VAL A 500 17.974 -8.052 -15.321 1.00 38.72 C ATOM 398 C VAL A 500 17.119 -7.170 -14.430 1.00 42.32 C ATOM 399 O VAL A 500 15.884 -7.142 -14.561 1.00 38.19 O ATOM 400 CB VAL A 500 18.836 -7.140 -16.236 1.00 39.00 C ATOM 401 CG1 VAL A 500 19.697 -7.971 -17.169 1.00 41.81 C ATOM 402 CG2 VAL A 500 17.978 -6.196 -17.047 1.00 40.19 C ATOM 403 H VAL A 500 16.230 -8.438 -16.524 1.00 0.00 H ATOM 404 N ALA A 501 17.764 -6.507 -13.476 1.00 35.77 N ATOM 405 CA ALA A 501 17.131 -5.464 -12.707 1.00 37.07 C ATOM 406 C ALA A 501 17.734 -4.113 -13.098 1.00 39.62 C ATOM 407 O ALA A 501 18.935 -4.010 -13.360 1.00 39.91 O ATOM 408 CB ALA A 501 17.311 -5.710 -11.238 1.00 37.88 C ATOM 409 H ALA A 501 18.756 -6.748 -13.278 1.00 0.00 H ATOM 410 N VAL A 502 16.892 -3.089 -13.105 1.00 34.72 N ATOM 411 CA VAL A 502 17.267 -1.765 -13.528 1.00 37.98 C ATOM 412 C VAL A 502 16.934 -0.746 -12.456 1.00 42.60 C ATOM 413 O VAL A 502 15.777 -0.583 -12.082 1.00 41.28 O ATOM 414 CB VAL A 502 16.538 -1.386 -14.829 1.00 44.46 C ATOM 415 CG1 VAL A 502 17.001 -0.025 -15.327 1.00 42.36 C ATOM 416 CG2 VAL A 502 16.760 -2.456 -15.878 1.00 44.01 C ATOM 417 H VAL A 502 15.914 -3.250 -12.790 1.00 0.00 H ATOM 418 N LYS A 503 17.943 -0.061 -11.939 1.00 39.87 N ATOM 419 CA LYS A 503 17.689 1.051 -11.014 1.00 40.26 C ATOM 420 C LYS A 503 17.611 2.376 -11.766 1.00 43.50 C ATOM 421 O LYS A 503 18.401 2.629 -12.669 1.00 41.49 O ATOM 422 CB LYS A 503 18.769 1.138 -9.954 1.00 40.62 C ATOM 423 CG LYS A 503 18.364 2.071 -8.815 1.00 44.79 C ATOM 424 CD LYS A 503 19.482 2.328 -7.849 1.00 44.73 C ATOM 425 CE LYS A 503 19.613 1.260 -6.811 1.00 47.60 C ATOM 426 NZ LYS A 503 20.058 1.883 -5.523 1.00 48.24 N ATOM 427 HZ1 LYS A 503 20.976 2.350 -5.664 1.00 0.00 H ATOM 428 HZ2 LYS A 503 19.354 2.585 -5.218 1.00 0.00 H ATOM 429 HZ3 LYS A 503 20.151 1.145 -4.796 1.00 0.00 H ATOM 430 H LYS A 503 18.921 -0.312 -12.190 1.00 0.00 H ATOM 431 N MET A 504 16.643 3.208 -11.386 1.00 43.60 N ATOM 432 CA MET A 504 16.410 4.503 -12.017 1.00 44.47 C ATOM 433 C MET A 504 15.817 5.489 -10.996 1.00 44.75 C ATOM 434 O MET A 504 15.380 5.089 -9.914 1.00 45.37 O ATOM 435 CB MET A 504 15.452 4.353 -13.197 1.00 47.14 C ATOM 436 CG MET A 504 14.047 3.914 -12.818 1.00 50.73 C ATOM 437 SD MET A 504 13.012 3.444 -14.229 1.00 60.50 S ATOM 438 CE MET A 504 13.626 1.807 -14.608 1.00 54.80 C ATOM 439 H MET A 504 16.023 2.921 -10.602 1.00 0.00 H ATOM 440 N LEU A 505 15.766 6.764 -11.363 1.00 50.56 N ATOM 441 CA LEU A 505 15.101 7.786 -10.539 1.00 54.76 C ATOM 442 C LEU A 505 13.607 7.864 -10.850 1.00 59.82 C ATOM 443 O LEU A 505 13.187 7.601 -11.979 1.00 53.03 O ATOM 444 CB LEU A 505 15.731 9.161 -10.784 1.00 55.81 C ATOM 445 CG LEU A 505 17.224 9.270 -10.476 1.00 54.69 C ATOM 446 CD1 LEU A 505 17.727 10.635 -10.891 1.00 59.90 C ATOM 447 CD2 LEU A 505 17.487 9.023 -9.005 1.00 50.55 C ATOM 448 H LEU A 505 16.209 7.049 -12.260 1.00 0.00 H ATOM 449 N LYS A 506 12.826 8.270 -9.847 1.00 67.53 N ATOM 450 CA LYS A 506 11.447 8.710 -10.056 1.00 68.52 C ATOM 451 C LYS A 506 11.467 10.158 -10.496 1.00 65.77 C ATOM 452 O LYS A 506 12.435 10.871 -10.225 1.00 61.07 O ATOM 453 CB LYS A 506 10.630 8.584 -8.770 1.00 70.29 C ATOM 454 CG LYS A 506 10.187 7.167 -8.451 1.00 79.12 C ATOM 455 CD LYS A 506 9.233 7.132 -7.261 1.00 81.17 C ATOM 456 CE LYS A 506 9.453 5.881 -6.435 1.00 78.80 C ATOM 457 NZ LYS A 506 8.325 5.625 -5.504 1.00 89.21 N ATOM 458 HZ1 LYS A 506 8.224 6.431 -4.854 1.00 0.00 H ATOM 459 HZ2 LYS A 506 7.447 5.505 -6.049 1.00 0.00 H ATOM 460 HZ3 LYS A 506 8.517 4.760 -4.959 1.00 0.00 H ATOM 461 H LYS A 506 13.212 8.274 -8.881 1.00 0.00 H ATOM 462 N ASP A 507 10.384 10.603 -11.138 1.00 72.43 N ATOM 463 CA ASP A 507 10.237 12.012 -11.551 1.00 75.49 C ATOM 464 C ASP A 507 10.354 13.012 -10.380 1.00 72.54 C ATOM 465 O ASP A 507 10.705 14.173 -10.592 1.00 73.44 O ATOM 466 CB ASP A 507 8.905 12.224 -12.282 1.00 80.41 C ATOM 467 H ASP A 507 9.618 9.934 -11.354 1.00 0.00 H ATOM 468 N ASN A 508 10.117 12.546 -9.152 1.00 69.85 N ATOM 469 CA ASN A 508 10.079 13.411 -7.968 1.00 75.29 C ATOM 470 C ASN A 508 11.453 13.625 -7.326 1.00 78.68 C ATOM 471 O ASN A 508 11.546 13.698 -6.101 1.00 77.28 O ATOM 472 CB ASN A 508 9.151 12.781 -6.919 1.00 70.31 C ATOM 473 H ASN A 508 9.952 11.526 -9.029 1.00 0.00 H ATOM 474 N ALA A 509 12.515 13.721 -8.128 1.00 82.87 N ATOM 475 CA ALA A 509 13.875 13.469 -7.619 1.00 78.89 C ATOM 476 C ALA A 509 14.831 14.632 -7.875 1.00 72.06 C ATOM 477 O ALA A 509 14.787 15.263 -8.928 1.00 69.87 O ATOM 478 CB ALA A 509 14.437 12.184 -8.213 1.00 77.06 C ATOM 479 H ALA A 509 12.381 13.977 -9.127 1.00 0.00 H ATOM 480 N SER A 510 15.719 14.876 -6.915 1.00 67.81 N ATOM 481 CA SER A 510 16.596 16.040 -6.936 1.00 70.08 C ATOM 482 C SER A 510 17.933 15.727 -7.602 1.00 83.45 C ATOM 483 O SER A 510 18.297 14.556 -7.773 1.00 81.33 O ATOM 484 CB SER A 510 16.880 16.482 -5.506 1.00 72.55 C ATOM 485 OG SER A 510 17.714 15.544 -4.847 1.00 64.58 O ATOM 486 HG SER A 510 17.265 14.662 -4.826 1.00 0.00 H ATOM 487 H SER A 510 15.790 14.211 -6.119 1.00 0.00 H ATOM 488 N ASP A 511 18.705 16.777 -7.879 1.00 76.75 N ATOM 489 CA ASP A 511 20.059 16.618 -8.375 1.00 68.35 C ATOM 490 C ASP A 511 20.887 15.781 -7.398 1.00 72.28 C ATOM 491 O ASP A 511 21.752 15.026 -7.829 1.00 64.95 O ATOM 492 CB ASP A 511 20.716 17.977 -8.640 1.00 72.61 C ATOM 493 H ASP A 511 18.327 17.735 -7.736 1.00 0.00 H ATOM 494 N LYS A 512 20.596 15.863 -6.096 1.00 72.98 N ATOM 495 CA LYS A 512 21.316 15.041 -5.120 1.00 66.85 C ATOM 496 C LYS A 512 21.067 13.562 -5.379 1.00 61.51 C ATOM 497 O LYS A 512 21.988 12.759 -5.275 1.00 59.14 O ATOM 498 CB LYS A 512 20.932 15.371 -3.679 1.00 61.20 C ATOM 499 H LYS A 512 19.853 16.515 -5.773 1.00 0.00 H ATOM 500 N ASP A 513 19.815 13.207 -5.667 1.00 62.79 N ATOM 501 CA ASP A 513 19.441 11.811 -5.882 1.00 58.90 C ATOM 502 C ASP A 513 20.173 11.298 -7.114 1.00 55.16 C ATOM 503 O ASP A 513 20.702 10.201 -7.108 1.00 50.34 O ATOM 504 CB ASP A 513 17.932 11.651 -6.085 1.00 65.90 C ATOM 505 CG ASP A 513 17.111 12.028 -4.840 1.00 68.59 C ATOM 506 OD1 ASP A 513 17.487 11.625 -3.724 1.00 72.33 O ATOM 507 OD2 ASP A 513 16.045 12.663 -4.999 1.00 66.09 O ATOM 508 H ASP A 513 19.085 13.944 -5.741 1.00 0.00 H ATOM 509 N LEU A 514 20.234 12.117 -8.155 1.00 53.50 N ATOM 510 CA LEU A 514 20.998 11.774 -9.332 1.00 58.65 C ATOM 511 C LEU A 514 22.496 11.574 -9.035 1.00 55.34 C ATOM 512 O LEU A 514 23.102 10.610 -9.494 1.00 53.10 O ATOM 513 CB LEU A 514 20.792 12.823 -10.408 1.00 53.43 C ATOM 514 CG LEU A 514 21.534 12.562 -11.704 1.00 58.63 C ATOM 515 CD1 LEU A 514 21.067 11.270 -12.374 1.00 55.27 C ATOM 516 CD2 LEU A 514 21.327 13.762 -12.623 1.00 63.16 C ATOM 517 H LEU A 514 19.723 13.022 -8.124 1.00 0.00 H ATOM 518 N ALA A 515 23.069 12.447 -8.220 1.00 61.59 N ATOM 519 CA ALA A 515 24.468 12.301 -7.795 1.00 54.37 C ATOM 520 C ALA A 515 24.728 10.991 -7.076 1.00 54.83 C ATOM 521 O ALA A 515 25.790 10.395 -7.263 1.00 52.41 O ATOM 522 CB ALA A 515 24.886 13.465 -6.913 1.00 55.30 C ATOM 523 H ALA A 515 22.515 13.256 -7.872 1.00 0.00 H ATOM 524 N ASP A 516 23.779 10.561 -6.240 1.00 47.59 N ATOM 525 CA ASP A 516 23.905 9.293 -5.509 1.00 50.49 C ATOM 526 C ASP A 516 23.877 8.047 -6.406 1.00 48.37 C ATOM 527 O ASP A 516 24.627 7.099 -6.171 1.00 46.69 O ATOM 528 CB ASP A 516 22.816 9.171 -4.450 1.00 52.83 C ATOM 529 CG ASP A 516 22.951 10.219 -3.336 1.00 65.96 C ATOM 530 OD1 ASP A 516 24.022 10.858 -3.207 1.00 61.69 O ATOM 531 OD2 ASP A 516 21.971 10.400 -2.584 1.00 64.41 O ATOM 532 H ASP A 516 22.926 11.141 -6.103 1.00 0.00 H ATOM 533 N LEU A 517 22.987 8.037 -7.393 1.00 46.42 N ATOM 534 CA LEU A 517 22.879 6.919 -8.319 1.00 45.29 C ATOM 535 C LEU A 517 24.111 6.846 -9.226 1.00 42.43 C ATOM 536 O LEU A 517 24.605 5.776 -9.491 1.00 42.82 O ATOM 537 CB LEU A 517 21.634 7.059 -9.175 1.00 44.16 C ATOM 538 CG LEU A 517 21.364 5.946 -10.188 1.00 41.97 C ATOM 539 CD1 LEU A 517 21.375 4.596 -9.513 1.00 40.63 C ATOM 540 CD2 LEU A 517 20.029 6.207 -10.855 1.00 45.18 C ATOM 541 H LEU A 517 22.350 8.851 -7.507 1.00 0.00 H ATOM 542 N VAL A 518 24.601 7.989 -9.682 1.00 39.84 N ATOM 543 CA VAL A 518 25.858 8.047 -10.439 1.00 41.16 C ATOM 544 C VAL A 518 27.021 7.497 -9.599 1.00 45.84 C ATOM 545 O VAL A 518 27.804 6.654 -10.053 1.00 39.63 O ATOM 546 CB VAL A 518 26.143 9.490 -10.902 1.00 44.73 C ATOM 547 CG1 VAL A 518 27.563 9.645 -11.425 1.00 48.13 C ATOM 548 CG2 VAL A 518 25.147 9.906 -11.982 1.00 44.17 C ATOM 549 H VAL A 518 24.081 8.871 -9.499 1.00 0.00 H ATOM 550 N SER A 519 27.079 7.912 -8.342 1.00 43.13 N ATOM 551 CA SER A 519 28.104 7.428 -7.433 1.00 44.25 C ATOM 552 C SER A 519 28.030 5.903 -7.289 1.00 38.86 C ATOM 553 O SER A 519 29.038 5.190 -7.355 1.00 38.67 O ATOM 554 CB SER A 519 27.917 8.107 -6.081 1.00 45.94 C ATOM 555 OG SER A 519 28.875 7.648 -5.155 1.00 50.95 O ATOM 556 HG SER A 519 28.736 8.101 -4.286 1.00 0.00 H ATOM 557 H SER A 519 26.377 8.598 -7.999 1.00 0.00 H ATOM 558 N GLU A 520 26.838 5.386 -7.088 1.00 38.72 N ATOM 559 CA GLU A 520 26.685 3.923 -6.974 1.00 38.48 C ATOM 560 C GLU A 520 27.164 3.229 -8.273 1.00 35.77 C ATOM 561 O GLU A 520 27.925 2.255 -8.214 1.00 35.86 O ATOM 562 CB GLU A 520 25.236 3.517 -6.633 1.00 36.56 C ATOM 563 CG GLU A 520 25.104 2.023 -6.306 1.00 38.97 C ATOM 564 CD GLU A 520 23.705 1.599 -5.829 1.00 44.91 C ATOM 565 OE1 GLU A 520 22.772 2.419 -5.897 1.00 46.62 O ATOM 566 OE2 GLU A 520 23.538 0.410 -5.445 1.00 47.53 O ATOM 567 H GLU A 520 26.006 6.006 -7.010 1.00 0.00 H ATOM 568 N MET A 521 26.769 3.763 -9.430 1.00 34.70 N ATOM 569 CA MET A 521 27.209 3.211 -10.741 1.00 41.90 C ATOM 570 C MET A 521 28.746 3.192 -10.889 1.00 34.96 C ATOM 571 O MET A 521 29.348 2.182 -11.211 1.00 34.55 O ATOM 572 CB MET A 521 26.585 4.041 -11.876 1.00 39.66 C ATOM 573 CG MET A 521 27.244 3.902 -13.251 1.00 49.89 C ATOM 574 SD MET A 521 26.335 4.868 -14.500 1.00 49.10 S ATOM 575 CE MET A 521 27.096 6.471 -14.255 1.00 49.41 C ATOM 576 H MET A 521 26.136 4.588 -9.416 1.00 0.00 H ATOM 577 N GLU A 522 29.370 4.321 -10.590 1.00 38.52 N ATOM 578 CA GLU A 522 30.805 4.475 -10.726 1.00 36.03 C ATOM 579 C GLU A 522 31.568 3.600 -9.748 1.00 32.76 C ATOM 580 O GLU A 522 32.601 3.012 -10.083 1.00 36.94 O ATOM 581 CB GLU A 522 31.191 5.969 -10.572 1.00 38.53 C ATOM 582 CG GLU A 522 30.692 6.849 -11.718 1.00 39.38 C ATOM 583 CD GLU A 522 31.190 6.335 -13.078 1.00 51.02 C ATOM 584 OE1 GLU A 522 32.402 6.053 -13.223 1.00 58.16 O ATOM 585 OE2 GLU A 522 30.368 6.076 -13.958 1.00 50.49 O ATOM 586 H GLU A 522 28.810 5.127 -10.245 1.00 0.00 H ATOM 587 N VAL A 523 31.072 3.519 -8.532 1.00 29.71 N ATOM 588 CA VAL A 523 31.653 2.650 -7.527 1.00 32.19 C ATOM 589 C VAL A 523 31.551 1.200 -7.989 1.00 31.65 C ATOM 590 O VAL A 523 32.485 0.431 -7.815 1.00 32.22 O ATOM 591 CB VAL A 523 30.939 2.844 -6.156 1.00 36.10 C ATOM 592 CG1 VAL A 523 31.213 1.707 -5.202 1.00 42.00 C ATOM 593 CG2 VAL A 523 31.382 4.157 -5.528 1.00 45.31 C ATOM 594 H VAL A 523 30.241 4.094 -8.285 1.00 0.00 H ATOM 595 N MET A 524 30.401 0.802 -8.533 1.00 33.38 N ATOM 596 CA MET A 524 30.294 -0.575 -9.037 1.00 33.48 C ATOM 597 C MET A 524 31.266 -0.846 -10.194 1.00 33.31 C ATOM 598 O MET A 524 31.928 -1.880 -10.223 1.00 32.35 O ATOM 599 CB MET A 524 28.863 -0.895 -9.419 1.00 30.71 C ATOM 600 CG MET A 524 27.989 -0.993 -8.180 1.00 31.73 C ATOM 601 SD MET A 524 26.259 -1.361 -8.547 1.00 40.56 S ATOM 602 CE MET A 524 26.473 -3.110 -8.930 1.00 36.91 C ATOM 603 H MET A 524 29.594 1.454 -8.600 1.00 0.00 H ATOM 604 N LYS A 525 31.409 0.100 -11.112 1.00 31.51 N ATOM 605 CA LYS A 525 32.426 -0.069 -12.146 1.00 32.23 C ATOM 606 C LYS A 525 33.790 -0.314 -11.570 1.00 32.12 C ATOM 607 O LYS A 525 34.491 -1.220 -11.999 1.00 33.90 O ATOM 608 CB LYS A 525 32.522 1.164 -13.033 1.00 37.19 C ATOM 609 CG LYS A 525 31.308 1.388 -13.917 1.00 37.93 C ATOM 610 CD LYS A 525 31.556 2.637 -14.742 1.00 42.96 C ATOM 611 CE LYS A 525 30.347 3.055 -15.542 1.00 44.17 C ATOM 612 NZ LYS A 525 30.683 4.341 -16.214 1.00 43.11 N ATOM 613 HZ1 LYS A 525 30.911 5.057 -15.495 1.00 0.00 H ATOM 614 HZ2 LYS A 525 31.503 4.201 -16.838 1.00 0.00 H ATOM 615 HZ3 LYS A 525 29.869 4.660 -16.777 1.00 0.00 H ATOM 616 H LYS A 525 30.807 0.948 -11.096 1.00 0.00 H ATOM 617 N LEU A 526 34.207 0.538 -10.651 1.00 33.44 N ATOM 618 CA LEU A 526 35.558 0.428 -10.103 1.00 32.99 C ATOM 619 C LEU A 526 35.794 -0.896 -9.333 1.00 34.77 C ATOM 620 O LEU A 526 36.863 -1.509 -9.403 1.00 33.99 O ATOM 621 CB LEU A 526 35.820 1.632 -9.187 1.00 39.59 C ATOM 622 CG LEU A 526 37.172 1.719 -8.483 1.00 48.52 C ATOM 623 CD1 LEU A 526 38.285 1.789 -9.531 1.00 51.17 C ATOM 624 CD2 LEU A 526 37.205 2.937 -7.556 1.00 50.62 C ATOM 625 H LEU A 526 33.572 1.290 -10.316 1.00 0.00 H ATOM 626 N ILE A 527 34.833 -1.311 -8.529 1.00 34.57 N ATOM 627 CA ILE A 527 34.997 -2.523 -7.761 1.00 32.44 C ATOM 628 C ILE A 527 35.236 -3.754 -8.650 1.00 29.85 C ATOM 629 O ILE A 527 35.970 -4.680 -8.269 1.00 34.39 O ATOM 630 CB ILE A 527 33.772 -2.719 -6.788 1.00 34.91 C ATOM 631 CG1 ILE A 527 33.877 -1.706 -5.617 1.00 34.97 C ATOM 632 CG2 ILE A 527 33.738 -4.150 -6.267 1.00 33.42 C ATOM 633 CD1 ILE A 527 32.662 -1.660 -4.706 1.00 41.27 C ATOM 634 H ILE A 527 33.953 -0.762 -8.448 1.00 0.00 H ATOM 635 N GLY A 528 34.545 -3.799 -9.786 1.00 34.68 N ATOM 636 CA GLY A 528 34.651 -4.905 -10.713 1.00 32.58 C ATOM 637 C GLY A 528 33.799 -6.112 -10.343 1.00 37.74 C ATOM 638 O GLY A 528 33.085 -6.093 -9.330 1.00 37.63 O ATOM 639 H GLY A 528 33.906 -3.011 -10.016 1.00 0.00 H ATOM 640 N ARG A 529 33.987 -7.193 -11.108 1.00 33.47 N ATOM 641 CA ARG A 529 33.081 -8.364 -11.150 1.00 39.51 C ATOM 642 C ARG A 529 33.476 -9.441 -10.127 1.00 34.93 C ATOM 643 O ARG A 529 34.642 -9.760 -9.980 1.00 32.66 O ATOM 644 CB ARG A 529 33.130 -9.022 -12.551 1.00 39.61 C ATOM 645 CG ARG A 529 31.830 -9.720 -12.934 1.00 60.10 C ATOM 646 CD ARG A 529 31.986 -10.748 -14.045 1.00 56.68 C ATOM 647 NE ARG A 529 32.614 -11.952 -13.497 1.00 80.67 N ATOM 648 CZ ARG A 529 31.982 -12.909 -12.810 1.00 76.64 C ATOM 649 NH1 ARG A 529 32.670 -13.945 -12.334 1.00 87.24 N ATOM 650 NH2 ARG A 529 30.669 -12.850 -12.602 1.00 62.85 N ATOM 651 HE ARG A 529 33.635 -12.072 -13.655 1.00 0.00 H ATOM 652 HH12 ARG A 529 32.182 -14.692 -11.799 1.00 0.00 H ATOM 653 HH11 ARG A 529 33.695 -14.008 -12.497 1.00 0.00 H ATOM 654 HH22 ARG A 529 30.193 -13.603 -12.065 1.00 0.00 H ATOM 655 HH21 ARG A 529 30.119 -12.051 -12.976 1.00 0.00 H ATOM 656 H ARG A 529 34.830 -7.213 -11.717 1.00 0.00 H ATOM 657 N HIS A 530 32.498 -10.113 -9.536 1.00 33.30 N ATOM 658 CA HIS A 530 32.774 -11.316 -8.771 1.00 30.06 C ATOM 659 C HIS A 530 31.531 -12.188 -8.742 1.00 30.92 C ATOM 660 O HIS A 530 30.416 -11.674 -8.735 1.00 34.41 O ATOM 661 CB HIS A 530 33.235 -10.983 -7.342 1.00 33.03 C ATOM 662 CG HIS A 530 33.768 -12.161 -6.583 1.00 34.44 C ATOM 663 ND1 HIS A 530 32.967 -12.985 -5.811 1.00 34.31 N ATOM 664 CD2 HIS A 530 35.046 -12.581 -6.377 1.00 32.54 C ATOM 665 CE1 HIS A 530 33.720 -13.908 -5.236 1.00 37.06 C ATOM 666 NE2 HIS A 530 34.985 -13.694 -5.575 1.00 31.66 N ATOM 667 H HIS A 530 31.519 -9.774 -9.622 1.00 0.00 H ATOM 668 N LYS A 531 31.747 -13.498 -8.698 1.00 32.81 N ATOM 669 CA LYS A 531 30.657 -14.487 -8.663 1.00 33.47 C ATOM 670 C LYS A 531 29.665 -14.227 -7.525 1.00 34.95 C ATOM 671 O LYS A 531 28.451 -14.463 -7.687 1.00 35.16 O ATOM 672 CB LYS A 531 31.208 -15.895 -8.496 1.00 34.48 C ATOM 673 H LYS A 531 32.729 -13.840 -8.688 1.00 0.00 H ATOM 674 N ASN A 532 30.162 -13.701 -6.402 1.00 29.53 N ATOM 675 CA ASN A 532 29.347 -13.596 -5.178 1.00 28.63 C ATOM 676 C ASN A 532 28.866 -12.211 -4.781 1.00 29.59 C ATOM 677 O ASN A 532 28.542 -11.951 -3.614 1.00 34.12 O ATOM 678 CB ASN A 532 30.073 -14.290 -4.051 1.00 28.91 C ATOM 679 CG ASN A 532 30.251 -15.762 -4.328 1.00 35.27 C ATOM 680 OD1 ASN A 532 31.364 -16.287 -4.303 1.00 33.94 O ATOM 681 ND2 ASN A 532 29.148 -16.438 -4.608 1.00 30.40 N ATOM 682 HD22 ASN A 532 28.229 -15.952 -4.618 1.00 0.00 H ATOM 683 HD21 ASN A 532 29.201 -17.455 -4.819 1.00 0.00 H ATOM 684 H ASN A 532 31.144 -13.359 -6.391 1.00 0.00 H ATOM 685 N ILE A 533 28.795 -11.323 -5.771 1.00 29.05 N ATOM 686 CA ILE A 533 28.173 -10.029 -5.651 1.00 29.34 C ATOM 687 C ILE A 533 27.212 -9.847 -6.809 1.00 29.25 C ATOM 688 O ILE A 533 27.339 -10.525 -7.819 1.00 32.00 O ATOM 689 CB ILE A 533 29.229 -8.888 -5.591 1.00 30.60 C ATOM 690 CG1 ILE A 533 29.939 -8.663 -6.928 1.00 32.44 C ATOM 691 CG2 ILE A 533 30.295 -9.219 -4.548 1.00 32.14 C ATOM 692 CD1 ILE A 533 30.965 -7.514 -6.882 1.00 33.92 C ATOM 693 H ILE A 533 29.215 -11.580 -6.687 1.00 0.00 H ATOM 694 N ILE A 534 26.242 -8.956 -6.627 1.00 28.86 N ATOM 695 CA ILE A 534 25.321 -8.544 -7.682 1.00 32.17 C ATOM 696 C ILE A 534 26.092 -7.623 -8.628 1.00 34.25 C ATOM 697 O ILE A 534 26.526 -6.558 -8.227 1.00 34.34 O ATOM 698 CB ILE A 534 24.102 -7.780 -7.079 1.00 33.94 C ATOM 699 CG1 ILE A 534 23.188 -8.725 -6.292 1.00 29.81 C ATOM 700 CG2 ILE A 534 23.309 -7.043 -8.150 1.00 33.65 C ATOM 701 CD1 ILE A 534 22.477 -9.736 -7.183 1.00 29.29 C ATOM 702 H ILE A 534 26.134 -8.531 -5.684 1.00 0.00 H ATOM 703 N ASN A 535 26.340 -8.075 -9.847 1.00 31.93 N ATOM 704 CA ASN A 535 27.258 -7.350 -10.729 1.00 35.48 C ATOM 705 C ASN A 535 26.543 -6.317 -11.589 1.00 33.72 C ATOM 706 O ASN A 535 25.363 -6.484 -11.932 1.00 33.23 O ATOM 707 CB ASN A 535 28.023 -8.340 -11.603 1.00 33.76 C ATOM 708 CG ASN A 535 28.991 -9.143 -10.806 1.00 33.78 C ATOM 709 OD1 ASN A 535 29.936 -8.583 -10.211 1.00 35.44 O ATOM 710 ND2 ASN A 535 28.767 -10.459 -10.734 1.00 34.13 N ATOM 711 HD22 ASN A 535 27.966 -10.879 -11.248 1.00 0.00 H ATOM 712 HD21 ASN A 535 29.393 -11.063 -10.164 1.00 0.00 H ATOM 713 H ASN A 535 25.882 -8.947 -10.180 1.00 0.00 H ATOM 714 N LEU A 536 27.248 -5.224 -11.875 1.00 31.06 N ATOM 715 CA LEU A 536 26.845 -4.250 -12.886 1.00 33.09 C ATOM 716 C LEU A 536 26.923 -4.884 -14.255 1.00 32.84 C ATOM 717 O LEU A 536 27.893 -5.563 -14.565 1.00 31.10 O ATOM 718 CB LEU A 536 27.766 -3.043 -12.853 1.00 31.77 C ATOM 719 CG LEU A 536 27.439 -1.893 -13.774 1.00 33.41 C ATOM 720 CD1 LEU A 536 26.082 -1.279 -13.456 1.00 31.33 C ATOM 721 CD2 LEU A 536 28.553 -0.820 -13.735 1.00 33.94 C ATOM 722 H LEU A 536 28.131 -5.055 -11.352 1.00 0.00 H ATOM 723 N LEU A 537 25.898 -4.680 -15.065 1.00 29.64 N ATOM 724 CA LEU A 537 25.868 -5.270 -16.417 1.00 36.44 C ATOM 725 C LEU A 537 25.936 -4.249 -17.521 1.00 35.37 C ATOM 726 O LEU A 537 26.360 -4.561 -18.635 1.00 36.37 O ATOM 727 CB LEU A 537 24.587 -6.113 -16.619 1.00 39.34 C ATOM 728 CG LEU A 537 24.487 -7.341 -15.730 1.00 38.74 C ATOM 729 CD1 LEU A 537 23.123 -7.994 -15.883 1.00 40.05 C ATOM 730 CD2 LEU A 537 25.603 -8.342 -16.056 1.00 38.28 C ATOM 731 H LEU A 537 25.101 -4.095 -14.744 1.00 0.00 H ATOM 732 N GLY A 538 25.441 -3.058 -17.256 1.00 36.11 N ATOM 733 CA GLY A 538 25.352 -2.052 -18.297 1.00 33.19 C ATOM 734 C GLY A 538 24.717 -0.807 -17.754 1.00 37.17 C ATOM 735 O GLY A 538 24.142 -0.817 -16.656 1.00 37.43 O ATOM 736 H GLY A 538 25.112 -2.837 -16.294 1.00 0.00 H ATOM 737 N VAL A 539 24.806 0.286 -18.512 1.00 36.36 N ATOM 738 CA VAL A 539 24.131 1.525 -18.133 1.00 36.43 C ATOM 739 C VAL A 539 23.456 2.122 -19.360 1.00 34.94 C ATOM 740 O VAL A 539 23.879 1.868 -20.468 1.00 38.38 O ATOM 741 CB VAL A 539 25.108 2.556 -17.507 1.00 38.95 C ATOM 742 CG1 VAL A 539 25.801 1.963 -16.274 1.00 36.85 C ATOM 743 CG2 VAL A 539 26.141 2.995 -18.525 1.00 41.29 C ATOM 744 H VAL A 539 25.366 0.256 -19.388 1.00 0.00 H ATOM 745 N CYS A 540 22.438 2.946 -19.157 1.00 41.63 N ATOM 746 CA CYS A 540 21.932 3.813 -20.234 1.00 39.12 C ATOM 747 C CYS A 540 22.022 5.217 -19.725 1.00 42.34 C ATOM 748 O CYS A 540 21.363 5.538 -18.747 1.00 46.04 O ATOM 749 CB CYS A 540 20.484 3.499 -20.576 1.00 41.26 C ATOM 750 SG CYS A 540 20.229 1.808 -21.115 1.00 47.77 S ATOM 751 H CYS A 540 21.988 2.981 -18.220 1.00 0.00 H ATOM 752 N THR A 541 22.851 6.038 -20.377 1.00 41.37 N ATOM 753 CA THR A 541 23.159 7.385 -19.917 1.00 43.80 C ATOM 754 C THR A 541 22.766 8.514 -20.884 1.00 46.08 C ATOM 755 O THR A 541 22.723 9.676 -20.486 1.00 50.89 O ATOM 756 CB THR A 541 24.669 7.521 -19.640 1.00 44.83 C ATOM 757 OG1 THR A 541 25.401 7.349 -20.852 1.00 46.88 O ATOM 758 CG2 THR A 541 25.117 6.488 -18.644 1.00 44.10 C ATOM 759 HG1 THR A 541 25.216 6.450 -21.223 1.00 0.00 H ATOM 760 H THR A 541 23.297 5.699 -21.253 1.00 0.00 H ATOM 761 N GLN A 542 22.531 8.172 -22.146 1.00 47.14 N ATOM 762 CA GLN A 542 22.432 9.146 -23.223 1.00 57.28 C ATOM 763 C GLN A 542 20.973 9.275 -23.643 1.00 55.58 C ATOM 764 O GLN A 542 20.272 8.273 -23.748 1.00 57.69 O ATOM 765 CB GLN A 542 23.293 8.698 -24.414 1.00 58.95 C ATOM 766 CG GLN A 542 24.757 8.416 -24.079 1.00 64.96 C ATOM 767 CD GLN A 542 25.483 9.620 -23.498 1.00 68.81 C ATOM 768 OE1 GLN A 542 25.610 10.655 -24.154 1.00 69.04 O ATOM 769 NE2 GLN A 542 25.975 9.488 -22.269 1.00 65.97 N ATOM 770 HE22 GLN A 542 25.845 8.596 -21.750 1.00 0.00 H ATOM 771 HE21 GLN A 542 26.489 10.277 -21.827 1.00 0.00 H ATOM 772 H GLN A 542 22.413 7.164 -22.374 1.00 0.00 H ATOM 773 N GLU A 543 20.518 10.512 -23.841 1.00 62.28 N ATOM 774 CA GLU A 543 19.232 10.786 -24.497 1.00 56.56 C ATOM 775 C GLU A 543 18.102 10.045 -23.794 1.00 60.63 C ATOM 776 O GLU A 543 17.452 9.170 -24.372 1.00 72.53 O ATOM 777 CB GLU A 543 19.290 10.432 -25.997 1.00 56.59 C ATOM 778 H GLU A 543 21.096 11.315 -23.519 1.00 0.00 H ATOM 779 N GLY A 544 17.906 10.367 -22.521 1.00 57.76 N ATOM 780 CA GLY A 544 16.874 9.724 -21.723 1.00 57.16 C ATOM 781 C GLY A 544 17.361 9.552 -20.307 1.00 56.69 C ATOM 782 O GLY A 544 18.458 9.975 -19.981 1.00 54.16 O ATOM 783 H GLY A 544 18.505 11.096 -22.084 1.00 0.00 H ATOM 784 N PRO A 545 16.542 8.936 -19.450 1.00 52.22 N ATOM 785 CA PRO A 545 16.914 8.887 -18.038 1.00 58.45 C ATOM 786 C PRO A 545 18.025 7.861 -17.747 1.00 47.42 C ATOM 787 O PRO A 545 18.216 6.902 -18.512 1.00 49.95 O ATOM 788 CB PRO A 545 15.598 8.520 -17.327 1.00 56.49 C ATOM 789 CG PRO A 545 14.712 7.935 -18.370 1.00 53.41 C ATOM 790 CD PRO A 545 15.211 8.362 -19.716 1.00 57.56 C ATOM 791 N LEU A 546 18.746 8.099 -16.657 1.00 42.31 N ATOM 792 CA LEU A 546 19.791 7.207 -16.176 1.00 47.37 C ATOM 793 C LEU A 546 19.210 5.864 -15.759 1.00 45.04 C ATOM 794 O LEU A 546 18.355 5.796 -14.859 1.00 43.42 O ATOM 795 CB LEU A 546 20.523 7.836 -14.984 1.00 45.30 C ATOM 796 CG LEU A 546 21.725 7.058 -14.414 1.00 44.12 C ATOM 797 CD1 LEU A 546 22.698 6.657 -15.497 1.00 45.50 C ATOM 798 CD2 LEU A 546 22.456 7.861 -13.336 1.00 44.31 C ATOM 799 H LEU A 546 18.554 8.968 -16.119 1.00 0.00 H ATOM 800 N TYR A 547 19.667 4.810 -16.432 1.00 41.29 N ATOM 801 CA TYR A 547 19.380 3.434 -16.028 1.00 43.08 C ATOM 802 C TYR A 547 20.686 2.768 -15.624 1.00 43.26 C ATOM 803 O TYR A 547 21.652 2.803 -16.367 1.00 35.62 O ATOM 804 CB TYR A 547 18.775 2.633 -17.183 1.00 46.34 C ATOM 805 CG TYR A 547 17.388 3.060 -17.662 1.00 50.02 C ATOM 806 CD1 TYR A 547 16.577 3.932 -16.920 1.00 50.59 C ATOM 807 CD2 TYR A 547 16.870 2.536 -18.847 1.00 50.78 C ATOM 808 CE1 TYR A 547 15.312 4.286 -17.369 1.00 47.08 C ATOM 809 CE2 TYR A 547 15.611 2.868 -19.293 1.00 44.46 C ATOM 810 CZ TYR A 547 14.842 3.743 -18.558 1.00 51.67 C ATOM 811 OH TYR A 547 13.603 4.075 -19.035 1.00 63.22 O ATOM 812 HH TYR A 547 13.168 4.706 -18.409 1.00 0.00 H ATOM 813 H TYR A 547 20.251 4.971 -17.278 1.00 0.00 H ATOM 814 N VAL A 548 20.696 2.141 -14.457 1.00 38.36 N ATOM 815 CA VAL A 548 21.812 1.304 -14.042 1.00 37.06 C ATOM 816 C VAL A 548 21.327 -0.131 -14.002 1.00 38.20 C ATOM 817 O VAL A 548 20.454 -0.455 -13.209 1.00 39.27 O ATOM 818 CB VAL A 548 22.307 1.745 -12.663 1.00 37.26 C ATOM 819 CG1 VAL A 548 23.491 0.905 -12.225 1.00 40.05 C ATOM 820 CG2 VAL A 548 22.637 3.222 -12.697 1.00 36.98 C ATOM 821 H VAL A 548 19.882 2.250 -13.819 1.00 0.00 H ATOM 822 N ILE A 549 21.956 -0.996 -14.798 1.00 34.06 N ATOM 823 CA ILE A 549 21.466 -2.347 -15.034 1.00 37.24 C ATOM 824 C ILE A 549 22.345 -3.363 -14.317 1.00 37.39 C ATOM 825 O ILE A 549 23.557 -3.421 -14.559 1.00 33.72 O ATOM 826 CB ILE A 549 21.486 -2.695 -16.539 1.00 40.08 C ATOM 827 CG1 ILE A 549 20.853 -1.573 -17.361 1.00 42.08 C ATOM 828 CG2 ILE A 549 20.800 -4.034 -16.781 1.00 39.15 C ATOM 829 CD1 ILE A 549 21.152 -1.654 -18.841 1.00 45.26 C ATOM 830 H ILE A 549 22.832 -0.694 -15.270 1.00 0.00 H ATOM 831 N VAL A 550 21.720 -4.213 -13.498 1.00 33.03 N ATOM 832 CA VAL A 550 22.443 -5.208 -12.717 1.00 35.59 C ATOM 833 C VAL A 550 21.829 -6.595 -12.853 1.00 35.29 C ATOM 834 O VAL A 550 20.734 -6.760 -13.399 1.00 37.25 O ATOM 835 CB VAL A 550 22.548 -4.789 -11.227 1.00 38.76 C ATOM 836 CG1 VAL A 550 23.101 -3.367 -11.099 1.00 35.33 C ATOM 837 CG2 VAL A 550 21.202 -4.870 -10.522 1.00 34.92 C ATOM 838 H VAL A 550 20.685 -4.163 -13.415 1.00 0.00 H ATOM 839 N GLU A 551 22.557 -7.595 -12.381 1.00 33.54 N ATOM 840 CA GLU A 551 22.066 -8.964 -12.344 1.00 36.01 C ATOM 841 C GLU A 551 20.774 -9.058 -11.545 1.00 37.05 C ATOM 842 O GLU A 551 20.656 -8.439 -10.503 1.00 39.43 O ATOM 843 CB GLU A 551 23.107 -9.888 -11.737 1.00 38.81 C ATOM 844 CG GLU A 551 24.207 -10.278 -12.718 1.00 40.93 C ATOM 845 CD GLU A 551 25.419 -10.906 -12.037 1.00 43.18 C ATOM 846 OE1 GLU A 551 25.696 -10.647 -10.828 1.00 39.77 O ATOM 847 OE2 GLU A 551 26.116 -11.660 -12.726 1.00 47.04 O ATOM 848 H GLU A 551 23.513 -7.395 -12.024 1.00 0.00 H ATOM 849 N CYS A 552 19.842 -9.889 -12.005 1.00 36.55 N ATOM 850 CA CYS A 552 18.572 -10.101 -11.287 1.00 40.51 C ATOM 851 C CYS A 552 18.542 -11.495 -10.698 1.00 37.59 C ATOM 852 O CYS A 552 18.649 -12.453 -11.427 1.00 41.94 O ATOM 853 CB CYS A 552 17.388 -9.954 -12.234 1.00 44.48 C ATOM 854 SG CYS A 552 15.788 -9.885 -11.363 1.00 48.34 S ATOM 855 H CYS A 552 20.014 -10.402 -12.893 1.00 0.00 H ATOM 856 N ALA A 553 18.520 -11.632 -9.376 1.00 35.46 N ATOM 857 CA ALA A 553 18.667 -12.961 -8.787 1.00 36.10 C ATOM 858 C ALA A 553 17.253 -13.546 -8.660 1.00 40.04 C ATOM 859 O ALA A 553 16.401 -12.955 -7.990 1.00 37.77 O ATOM 860 CB ALA A 553 19.327 -12.872 -7.417 1.00 39.74 C ATOM 861 H ALA A 553 18.399 -10.799 -8.765 1.00 0.00 H ATOM 862 N ALA A 554 17.048 -14.728 -9.229 1.00 45.23 N ATOM 863 CA ALA A 554 15.705 -15.275 -9.456 1.00 50.65 C ATOM 864 C ALA A 554 15.012 -15.587 -8.136 1.00 48.40 C ATOM 865 O ALA A 554 13.825 -15.358 -8.003 1.00 55.31 O ATOM 866 CB ALA A 554 15.784 -16.538 -10.315 1.00 51.59 C ATOM 867 H ALA A 554 17.872 -15.289 -9.526 1.00 0.00 H ATOM 868 N LYS A 555 15.761 -16.059 -7.148 1.00 43.73 N ATOM 869 CA LYS A 555 15.152 -16.533 -5.910 1.00 41.92 C ATOM 870 C LYS A 555 15.085 -15.562 -4.752 1.00 40.95 C ATOM 871 O LYS A 555 14.840 -15.981 -3.632 1.00 40.63 O ATOM 872 CB LYS A 555 15.818 -17.821 -5.494 1.00 45.03 C ATOM 873 CG LYS A 555 15.676 -18.876 -6.581 1.00 45.24 C ATOM 874 CD LYS A 555 16.159 -20.200 -6.072 1.00 48.64 C ATOM 875 CE LYS A 555 15.956 -21.320 -7.072 1.00 50.65 C ATOM 876 NZ LYS A 555 16.614 -22.524 -6.499 1.00 53.37 N ATOM 877 HZ1 LYS A 555 17.626 -22.330 -6.358 1.00 0.00 H ATOM 878 HZ2 LYS A 555 16.174 -22.757 -5.586 1.00 0.00 H ATOM 879 HZ3 LYS A 555 16.501 -23.324 -7.154 1.00 0.00 H ATOM 880 H LYS A 555 16.795 -16.091 -7.257 1.00 0.00 H ATOM 881 N GLY A 556 15.245 -14.263 -5.017 1.00 41.40 N ATOM 882 CA GLY A 556 15.068 -13.242 -3.995 1.00 41.48 C ATOM 883 C GLY A 556 16.182 -13.213 -2.962 1.00 41.42 C ATOM 884 O GLY A 556 17.299 -13.670 -3.234 1.00 42.60 O ATOM 885 H GLY A 556 15.504 -13.973 -5.982 1.00 0.00 H ATOM 886 N ASN A 557 15.883 -12.655 -1.792 1.00 33.71 N ATOM 887 CA ASN A 557 16.864 -12.523 -0.740 1.00 32.98 C ATOM 888 C ASN A 557 16.988 -13.767 0.115 1.00 38.11 C ATOM 889 O ASN A 557 16.105 -14.639 0.139 1.00 35.93 O ATOM 890 CB ASN A 557 16.694 -11.219 0.046 1.00 36.88 C ATOM 891 CG ASN A 557 15.640 -11.287 1.149 1.00 42.14 C ATOM 892 OD1 ASN A 557 15.578 -12.230 1.934 1.00 41.19 O ATOM 893 ND2 ASN A 557 14.891 -10.205 1.288 1.00 40.15 N ATOM 894 HD22 ASN A 557 14.971 -9.426 0.604 1.00 0.00 H ATOM 895 HD21 ASN A 557 14.223 -10.134 2.082 1.00 0.00 H ATOM 896 H ASN A 557 14.917 -12.304 -1.630 1.00 0.00 H ATOM 897 N LEU A 558 18.120 -13.863 0.778 1.00 32.97 N ATOM 898 CA LEU A 558 18.516 -15.073 1.454 1.00 37.63 C ATOM 899 C LEU A 558 17.624 -15.349 2.674 1.00 37.54 C ATOM 900 O LEU A 558 17.364 -16.498 2.994 1.00 40.32 O ATOM 901 CB LEU A 558 19.983 -15.008 1.870 1.00 33.60 C ATOM 902 CG LEU A 558 20.538 -16.206 2.657 1.00 35.07 C ATOM 903 CD1 LEU A 558 20.454 -17.481 1.866 1.00 37.45 C ATOM 904 CD2 LEU A 558 21.966 -15.924 3.062 1.00 37.23 C ATOM 905 H LEU A 558 18.751 -13.037 0.816 1.00 0.00 H ATOM 906 N ARG A 559 17.183 -14.313 3.362 1.00 38.43 N ATOM 907 CA ARG A 559 16.273 -14.538 4.505 1.00 38.65 C ATOM 908 C ARG A 559 14.970 -15.202 4.025 1.00 40.55 C ATOM 909 O ARG A 559 14.569 -16.232 4.564 1.00 41.73 O ATOM 910 CB ARG A 559 15.985 -13.229 5.201 1.00 42.90 C ATOM 911 CG ARG A 559 14.919 -13.281 6.282 1.00 49.01 C ATOM 912 CD ARG A 559 14.731 -11.898 6.855 1.00 52.39 C ATOM 913 NE ARG A 559 13.925 -11.958 8.051 1.00 64.61 N ATOM 914 CZ ARG A 559 12.601 -12.022 8.056 1.00 78.54 C ATOM 915 NH1 ARG A 559 11.959 -12.121 9.214 1.00 77.36 N ATOM 916 NH2 ARG A 559 11.922 -12.001 6.913 1.00 80.77 N ATOM 917 HE ARG A 559 14.415 -11.951 8.968 1.00 0.00 H ATOM 918 HH12 ARG A 559 10.920 -12.172 9.230 1.00 0.00 H ATOM 919 HH11 ARG A 559 12.495 -12.148 10.105 1.00 0.00 H ATOM 920 HH22 ARG A 559 10.883 -12.052 6.924 1.00 0.00 H ATOM 921 HH21 ARG A 559 12.430 -11.934 6.008 1.00 0.00 H ATOM 922 H ARG A 559 17.473 -13.348 3.103 1.00 0.00 H ATOM 923 N GLU A 560 14.360 -14.651 2.980 1.00 41.57 N ATOM 924 CA GLU A 560 13.130 -15.226 2.432 1.00 47.21 C ATOM 925 C GLU A 560 13.360 -16.592 1.820 1.00 51.65 C ATOM 926 O GLU A 560 12.518 -17.477 1.951 1.00 44.71 O ATOM 927 CB GLU A 560 12.473 -14.304 1.414 1.00 50.27 C ATOM 928 CG GLU A 560 11.975 -12.978 1.989 1.00 60.35 C ATOM 929 CD GLU A 560 11.141 -13.122 3.263 1.00 67.54 C ATOM 930 OE1 GLU A 560 10.261 -14.010 3.301 1.00 64.20 O ATOM 931 OE2 GLU A 560 11.364 -12.335 4.223 1.00 63.53 O ATOM 932 H GLU A 560 14.763 -13.797 2.544 1.00 0.00 H ATOM 933 N PHE A 561 14.494 -16.769 1.144 1.00 42.20 N ATOM 934 CA PHE A 561 14.842 -18.066 0.590 1.00 42.00 C ATOM 935 C PHE A 561 14.942 -19.135 1.698 1.00 41.50 C ATOM 936 O PHE A 561 14.428 -20.243 1.537 1.00 45.92 O ATOM 937 CB PHE A 561 16.148 -17.981 -0.208 1.00 41.63 C ATOM 938 CG PHE A 561 16.737 -19.315 -0.557 1.00 36.53 C ATOM 939 CD1 PHE A 561 17.609 -19.948 0.315 1.00 42.49 C ATOM 940 CD2 PHE A 561 16.487 -19.890 -1.787 1.00 41.45 C ATOM 941 CE1 PHE A 561 18.225 -21.140 -0.033 1.00 41.76 C ATOM 942 CE2 PHE A 561 17.055 -21.105 -2.122 1.00 38.71 C ATOM 943 CZ PHE A 561 17.934 -21.722 -1.248 1.00 41.50 C ATOM 944 H PHE A 561 15.141 -15.966 1.011 1.00 0.00 H ATOM 945 N LEU A 562 15.516 -18.768 2.838 1.00 37.85 N ATOM 946 CA LEU A 562 15.638 -19.680 3.957 1.00 41.48 C ATOM 947 C LEU A 562 14.283 -19.945 4.609 1.00 46.71 C ATOM 948 O LEU A 562 13.942 -21.098 4.869 1.00 45.69 O ATOM 949 CB LEU A 562 16.601 -19.146 5.003 1.00 43.90 C ATOM 950 CG LEU A 562 18.088 -19.062 4.563 1.00 49.23 C ATOM 951 CD1 LEU A 562 18.885 -18.295 5.597 1.00 39.65 C ATOM 952 CD2 LEU A 562 18.708 -20.429 4.328 1.00 46.65 C ATOM 953 H LEU A 562 15.887 -17.801 2.930 1.00 0.00 H ATOM 954 N ARG A 563 13.530 -18.882 4.873 1.00 41.62 N ATOM 955 CA ARG A 563 12.244 -18.999 5.583 1.00 45.66 C ATOM 956 C ARG A 563 11.240 -19.848 4.796 1.00 42.81 C ATOM 957 O ARG A 563 10.598 -20.726 5.366 1.00 59.83 O ATOM 958 CB ARG A 563 11.683 -17.622 5.915 1.00 44.53 C ATOM 959 CG ARG A 563 12.455 -16.945 7.033 1.00 44.32 C ATOM 960 CD ARG A 563 11.986 -15.520 7.298 1.00 53.27 C ATOM 961 NE ARG A 563 10.728 -15.525 8.015 1.00 59.16 N ATOM 962 CZ ARG A 563 10.592 -15.853 9.297 1.00 68.46 C ATOM 963 NH1 ARG A 563 11.647 -16.165 10.041 1.00 68.18 N ATOM 964 NH2 ARG A 563 9.383 -15.886 9.841 1.00 68.31 N ATOM 965 HE ARG A 563 9.871 -15.253 7.491 1.00 0.00 H ATOM 966 HH12 ARG A 563 11.521 -16.419 11.042 1.00 0.00 H ATOM 967 HH11 ARG A 563 12.599 -16.155 9.623 1.00 0.00 H ATOM 968 HH22 ARG A 563 9.270 -16.142 10.843 1.00 0.00 H ATOM 969 HH21 ARG A 563 8.548 -15.656 9.266 1.00 0.00 H ATOM 970 H ARG A 563 13.857 -17.942 4.570 1.00 0.00 H ATOM 971 N ALA A 564 11.238 -19.706 3.477 1.00 45.48 N ATOM 972 CA ALA A 564 10.348 -20.480 2.616 1.00 46.45 C ATOM 973 C ALA A 564 10.758 -21.939 2.543 1.00 50.62 C ATOM 974 O ALA A 564 9.963 -22.785 2.159 1.00 44.38 O ATOM 975 CB ALA A 564 10.277 -19.885 1.224 1.00 44.95 C ATOM 976 H ALA A 564 11.890 -19.022 3.043 1.00 0.00 H ATOM 977 N ARG A 565 11.985 -22.256 2.928 1.00 50.21 N ATOM 978 CA ARG A 565 12.419 -23.640 2.919 1.00 50.89 C ATOM 979 C ARG A 565 12.437 -24.257 4.319 1.00 42.52 C ATOM 980 O ARG A 565 13.004 -25.329 4.511 1.00 45.35 O ATOM 981 CB ARG A 565 13.773 -23.765 2.199 1.00 51.86 C ATOM 982 CG ARG A 565 13.606 -23.737 0.676 1.00 54.78 C ATOM 983 CD ARG A 565 14.815 -23.196 -0.096 1.00 48.01 C ATOM 984 NE ARG A 565 14.478 -22.940 -1.505 1.00 41.33 N ATOM 985 CZ ARG A 565 13.823 -21.874 -1.968 1.00 43.12 C ATOM 986 NH1 ARG A 565 13.517 -20.854 -1.178 1.00 42.46 N ATOM 987 NH2 ARG A 565 13.544 -21.785 -3.266 1.00 47.41 N ATOM 988 HE ARG A 565 14.777 -23.653 -2.201 1.00 0.00 H ATOM 989 HH12 ARG A 565 13.006 -20.034 -1.562 1.00 0.00 H ATOM 990 HH11 ARG A 565 13.788 -20.874 -0.174 1.00 0.00 H ATOM 991 HH22 ARG A 565 13.034 -20.956 -3.633 1.00 0.00 H ATOM 992 HH21 ARG A 565 13.836 -22.544 -3.914 1.00 0.00 H ATOM 993 H ARG A 565 12.640 -21.510 3.238 1.00 0.00 H ATOM 994 N ARG A 566 11.831 -23.578 5.289 1.00 42.69 N ATOM 995 CA ARG A 566 11.584 -24.169 6.599 1.00 45.60 C ATOM 996 C ARG A 566 10.669 -25.383 6.490 1.00 49.80 C ATOM 997 O ARG A 566 9.580 -25.288 5.929 1.00 52.63 O ATOM 998 CB ARG A 566 10.972 -23.162 7.541 1.00 51.59 C ATOM 999 CG ARG A 566 11.998 -22.131 7.971 1.00 50.44 C ATOM 1000 CD ARG A 566 11.392 -21.043 8.813 1.00 50.32 C ATOM 1001 NE ARG A 566 12.453 -20.379 9.553 1.00 48.04 N ATOM 1002 CZ ARG A 566 12.276 -19.441 10.469 1.00 54.70 C ATOM 1003 NH1 ARG A 566 11.062 -19.053 10.810 1.00 57.86 N ATOM 1004 NH2 ARG A 566 13.332 -18.917 11.082 1.00 56.24 N ATOM 1005 HE ARG A 566 13.431 -20.665 9.345 1.00 0.00 H ATOM 1006 HH12 ARG A 566 10.935 -18.315 11.531 1.00 0.00 H ATOM 1007 HH11 ARG A 566 10.232 -19.485 10.357 1.00 0.00 H ATOM 1008 HH22 ARG A 566 13.202 -18.179 11.803 1.00 0.00 H ATOM 1009 HH21 ARG A 566 14.289 -19.245 10.841 1.00 0.00 H ATOM 1010 H ARG A 566 11.525 -22.600 5.108 1.00 0.00 H ATOM 1011 N PRO A 567 11.145 -26.542 6.951 1.00 49.51 N ATOM 1012 CA PRO A 567 10.304 -27.726 6.878 1.00 57.69 C ATOM 1013 C PRO A 567 9.229 -27.672 7.966 1.00 54.48 C ATOM 1014 O PRO A 567 9.470 -27.074 9.000 1.00 50.62 O ATOM 1015 CB PRO A 567 11.287 -28.862 7.170 1.00 51.43 C ATOM 1016 CG PRO A 567 12.298 -28.251 8.085 1.00 57.72 C ATOM 1017 CD PRO A 567 12.360 -26.778 7.752 1.00 52.46 C ATOM 1018 N PRO A 568 8.076 -28.332 7.756 1.00 55.76 N ATOM 1019 CA PRO A 568 7.112 -28.432 8.860 1.00 53.70 C ATOM 1020 C PRO A 568 7.723 -29.006 10.157 1.00 56.10 C ATOM 1021 O PRO A 568 8.361 -30.077 10.141 1.00 55.08 O ATOM 1022 CB PRO A 568 6.025 -29.361 8.304 1.00 56.34 C ATOM 1023 CG PRO A 568 6.607 -29.989 7.071 1.00 68.53 C ATOM 1024 CD PRO A 568 7.600 -29.004 6.534 1.00 60.54 C ATOM 1025 N GLY A 569 7.565 -28.269 11.257 1.00 64.32 N ATOM 1026 CA GLY A 569 7.857 -28.769 12.607 1.00 56.95 C ATOM 1027 C GLY A 569 9.235 -29.376 12.773 1.00 62.03 C ATOM 1028 O GLY A 569 10.233 -28.738 12.465 1.00 75.48 O ATOM 1029 H GLY A 569 7.219 -27.294 11.154 1.00 0.00 H ATOM 1030 N SER A 570 9.281 -30.617 13.245 1.00 65.06 N ATOM 1031 CA SER A 570 10.536 -31.343 13.482 1.00 63.28 C ATOM 1032 C SER A 570 11.072 -32.075 12.256 1.00 55.51 C ATOM 1033 O SER A 570 12.067 -32.774 12.376 1.00 64.10 O ATOM 1034 CB SER A 570 10.341 -32.373 14.614 1.00 69.22 C ATOM 1035 H SER A 570 8.384 -31.098 13.457 1.00 0.00 H ATOM 1036 N SER A 571 10.444 -31.932 11.083 1.00 48.92 N ATOM 1037 CA SER A 571 10.802 -32.772 9.917 1.00 55.61 C ATOM 1038 C SER A 571 12.057 -32.248 9.168 1.00 62.09 C ATOM 1039 O SER A 571 12.463 -31.104 9.361 1.00 59.01 O ATOM 1040 CB SER A 571 9.595 -32.916 8.954 1.00 48.75 C ATOM 1041 OG SER A 571 9.314 -31.712 8.249 1.00 52.50 O ATOM 1042 HG SER A 571 9.104 -30.993 8.897 1.00 0.00 H ATOM 1043 H SER A 571 9.692 -31.219 10.989 1.00 0.00 H ATOM 1044 N GLU A 572 12.652 -33.087 8.317 1.00 60.34 N ATOM 1045 CA GLU A 572 13.804 -32.684 7.488 1.00 62.13 C ATOM 1046 C GLU A 572 13.351 -31.824 6.296 1.00 68.44 C ATOM 1047 O GLU A 572 12.380 -32.155 5.596 1.00 67.16 O ATOM 1048 CB GLU A 572 14.570 -33.916 6.979 1.00 54.39 C ATOM 1049 H GLU A 572 12.291 -34.059 8.236 1.00 0.00 H ATOM 1050 N GLY A 573 14.030 -30.696 6.100 1.00 67.43 N ATOM 1051 CA GLY A 573 13.771 -29.811 4.960 1.00 61.24 C ATOM 1052 C GLY A 573 14.805 -30.021 3.869 1.00 54.49 C ATOM 1053 O GLY A 573 15.808 -30.707 4.071 1.00 52.00 O ATOM 1054 H GLY A 573 14.771 -30.433 6.780 1.00 0.00 H ATOM 1055 N PRO A 574 14.589 -29.396 2.717 1.00 53.73 N ATOM 1056 CA PRO A 574 15.510 -29.603 1.618 1.00 62.36 C ATOM 1057 C PRO A 574 16.910 -28.991 1.809 1.00 60.44 C ATOM 1058 O PRO A 574 17.802 -29.327 1.042 1.00 76.74 O ATOM 1059 CB PRO A 574 14.774 -28.985 0.418 1.00 61.70 C ATOM 1060 CG PRO A 574 13.818 -28.008 0.991 1.00 57.55 C ATOM 1061 CD PRO A 574 13.482 -28.485 2.371 1.00 64.37 C ATOM 1062 N LEU A 575 17.120 -28.133 2.816 1.00 59.97 N ATOM 1063 CA LEU A 575 18.448 -27.524 3.048 1.00 54.71 C ATOM 1064 C LEU A 575 19.346 -28.339 3.972 1.00 46.36 C ATOM 1065 O LEU A 575 19.344 -28.153 5.181 1.00 47.68 O ATOM 1066 CB LEU A 575 18.326 -26.087 3.607 1.00 52.12 C ATOM 1067 CG LEU A 575 17.622 -25.095 2.673 1.00 54.12 C ATOM 1068 CD1 LEU A 575 17.553 -23.722 3.300 1.00 61.49 C ATOM 1069 CD2 LEU A 575 18.277 -25.021 1.306 1.00 58.92 C ATOM 1070 H LEU A 575 16.332 -27.890 3.449 1.00 0.00 H ATOM 1071 N SER A 576 20.227 -29.136 3.388 1.00 47.06 N ATOM 1072 CA SER A 576 21.217 -29.851 4.185 1.00 46.82 C ATOM 1073 C SER A 576 22.232 -28.896 4.825 1.00 51.00 C ATOM 1074 O SER A 576 22.411 -27.759 4.382 1.00 46.46 O ATOM 1075 CB SER A 576 21.957 -30.825 3.290 1.00 51.75 C ATOM 1076 OG SER A 576 22.644 -30.112 2.260 1.00 51.90 O ATOM 1077 HG SER A 576 23.293 -29.486 2.670 1.00 0.00 H ATOM 1078 H SER A 576 20.213 -29.253 2.355 1.00 0.00 H ATOM 1079 N PHE A 577 22.925 -29.413 5.831 1.00 39.16 N ATOM 1080 CA PHE A 577 24.061 -28.798 6.414 1.00 45.27 C ATOM 1081 C PHE A 577 25.063 -28.327 5.336 1.00 47.55 C ATOM 1082 O PHE A 577 25.436 -27.164 5.344 1.00 45.40 O ATOM 1083 CB PHE A 577 24.678 -29.747 7.447 1.00 40.62 C ATOM 1084 CG PHE A 577 25.913 -29.213 8.127 1.00 42.30 C ATOM 1085 CD1 PHE A 577 25.843 -28.124 8.978 1.00 43.09 C ATOM 1086 CD2 PHE A 577 27.155 -29.783 7.887 1.00 47.61 C ATOM 1087 CE1 PHE A 577 26.974 -27.647 9.605 1.00 46.06 C ATOM 1088 CE2 PHE A 577 28.299 -29.294 8.502 1.00 44.19 C ATOM 1089 CZ PHE A 577 28.203 -28.227 9.368 1.00 41.75 C ATOM 1090 H PHE A 577 22.615 -30.328 6.216 1.00 0.00 H ATOM 1091 N PRO A 578 25.464 -29.198 4.389 1.00 47.92 N ATOM 1092 CA PRO A 578 26.492 -28.709 3.468 1.00 46.46 C ATOM 1093 C PRO A 578 26.028 -27.546 2.603 1.00 40.07 C ATOM 1094 O PRO A 578 26.810 -26.636 2.326 1.00 42.66 O ATOM 1095 CB PRO A 578 26.821 -29.946 2.625 1.00 50.90 C ATOM 1096 CG PRO A 578 26.529 -31.081 3.545 1.00 51.76 C ATOM 1097 CD PRO A 578 25.273 -30.654 4.237 1.00 50.73 C ATOM 1098 N VAL A 579 24.743 -27.514 2.284 1.00 42.46 N ATOM 1099 CA VAL A 579 24.153 -26.378 1.573 1.00 44.89 C ATOM 1100 C VAL A 579 24.148 -25.086 2.397 1.00 45.52 C ATOM 1101 O VAL A 579 24.422 -24.010 1.862 1.00 40.64 O ATOM 1102 CB VAL A 579 22.720 -26.702 1.099 1.00 51.19 C ATOM 1103 CG1 VAL A 579 22.044 -25.483 0.508 1.00 51.76 C ATOM 1104 CG2 VAL A 579 22.759 -27.809 0.047 1.00 53.40 C ATOM 1105 H VAL A 579 24.137 -28.317 2.546 1.00 0.00 H ATOM 1106 N LEU A 580 23.820 -25.190 3.679 1.00 40.82 N ATOM 1107 CA LEU A 580 23.881 -24.041 4.594 1.00 42.50 C ATOM 1108 C LEU A 580 25.304 -23.449 4.716 1.00 41.71 C ATOM 1109 O LEU A 580 25.485 -22.239 4.672 1.00 43.18 O ATOM 1110 CB LEU A 580 23.354 -24.435 5.985 1.00 38.85 C ATOM 1111 CG LEU A 580 21.851 -24.812 5.941 1.00 44.86 C ATOM 1112 CD1 LEU A 580 21.309 -25.311 7.279 1.00 43.54 C ATOM 1113 CD2 LEU A 580 21.025 -23.646 5.402 1.00 41.17 C ATOM 1114 H LEU A 580 23.511 -26.112 4.047 1.00 0.00 H ATOM 1115 N VAL A 581 26.275 -24.315 4.961 1.00 34.26 N ATOM 1116 CA VAL A 581 27.657 -23.921 5.092 1.00 34.38 C ATOM 1117 C VAL A 581 28.122 -23.308 3.767 1.00 35.63 C ATOM 1118 O VAL A 581 28.782 -22.291 3.761 1.00 34.99 O ATOM 1119 CB VAL A 581 28.534 -25.110 5.482 1.00 35.92 C ATOM 1120 CG1 VAL A 581 29.991 -24.713 5.495 1.00 33.88 C ATOM 1121 CG2 VAL A 581 28.132 -25.638 6.864 1.00 41.93 C ATOM 1122 H VAL A 581 26.032 -25.321 5.063 1.00 0.00 H ATOM 1123 N SER A 582 27.641 -23.868 2.664 1.00 34.45 N ATOM 1124 CA SER A 582 27.984 -23.366 1.355 1.00 39.09 C ATOM 1125 C SER A 582 27.466 -21.946 1.149 1.00 34.56 C ATOM 1126 O SER A 582 28.203 -21.101 0.648 1.00 34.40 O ATOM 1127 CB SER A 582 27.517 -24.335 0.242 1.00 38.63 C ATOM 1128 OG SER A 582 27.536 -23.684 -1.005 1.00 42.42 O ATOM 1129 HG SER A 582 27.236 -24.312 -1.709 1.00 0.00 H ATOM 1130 H SER A 582 27.004 -24.686 2.745 1.00 0.00 H ATOM 1131 N CYS A 583 26.237 -21.669 1.580 1.00 34.55 N ATOM 1132 CA CYS A 583 25.719 -20.290 1.633 1.00 34.74 C ATOM 1133 C CYS A 583 26.629 -19.329 2.409 1.00 34.78 C ATOM 1134 O CYS A 583 26.960 -18.245 1.924 1.00 31.99 O ATOM 1135 CB CYS A 583 24.300 -20.228 2.247 1.00 41.82 C ATOM 1136 SG CYS A 583 23.028 -20.926 1.175 1.00 47.37 S ATOM 1137 H CYS A 583 25.623 -22.450 1.889 1.00 0.00 H ATOM 1138 N ALA A 584 27.059 -19.753 3.589 1.00 30.87 N ATOM 1139 CA ALA A 584 27.948 -18.942 4.403 1.00 34.56 C ATOM 1140 C ALA A 584 29.326 -18.724 3.705 1.00 34.58 C ATOM 1141 O ALA A 584 29.854 -17.615 3.705 1.00 32.31 O ATOM 1142 CB ALA A 584 28.133 -19.586 5.759 1.00 32.12 C ATOM 1143 H ALA A 584 26.754 -20.684 3.939 1.00 0.00 H ATOM 1144 N TYR A 585 29.915 -19.807 3.204 1.00 33.21 N ATOM 1145 CA TYR A 585 31.190 -19.753 2.470 1.00 33.61 C ATOM 1146 C TYR A 585 31.149 -18.741 1.297 1.00 33.25 C ATOM 1147 O TYR A 585 32.022 -17.848 1.163 1.00 30.66 O ATOM 1148 CB TYR A 585 31.515 -21.162 1.926 1.00 33.99 C ATOM 1149 CG TYR A 585 32.737 -21.195 1.053 1.00 32.73 C ATOM 1150 CD1 TYR A 585 33.990 -21.309 1.617 1.00 34.30 C ATOM 1151 CD2 TYR A 585 32.632 -21.126 -0.339 1.00 32.15 C ATOM 1152 CE1 TYR A 585 35.131 -21.305 0.823 1.00 36.06 C ATOM 1153 CE2 TYR A 585 33.766 -21.100 -1.135 1.00 35.25 C ATOM 1154 CZ TYR A 585 34.999 -21.236 -0.549 1.00 33.81 C ATOM 1155 OH TYR A 585 36.133 -21.224 -1.311 1.00 37.00 O ATOM 1156 HH TYR A 585 36.924 -21.333 -0.726 1.00 0.00 H ATOM 1157 H TYR A 585 29.455 -20.730 3.337 1.00 0.00 H ATOM 1158 N GLN A 586 30.087 -18.820 0.511 1.00 28.86 N ATOM 1159 CA GLN A 586 29.912 -17.939 -0.620 1.00 30.77 C ATOM 1160 C GLN A 586 29.785 -16.476 -0.226 1.00 35.72 C ATOM 1161 O GLN A 586 30.345 -15.619 -0.907 1.00 31.88 O ATOM 1162 CB GLN A 586 28.718 -18.337 -1.463 1.00 33.44 C ATOM 1163 CG GLN A 586 28.929 -19.619 -2.283 1.00 36.09 C ATOM 1164 CD GLN A 586 27.662 -19.981 -3.036 1.00 36.79 C ATOM 1165 OE1 GLN A 586 27.211 -19.206 -3.866 1.00 39.74 O ATOM 1166 NE2 GLN A 586 26.947 -21.001 -2.546 1.00 44.84 N ATOM 1167 HE22 GLN A 586 27.367 -21.639 -1.840 1.00 0.00 H ATOM 1168 HE21 GLN A 586 25.971 -21.156 -2.871 1.00 0.00 H ATOM 1169 H GLN A 586 29.360 -19.535 0.713 1.00 0.00 H ATOM 1170 N VAL A 587 29.058 -16.197 0.856 1.00 30.31 N ATOM 1171 CA VAL A 587 28.999 -14.858 1.389 1.00 30.43 C ATOM 1172 C VAL A 587 30.367 -14.375 1.834 1.00 29.59 C ATOM 1173 O VAL A 587 30.744 -13.234 1.535 1.00 27.70 O ATOM 1174 CB VAL A 587 27.931 -14.707 2.486 1.00 29.80 C ATOM 1175 CG1 VAL A 587 27.973 -13.309 3.095 1.00 34.45 C ATOM 1176 CG2 VAL A 587 26.564 -14.933 1.848 1.00 29.43 C ATOM 1177 H VAL A 587 28.524 -16.957 1.324 1.00 0.00 H ATOM 1178 N ALA A 588 31.097 -15.217 2.545 1.00 29.51 N ATOM 1179 CA ALA A 588 32.436 -14.862 2.992 1.00 29.73 C ATOM 1180 C ALA A 588 33.380 -14.539 1.798 1.00 31.21 C ATOM 1181 O ALA A 588 34.184 -13.582 1.861 1.00 27.59 O ATOM 1182 CB ALA A 588 33.016 -15.997 3.827 1.00 30.75 C ATOM 1183 H ALA A 588 30.708 -16.150 2.789 1.00 0.00 H ATOM 1184 N ARG A 589 33.297 -15.344 0.744 1.00 30.28 N ATOM 1185 CA ARG A 589 34.088 -15.076 -0.506 1.00 34.04 C ATOM 1186 C ARG A 589 33.746 -13.764 -1.146 1.00 31.93 C ATOM 1187 O ARG A 589 34.627 -13.059 -1.552 1.00 29.73 O ATOM 1188 CB ARG A 589 33.903 -16.155 -1.564 1.00 32.81 C ATOM 1189 CG ARG A 589 34.438 -17.525 -1.187 1.00 38.53 C ATOM 1190 CD ARG A 589 35.949 -17.604 -1.257 1.00 46.64 C ATOM 1191 NE ARG A 589 36.538 -17.268 -2.546 1.00 52.62 N ATOM 1192 CZ ARG A 589 36.694 -18.099 -3.580 1.00 62.50 C ATOM 1193 NH1 ARG A 589 36.188 -19.331 -3.588 1.00 57.18 N ATOM 1194 NH2 ARG A 589 37.299 -17.653 -4.669 1.00 59.68 N ATOM 1195 HE ARG A 589 36.868 -16.290 -2.673 1.00 0.00 H ATOM 1196 HH12 ARG A 589 36.332 -19.947 -4.413 1.00 0.00 H ATOM 1197 HH11 ARG A 589 35.649 -19.677 -2.769 1.00 0.00 H ATOM 1198 HH22 ARG A 589 37.431 -18.283 -5.486 1.00 0.00 H ATOM 1199 HH21 ARG A 589 37.643 -16.672 -4.708 1.00 0.00 H ATOM 1200 H ARG A 589 32.673 -16.175 0.785 1.00 0.00 H ATOM 1201 N GLY A 590 32.453 -13.439 -1.242 1.00 31.16 N ATOM 1202 CA GLY A 590 32.020 -12.143 -1.735 1.00 31.02 C ATOM 1203 C GLY A 590 32.549 -11.004 -0.886 1.00 33.31 C ATOM 1204 O GLY A 590 33.025 -9.981 -1.406 1.00 29.31 O ATOM 1205 H GLY A 590 31.735 -14.135 -0.955 1.00 0.00 H ATOM 1206 N MET A 591 32.434 -11.149 0.431 1.00 29.91 N ATOM 1207 CA MET A 591 32.960 -10.131 1.339 1.00 29.17 C ATOM 1208 C MET A 591 34.486 -9.996 1.285 1.00 31.03 C ATOM 1209 O MET A 591 35.001 -8.892 1.372 1.00 31.55 O ATOM 1210 CB MET A 591 32.524 -10.415 2.783 1.00 29.61 C ATOM 1211 CG MET A 591 31.035 -10.220 3.020 1.00 27.43 C ATOM 1212 SD MET A 591 30.419 -8.575 2.622 1.00 34.42 S ATOM 1213 CE MET A 591 31.291 -7.514 3.772 1.00 36.07 C ATOM 1214 H MET A 591 31.966 -11.993 0.818 1.00 0.00 H ATOM 1215 N GLN A 592 35.196 -11.108 1.122 1.00 30.54 N ATOM 1216 CA GLN A 592 36.646 -11.071 0.968 1.00 32.55 C ATOM 1217 C GLN A 592 37.053 -10.337 -0.304 1.00 32.37 C ATOM 1218 O GLN A 592 37.983 -9.511 -0.307 1.00 30.81 O ATOM 1219 CB GLN A 592 37.212 -12.482 0.993 1.00 30.20 C ATOM 1220 CG GLN A 592 38.700 -12.549 0.705 1.00 37.32 C ATOM 1221 CD GLN A 592 39.196 -13.965 0.482 1.00 37.30 C ATOM 1222 OE1 GLN A 592 38.515 -14.794 -0.106 1.00 39.07 O ATOM 1223 NE2 GLN A 592 40.366 -14.252 1.002 1.00 37.51 N ATOM 1224 HE22 GLN A 592 40.911 -13.515 1.494 1.00 0.00 H ATOM 1225 HE21 GLN A 592 40.748 -15.216 0.922 1.00 0.00 H ATOM 1226 H GLN A 592 34.706 -12.025 1.104 1.00 0.00 H ATOM 1227 N TYR A 593 36.281 -10.551 -1.360 1.00 30.88 N ATOM 1228 CA TYR A 593 36.478 -9.806 -2.579 1.00 28.97 C ATOM 1229 C TYR A 593 36.221 -8.313 -2.391 1.00 30.41 C ATOM 1230 O TYR A 593 37.057 -7.489 -2.707 1.00 30.60 O ATOM 1231 CB TYR A 593 35.642 -10.363 -3.719 1.00 28.04 C ATOM 1232 CG TYR A 593 35.881 -9.584 -4.991 1.00 30.15 C ATOM 1233 CD1 TYR A 593 37.050 -9.794 -5.771 1.00 33.93 C ATOM 1234 CD2 TYR A 593 35.004 -8.573 -5.371 1.00 28.30 C ATOM 1235 CE1 TYR A 593 37.295 -9.019 -6.914 1.00 34.65 C ATOM 1236 CE2 TYR A 593 35.231 -7.810 -6.504 1.00 32.51 C ATOM 1237 CZ TYR A 593 36.355 -8.042 -7.280 1.00 35.26 C ATOM 1238 OH TYR A 593 36.554 -7.207 -8.361 1.00 28.88 O ATOM 1239 HH TYR A 593 36.637 -6.273 -8.044 1.00 0.00 H ATOM 1240 H TYR A 593 35.525 -11.264 -1.309 1.00 0.00 H ATOM 1241 N LEU A 594 35.071 -7.944 -1.852 1.00 29.43 N ATOM 1242 CA LEU A 594 34.759 -6.526 -1.671 1.00 30.99 C ATOM 1243 C LEU A 594 35.811 -5.877 -0.802 1.00 33.08 C ATOM 1244 O LEU A 594 36.210 -4.748 -1.045 1.00 34.32 O ATOM 1245 CB LEU A 594 33.377 -6.348 -1.046 1.00 26.64 C ATOM 1246 CG LEU A 594 32.231 -6.751 -1.983 1.00 30.15 C ATOM 1247 CD1 LEU A 594 30.898 -6.729 -1.257 1.00 29.27 C ATOM 1248 CD2 LEU A 594 32.181 -5.784 -3.159 1.00 31.84 C ATOM 1249 H LEU A 594 34.384 -8.666 -1.555 1.00 0.00 H ATOM 1250 N GLU A 595 36.269 -6.605 0.205 1.00 32.35 N ATOM 1251 CA GLU A 595 37.247 -6.073 1.107 1.00 36.34 C ATOM 1252 C GLU A 595 38.562 -5.791 0.337 1.00 38.29 C ATOM 1253 O GLU A 595 39.148 -4.747 0.521 1.00 35.33 O ATOM 1254 CB GLU A 595 37.468 -7.029 2.272 1.00 37.87 C ATOM 1255 CG GLU A 595 38.679 -6.697 3.121 1.00 41.96 C ATOM 1256 CD GLU A 595 38.910 -7.732 4.210 1.00 47.77 C ATOM 1257 OE1 GLU A 595 39.015 -8.959 3.921 1.00 51.36 O ATOM 1258 OE2 GLU A 595 38.972 -7.304 5.362 1.00 48.55 O ATOM 1259 H GLU A 595 35.915 -7.573 0.343 1.00 0.00 H ATOM 1260 N SER A 596 38.946 -6.677 -0.578 1.00 34.21 N ATOM 1261 CA SER A 596 40.161 -6.491 -1.389 1.00 37.83 C ATOM 1262 C SER A 596 40.022 -5.307 -2.351 1.00 41.64 C ATOM 1263 O SER A 596 41.019 -4.731 -2.757 1.00 40.56 O ATOM 1264 CB SER A 596 40.480 -7.742 -2.195 1.00 37.64 C ATOM 1265 OG SER A 596 39.630 -7.807 -3.325 1.00 36.18 O ATOM 1266 HG SER A 596 38.687 -7.839 -3.026 1.00 0.00 H ATOM 1267 H SER A 596 38.369 -7.529 -0.726 1.00 0.00 H ATOM 1268 N ARG A 597 38.792 -4.890 -2.649 1.00 36.27 N ATOM 1269 CA ARG A 597 38.542 -3.691 -3.468 1.00 32.20 C ATOM 1270 C ARG A 597 38.189 -2.492 -2.596 1.00 34.39 C ATOM 1271 O ARG A 597 37.639 -1.509 -3.078 1.00 36.31 O ATOM 1272 CB ARG A 597 37.442 -4.002 -4.476 1.00 32.73 C ATOM 1273 CG ARG A 597 37.660 -5.316 -5.218 1.00 39.33 C ATOM 1274 CD ARG A 597 38.837 -5.262 -6.194 1.00 40.14 C ATOM 1275 NE ARG A 597 38.578 -4.168 -7.117 1.00 45.43 N ATOM 1276 CZ ARG A 597 39.482 -3.329 -7.608 1.00 58.38 C ATOM 1277 NH1 ARG A 597 40.776 -3.478 -7.360 1.00 64.50 N ATOM 1278 NH2 ARG A 597 39.080 -2.356 -8.400 1.00 52.85 N ATOM 1279 HE ARG A 597 37.593 -4.030 -7.421 1.00 0.00 H ATOM 1280 HH12 ARG A 597 41.462 -2.806 -7.758 1.00 0.00 H ATOM 1281 HH11 ARG A 597 41.104 -4.267 -6.768 1.00 0.00 H ATOM 1282 HH22 ARG A 597 39.772 -1.688 -8.795 1.00 0.00 H ATOM 1283 HH21 ARG A 597 38.071 -2.256 -8.630 1.00 0.00 H ATOM 1284 H ARG A 597 37.979 -5.430 -2.290 1.00 0.00 H ATOM 1285 N LYS A 598 38.580 -2.557 -1.322 1.00 33.28 N ATOM 1286 CA LYS A 598 38.383 -1.481 -0.353 1.00 36.96 C ATOM 1287 C LYS A 598 36.950 -1.099 -0.150 1.00 39.34 C ATOM 1288 O LYS A 598 36.680 0.015 0.223 1.00 34.57 O ATOM 1289 CB LYS A 598 39.218 -0.241 -0.693 1.00 41.42 C ATOM 1290 CG LYS A 598 40.671 -0.600 -0.949 1.00 45.92 C ATOM 1291 CD LYS A 598 41.494 0.641 -1.241 1.00 62.39 C ATOM 1292 CE LYS A 598 42.978 0.321 -1.166 1.00 66.03 C ATOM 1293 NZ LYS A 598 43.781 1.302 -1.948 1.00 75.01 N ATOM 1294 HZ1 LYS A 598 43.485 1.274 -2.945 1.00 0.00 H ATOM 1295 HZ2 LYS A 598 43.627 2.257 -1.566 1.00 0.00 H ATOM 1296 HZ3 LYS A 598 44.789 1.057 -1.878 1.00 0.00 H ATOM 1297 H LYS A 598 39.053 -3.425 -0.999 1.00 0.00 H ATOM 1298 N CYS A 599 36.037 -2.062 -0.239 1.00 32.17 N ATOM 1299 CA CYS A 599 34.631 -1.757 -0.034 1.00 33.43 C ATOM 1300 C CYS A 599 34.232 -2.287 1.340 1.00 37.94 C ATOM 1301 O CYS A 599 34.392 -3.484 1.603 1.00 36.14 O ATOM 1302 CB CYS A 599 33.827 -2.427 -1.129 1.00 37.99 C ATOM 1303 SG CYS A 599 32.052 -2.380 -0.863 1.00 37.68 S ATOM 1304 H CYS A 599 36.330 -3.036 -0.456 1.00 0.00 H ATOM 1305 N ILE A 600 33.798 -1.383 2.217 1.00 35.82 N ATOM 1306 CA ILE A 600 33.157 -1.739 3.496 1.00 39.90 C ATOM 1307 C ILE A 600 31.643 -1.700 3.303 1.00 38.24 C ATOM 1308 O ILE A 600 31.097 -0.700 2.863 1.00 32.92 O ATOM 1309 CB ILE A 600 33.541 -0.756 4.612 1.00 40.49 C ATOM 1310 CG1 ILE A 600 35.043 -0.861 4.936 1.00 41.45 C ATOM 1311 CG2 ILE A 600 32.743 -1.027 5.891 1.00 43.40 C ATOM 1312 CD1 ILE A 600 35.624 0.412 5.512 1.00 44.06 C ATOM 1313 H ILE A 600 33.917 -0.376 1.988 1.00 0.00 H ATOM 1314 N HIS A 601 30.956 -2.782 3.640 1.00 32.03 N ATOM 1315 CA HIS A 601 29.545 -2.909 3.294 1.00 33.56 C ATOM 1316 C HIS A 601 28.669 -2.045 4.203 1.00 34.98 C ATOM 1317 O HIS A 601 27.856 -1.273 3.710 1.00 35.35 O ATOM 1318 CB HIS A 601 29.095 -4.363 3.382 1.00 36.33 C ATOM 1319 CG HIS A 601 27.770 -4.624 2.743 1.00 36.28 C ATOM 1320 ND1 HIS A 601 26.576 -4.222 3.316 1.00 35.41 N ATOM 1321 CD2 HIS A 601 27.443 -5.209 1.565 1.00 36.56 C ATOM 1322 CE1 HIS A 601 25.579 -4.496 2.491 1.00 33.51 C ATOM 1323 NE2 HIS A 601 26.072 -5.107 1.424 1.00 38.38 N ATOM 1324 H HIS A 601 31.429 -3.550 4.158 1.00 0.00 H ATOM 1325 N ARG A 602 28.805 -2.247 5.513 1.00 37.93 N ATOM 1326 CA ARG A 602 28.107 -1.502 6.565 1.00 40.57 C ATOM 1327 C ARG A 602 26.722 -2.039 6.880 1.00 42.80 C ATOM 1328 O ARG A 602 26.222 -1.744 7.953 1.00 45.32 O ATOM 1329 CB ARG A 602 28.011 0.013 6.295 1.00 42.53 C ATOM 1330 CG ARG A 602 29.357 0.695 6.126 1.00 48.01 C ATOM 1331 CD ARG A 602 29.235 2.201 5.881 1.00 54.99 C ATOM 1332 NE ARG A 602 30.559 2.857 5.913 1.00 63.17 N ATOM 1333 CZ ARG A 602 31.451 2.873 4.912 1.00 70.36 C ATOM 1334 NH1 ARG A 602 32.605 3.511 5.084 1.00 70.54 N ATOM 1335 NH2 ARG A 602 31.203 2.286 3.729 1.00 68.00 N ATOM 1336 HE ARG A 602 30.822 3.350 6.790 1.00 0.00 H ATOM 1337 HH12 ARG A 602 33.307 3.532 4.317 1.00 0.00 H ATOM 1338 HH11 ARG A 602 32.806 3.989 5.986 1.00 0.00 H ATOM 1339 HH22 ARG A 602 31.917 2.317 2.973 1.00 0.00 H ATOM 1340 HH21 ARG A 602 30.297 1.801 3.569 1.00 0.00 H ATOM 1341 H ARG A 602 29.461 -2.996 5.814 1.00 0.00 H ATOM 1342 N ASP A 603 26.127 -2.864 6.012 1.00 35.53 N ATOM 1343 CA ASP A 603 24.781 -3.423 6.289 1.00 35.56 C ATOM 1344 C ASP A 603 24.631 -4.891 5.838 1.00 31.90 C ATOM 1345 O ASP A 603 23.667 -5.281 5.139 1.00 36.01 O ATOM 1346 CB ASP A 603 23.722 -2.522 5.641 1.00 39.47 C ATOM 1347 CG ASP A 603 22.311 -2.827 6.110 1.00 47.88 C ATOM 1348 OD1 ASP A 603 22.116 -3.587 7.096 1.00 49.45 O ATOM 1349 OD2 ASP A 603 21.392 -2.320 5.452 1.00 57.17 O ATOM 1350 H ASP A 603 26.615 -3.118 5.129 1.00 0.00 H ATOM 1351 N LEU A 604 25.621 -5.702 6.196 1.00 31.36 N ATOM 1352 CA LEU A 604 25.630 -7.091 5.817 1.00 32.41 C ATOM 1353 C LEU A 604 24.617 -7.820 6.726 1.00 34.45 C ATOM 1354 O LEU A 604 24.628 -7.659 7.950 1.00 35.47 O ATOM 1355 CB LEU A 604 27.019 -7.685 5.985 1.00 35.02 C ATOM 1356 CG LEU A 604 27.142 -9.189 5.722 1.00 37.37 C ATOM 1357 CD1 LEU A 604 26.711 -9.552 4.318 1.00 38.90 C ATOM 1358 CD2 LEU A 604 28.575 -9.607 5.953 1.00 38.54 C ATOM 1359 H LEU A 604 26.407 -5.325 6.763 1.00 0.00 H ATOM 1360 N ALA A 605 23.708 -8.529 6.085 1.00 38.16 N ATOM 1361 CA ALA A 605 22.588 -9.243 6.731 1.00 41.07 C ATOM 1362 C ALA A 605 21.984 -10.142 5.659 1.00 33.69 C ATOM 1363 O ALA A 605 22.134 -9.838 4.461 1.00 36.42 O ATOM 1364 CB ALA A 605 21.545 -8.255 7.197 1.00 36.74 C ATOM 1365 H ALA A 605 23.786 -8.590 5.050 1.00 0.00 H ATOM 1366 N ALA A 606 21.175 -11.125 6.061 1.00 33.67 N ATOM 1367 CA ALA A 606 20.629 -12.081 5.096 1.00 36.66 C ATOM 1368 C ALA A 606 19.701 -11.410 4.088 1.00 36.27 C ATOM 1369 O ALA A 606 19.635 -11.819 2.931 1.00 35.00 O ATOM 1370 CB ALA A 606 19.956 -13.240 5.802 1.00 37.63 C ATOM 1371 H ALA A 606 20.931 -11.212 7.068 1.00 0.00 H ATOM 1372 N ARG A 607 19.025 -10.339 4.513 1.00 36.65 N ATOM 1373 CA ARG A 607 18.148 -9.578 3.617 1.00 35.59 C ATOM 1374 C ARG A 607 18.937 -8.856 2.487 1.00 35.26 C ATOM 1375 O ARG A 607 18.364 -8.485 1.455 1.00 36.83 O ATOM 1376 CB ARG A 607 17.292 -8.558 4.407 1.00 39.81 C ATOM 1377 CG ARG A 607 18.089 -7.413 5.031 1.00 45.41 C ATOM 1378 CD ARG A 607 17.280 -6.399 5.869 1.00 49.48 C ATOM 1379 NE ARG A 607 18.211 -5.506 6.589 1.00 51.08 N ATOM 1380 CZ ARG A 607 18.844 -5.778 7.744 1.00 55.95 C ATOM 1381 NH1 ARG A 607 18.561 -6.861 8.452 1.00 48.76 N ATOM 1382 NH2 ARG A 607 19.755 -4.930 8.222 1.00 52.24 N ATOM 1383 HE ARG A 607 18.395 -4.576 6.161 1.00 0.00 H ATOM 1384 HH12 ARG A 607 19.066 -7.047 9.342 1.00 0.00 H ATOM 1385 HH11 ARG A 607 17.834 -7.525 8.118 1.00 0.00 H ATOM 1386 HH22 ARG A 607 20.244 -5.141 9.115 1.00 0.00 H ATOM 1387 HH21 ARG A 607 19.977 -4.057 7.702 1.00 0.00 H ATOM 1388 H ARG A 607 19.123 -10.037 5.503 1.00 0.00 H ATOM 1389 N ASN A 608 20.229 -8.619 2.707 1.00 33.24 N ATOM 1390 CA ASN A 608 21.064 -7.994 1.686 1.00 35.17 C ATOM 1391 C ASN A 608 21.949 -9.007 0.963 1.00 35.46 C ATOM 1392 O ASN A 608 22.944 -8.637 0.361 1.00 37.77 O ATOM 1393 CB ASN A 608 21.880 -6.864 2.323 1.00 36.74 C ATOM 1394 CG ASN A 608 21.001 -5.680 2.741 1.00 45.01 C ATOM 1395 OD1 ASN A 608 20.075 -5.319 2.026 1.00 51.88 O ATOM 1396 ND2 ASN A 608 21.252 -5.117 3.925 1.00 45.02 N ATOM 1397 HD22 ASN A 608 22.049 -5.453 4.502 1.00 0.00 H ATOM 1398 HD21 ASN A 608 20.650 -4.342 4.270 1.00 0.00 H ATOM 1399 H ASN A 608 20.650 -8.883 3.621 1.00 0.00 H ATOM 1400 N VAL A 609 21.565 -10.289 1.000 1.00 35.15 N ATOM 1401 CA VAL A 609 22.189 -11.305 0.185 1.00 32.13 C ATOM 1402 C VAL A 609 21.096 -11.861 -0.696 1.00 37.28 C ATOM 1403 O VAL A 609 20.039 -12.167 -0.195 1.00 37.33 O ATOM 1404 CB VAL A 609 22.850 -12.392 1.039 1.00 32.00 C ATOM 1405 CG1 VAL A 609 23.420 -13.490 0.173 1.00 31.49 C ATOM 1406 CG2 VAL A 609 23.967 -11.809 1.883 1.00 36.27 C ATOM 1407 H VAL A 609 20.790 -10.563 1.638 1.00 0.00 H ATOM 1408 N LEU A 610 21.316 -11.896 -2.012 1.00 33.77 N ATOM 1409 CA LEU A 610 20.348 -12.440 -2.962 1.00 32.85 C ATOM 1410 C LEU A 610 20.780 -13.816 -3.476 1.00 33.68 C ATOM 1411 O LEU A 610 21.929 -14.238 -3.297 1.00 34.91 O ATOM 1412 CB LEU A 610 20.084 -11.460 -4.110 1.00 32.97 C ATOM 1413 CG LEU A 610 19.764 -10.006 -3.761 1.00 35.33 C ATOM 1414 CD1 LEU A 610 19.382 -9.169 -4.965 1.00 35.60 C ATOM 1415 CD2 LEU A 610 18.676 -9.923 -2.695 1.00 38.11 C ATOM 1416 H LEU A 610 22.214 -11.520 -2.377 1.00 0.00 H ATOM 1417 N VAL A 611 19.817 -14.572 -4.006 1.00 35.29 N ATOM 1418 CA VAL A 611 20.042 -15.984 -4.380 1.00 35.77 C ATOM 1419 C VAL A 611 19.597 -16.218 -5.808 1.00 33.32 C ATOM 1420 O VAL A 611 18.496 -15.829 -6.186 1.00 37.07 O ATOM 1421 CB VAL A 611 19.276 -16.942 -3.444 1.00 42.32 C ATOM 1422 CG1 VAL A 611 19.692 -18.403 -3.686 1.00 42.81 C ATOM 1423 CG2 VAL A 611 19.515 -16.537 -1.995 1.00 44.85 C ATOM 1424 H VAL A 611 18.877 -14.154 -4.161 1.00 0.00 H ATOM 1425 N THR A 612 20.495 -16.776 -6.614 1.00 36.36 N ATOM 1426 CA THR A 612 20.256 -16.974 -8.029 1.00 38.35 C ATOM 1427 C THR A 612 19.469 -18.273 -8.255 1.00 42.16 C ATOM 1428 O THR A 612 19.300 -19.071 -7.345 1.00 37.96 O ATOM 1429 CB THR A 612 21.563 -17.059 -8.868 1.00 34.05 C ATOM 1430 OG1 THR A 612 22.237 -18.294 -8.610 1.00 33.11 O ATOM 1431 CG2 THR A 612 22.498 -15.898 -8.559 1.00 37.47 C ATOM 1432 HG1 THR A 612 23.066 -18.335 -9.150 1.00 0.00 H ATOM 1433 H THR A 612 21.404 -17.082 -6.213 1.00 0.00 H ATOM 1434 N GLU A 613 19.032 -18.474 -9.491 1.00 44.72 N ATOM 1435 CA GLU A 613 18.367 -19.711 -9.899 1.00 52.20 C ATOM 1436 C GLU A 613 19.206 -20.938 -9.533 1.00 52.63 C ATOM 1437 O GLU A 613 18.662 -21.940 -9.090 1.00 55.35 O ATOM 1438 CB GLU A 613 18.064 -19.689 -11.405 1.00 59.06 C ATOM 1439 CG GLU A 613 17.092 -20.779 -11.875 1.00 74.59 C ATOM 1440 CD GLU A 613 15.681 -20.641 -11.284 1.00 78.24 C ATOM 1441 OE1 GLU A 613 14.996 -19.628 -11.559 1.00 80.01 O ATOM 1442 OE2 GLU A 613 15.239 -21.563 -10.564 1.00 72.94 O ATOM 1443 H GLU A 613 19.167 -17.723 -10.197 1.00 0.00 H ATOM 1444 N ASP A 614 20.530 -20.816 -9.645 1.00 48.03 N ATOM 1445 CA ASP A 614 21.471 -21.882 -9.300 1.00 43.84 C ATOM 1446 C ASP A 614 21.939 -21.868 -7.817 1.00 47.15 C ATOM 1447 O ASP A 614 22.932 -22.494 -7.479 1.00 46.53 O ATOM 1448 CB ASP A 614 22.684 -21.782 -10.248 1.00 50.91 C ATOM 1449 H ASP A 614 20.913 -19.915 -9.996 1.00 0.00 H ATOM 1450 N ASN A 615 21.226 -21.171 -6.927 1.00 48.82 N ATOM 1451 CA ASN A 615 21.601 -21.121 -5.490 1.00 47.05 C ATOM 1452 C ASN A 615 22.981 -20.561 -5.187 1.00 46.13 C ATOM 1453 O ASN A 615 23.609 -20.964 -4.197 1.00 47.31 O ATOM 1454 CB ASN A 615 21.488 -22.508 -4.851 1.00 52.14 C ATOM 1455 CG ASN A 615 20.060 -22.989 -4.783 1.00 54.91 C ATOM 1456 OD1 ASN A 615 19.137 -22.295 -5.217 1.00 53.93 O ATOM 1457 ND2 ASN A 615 19.870 -24.181 -4.226 1.00 65.11 N ATOM 1458 HD22 ASN A 615 20.683 -24.727 -3.875 1.00 0.00 H ATOM 1459 HD21 ASN A 615 18.908 -24.568 -4.141 1.00 0.00 H ATOM 1460 H ASN A 615 20.386 -20.649 -7.249 1.00 0.00 H ATOM 1461 N VAL A 616 23.442 -19.644 -6.038 1.00 40.14 N ATOM 1462 CA VAL A 616 24.662 -18.854 -5.787 1.00 39.30 C ATOM 1463 C VAL A 616 24.266 -17.636 -4.932 1.00 32.77 C ATOM 1464 O VAL A 616 23.290 -16.963 -5.243 1.00 35.22 O ATOM 1465 CB VAL A 616 25.300 -18.378 -7.124 1.00 41.14 C ATOM 1466 CG1 VAL A 616 26.474 -17.431 -6.878 1.00 45.93 C ATOM 1467 CG2 VAL A 616 25.746 -19.561 -7.964 1.00 41.86 C ATOM 1468 H VAL A 616 22.917 -19.478 -6.920 1.00 0.00 H ATOM 1469 N MET A 617 25.034 -17.349 -3.880 1.00 35.87 N ATOM 1470 CA MET A 617 24.822 -16.150 -3.091 1.00 35.03 C ATOM 1471 C MET A 617 25.476 -14.921 -3.784 1.00 38.04 C ATOM 1472 O MET A 617 26.656 -14.958 -4.164 1.00 33.78 O ATOM 1473 CB MET A 617 25.452 -16.296 -1.711 1.00 32.33 C ATOM 1474 CG MET A 617 25.099 -17.551 -0.942 1.00 41.11 C ATOM 1475 SD MET A 617 23.347 -17.582 -0.502 1.00 39.25 S ATOM 1476 CE MET A 617 22.723 -18.710 -1.730 1.00 41.81 C ATOM 1477 H MET A 617 25.802 -18.000 -3.619 1.00 0.00 H ATOM 1478 N LYS A 618 24.763 -13.804 -3.763 1.00 33.95 N ATOM 1479 CA LYS A 618 25.245 -12.540 -4.295 1.00 34.71 C ATOM 1480 C LYS A 618 24.930 -11.385 -3.337 1.00 36.88 C ATOM 1481 O LYS A 618 23.773 -11.054 -3.132 1.00 33.41 O ATOM 1482 CB LYS A 618 24.637 -12.279 -5.682 1.00 33.60 C ATOM 1483 CG LYS A 618 25.184 -13.199 -6.752 1.00 34.43 C ATOM 1484 CD LYS A 618 24.576 -12.904 -8.101 1.00 35.54 C ATOM 1485 CE LYS A 618 25.325 -13.628 -9.200 1.00 35.54 C ATOM 1486 NZ LYS A 618 26.671 -13.046 -9.373 1.00 34.71 N ATOM 1487 HZ1 LYS A 618 26.583 -12.041 -9.627 1.00 0.00 H ATOM 1488 HZ2 LYS A 618 27.203 -13.135 -8.484 1.00 0.00 H ATOM 1489 HZ3 LYS A 618 27.172 -13.553 -10.130 1.00 0.00 H ATOM 1490 H LYS A 618 23.811 -13.833 -3.345 1.00 0.00 H ATOM 1491 N ILE A 619 25.982 -10.783 -2.775 1.00 31.75 N ATOM 1492 CA ILE A 619 25.869 -9.610 -1.915 1.00 31.22 C ATOM 1493 C ILE A 619 25.266 -8.439 -2.656 1.00 37.33 C ATOM 1494 O ILE A 619 25.709 -8.082 -3.739 1.00 35.25 O ATOM 1495 CB ILE A 619 27.225 -9.223 -1.335 1.00 30.41 C ATOM 1496 CG1 ILE A 619 27.779 -10.417 -0.549 1.00 35.65 C ATOM 1497 CG2 ILE A 619 27.111 -7.989 -0.424 1.00 29.99 C ATOM 1498 CD1 ILE A 619 29.266 -10.390 -0.406 1.00 34.28 C ATOM 1499 H ILE A 619 26.929 -11.170 -2.960 1.00 0.00 H ATOM 1500 N ALA A 620 24.262 -7.814 -2.051 1.00 31.47 N ATOM 1501 CA ALA A 620 23.553 -6.714 -2.686 1.00 34.01 C ATOM 1502 C ALA A 620 23.998 -5.431 -2.047 1.00 32.07 C ATOM 1503 O ALA A 620 24.574 -5.441 -0.956 1.00 33.88 O ATOM 1504 CB ALA A 620 22.043 -6.886 -2.495 1.00 39.24 C ATOM 1505 H ALA A 620 23.976 -8.119 -1.099 1.00 0.00 H ATOM 1506 N ASP A 621 23.755 -4.323 -2.755 1.00 33.82 N ATOM 1507 CA ASP A 621 23.796 -2.974 -2.167 1.00 40.35 C ATOM 1508 C ASP A 621 25.099 -2.614 -1.489 1.00 41.79 C ATOM 1509 O ASP A 621 25.098 -1.964 -0.462 1.00 40.29 O ATOM 1510 CB ASP A 621 22.640 -2.841 -1.165 1.00 44.13 C ATOM 1511 CG ASP A 621 21.290 -2.733 -1.858 1.00 48.49 C ATOM 1512 OD1 ASP A 621 21.236 -2.746 -3.121 1.00 49.29 O ATOM 1513 OD2 ASP A 621 20.295 -2.585 -1.127 1.00 59.72 O ATOM 1514 H ASP A 621 23.527 -4.418 -3.765 1.00 0.00 H ATOM 1515 N PHE A 622 26.209 -3.056 -2.062 1.00 39.84 N ATOM 1516 CA PHE A 622 27.521 -2.778 -1.505 1.00 37.85 C ATOM 1517 C PHE A 622 28.080 -1.427 -1.967 1.00 39.64 C ATOM 1518 O PHE A 622 29.183 -1.061 -1.592 1.00 40.97 O ATOM 1519 CB PHE A 622 28.510 -3.903 -1.886 1.00 33.46 C ATOM 1520 CG PHE A 622 28.593 -4.160 -3.365 1.00 33.79 C ATOM 1521 CD1 PHE A 622 29.438 -3.412 -4.160 1.00 35.67 C ATOM 1522 CD2 PHE A 622 27.807 -5.137 -3.961 1.00 33.63 C ATOM 1523 CE1 PHE A 622 29.504 -3.626 -5.534 1.00 37.92 C ATOM 1524 CE2 PHE A 622 27.894 -5.383 -5.319 1.00 34.35 C ATOM 1525 CZ PHE A 622 28.732 -4.611 -6.107 1.00 35.79 C ATOM 1526 H PHE A 622 26.139 -3.617 -2.935 1.00 0.00 H ATOM 1527 N GLY A 623 27.427 -0.788 -2.923 1.00 40.98 N ATOM 1528 CA GLY A 623 27.953 0.444 -3.506 1.00 44.92 C ATOM 1529 C GLY A 623 27.152 1.682 -3.118 1.00 48.19 C ATOM 1530 O GLY A 623 27.391 2.751 -3.673 1.00 43.88 O ATOM 1531 H GLY A 623 26.522 -1.169 -3.266 1.00 0.00 H ATOM 1532 N LEU A 624 26.140 1.530 -2.262 1.00 48.78 N ATOM 1533 CA LEU A 624 25.451 2.707 -1.673 1.00 58.61 C ATOM 1534 C LEU A 624 26.388 3.369 -0.664 1.00 48.53 C ATOM 1535 O LEU A 624 26.760 4.517 -0.842 1.00 60.00 O ATOM 1536 CB LEU A 624 24.158 2.338 -0.937 1.00 55.12 C ATOM 1537 CG LEU A 624 23.066 1.410 -1.489 1.00 57.10 C ATOM 1538 CD1 LEU A 624 22.189 0.963 -0.326 1.00 61.56 C ATOM 1539 CD2 LEU A 624 22.196 2.102 -2.532 1.00 60.44 C ATOM 1540 H LEU A 624 25.828 0.572 -2.003 1.00 0.00 H TER 1541 LEU A 624 ATOM 1542 N PRO A 643 18.919 -1.381 11.833 1.00 73.98 N ATOM 1543 CA PRO A 643 19.701 -2.612 11.691 1.00 60.07 C ATOM 1544 C PRO A 643 20.627 -2.786 12.885 1.00 54.01 C ATOM 1545 O PRO A 643 21.688 -3.391 12.781 1.00 43.26 O ATOM 1546 CB PRO A 643 20.500 -2.358 10.413 1.00 63.21 C ATOM 1547 CG PRO A 643 20.753 -0.882 10.451 1.00 64.53 C ATOM 1548 CD PRO A 643 19.566 -0.248 11.152 1.00 62.32 C ATOM 1549 HN2 PRO A 643 18.822 -1.157 12.844 1.00 0.00 H ATOM 1550 HN1 PRO A 643 17.976 -1.530 11.420 1.00 0.00 H ATOM 1551 N VAL A 644 20.196 -2.282 14.032 1.00 47.55 N ATOM 1552 CA VAL A 644 21.031 -2.238 15.224 1.00 42.70 C ATOM 1553 C VAL A 644 21.464 -3.635 15.674 1.00 36.89 C ATOM 1554 O VAL A 644 22.556 -3.820 16.207 1.00 40.30 O ATOM 1555 CB VAL A 644 20.294 -1.461 16.363 1.00 46.67 C ATOM 1556 CG1 VAL A 644 19.276 -2.317 17.080 1.00 44.18 C ATOM 1557 CG2 VAL A 644 21.259 -0.922 17.371 1.00 56.30 C ATOM 1558 H VAL A 644 19.228 -1.905 14.083 1.00 0.00 H ATOM 1559 N LYS A 645 20.627 -4.635 15.419 1.00 39.38 N ATOM 1560 CA LYS A 645 20.938 -5.998 15.820 1.00 39.93 C ATOM 1561 C LYS A 645 22.083 -6.643 15.012 1.00 42.37 C ATOM 1562 O LYS A 645 22.608 -7.685 15.424 1.00 39.82 O ATOM 1563 CB LYS A 645 19.682 -6.866 15.728 1.00 43.09 C ATOM 1564 CG LYS A 645 18.750 -6.633 16.907 1.00 52.61 C ATOM 1565 CD LYS A 645 17.482 -7.461 16.811 1.00 57.87 C ATOM 1566 CE LYS A 645 16.596 -7.243 18.028 1.00 60.27 C ATOM 1567 NZ LYS A 645 15.175 -7.548 17.708 1.00 62.54 N ATOM 1568 HZ1 LYS A 645 14.852 -6.924 16.941 1.00 0.00 H ATOM 1569 HZ2 LYS A 645 15.094 -8.540 17.407 1.00 0.00 H ATOM 1570 HZ3 LYS A 645 14.589 -7.392 18.553 1.00 0.00 H ATOM 1571 H LYS A 645 19.734 -4.440 14.924 1.00 0.00 H ATOM 1572 N TRP A 646 22.473 -6.002 13.905 1.00 36.78 N ATOM 1573 CA TRP A 646 23.556 -6.500 13.021 1.00 38.75 C ATOM 1574 C TRP A 646 24.847 -5.734 13.196 1.00 39.77 C ATOM 1575 O TRP A 646 25.891 -6.156 12.673 1.00 35.62 O ATOM 1576 CB TRP A 646 23.126 -6.405 11.557 1.00 35.48 C ATOM 1577 CG TRP A 646 22.211 -7.517 11.115 1.00 36.49 C ATOM 1578 CD1 TRP A 646 22.568 -8.681 10.494 1.00 39.16 C ATOM 1579 CD2 TRP A 646 20.804 -7.607 11.358 1.00 41.31 C ATOM 1580 NE1 TRP A 646 21.458 -9.471 10.291 1.00 37.03 N ATOM 1581 CE2 TRP A 646 20.359 -8.830 10.803 1.00 40.89 C ATOM 1582 CE3 TRP A 646 19.870 -6.770 11.994 1.00 45.15 C ATOM 1583 CZ2 TRP A 646 19.017 -9.238 10.864 1.00 41.61 C ATOM 1584 CZ3 TRP A 646 18.530 -7.171 12.039 1.00 46.20 C ATOM 1585 CH2 TRP A 646 18.118 -8.392 11.476 1.00 46.23 C ATOM 1586 HE1 TRP A 646 21.454 -10.401 9.826 1.00 0.00 H ATOM 1587 H TRP A 646 21.995 -5.114 13.652 1.00 0.00 H ATOM 1588 N MET A 647 24.795 -4.650 13.980 1.00 39.69 N ATOM 1589 CA MET A 647 25.931 -3.745 14.134 1.00 40.48 C ATOM 1590 C MET A 647 26.921 -4.131 15.212 1.00 40.45 C ATOM 1591 O MET A 647 26.554 -4.503 16.329 1.00 38.54 O ATOM 1592 CB MET A 647 25.451 -2.315 14.370 1.00 42.38 C ATOM 1593 CG MET A 647 24.652 -1.770 13.213 1.00 46.41 C ATOM 1594 SD MET A 647 23.749 -0.259 13.581 1.00 52.14 S ATOM 1595 CE MET A 647 25.081 0.891 13.912 1.00 50.07 C ATOM 1596 H MET A 647 23.916 -4.445 14.497 1.00 0.00 H ATOM 1597 N ALA A 648 28.199 -3.991 14.877 1.00 33.34 N ATOM 1598 CA ALA A 648 29.268 -4.110 15.854 1.00 37.75 C ATOM 1599 C ALA A 648 29.147 -2.998 16.884 1.00 39.78 C ATOM 1600 O ALA A 648 28.618 -1.916 16.585 1.00 39.79 O ATOM 1601 CB ALA A 648 30.645 -4.043 15.189 1.00 35.18 C ATOM 1602 H ALA A 648 28.442 -3.790 13.886 1.00 0.00 H ATOM 1603 N PRO A 649 29.674 -3.253 18.080 1.00 41.19 N ATOM 1604 CA PRO A 649 29.680 -2.278 19.162 1.00 45.95 C ATOM 1605 C PRO A 649 30.270 -0.917 18.757 1.00 44.30 C ATOM 1606 O PRO A 649 29.601 0.105 18.932 1.00 38.60 O ATOM 1607 CB PRO A 649 30.540 -2.936 20.227 1.00 45.21 C ATOM 1608 CG PRO A 649 30.484 -4.392 19.953 1.00 50.61 C ATOM 1609 CD PRO A 649 30.152 -4.582 18.509 1.00 44.10 C ATOM 1610 N GLU A 650 31.451 -0.927 18.131 1.00 39.44 N ATOM 1611 CA GLU A 650 32.130 0.292 17.706 1.00 37.60 C ATOM 1612 C GLU A 650 31.308 1.058 16.690 1.00 36.86 C ATOM 1613 O GLU A 650 31.450 2.278 16.559 1.00 43.09 O ATOM 1614 CB GLU A 650 33.551 0.001 17.152 1.00 46.56 C ATOM 1615 CG GLU A 650 33.629 -0.756 15.831 1.00 40.56 C ATOM 1616 CD GLU A 650 33.643 -2.273 15.979 1.00 41.18 C ATOM 1617 OE1 GLU A 650 33.282 -2.821 17.063 1.00 38.09 O ATOM 1618 OE2 GLU A 650 33.981 -2.940 14.977 1.00 39.62 O ATOM 1619 H GLU A 650 31.905 -1.843 17.939 1.00 0.00 H ATOM 1620 N ALA A 651 30.430 0.358 15.972 1.00 38.68 N ATOM 1621 CA ALA A 651 29.517 1.031 15.050 1.00 40.04 C ATOM 1622 C ALA A 651 28.348 1.615 15.825 1.00 46.01 C ATOM 1623 O ALA A 651 27.953 2.753 15.596 1.00 45.80 O ATOM 1624 CB ALA A 651 29.024 0.072 13.988 1.00 41.69 C ATOM 1625 H ALA A 651 30.394 -0.677 16.069 1.00 0.00 H ATOM 1626 N LEU A 652 27.780 0.801 16.709 1.00 43.18 N ATOM 1627 CA LEU A 652 26.683 1.224 17.595 1.00 52.46 C ATOM 1628 C LEU A 652 27.056 2.494 18.350 1.00 46.72 C ATOM 1629 O LEU A 652 26.353 3.474 18.294 1.00 49.98 O ATOM 1630 CB LEU A 652 26.380 0.139 18.641 1.00 42.76 C ATOM 1631 CG LEU A 652 25.605 -1.095 18.208 1.00 49.28 C ATOM 1632 CD1 LEU A 652 25.536 -2.109 19.339 1.00 47.95 C ATOM 1633 CD2 LEU A 652 24.214 -0.693 17.767 1.00 52.25 C ATOM 1634 H LEU A 652 28.126 -0.177 16.778 1.00 0.00 H ATOM 1635 N PHE A 653 28.177 2.455 19.054 1.00 48.79 N ATOM 1636 CA PHE A 653 28.430 3.435 20.081 1.00 44.59 C ATOM 1637 C PHE A 653 29.308 4.554 19.525 1.00 53.12 C ATOM 1638 O PHE A 653 29.121 5.702 19.912 1.00 50.96 O ATOM 1639 CB PHE A 653 29.034 2.801 21.352 1.00 44.16 C ATOM 1640 CG PHE A 653 28.199 1.697 21.949 1.00 45.56 C ATOM 1641 CD1 PHE A 653 26.856 1.891 22.248 1.00 42.18 C ATOM 1642 CD2 PHE A 653 28.745 0.435 22.162 1.00 46.83 C ATOM 1643 CE1 PHE A 653 26.082 0.856 22.714 1.00 41.63 C ATOM 1644 CE2 PHE A 653 27.976 -0.588 22.682 1.00 45.62 C ATOM 1645 CZ PHE A 653 26.645 -0.376 22.945 1.00 42.68 C ATOM 1646 H PHE A 653 28.880 1.712 18.865 1.00 0.00 H ATOM 1647 N ASP A 654 30.275 4.223 18.653 1.00 50.84 N ATOM 1648 CA ASP A 654 31.239 5.212 18.134 1.00 46.51 C ATOM 1649 C ASP A 654 31.042 5.644 16.646 1.00 47.71 C ATOM 1650 O ASP A 654 31.866 6.380 16.102 1.00 49.91 O ATOM 1651 CB ASP A 654 32.672 4.689 18.368 1.00 44.51 C ATOM 1652 CG ASP A 654 33.709 5.805 18.589 1.00 47.02 C ATOM 1653 OD1 ASP A 654 33.338 6.990 18.775 1.00 54.63 O ATOM 1654 OD2 ASP A 654 34.924 5.473 18.630 1.00 46.93 O ATOM 1655 H ASP A 654 30.346 3.236 18.333 1.00 0.00 H ATOM 1656 N ARG A 655 29.968 5.190 16.001 1.00 49.80 N ATOM 1657 CA ARG A 655 29.723 5.429 14.565 1.00 47.99 C ATOM 1658 C ARG A 655 30.924 5.017 13.650 1.00 51.02 C ATOM 1659 O ARG A 655 31.041 5.490 12.522 1.00 50.12 O ATOM 1660 CB ARG A 655 29.283 6.900 14.337 1.00 44.88 C ATOM 1661 H ARG A 655 29.267 4.639 16.536 1.00 0.00 H ATOM 1662 N VAL A 656 31.789 4.118 14.139 1.00 42.36 N ATOM 1663 CA VAL A 656 32.956 3.620 13.390 1.00 46.83 C ATOM 1664 C VAL A 656 32.600 2.326 12.630 1.00 45.32 C ATOM 1665 O VAL A 656 32.156 1.335 13.224 1.00 43.32 O ATOM 1666 CB VAL A 656 34.129 3.334 14.351 1.00 48.46 C ATOM 1667 CG1 VAL A 656 35.318 2.723 13.601 1.00 53.11 C ATOM 1668 CG2 VAL A 656 34.551 4.628 15.064 1.00 50.05 C ATOM 1669 H VAL A 656 31.628 3.752 15.099 1.00 0.00 H ATOM 1670 N TYR A 657 32.785 2.332 11.318 1.00 44.72 N ATOM 1671 CA TYR A 657 32.546 1.138 10.487 1.00 41.71 C ATOM 1672 C TYR A 657 33.839 0.755 9.780 1.00 40.77 C ATOM 1673 O TYR A 657 34.412 1.578 9.066 1.00 39.48 O ATOM 1674 CB TYR A 657 31.492 1.425 9.429 1.00 45.60 C ATOM 1675 CG TYR A 657 30.081 1.672 9.938 1.00 48.74 C ATOM 1676 CD1 TYR A 657 29.693 2.933 10.390 1.00 52.87 C ATOM 1677 CD2 TYR A 657 29.124 0.662 9.907 1.00 46.74 C ATOM 1678 CE1 TYR A 657 28.399 3.174 10.823 1.00 56.53 C ATOM 1679 CE2 TYR A 657 27.828 0.888 10.333 1.00 50.78 C ATOM 1680 CZ TYR A 657 27.466 2.151 10.775 1.00 51.76 C ATOM 1681 OH TYR A 657 26.184 2.371 11.187 1.00 51.50 O ATOM 1682 HH TYR A 657 26.087 3.315 11.470 1.00 0.00 H ATOM 1683 H TYR A 657 33.109 3.207 10.860 1.00 0.00 H ATOM 1684 N THR A 658 34.279 -0.488 9.959 1.00 39.39 N ATOM 1685 CA THR A 658 35.498 -1.005 9.328 1.00 37.98 C ATOM 1686 C THR A 658 35.166 -2.361 8.690 1.00 38.17 C ATOM 1687 O THR A 658 34.038 -2.872 8.861 1.00 34.30 O ATOM 1688 CB THR A 658 36.609 -1.251 10.372 1.00 38.63 C ATOM 1689 OG1 THR A 658 36.153 -2.227 11.311 1.00 35.00 O ATOM 1690 CG2 THR A 658 37.027 0.048 11.083 1.00 41.20 C ATOM 1691 HG1 THR A 658 36.860 -2.391 11.984 1.00 0.00 H ATOM 1692 H THR A 658 33.733 -1.123 10.575 1.00 0.00 H ATOM 1693 N HIS A 659 36.177 -3.009 8.101 1.00 34.51 N ATOM 1694 CA HIS A 659 36.012 -4.400 7.642 1.00 36.50 C ATOM 1695 C HIS A 659 35.722 -5.319 8.827 1.00 34.52 C ATOM 1696 O HIS A 659 34.933 -6.250 8.718 1.00 31.53 O ATOM 1697 CB HIS A 659 37.248 -4.898 6.879 1.00 36.48 C ATOM 1698 CG HIS A 659 37.485 -4.166 5.604 1.00 37.52 C ATOM 1699 ND1 HIS A 659 36.572 -4.181 4.565 1.00 34.69 N ATOM 1700 CD2 HIS A 659 38.473 -3.308 5.236 1.00 36.19 C ATOM 1701 CE1 HIS A 659 37.024 -3.410 3.586 1.00 40.77 C ATOM 1702 NE2 HIS A 659 38.159 -2.851 3.976 1.00 37.55 N ATOM 1703 H HIS A 659 37.088 -2.527 7.966 1.00 0.00 H ATOM 1704 N GLN A 660 36.294 -4.997 9.979 1.00 32.46 N ATOM 1705 CA GLN A 660 36.070 -5.798 11.165 1.00 36.57 C ATOM 1706 C GLN A 660 34.685 -5.667 11.755 1.00 31.97 C ATOM 1707 O GLN A 660 34.166 -6.642 12.336 1.00 30.37 O ATOM 1708 CB GLN A 660 37.163 -5.584 12.236 1.00 37.33 C ATOM 1709 CG GLN A 660 38.523 -6.174 11.837 1.00 41.14 C ATOM 1710 CD GLN A 660 38.438 -7.592 11.178 1.00 46.30 C ATOM 1711 OE1 GLN A 660 38.409 -7.714 9.939 1.00 43.90 O ATOM 1712 NE2 GLN A 660 38.486 -8.641 11.991 1.00 39.13 N ATOM 1713 HE22 GLN A 660 38.509 -8.500 13.021 1.00 0.00 H ATOM 1714 HE21 GLN A 660 38.500 -9.604 11.598 1.00 0.00 H ATOM 1715 H GLN A 660 36.910 -4.161 10.032 1.00 0.00 H ATOM 1716 N SER A 661 34.061 -4.512 11.579 1.00 30.83 N ATOM 1717 CA SER A 661 32.651 -4.368 11.935 1.00 34.50 C ATOM 1718 C SER A 661 31.732 -5.142 10.967 1.00 38.08 C ATOM 1719 O SER A 661 30.740 -5.747 11.388 1.00 33.87 O ATOM 1720 CB SER A 661 32.276 -2.878 12.094 1.00 35.43 C ATOM 1721 OG SER A 661 32.214 -2.230 10.868 1.00 41.04 O ATOM 1722 HG SER A 661 31.530 -2.665 10.300 1.00 0.00 H ATOM 1723 H SER A 661 34.579 -3.701 11.184 1.00 0.00 H ATOM 1724 N ASP A 662 32.145 -5.278 9.709 1.00 33.95 N ATOM 1725 CA ASP A 662 31.420 -6.141 8.797 1.00 33.28 C ATOM 1726 C ASP A 662 31.538 -7.602 9.234 1.00 30.00 C ATOM 1727 O ASP A 662 30.648 -8.372 8.958 1.00 31.69 O ATOM 1728 CB ASP A 662 31.942 -6.047 7.358 1.00 35.33 C ATOM 1729 CG ASP A 662 31.451 -4.833 6.602 1.00 38.11 C ATOM 1730 OD1 ASP A 662 30.413 -4.210 6.926 1.00 34.68 O ATOM 1731 OD2 ASP A 662 32.082 -4.543 5.564 1.00 40.62 O ATOM 1732 H ASP A 662 32.988 -4.765 9.380 1.00 0.00 H ATOM 1733 N VAL A 663 32.670 -7.987 9.804 1.00 30.38 N ATOM 1734 CA VAL A 663 32.844 -9.330 10.318 1.00 30.29 C ATOM 1735 C VAL A 663 31.849 -9.662 11.443 1.00 32.12 C ATOM 1736 O VAL A 663 31.307 -10.770 11.515 1.00 29.75 O ATOM 1737 CB VAL A 663 34.275 -9.569 10.789 1.00 28.94 C ATOM 1738 CG1 VAL A 663 34.388 -10.875 11.580 1.00 29.90 C ATOM 1739 CG2 VAL A 663 35.232 -9.622 9.588 1.00 32.77 C ATOM 1740 H VAL A 663 33.454 -7.308 9.885 1.00 0.00 H ATOM 1741 N TRP A 664 31.598 -8.698 12.302 1.00 33.28 N ATOM 1742 CA TRP A 664 30.598 -8.871 13.338 1.00 33.70 C ATOM 1743 C TRP A 664 29.248 -9.152 12.704 1.00 30.60 C ATOM 1744 O TRP A 664 28.529 -10.069 13.119 1.00 32.73 O ATOM 1745 CB TRP A 664 30.524 -7.593 14.223 1.00 36.05 C ATOM 1746 CG TRP A 664 29.474 -7.645 15.247 1.00 31.00 C ATOM 1747 CD1 TRP A 664 28.114 -7.600 15.044 1.00 33.33 C ATOM 1748 CD2 TRP A 664 29.670 -7.794 16.658 1.00 32.87 C ATOM 1749 NE1 TRP A 664 27.466 -7.672 16.247 1.00 32.00 N ATOM 1750 CE2 TRP A 664 28.398 -7.796 17.253 1.00 34.48 C ATOM 1751 CE3 TRP A 664 30.804 -7.863 17.480 1.00 36.65 C ATOM 1752 CZ2 TRP A 664 28.228 -7.903 18.629 1.00 34.89 C ATOM 1753 CZ3 TRP A 664 30.630 -7.932 18.860 1.00 38.68 C ATOM 1754 CH2 TRP A 664 29.353 -7.957 19.410 1.00 34.76 C ATOM 1755 HE1 TRP A 664 26.435 -7.638 16.380 1.00 0.00 H ATOM 1756 H TRP A 664 32.122 -7.802 12.238 1.00 0.00 H ATOM 1757 N SER A 665 28.911 -8.394 11.672 1.00 30.51 N ATOM 1758 CA SER A 665 27.653 -8.579 11.010 1.00 27.22 C ATOM 1759 C SER A 665 27.556 -9.954 10.350 1.00 31.77 C ATOM 1760 O SER A 665 26.466 -10.548 10.274 1.00 30.60 O ATOM 1761 CB SER A 665 27.377 -7.488 9.961 1.00 26.88 C ATOM 1762 OG SER A 665 27.523 -6.182 10.469 1.00 31.39 O ATOM 1763 HG SER A 665 26.888 -6.047 11.217 1.00 0.00 H ATOM 1764 H SER A 665 29.565 -7.657 11.339 1.00 0.00 H ATOM 1765 N PHE A 666 28.676 -10.427 9.809 1.00 30.14 N ATOM 1766 CA PHE A 666 28.698 -11.703 9.154 1.00 27.90 C ATOM 1767 C PHE A 666 28.394 -12.785 10.194 1.00 29.86 C ATOM 1768 O PHE A 666 27.716 -13.738 9.889 1.00 32.52 O ATOM 1769 CB PHE A 666 30.057 -11.966 8.539 1.00 28.80 C ATOM 1770 CG PHE A 666 30.189 -13.341 7.938 1.00 29.54 C ATOM 1771 CD1 PHE A 666 29.825 -13.572 6.611 1.00 34.13 C ATOM 1772 CD2 PHE A 666 30.651 -14.386 8.684 1.00 30.97 C ATOM 1773 CE1 PHE A 666 29.917 -14.833 6.056 1.00 34.12 C ATOM 1774 CE2 PHE A 666 30.776 -15.643 8.124 1.00 34.28 C ATOM 1775 CZ PHE A 666 30.408 -15.871 6.822 1.00 35.49 C ATOM 1776 H PHE A 666 29.548 -9.863 9.862 1.00 0.00 H ATOM 1777 N GLY A 667 28.889 -12.640 11.418 1.00 31.54 N ATOM 1778 CA GLY A 667 28.509 -13.587 12.488 1.00 35.52 C ATOM 1779 C GLY A 667 26.994 -13.620 12.741 1.00 32.13 C ATOM 1780 O GLY A 667 26.421 -14.680 12.918 1.00 31.97 O ATOM 1781 H GLY A 667 29.545 -11.859 11.624 1.00 0.00 H ATOM 1782 N ILE A 668 26.347 -12.456 12.673 1.00 32.16 N ATOM 1783 CA ILE A 668 24.912 -12.373 12.831 1.00 34.32 C ATOM 1784 C ILE A 668 24.245 -13.052 11.651 1.00 37.81 C ATOM 1785 O ILE A 668 23.304 -13.832 11.803 1.00 33.62 O ATOM 1786 CB ILE A 668 24.417 -10.897 12.965 1.00 35.34 C ATOM 1787 CG1 ILE A 668 25.103 -10.152 14.121 1.00 35.21 C ATOM 1788 CG2 ILE A 668 22.907 -10.848 13.156 1.00 32.97 C ATOM 1789 CD1 ILE A 668 24.814 -10.684 15.535 1.00 38.37 C ATOM 1790 H ILE A 668 26.889 -11.585 12.502 1.00 0.00 H ATOM 1791 N LEU A 669 24.772 -12.812 10.455 1.00 36.44 N ATOM 1792 CA LEU A 669 24.277 -13.486 9.276 1.00 30.79 C ATOM 1793 C LEU A 669 24.379 -15.017 9.375 1.00 32.15 C ATOM 1794 O LEU A 669 23.492 -15.726 8.883 1.00 31.95 O ATOM 1795 CB LEU A 669 24.985 -12.960 8.027 1.00 33.86 C ATOM 1796 CG LEU A 669 24.553 -13.517 6.665 1.00 41.06 C ATOM 1797 CD1 LEU A 669 24.748 -12.456 5.600 1.00 50.69 C ATOM 1798 CD2 LEU A 669 25.384 -14.711 6.319 1.00 45.73 C ATOM 1799 H LEU A 669 25.552 -12.130 10.366 1.00 0.00 H ATOM 1800 N LEU A 670 25.499 -15.513 9.900 1.00 29.74 N ATOM 1801 CA LEU A 670 25.690 -16.949 10.115 1.00 35.28 C ATOM 1802 C LEU A 670 24.600 -17.547 10.993 1.00 35.57 C ATOM 1803 O LEU A 670 24.169 -18.683 10.777 1.00 34.92 O ATOM 1804 CB LEU A 670 26.994 -17.237 10.826 1.00 36.77 C ATOM 1805 CG LEU A 670 28.192 -17.715 10.055 1.00 52.71 C ATOM 1806 CD1 LEU A 670 29.285 -17.955 11.083 1.00 49.37 C ATOM 1807 CD2 LEU A 670 27.874 -18.961 9.218 1.00 48.60 C ATOM 1808 H LEU A 670 26.263 -14.859 10.166 1.00 0.00 H ATOM 1809 N TRP A 671 24.300 -16.838 12.072 1.00 37.21 N ATOM 1810 CA TRP A 671 23.191 -17.189 12.951 1.00 35.98 C ATOM 1811 C TRP A 671 21.864 -17.189 12.215 1.00 36.04 C ATOM 1812 O TRP A 671 21.052 -18.118 12.368 1.00 39.51 O ATOM 1813 CB TRP A 671 23.148 -16.219 14.127 1.00 36.88 C ATOM 1814 CG TRP A 671 22.177 -16.629 15.236 1.00 41.19 C ATOM 1815 CD1 TRP A 671 22.464 -17.385 16.345 1.00 41.53 C ATOM 1816 CD2 TRP A 671 20.779 -16.338 15.297 1.00 37.28 C ATOM 1817 NE1 TRP A 671 21.321 -17.561 17.102 1.00 43.62 N ATOM 1818 CE2 TRP A 671 20.279 -16.916 16.494 1.00 40.24 C ATOM 1819 CE3 TRP A 671 19.906 -15.608 14.488 1.00 42.76 C ATOM 1820 CZ2 TRP A 671 18.946 -16.801 16.879 1.00 46.23 C ATOM 1821 CZ3 TRP A 671 18.570 -15.501 14.864 1.00 50.15 C ATOM 1822 CH2 TRP A 671 18.105 -16.095 16.054 1.00 46.12 C ATOM 1823 HE1 TRP A 671 21.263 -18.098 17.991 1.00 0.00 H ATOM 1824 H TRP A 671 24.876 -16.002 12.300 1.00 0.00 H ATOM 1825 N GLU A 672 21.644 -16.193 11.362 1.00 35.09 N ATOM 1826 CA GLU A 672 20.448 -16.202 10.524 1.00 33.49 C ATOM 1827 C GLU A 672 20.399 -17.449 9.662 1.00 36.29 C ATOM 1828 O GLU A 672 19.344 -18.011 9.432 1.00 38.44 O ATOM 1829 CB GLU A 672 20.391 -14.980 9.603 1.00 38.86 C ATOM 1830 CG GLU A 672 20.146 -13.639 10.272 1.00 44.59 C ATOM 1831 CD GLU A 672 20.049 -12.517 9.252 1.00 42.63 C ATOM 1832 OE1 GLU A 672 18.931 -12.157 8.820 1.00 40.12 O ATOM 1833 OE2 GLU A 672 21.116 -11.997 8.844 1.00 37.76 O ATOM 1834 H GLU A 672 22.323 -15.408 11.292 1.00 0.00 H ATOM 1835 N ILE A 673 21.540 -17.872 9.126 1.00 36.01 N ATOM 1836 CA ILE A 673 21.509 -18.979 8.168 1.00 34.89 C ATOM 1837 C ILE A 673 21.082 -20.236 8.919 1.00 34.58 C ATOM 1838 O ILE A 673 20.273 -21.053 8.419 1.00 33.83 O ATOM 1839 CB ILE A 673 22.880 -19.180 7.457 1.00 31.68 C ATOM 1840 CG1 ILE A 673 23.063 -18.065 6.401 1.00 37.44 C ATOM 1841 CG2 ILE A 673 22.951 -20.560 6.831 1.00 35.96 C ATOM 1842 CD1 ILE A 673 24.474 -17.938 5.821 1.00 39.45 C ATOM 1843 H ILE A 673 22.442 -17.423 9.384 1.00 0.00 H ATOM 1844 N PHE A 674 21.695 -20.422 10.074 1.00 34.64 N ATOM 1845 CA PHE A 674 21.487 -21.646 10.826 1.00 39.91 C ATOM 1846 C PHE A 674 20.225 -21.632 11.700 1.00 46.68 C ATOM 1847 O PHE A 674 19.970 -22.610 12.367 1.00 42.76 O ATOM 1848 CB PHE A 674 22.713 -21.987 11.640 1.00 41.87 C ATOM 1849 CG PHE A 674 23.768 -22.621 10.817 1.00 50.11 C ATOM 1850 CD1 PHE A 674 23.761 -23.992 10.623 1.00 48.04 C ATOM 1851 CD2 PHE A 674 24.665 -21.834 10.095 1.00 48.33 C ATOM 1852 CE1 PHE A 674 24.681 -24.576 9.768 1.00 50.48 C ATOM 1853 CE2 PHE A 674 25.558 -22.408 9.219 1.00 49.33 C ATOM 1854 CZ PHE A 674 25.568 -23.783 9.061 1.00 48.63 C ATOM 1855 H PHE A 674 22.330 -19.688 10.447 1.00 0.00 H ATOM 1856 N THR A 675 19.430 -20.557 11.643 1.00 41.95 N ATOM 1857 CA THR A 675 18.059 -20.558 12.167 1.00 40.07 C ATOM 1858 C THR A 675 17.072 -20.531 11.014 1.00 40.22 C ATOM 1859 O THR A 675 15.914 -20.194 11.196 1.00 40.60 O ATOM 1860 CB THR A 675 17.821 -19.337 13.093 1.00 38.48 C ATOM 1861 OG1 THR A 675 18.155 -18.115 12.415 1.00 38.97 O ATOM 1862 CG2 THR A 675 18.630 -19.465 14.332 1.00 37.86 C ATOM 1863 HG1 THR A 675 19.109 -18.136 12.150 1.00 0.00 H ATOM 1864 H THR A 675 19.798 -19.686 11.210 1.00 0.00 H ATOM 1865 N LEU A 676 17.564 -20.783 9.800 1.00 38.96 N ATOM 1866 CA LEU A 676 16.761 -20.661 8.595 1.00 41.94 C ATOM 1867 C LEU A 676 15.978 -19.371 8.530 1.00 39.45 C ATOM 1868 O LEU A 676 14.783 -19.345 8.153 1.00 38.22 O ATOM 1869 CB LEU A 676 15.822 -21.865 8.452 1.00 50.10 C ATOM 1870 CG LEU A 676 16.496 -23.236 8.469 1.00 48.19 C ATOM 1871 CD1 LEU A 676 15.439 -24.284 8.121 1.00 53.06 C ATOM 1872 CD2 LEU A 676 17.653 -23.326 7.487 1.00 50.62 C ATOM 1873 H LEU A 676 18.558 -21.077 9.713 1.00 0.00 H ATOM 1874 N GLY A 677 16.676 -18.279 8.822 1.00 38.00 N ATOM 1875 CA GLY A 677 16.114 -16.964 8.645 1.00 37.11 C ATOM 1876 C GLY A 677 15.393 -16.432 9.874 1.00 34.07 C ATOM 1877 O GLY A 677 14.457 -15.664 9.745 1.00 41.56 O ATOM 1878 H GLY A 677 17.646 -18.375 9.185 1.00 0.00 H ATOM 1879 N GLY A 678 15.886 -16.778 11.040 1.00 40.20 N ATOM 1880 CA GLY A 678 15.347 -16.268 12.281 1.00 47.22 C ATOM 1881 C GLY A 678 15.752 -14.830 12.545 1.00 48.83 C ATOM 1882 O GLY A 678 16.713 -14.313 11.935 1.00 48.10 O ATOM 1883 H GLY A 678 16.688 -17.439 11.072 1.00 0.00 H ATOM 1884 N SER A 679 15.013 -14.201 13.464 1.00 44.88 N ATOM 1885 CA SER A 679 15.239 -12.813 13.884 1.00 48.36 C ATOM 1886 C SER A 679 16.192 -12.807 15.043 1.00 45.74 C ATOM 1887 O SER A 679 15.974 -13.500 16.044 1.00 49.48 O ATOM 1888 CB SER A 679 13.927 -12.144 14.321 1.00 51.05 C ATOM 1889 OG SER A 679 12.890 -12.512 13.438 1.00 55.56 O ATOM 1890 HG SER A 679 12.046 -12.079 13.723 1.00 0.00 H ATOM 1891 H SER A 679 14.232 -14.726 13.907 1.00 0.00 H ATOM 1892 N PRO A 680 17.286 -12.056 14.912 1.00 46.33 N ATOM 1893 CA PRO A 680 18.336 -12.064 15.931 1.00 45.43 C ATOM 1894 C PRO A 680 17.868 -11.544 17.304 1.00 40.42 C ATOM 1895 O PRO A 680 17.017 -10.674 17.372 1.00 45.04 O ATOM 1896 CB PRO A 680 19.397 -11.117 15.348 1.00 45.81 C ATOM 1897 CG PRO A 680 19.122 -11.056 13.905 1.00 51.34 C ATOM 1898 CD PRO A 680 17.639 -11.211 13.757 1.00 49.19 C ATOM 1899 N TYR A 681 18.500 -12.015 18.366 1.00 46.86 N ATOM 1900 CA TYR A 681 18.135 -11.659 19.738 1.00 54.23 C ATOM 1901 C TYR A 681 16.627 -11.761 19.895 1.00 56.30 C ATOM 1902 O TYR A 681 15.934 -10.750 20.087 1.00 66.66 O ATOM 1903 CB TYR A 681 18.650 -10.273 20.118 1.00 50.68 C ATOM 1904 CG TYR A 681 20.133 -10.089 19.854 1.00 45.80 C ATOM 1905 CD1 TYR A 681 21.076 -10.510 20.763 1.00 41.79 C ATOM 1906 CD2 TYR A 681 20.583 -9.547 18.646 1.00 46.08 C ATOM 1907 CE1 TYR A 681 22.427 -10.328 20.524 1.00 45.55 C ATOM 1908 CE2 TYR A 681 21.941 -9.382 18.386 1.00 39.95 C ATOM 1909 CZ TYR A 681 22.854 -9.780 19.311 1.00 39.67 C ATOM 1910 OH TYR A 681 24.203 -9.607 19.063 1.00 40.28 O ATOM 1911 HH TYR A 681 24.393 -8.644 18.935 1.00 0.00 H ATOM 1912 H TYR A 681 19.295 -12.670 18.219 1.00 0.00 H ATOM 1913 N PRO A 682 16.111 -12.977 19.685 1.00 58.44 N ATOM 1914 CA PRO A 682 14.678 -13.229 19.645 1.00 65.17 C ATOM 1915 C PRO A 682 14.000 -12.768 20.938 1.00 77.81 C ATOM 1916 O PRO A 682 14.485 -13.075 22.047 1.00 61.65 O ATOM 1917 CB PRO A 682 14.578 -14.756 19.505 1.00 69.81 C ATOM 1918 CG PRO A 682 15.962 -15.262 19.269 1.00 71.16 C ATOM 1919 CD PRO A 682 16.894 -14.222 19.801 1.00 61.48 C ATOM 1920 N GLY A 683 12.939 -11.976 20.778 1.00 82.71 N ATOM 1921 CA GLY A 683 12.244 -11.352 21.893 1.00 89.00 C ATOM 1922 C GLY A 683 12.933 -10.078 22.334 1.00 90.72 C ATOM 1923 O GLY A 683 12.352 -8.995 22.251 1.00 84.90 O ATOM 1924 H GLY A 683 12.593 -11.797 19.814 1.00 0.00 H ATOM 1925 N ILE A 684 14.199 -10.216 22.735 1.00 88.30 N ATOM 1926 CA ILE A 684 14.905 -9.226 23.542 1.00 74.48 C ATOM 1927 C ILE A 684 14.685 -7.831 22.995 1.00 85.20 C ATOM 1928 O ILE A 684 15.091 -7.550 21.869 1.00 97.17 O ATOM 1929 CB ILE A 684 16.416 -9.541 23.611 1.00 72.99 C ATOM 1930 CG1 ILE A 684 16.652 -10.687 24.594 1.00 75.73 C ATOM 1931 CG2 ILE A 684 17.235 -8.319 24.024 1.00 73.31 C ATOM 1932 CD1 ILE A 684 18.063 -11.235 24.583 1.00 80.61 C ATOM 1933 H ILE A 684 14.711 -11.077 22.457 1.00 0.00 H ATOM 1934 N PRO A 685 14.040 -6.951 23.793 1.00 96.37 N ATOM 1935 CA PRO A 685 13.673 -5.635 23.269 1.00 92.81 C ATOM 1936 C PRO A 685 14.909 -4.851 22.840 1.00 80.93 C ATOM 1937 O PRO A 685 15.933 -4.900 23.529 1.00 86.01 O ATOM 1938 CB PRO A 685 12.972 -4.961 24.460 1.00 89.58 C ATOM 1939 CG PRO A 685 13.546 -5.621 25.669 1.00 88.71 C ATOM 1940 CD PRO A 685 13.840 -7.038 25.257 1.00 93.84 C ATOM 1941 N VAL A 686 14.790 -4.101 21.745 1.00 78.70 N ATOM 1942 CA VAL A 686 15.931 -3.405 21.142 1.00 85.78 C ATOM 1943 C VAL A 686 16.695 -2.451 22.084 1.00 90.80 C ATOM 1944 O VAL A 686 17.700 -1.857 21.671 1.00 95.02 O ATOM 1945 CB VAL A 686 15.500 -2.632 19.879 1.00 74.88 C ATOM 1946 H VAL A 686 13.854 -4.006 21.302 1.00 0.00 H ATOM 1947 N GLU A 687 16.232 -2.316 23.333 1.00 77.85 N ATOM 1948 CA GLU A 687 16.850 -1.428 24.322 1.00 68.80 C ATOM 1949 C GLU A 687 17.769 -2.179 25.282 1.00 68.41 C ATOM 1950 O GLU A 687 18.785 -1.626 25.734 1.00 70.58 O ATOM 1951 CB GLU A 687 15.767 -0.671 25.096 1.00 73.62 C ATOM 1952 H GLU A 687 15.396 -2.866 23.614 1.00 0.00 H ATOM 1953 N GLU A 688 17.446 -3.450 25.555 1.00 67.00 N ATOM 1954 CA GLU A 688 18.284 -4.306 26.413 1.00 61.73 C ATOM 1955 C GLU A 688 19.536 -4.842 25.703 1.00 60.25 C ATOM 1956 O GLU A 688 20.436 -5.419 26.347 1.00 63.45 O ATOM 1957 CB GLU A 688 17.464 -5.483 26.970 1.00 60.22 C ATOM 1958 H GLU A 688 16.575 -3.846 25.148 1.00 0.00 H ATOM 1959 N LEU A 689 19.584 -4.670 24.379 1.00 68.74 N ATOM 1960 CA LEU A 689 20.669 -5.217 23.548 1.00 58.19 C ATOM 1961 C LEU A 689 22.025 -4.687 23.981 1.00 45.35 C ATOM 1962 O LEU A 689 22.939 -5.430 24.276 1.00 49.49 O ATOM 1963 CB LEU A 689 20.422 -4.863 22.067 1.00 55.25 C ATOM 1964 CG LEU A 689 21.482 -5.376 21.069 1.00 58.57 C ATOM 1965 CD1 LEU A 689 21.782 -6.863 21.225 1.00 55.32 C ATOM 1966 CD2 LEU A 689 21.037 -5.070 19.651 1.00 58.71 C ATOM 1967 H LEU A 689 18.825 -4.129 23.917 1.00 0.00 H ATOM 1968 N PHE A 690 22.134 -3.376 24.050 1.00 57.17 N ATOM 1969 CA PHE A 690 23.425 -2.722 24.276 1.00 55.51 C ATOM 1970 C PHE A 690 23.984 -3.104 25.617 1.00 54.71 C ATOM 1971 O PHE A 690 25.176 -3.390 25.756 1.00 50.93 O ATOM 1972 CB PHE A 690 23.236 -1.213 24.161 1.00 60.11 C ATOM 1973 CG PHE A 690 22.315 -0.843 23.045 1.00 66.62 C ATOM 1974 CD1 PHE A 690 22.603 -1.267 21.756 1.00 73.56 C ATOM 1975 CD2 PHE A 690 21.064 -0.282 23.300 1.00 71.03 C ATOM 1976 CE1 PHE A 690 21.710 -1.033 20.719 1.00 81.40 C ATOM 1977 CE2 PHE A 690 20.160 -0.056 22.269 1.00 72.08 C ATOM 1978 CZ PHE A 690 20.484 -0.428 20.974 1.00 76.51 C ATOM 1979 H PHE A 690 21.282 -2.790 23.941 1.00 0.00 H ATOM 1980 N SER A 691 23.097 -3.191 26.602 1.00 54.63 N ATOM 1981 CA SER A 691 23.493 -3.646 27.922 1.00 50.22 C ATOM 1982 C SER A 691 23.931 -5.122 27.921 1.00 41.20 C ATOM 1983 O SER A 691 24.966 -5.477 28.516 1.00 50.35 O ATOM 1984 CB SER A 691 22.338 -3.408 28.909 1.00 59.45 C ATOM 1985 OG SER A 691 22.550 -4.096 30.120 1.00 51.94 O ATOM 1986 HG SER A 691 21.792 -3.924 30.733 1.00 0.00 H ATOM 1987 H SER A 691 22.106 -2.930 26.425 1.00 0.00 H ATOM 1988 N LEU A 692 23.154 -5.980 27.250 1.00 50.16 N ATOM 1989 CA LEU A 692 23.546 -7.395 27.048 1.00 44.69 C ATOM 1990 C LEU A 692 24.983 -7.504 26.506 1.00 43.80 C ATOM 1991 O LEU A 692 25.822 -8.267 27.027 1.00 46.38 O ATOM 1992 CB LEU A 692 22.561 -8.069 26.079 1.00 56.26 C ATOM 1993 H LEU A 692 22.250 -5.645 26.859 1.00 0.00 H ATOM 1994 N LEU A 693 25.295 -6.699 25.485 1.00 45.77 N ATOM 1995 CA LEU A 693 26.584 -6.836 24.809 1.00 46.46 C ATOM 1996 C LEU A 693 27.704 -6.366 25.689 1.00 45.07 C ATOM 1997 O LEU A 693 28.781 -7.013 25.794 1.00 41.00 O ATOM 1998 CB LEU A 693 26.574 -6.065 23.492 1.00 49.58 C ATOM 1999 CG LEU A 693 25.578 -6.545 22.429 1.00 46.72 C ATOM 2000 CD1 LEU A 693 25.707 -5.670 21.190 1.00 49.28 C ATOM 2001 CD2 LEU A 693 25.818 -8.010 22.085 1.00 42.72 C ATOM 2002 H LEU A 693 24.619 -5.974 25.171 1.00 0.00 H ATOM 2003 N ARG A 694 27.462 -5.235 26.352 1.00 47.15 N ATOM 2004 CA ARG A 694 28.448 -4.687 27.291 1.00 47.80 C ATOM 2005 C ARG A 694 28.764 -5.637 28.424 1.00 48.83 C ATOM 2006 O ARG A 694 29.875 -5.652 28.922 1.00 51.10 O ATOM 2007 CB ARG A 694 27.958 -3.364 27.880 1.00 50.49 C ATOM 2008 CG ARG A 694 28.358 -2.173 27.043 1.00 48.66 C ATOM 2009 CD ARG A 694 27.306 -1.077 27.080 1.00 43.97 C ATOM 2010 NE ARG A 694 27.806 0.112 26.395 1.00 40.27 N ATOM 2011 CZ ARG A 694 27.150 1.260 26.281 1.00 41.92 C ATOM 2012 NH1 ARG A 694 25.927 1.402 26.798 1.00 44.99 N ATOM 2013 NH2 ARG A 694 27.698 2.265 25.590 1.00 43.13 N ATOM 2014 HE ARG A 694 28.750 0.055 25.963 1.00 0.00 H ATOM 2015 HH12 ARG A 694 25.424 2.307 26.702 1.00 0.00 H ATOM 2016 HH11 ARG A 694 25.478 0.608 27.297 1.00 0.00 H ATOM 2017 HH22 ARG A 694 27.191 3.168 25.495 1.00 0.00 H ATOM 2018 HH21 ARG A 694 28.631 2.144 25.147 1.00 0.00 H ATOM 2019 H ARG A 694 26.563 -4.734 26.202 1.00 0.00 H ATOM 2020 N GLU A 695 27.787 -6.434 28.824 1.00 46.03 N ATOM 2021 CA GLU A 695 28.011 -7.399 29.886 1.00 57.48 C ATOM 2022 C GLU A 695 28.574 -8.756 29.398 1.00 61.47 C ATOM 2023 O GLU A 695 28.846 -9.639 30.209 1.00 55.90 O ATOM 2024 CB GLU A 695 26.719 -7.538 30.727 1.00 63.17 C ATOM 2025 CG GLU A 695 26.584 -6.405 31.773 1.00 74.03 C ATOM 2026 CD GLU A 695 25.153 -5.911 32.039 1.00 78.03 C ATOM 2027 OE1 GLU A 695 24.194 -6.593 31.608 1.00 85.07 O ATOM 2028 OE2 GLU A 695 24.988 -4.837 32.700 1.00 58.01 O ATOM 2029 H GLU A 695 26.851 -6.369 28.375 1.00 0.00 H ATOM 2030 N GLY A 696 28.846 -8.905 28.098 1.00 53.14 N ATOM 2031 CA GLY A 696 29.469 -10.139 27.603 1.00 44.90 C ATOM 2032 C GLY A 696 28.493 -11.184 27.081 1.00 40.61 C ATOM 2033 O GLY A 696 28.902 -12.251 26.649 1.00 54.56 O ATOM 2034 H GLY A 696 28.615 -8.141 27.432 1.00 0.00 H ATOM 2035 N HIS A 697 27.221 -10.838 27.006 1.00 44.60 N ATOM 2036 CA HIS A 697 26.202 -11.737 26.511 1.00 46.28 C ATOM 2037 C HIS A 697 26.212 -11.738 24.997 1.00 49.03 C ATOM 2038 O HIS A 697 26.345 -10.679 24.398 1.00 51.24 O ATOM 2039 CB HIS A 697 24.808 -11.248 26.921 1.00 45.61 C ATOM 2040 H HIS A 697 26.942 -9.885 27.314 1.00 0.00 H ATOM 2041 N ARG A 698 25.879 -12.889 24.414 1.00 43.82 N ATOM 2042 CA ARG A 698 25.681 -13.037 22.970 1.00 49.89 C ATOM 2043 C ARG A 698 24.532 -13.990 22.731 1.00 45.23 C ATOM 2044 O ARG A 698 24.108 -14.679 23.658 1.00 49.11 O ATOM 2045 CB ARG A 698 26.951 -13.623 22.355 1.00 41.28 C ATOM 2046 CG ARG A 698 28.189 -12.768 22.561 1.00 37.24 C ATOM 2047 CD ARG A 698 28.045 -11.419 21.875 1.00 33.40 C ATOM 2048 NE ARG A 698 29.308 -10.698 21.956 1.00 37.62 N ATOM 2049 CZ ARG A 698 29.664 -9.832 22.905 1.00 44.15 C ATOM 2050 NH1 ARG A 698 28.863 -9.560 23.945 1.00 46.63 N ATOM 2051 NH2 ARG A 698 30.866 -9.266 22.830 1.00 35.24 N ATOM 2052 HE ARG A 698 29.999 -10.876 21.200 1.00 0.00 H ATOM 2053 HH12 ARG A 698 29.166 -8.880 24.671 1.00 0.00 H ATOM 2054 HH11 ARG A 698 27.938 -10.029 24.026 1.00 0.00 H ATOM 2055 HH22 ARG A 698 31.167 -8.587 23.558 1.00 0.00 H ATOM 2056 HH21 ARG A 698 31.504 -9.503 22.043 1.00 0.00 H ATOM 2057 H ARG A 698 25.753 -13.727 25.016 1.00 0.00 H ATOM 2058 N MET A 699 24.070 -14.110 21.498 1.00 41.56 N ATOM 2059 CA MET A 699 23.099 -15.175 21.184 1.00 40.74 C ATOM 2060 C MET A 699 23.619 -16.560 21.504 1.00 42.22 C ATOM 2061 O MET A 699 24.843 -16.834 21.466 1.00 45.54 O ATOM 2062 CB MET A 699 22.620 -15.138 19.748 1.00 42.54 C ATOM 2063 CG MET A 699 21.721 -13.959 19.508 1.00 45.04 C ATOM 2064 SD MET A 699 21.066 -13.902 17.866 1.00 49.13 S ATOM 2065 CE MET A 699 22.441 -13.213 16.915 1.00 47.84 C ATOM 2066 H MET A 699 24.389 -13.457 20.754 1.00 0.00 H ATOM 2067 N ASP A 700 22.671 -17.406 21.892 1.00 45.64 N ATOM 2068 CA ASP A 700 22.913 -18.815 22.170 1.00 51.04 C ATOM 2069 C ASP A 700 23.019 -19.603 20.881 1.00 48.98 C ATOM 2070 O ASP A 700 22.479 -19.204 19.851 1.00 44.79 O ATOM 2071 CB ASP A 700 21.726 -19.405 22.934 1.00 57.23 C ATOM 2072 CG ASP A 700 21.552 -18.800 24.301 1.00 64.23 C ATOM 2073 OD1 ASP A 700 22.566 -18.631 25.010 1.00 57.83 O ATOM 2074 OD2 ASP A 700 20.393 -18.525 24.665 1.00 66.74 O ATOM 2075 H ASP A 700 21.703 -17.042 22.003 1.00 0.00 H ATOM 2076 N ARG A 701 23.577 -20.799 20.998 1.00 49.57 N ATOM 2077 CA ARG A 701 23.685 -21.699 19.869 1.00 47.85 C ATOM 2078 C ARG A 701 22.301 -22.072 19.413 1.00 52.19 C ATOM 2079 O ARG A 701 21.505 -22.507 20.210 1.00 57.09 O ATOM 2080 CB ARG A 701 24.461 -22.940 20.265 1.00 46.43 C ATOM 2081 CG ARG A 701 24.734 -23.914 19.127 1.00 50.93 C ATOM 2082 CD ARG A 701 25.774 -24.935 19.554 1.00 53.89 C ATOM 2083 NE ARG A 701 25.222 -25.807 20.581 1.00 55.40 N ATOM 2084 CZ ARG A 701 24.331 -26.775 20.357 1.00 62.39 C ATOM 2085 NH1 ARG A 701 23.933 -27.073 19.122 1.00 54.78 N ATOM 2086 NH2 ARG A 701 23.843 -27.466 21.378 1.00 58.26 N ATOM 2087 HE ARG A 701 25.545 -25.665 21.559 1.00 0.00 H ATOM 2088 HH12 ARG A 701 23.238 -27.831 18.968 1.00 0.00 H ATOM 2089 HH11 ARG A 701 24.317 -26.548 18.311 1.00 0.00 H ATOM 2090 HH22 ARG A 701 23.148 -28.222 21.210 1.00 0.00 H ATOM 2091 HH21 ARG A 701 24.155 -27.252 22.347 1.00 0.00 H ATOM 2092 H ARG A 701 23.946 -21.098 21.923 1.00 0.00 H ATOM 2093 N PRO A 702 21.995 -21.856 18.127 1.00 54.06 N ATOM 2094 CA PRO A 702 20.707 -22.328 17.619 1.00 55.85 C ATOM 2095 C PRO A 702 20.604 -23.857 17.585 1.00 56.58 C ATOM 2096 O PRO A 702 21.628 -24.546 17.487 1.00 52.94 O ATOM 2097 CB PRO A 702 20.640 -21.782 16.197 1.00 50.03 C ATOM 2098 CG PRO A 702 21.982 -21.254 15.883 1.00 48.94 C ATOM 2099 CD PRO A 702 22.749 -21.062 17.141 1.00 49.92 C ATOM 2100 N PRO A 703 19.374 -24.379 17.694 1.00 63.93 N ATOM 2101 CA PRO A 703 19.146 -25.813 17.591 1.00 58.43 C ATOM 2102 C PRO A 703 19.833 -26.404 16.373 1.00 60.73 C ATOM 2103 O PRO A 703 19.724 -25.856 15.262 1.00 52.33 O ATOM 2104 CB PRO A 703 17.625 -25.918 17.455 1.00 61.06 C ATOM 2105 CG PRO A 703 17.090 -24.699 18.138 1.00 63.57 C ATOM 2106 CD PRO A 703 18.158 -23.646 18.107 1.00 60.89 C ATOM 2107 N HIS A 704 20.555 -27.500 16.603 1.00 58.82 N ATOM 2108 CA HIS A 704 21.135 -28.327 15.541 1.00 67.71 C ATOM 2109 C HIS A 704 22.363 -27.683 14.906 1.00 65.36 C ATOM 2110 O HIS A 704 22.993 -28.295 14.057 1.00 73.02 O ATOM 2111 CB HIS A 704 20.095 -28.715 14.469 1.00 68.78 C ATOM 2112 CG HIS A 704 18.767 -29.108 15.037 1.00 81.61 C ATOM 2113 ND1 HIS A 704 18.633 -30.074 16.014 1.00 88.48 N ATOM 2114 CD2 HIS A 704 17.524 -28.609 14.827 1.00 85.96 C ATOM 2115 CE1 HIS A 704 17.362 -30.170 16.363 1.00 85.28 C ATOM 2116 NE2 HIS A 704 16.670 -29.286 15.665 1.00 91.67 N ATOM 2117 H HIS A 704 20.716 -27.784 17.590 1.00 0.00 H ATOM 2118 N CYS A 705 22.738 -26.485 15.357 1.00 63.72 N ATOM 2119 CA CYS A 705 23.958 -25.831 14.882 1.00 55.98 C ATOM 2120 C CYS A 705 25.167 -26.499 15.498 1.00 53.63 C ATOM 2121 O CYS A 705 25.303 -26.494 16.717 1.00 51.55 O ATOM 2122 CB CYS A 705 23.972 -24.349 15.273 1.00 57.58 C ATOM 2123 SG CYS A 705 25.423 -23.449 14.656 1.00 48.26 S ATOM 2124 H CYS A 705 22.148 -26.003 16.065 1.00 0.00 H ATOM 2125 N PRO A 706 26.072 -27.051 14.668 1.00 54.41 N ATOM 2126 CA PRO A 706 27.217 -27.707 15.300 1.00 48.57 C ATOM 2127 C PRO A 706 28.102 -26.730 16.064 1.00 54.10 C ATOM 2128 O PRO A 706 28.155 -25.547 15.723 1.00 49.87 O ATOM 2129 CB PRO A 706 27.987 -28.340 14.127 1.00 48.76 C ATOM 2130 CG PRO A 706 27.306 -27.904 12.889 1.00 56.76 C ATOM 2131 CD PRO A 706 25.951 -27.381 13.241 1.00 52.61 C ATOM 2132 N PRO A 707 28.809 -27.227 17.083 1.00 55.45 N ATOM 2133 CA PRO A 707 29.720 -26.424 17.871 1.00 53.64 C ATOM 2134 C PRO A 707 30.734 -25.621 17.072 1.00 51.90 C ATOM 2135 O PRO A 707 31.078 -24.518 17.486 1.00 49.97 O ATOM 2136 CB PRO A 707 30.422 -27.462 18.739 1.00 56.91 C ATOM 2137 CG PRO A 707 29.366 -28.498 18.960 1.00 57.79 C ATOM 2138 CD PRO A 707 28.561 -28.545 17.703 1.00 58.16 C ATOM 2139 N GLU A 708 31.245 -26.198 15.989 1.00 49.90 N ATOM 2140 CA GLU A 708 32.247 -25.559 15.146 1.00 52.67 C ATOM 2141 C GLU A 708 31.693 -24.265 14.541 1.00 44.48 C ATOM 2142 O GLU A 708 32.359 -23.255 14.532 1.00 40.30 O ATOM 2143 CB GLU A 708 32.716 -26.511 14.017 1.00 49.78 C ATOM 2144 H GLU A 708 30.914 -27.150 15.731 1.00 0.00 H ATOM 2145 N LEU A 709 30.476 -24.306 14.036 1.00 39.55 N ATOM 2146 CA LEU A 709 29.891 -23.117 13.462 1.00 42.95 C ATOM 2147 C LEU A 709 29.456 -22.087 14.501 1.00 51.23 C ATOM 2148 O LEU A 709 29.662 -20.865 14.307 1.00 40.11 O ATOM 2149 CB LEU A 709 28.754 -23.474 12.511 1.00 45.61 C ATOM 2150 CG LEU A 709 29.408 -23.644 11.118 1.00 52.90 C ATOM 2151 CD1 LEU A 709 29.582 -25.100 10.722 1.00 50.21 C ATOM 2152 CD2 LEU A 709 28.604 -22.875 10.110 1.00 61.08 C ATOM 2153 H LEU A 709 29.937 -25.195 14.051 1.00 0.00 H ATOM 2154 N TYR A 710 28.907 -22.550 15.622 1.00 43.19 N ATOM 2155 CA TYR A 710 28.658 -21.632 16.734 1.00 39.71 C ATOM 2156 C TYR A 710 29.930 -20.937 17.173 1.00 38.43 C ATOM 2157 O TYR A 710 29.920 -19.735 17.368 1.00 36.85 O ATOM 2158 CB TYR A 710 27.995 -22.343 17.926 1.00 44.02 C ATOM 2159 CG TYR A 710 27.571 -21.378 19.029 1.00 45.26 C ATOM 2160 CD1 TYR A 710 26.667 -20.342 18.763 1.00 40.43 C ATOM 2161 CD2 TYR A 710 28.127 -21.467 20.316 1.00 44.16 C ATOM 2162 CE1 TYR A 710 26.328 -19.421 19.737 1.00 45.68 C ATOM 2163 CE2 TYR A 710 27.781 -20.563 21.308 1.00 46.85 C ATOM 2164 CZ TYR A 710 26.883 -19.552 21.023 1.00 45.51 C ATOM 2165 OH TYR A 710 26.553 -18.658 21.998 1.00 41.82 O ATOM 2166 HH TYR A 710 25.904 -18.003 21.637 1.00 0.00 H ATOM 2167 H TYR A 710 28.657 -23.556 15.707 1.00 0.00 H ATOM 2168 N GLY A 711 31.014 -21.703 17.298 1.00 39.49 N ATOM 2169 CA GLY A 711 32.347 -21.190 17.634 1.00 40.44 C ATOM 2170 C GLY A 711 32.818 -20.063 16.721 1.00 43.30 C ATOM 2171 O GLY A 711 33.373 -19.068 17.193 1.00 42.38 O ATOM 2172 H GLY A 711 30.908 -22.727 17.148 1.00 0.00 H ATOM 2173 N LEU A 712 32.578 -20.202 15.415 1.00 41.80 N ATOM 2174 CA LEU A 712 32.874 -19.123 14.469 1.00 40.15 C ATOM 2175 C LEU A 712 32.020 -17.894 14.740 1.00 37.09 C ATOM 2176 O LEU A 712 32.516 -16.763 14.681 1.00 37.31 O ATOM 2177 CB LEU A 712 32.591 -19.576 13.018 1.00 43.74 C ATOM 2178 CG LEU A 712 33.715 -20.167 12.199 1.00 48.92 C ATOM 2179 CD1 LEU A 712 33.195 -20.405 10.777 1.00 51.41 C ATOM 2180 CD2 LEU A 712 34.914 -19.229 12.189 1.00 42.51 C ATOM 2181 H LEU A 712 32.173 -21.093 15.063 1.00 0.00 H ATOM 2182 N MET A 713 30.713 -18.095 14.901 1.00 35.03 N ATOM 2183 CA MET A 713 29.841 -16.957 15.250 1.00 36.82 C ATOM 2184 C MET A 713 30.398 -16.199 16.430 1.00 37.19 C ATOM 2185 O MET A 713 30.556 -14.985 16.386 1.00 38.34 O ATOM 2186 CB MET A 713 28.462 -17.415 15.623 1.00 42.72 C ATOM 2187 CG MET A 713 27.701 -18.049 14.508 1.00 43.25 C ATOM 2188 SD MET A 713 26.169 -18.630 15.213 1.00 41.33 S ATOM 2189 CE MET A 713 25.855 -19.896 13.991 1.00 40.74 C ATOM 2190 H MET A 713 30.310 -19.046 14.782 1.00 0.00 H ATOM 2191 N ARG A 714 30.770 -16.930 17.475 1.00 37.74 N ATOM 2192 CA ARG A 714 31.269 -16.304 18.686 1.00 37.47 C ATOM 2193 C ARG A 714 32.567 -15.537 18.485 1.00 41.09 C ATOM 2194 O ARG A 714 32.790 -14.526 19.139 1.00 37.60 O ATOM 2195 CB ARG A 714 31.450 -17.357 19.781 1.00 41.30 C ATOM 2196 CG ARG A 714 30.125 -17.951 20.233 1.00 44.55 C ATOM 2197 CD ARG A 714 29.263 -16.907 20.942 1.00 53.98 C ATOM 2198 NE ARG A 714 29.966 -16.390 22.119 1.00 59.70 N ATOM 2199 CZ ARG A 714 29.658 -16.672 23.387 1.00 63.09 C ATOM 2200 NH1 ARG A 714 28.605 -17.424 23.706 1.00 55.54 N ATOM 2201 NH2 ARG A 714 30.400 -16.160 24.351 1.00 67.18 N ATOM 2202 HE ARG A 714 30.770 -15.752 21.953 1.00 0.00 H ATOM 2203 HH12 ARG A 714 28.393 -17.625 24.704 1.00 0.00 H ATOM 2204 HH11 ARG A 714 27.996 -17.810 22.957 1.00 0.00 H ATOM 2205 HH22 ARG A 714 30.177 -16.368 25.345 1.00 0.00 H ATOM 2206 HH21 ARG A 714 31.208 -15.549 24.116 1.00 0.00 H ATOM 2207 H ARG A 714 30.703 -17.967 17.425 1.00 0.00 H ATOM 2208 N GLU A 715 33.430 -16.004 17.590 1.00 36.96 N ATOM 2209 CA GLU A 715 34.662 -15.287 17.312 1.00 38.99 C ATOM 2210 C GLU A 715 34.358 -13.980 16.598 1.00 34.74 C ATOM 2211 O GLU A 715 35.039 -12.981 16.833 1.00 34.95 O ATOM 2212 CB GLU A 715 35.622 -16.130 16.463 1.00 48.88 C ATOM 2213 CG GLU A 715 36.267 -17.303 17.194 1.00 58.19 C ATOM 2214 CD GLU A 715 36.879 -18.326 16.239 1.00 77.37 C ATOM 2215 OE1 GLU A 715 37.610 -17.917 15.309 1.00 82.27 O ATOM 2216 OE2 GLU A 715 36.627 -19.543 16.409 1.00 94.08 O ATOM 2217 H GLU A 715 33.222 -16.889 17.085 1.00 0.00 H ATOM 2218 N CYS A 716 33.352 -13.984 15.721 1.00 33.99 N ATOM 2219 CA CYS A 716 32.999 -12.755 15.007 1.00 36.14 C ATOM 2220 C CYS A 716 32.430 -11.726 15.994 1.00 39.11 C ATOM 2221 O CYS A 716 32.371 -10.534 15.694 1.00 32.65 O ATOM 2222 CB CYS A 716 31.940 -13.031 13.927 1.00 38.32 C ATOM 2223 SG CYS A 716 32.438 -14.099 12.525 1.00 35.62 S ATOM 2224 H CYS A 716 32.819 -14.859 15.545 1.00 0.00 H ATOM 2225 N TRP A 717 31.951 -12.198 17.147 1.00 36.83 N ATOM 2226 CA TRP A 717 31.311 -11.315 18.126 1.00 33.50 C ATOM 2227 C TRP A 717 32.191 -10.983 19.312 1.00 38.74 C ATOM 2228 O TRP A 717 31.682 -10.503 20.321 1.00 40.35 O ATOM 2229 CB TRP A 717 29.979 -11.899 18.628 1.00 35.41 C ATOM 2230 CG TRP A 717 28.980 -12.243 17.592 1.00 31.78 C ATOM 2231 CD1 TRP A 717 28.786 -11.628 16.371 1.00 32.55 C ATOM 2232 CD2 TRP A 717 27.991 -13.265 17.682 1.00 35.81 C ATOM 2233 NE1 TRP A 717 27.737 -12.220 15.711 1.00 36.03 N ATOM 2234 CE2 TRP A 717 27.237 -13.229 16.494 1.00 35.77 C ATOM 2235 CE3 TRP A 717 27.672 -14.209 18.651 1.00 37.24 C ATOM 2236 CZ2 TRP A 717 26.187 -14.101 16.261 1.00 40.26 C ATOM 2237 CZ3 TRP A 717 26.637 -15.078 18.414 1.00 37.33 C ATOM 2238 CH2 TRP A 717 25.914 -15.036 17.234 1.00 39.40 C ATOM 2239 HE1 TRP A 717 27.381 -11.948 14.773 1.00 0.00 H ATOM 2240 H TRP A 717 32.034 -13.214 17.355 1.00 0.00 H ATOM 2241 N HIS A 718 33.499 -11.206 19.203 1.00 39.03 N ATOM 2242 CA HIS A 718 34.444 -10.613 20.139 1.00 43.20 C ATOM 2243 C HIS A 718 34.289 -9.101 20.159 1.00 44.35 C ATOM 2244 O HIS A 718 34.207 -8.462 19.110 1.00 36.64 O ATOM 2245 CB HIS A 718 35.893 -10.953 19.784 1.00 46.45 C ATOM 2246 CG HIS A 718 36.268 -12.368 20.072 1.00 59.95 C ATOM 2247 ND1 HIS A 718 37.575 -12.798 20.089 1.00 69.96 N ATOM 2248 CD2 HIS A 718 35.513 -13.443 20.397 1.00 63.66 C ATOM 2249 CE1 HIS A 718 37.608 -14.088 20.367 1.00 63.16 C ATOM 2250 NE2 HIS A 718 36.371 -14.504 20.558 1.00 61.94 N ATOM 2251 H HIS A 718 33.852 -11.814 18.436 1.00 0.00 H ATOM 2252 N ALA A 719 34.358 -8.532 21.356 1.00 39.41 N ATOM 2253 CA ALA A 719 34.207 -7.083 21.538 1.00 47.99 C ATOM 2254 C ALA A 719 35.326 -6.352 20.804 1.00 44.06 C ATOM 2255 O ALA A 719 35.103 -5.320 20.179 1.00 40.47 O ATOM 2256 CB ALA A 719 34.228 -6.713 23.036 1.00 43.25 C ATOM 2257 H ALA A 719 34.524 -9.131 22.190 1.00 0.00 H ATOM 2258 N ALA A 720 36.547 -6.841 20.965 1.00 38.02 N ATOM 2259 CA ALA A 720 37.687 -6.201 20.337 1.00 43.15 C ATOM 2260 C ALA A 720 37.731 -6.543 18.815 1.00 35.67 C ATOM 2261 O ALA A 720 37.877 -7.706 18.458 1.00 37.80 O ATOM 2262 CB ALA A 720 38.966 -6.639 21.052 1.00 42.06 C ATOM 2263 H ALA A 720 36.689 -7.691 21.547 1.00 0.00 H ATOM 2264 N PRO A 721 37.583 -5.538 17.933 1.00 40.03 N ATOM 2265 CA PRO A 721 37.692 -5.764 16.463 1.00 40.98 C ATOM 2266 C PRO A 721 38.858 -6.637 16.055 1.00 42.21 C ATOM 2267 O PRO A 721 38.693 -7.509 15.214 1.00 36.16 O ATOM 2268 CB PRO A 721 37.938 -4.359 15.901 1.00 40.79 C ATOM 2269 CG PRO A 721 37.326 -3.430 16.890 1.00 41.92 C ATOM 2270 CD PRO A 721 37.400 -4.104 18.244 1.00 43.49 C ATOM 2271 N SER A 722 40.022 -6.412 16.669 1.00 38.87 N ATOM 2272 CA SER A 722 41.239 -7.076 16.261 1.00 39.91 C ATOM 2273 C SER A 722 41.251 -8.517 16.678 1.00 43.80 C ATOM 2274 O SER A 722 42.091 -9.257 16.210 1.00 44.69 O ATOM 2275 CB SER A 722 42.472 -6.389 16.853 1.00 43.72 C ATOM 2276 OG SER A 722 42.474 -6.528 18.253 1.00 43.61 O ATOM 2277 HG SER A 722 41.657 -6.111 18.626 1.00 0.00 H ATOM 2278 H SER A 722 40.054 -5.741 17.463 1.00 0.00 H ATOM 2279 N GLN A 723 40.350 -8.921 17.568 1.00 40.51 N ATOM 2280 CA GLN A 723 40.243 -10.331 17.917 1.00 41.89 C ATOM 2281 C GLN A 723 39.215 -11.060 17.094 1.00 41.62 C ATOM 2282 O GLN A 723 39.096 -12.264 17.230 1.00 41.55 O ATOM 2283 CB GLN A 723 39.901 -10.535 19.404 1.00 44.77 C ATOM 2284 CG GLN A 723 40.827 -9.839 20.376 1.00 54.38 C ATOM 2285 CD GLN A 723 42.276 -10.147 20.100 1.00 63.17 C ATOM 2286 OE1 GLN A 723 42.737 -11.258 20.347 1.00 76.92 O ATOM 2287 NE2 GLN A 723 43.003 -9.168 19.564 1.00 75.69 N ATOM 2288 HE22 GLN A 723 42.569 -8.243 19.372 1.00 0.00 H ATOM 2289 HE21 GLN A 723 44.005 -9.329 19.337 1.00 0.00 H ATOM 2290 H GLN A 723 39.719 -8.227 18.017 1.00 0.00 H ATOM 2291 N ARG A 724 38.464 -10.366 16.242 1.00 35.76 N ATOM 2292 CA ARG A 724 37.566 -11.086 15.343 1.00 39.37 C ATOM 2293 C ARG A 724 38.386 -11.686 14.205 1.00 40.43 C ATOM 2294 O ARG A 724 39.437 -11.154 13.846 1.00 34.39 O ATOM 2295 CB ARG A 724 36.482 -10.165 14.786 1.00 37.54 C ATOM 2296 CG ARG A 724 35.742 -9.414 15.865 1.00 35.63 C ATOM 2297 CD ARG A 724 34.739 -8.427 15.333 1.00 40.60 C ATOM 2298 NE ARG A 724 34.398 -7.532 16.436 1.00 40.05 N ATOM 2299 CZ ARG A 724 34.089 -6.253 16.331 1.00 39.99 C ATOM 2300 NH1 ARG A 724 33.977 -5.668 15.145 1.00 40.39 N ATOM 2301 NH2 ARG A 724 33.898 -5.547 17.436 1.00 38.35 N ATOM 2302 HE ARG A 724 34.399 -7.940 17.392 1.00 0.00 H ATOM 2303 HH12 ARG A 724 33.733 -4.659 15.084 1.00 0.00 H ATOM 2304 HH11 ARG A 724 34.134 -6.219 14.277 1.00 0.00 H ATOM 2305 HH22 ARG A 724 33.654 -4.538 17.373 1.00 0.00 H ATOM 2306 HH21 ARG A 724 33.992 -6.002 18.366 1.00 0.00 H ATOM 2307 H ARG A 724 38.516 -9.328 16.217 1.00 0.00 H ATOM 2308 N PRO A 725 37.880 -12.753 13.594 1.00 35.79 N ATOM 2309 CA PRO A 725 38.563 -13.239 12.398 1.00 38.42 C ATOM 2310 C PRO A 725 38.528 -12.231 11.239 1.00 36.03 C ATOM 2311 O PRO A 725 37.643 -11.375 11.197 1.00 32.73 O ATOM 2312 CB PRO A 725 37.778 -14.489 12.012 1.00 38.00 C ATOM 2313 CG PRO A 725 36.791 -14.747 13.076 1.00 39.76 C ATOM 2314 CD PRO A 725 36.644 -13.489 13.884 1.00 38.67 C ATOM 2315 N THR A 726 39.458 -12.370 10.295 1.00 33.84 N ATOM 2316 CA THR A 726 39.384 -11.670 9.002 1.00 32.97 C ATOM 2317 C THR A 726 38.447 -12.441 8.034 1.00 32.34 C ATOM 2318 O THR A 726 38.161 -13.616 8.248 1.00 29.73 O ATOM 2319 CB THR A 726 40.757 -11.563 8.332 1.00 34.90 C ATOM 2320 OG1 THR A 726 41.246 -12.881 8.105 1.00 36.30 O ATOM 2321 CG2 THR A 726 41.757 -10.797 9.238 1.00 39.11 C ATOM 2322 HG1 THR A 726 42.135 -12.832 7.672 1.00 0.00 H ATOM 2323 H THR A 726 40.267 -12.997 10.479 1.00 0.00 H ATOM 2324 N PHE A 727 38.005 -11.791 6.961 1.00 28.81 N ATOM 2325 CA PHE A 727 37.243 -12.490 5.945 1.00 33.23 C ATOM 2326 C PHE A 727 38.041 -13.624 5.312 1.00 35.06 C ATOM 2327 O PHE A 727 37.491 -14.709 5.086 1.00 33.34 O ATOM 2328 CB PHE A 727 36.614 -11.548 4.913 1.00 30.74 C ATOM 2329 CG PHE A 727 35.361 -10.891 5.411 1.00 32.22 C ATOM 2330 CD1 PHE A 727 34.248 -11.650 5.715 1.00 31.39 C ATOM 2331 CD2 PHE A 727 35.335 -9.538 5.676 1.00 34.19 C ATOM 2332 CE1 PHE A 727 33.099 -11.064 6.223 1.00 33.33 C ATOM 2333 CE2 PHE A 727 34.185 -8.937 6.155 1.00 33.67 C ATOM 2334 CZ PHE A 727 33.074 -9.699 6.447 1.00 32.70 C ATOM 2335 H PHE A 727 38.207 -10.777 6.850 1.00 0.00 H ATOM 2336 N LYS A 728 39.356 -13.450 5.244 1.00 34.12 N ATOM 2337 CA LYS A 728 40.213 -14.520 4.747 1.00 34.97 C ATOM 2338 C LYS A 728 40.168 -15.712 5.672 1.00 33.17 C ATOM 2339 O LYS A 728 40.069 -16.839 5.208 1.00 31.71 O ATOM 2340 CB LYS A 728 41.651 -14.027 4.630 1.00 40.55 C ATOM 2341 CG LYS A 728 42.620 -15.088 4.130 1.00 45.41 C ATOM 2342 CD LYS A 728 43.881 -14.430 3.597 1.00 53.06 C ATOM 2343 CE LYS A 728 44.685 -15.376 2.730 1.00 60.90 C ATOM 2344 NZ LYS A 728 45.391 -16.347 3.588 1.00 65.09 N ATOM 2345 HZ1 LYS A 728 46.029 -15.838 4.233 1.00 0.00 H ATOM 2346 HZ2 LYS A 728 44.696 -16.888 4.142 1.00 0.00 H ATOM 2347 HZ3 LYS A 728 45.943 -16.997 2.993 1.00 0.00 H ATOM 2348 H LYS A 728 39.776 -12.548 5.546 1.00 0.00 H ATOM 2349 N GLN A 729 40.245 -15.482 6.983 1.00 34.85 N ATOM 2350 CA GLN A 729 40.137 -16.599 7.939 1.00 35.18 C ATOM 2351 C GLN A 729 38.748 -17.220 7.936 1.00 29.76 C ATOM 2352 O GLN A 729 38.578 -18.404 8.156 1.00 33.00 O ATOM 2353 CB GLN A 729 40.557 -16.188 9.359 1.00 35.47 C ATOM 2354 CG GLN A 729 42.034 -15.854 9.502 1.00 40.51 C ATOM 2355 CD GLN A 729 42.354 -15.094 10.790 1.00 45.55 C ATOM 2356 OE1 GLN A 729 41.640 -14.180 11.204 1.00 38.16 O ATOM 2357 NE2 GLN A 729 43.434 -15.482 11.430 1.00 47.54 N ATOM 2358 HE22 GLN A 729 44.013 -16.258 11.050 1.00 0.00 H ATOM 2359 HE21 GLN A 729 43.710 -15.013 12.316 1.00 0.00 H ATOM 2360 H GLN A 729 40.382 -14.512 7.332 1.00 0.00 H ATOM 2361 N LEU A 730 37.716 -16.435 7.706 1.00 30.26 N ATOM 2362 CA LEU A 730 36.371 -17.059 7.673 1.00 30.76 C ATOM 2363 C LEU A 730 36.216 -17.958 6.451 1.00 36.78 C ATOM 2364 O LEU A 730 35.597 -19.038 6.511 1.00 31.85 O ATOM 2365 CB LEU A 730 35.283 -15.989 7.672 1.00 31.67 C ATOM 2366 CG LEU A 730 35.170 -15.202 8.999 1.00 33.85 C ATOM 2367 CD1 LEU A 730 34.342 -13.931 8.803 1.00 34.78 C ATOM 2368 CD2 LEU A 730 34.525 -16.097 10.024 1.00 36.66 C ATOM 2369 H LEU A 730 37.840 -15.414 7.553 1.00 0.00 H ATOM 2370 N VAL A 731 36.736 -17.488 5.321 1.00 33.38 N ATOM 2371 CA VAL A 731 36.742 -18.319 4.087 1.00 33.54 C ATOM 2372 C VAL A 731 37.453 -19.649 4.363 1.00 31.50 C ATOM 2373 O VAL A 731 36.921 -20.735 4.091 1.00 32.56 O ATOM 2374 CB VAL A 731 37.401 -17.536 2.919 1.00 30.76 C ATOM 2375 CG1 VAL A 731 37.709 -18.426 1.713 1.00 35.41 C ATOM 2376 CG2 VAL A 731 36.481 -16.417 2.490 1.00 33.00 C ATOM 2377 H VAL A 731 37.142 -16.531 5.300 1.00 0.00 H ATOM 2378 N GLU A 732 38.627 -19.566 4.960 1.00 33.46 N ATOM 2379 CA GLU A 732 39.424 -20.755 5.252 1.00 34.82 C ATOM 2380 C GLU A 732 38.765 -21.699 6.238 1.00 37.21 C ATOM 2381 O GLU A 732 38.866 -22.917 6.091 1.00 37.08 O ATOM 2382 CB GLU A 732 40.809 -20.369 5.771 1.00 38.54 C ATOM 2383 CG GLU A 732 41.712 -19.793 4.695 1.00 46.36 C ATOM 2384 CD GLU A 732 42.905 -19.006 5.273 1.00 57.11 C ATOM 2385 OE1 GLU A 732 43.799 -18.623 4.485 1.00 52.47 O ATOM 2386 OE2 GLU A 732 42.930 -18.723 6.500 1.00 66.12 O ATOM 2387 H GLU A 732 38.994 -18.631 5.229 1.00 0.00 H ATOM 2388 N ALA A 733 38.166 -21.153 7.288 1.00 33.60 N ATOM 2389 CA ALA A 733 37.413 -21.981 8.238 1.00 32.20 C ATOM 2390 C ALA A 733 36.213 -22.652 7.593 1.00 30.80 C ATOM 2391 O ALA A 733 35.947 -23.819 7.845 1.00 34.30 O ATOM 2392 CB ALA A 733 36.950 -21.141 9.425 1.00 35.85 C ATOM 2393 H ALA A 733 38.231 -20.126 7.440 1.00 0.00 H ATOM 2394 N LEU A 734 35.412 -21.911 6.823 1.00 30.62 N ATOM 2395 CA LEU A 734 34.266 -22.526 6.214 1.00 29.79 C ATOM 2396 C LEU A 734 34.686 -23.562 5.139 1.00 37.72 C ATOM 2397 O LEU A 734 34.035 -24.609 4.942 1.00 33.81 O ATOM 2398 CB LEU A 734 33.303 -21.473 5.668 1.00 31.53 C ATOM 2399 CG LEU A 734 32.698 -20.594 6.775 1.00 33.87 C ATOM 2400 CD1 LEU A 734 32.164 -19.298 6.201 1.00 32.91 C ATOM 2401 CD2 LEU A 734 31.624 -21.336 7.594 1.00 32.09 C ATOM 2402 H LEU A 734 35.615 -20.903 6.667 1.00 0.00 H ATOM 2403 N ASP A 735 35.767 -23.254 4.431 1.00 37.71 N ATOM 2404 CA ASP A 735 36.361 -24.218 3.496 1.00 38.74 C ATOM 2405 C ASP A 735 36.712 -25.544 4.216 1.00 39.64 C ATOM 2406 O ASP A 735 36.344 -26.619 3.734 1.00 35.28 O ATOM 2407 CB ASP A 735 37.602 -23.600 2.861 1.00 42.04 C ATOM 2408 CG ASP A 735 38.208 -24.467 1.778 1.00 44.48 C ATOM 2409 OD1 ASP A 735 37.456 -24.937 0.889 1.00 43.82 O ATOM 2410 OD2 ASP A 735 39.449 -24.605 1.802 1.00 37.47 O ATOM 2411 H ASP A 735 36.200 -22.315 4.541 1.00 0.00 H ATOM 2412 N LYS A 736 37.372 -25.470 5.373 1.00 36.80 N ATOM 2413 CA LYS A 736 37.740 -26.694 6.106 1.00 40.08 C ATOM 2414 C LYS A 736 36.502 -27.501 6.434 1.00 41.28 C ATOM 2415 O LYS A 736 36.507 -28.715 6.319 1.00 43.45 O ATOM 2416 CB LYS A 736 38.515 -26.385 7.399 1.00 38.74 C ATOM 2417 H LYS A 736 37.629 -24.540 5.761 1.00 0.00 H ATOM 2418 N VAL A 737 35.420 -26.829 6.810 1.00 38.63 N ATOM 2419 CA VAL A 737 34.165 -27.536 7.089 1.00 40.67 C ATOM 2420 C VAL A 737 33.594 -28.248 5.881 1.00 42.39 C ATOM 2421 O VAL A 737 33.232 -29.434 5.970 1.00 40.89 O ATOM 2422 CB VAL A 737 33.066 -26.631 7.685 1.00 39.08 C ATOM 2423 CG1 VAL A 737 31.797 -27.438 7.944 1.00 40.07 C ATOM 2424 CG2 VAL A 737 33.554 -25.988 8.983 1.00 37.12 C ATOM 2425 H VAL A 737 35.463 -25.794 6.907 1.00 0.00 H ATOM 2426 N LEU A 738 33.507 -27.547 4.754 1.00 41.79 N ATOM 2427 CA LEU A 738 32.977 -28.151 3.538 1.00 41.95 C ATOM 2428 C LEU A 738 33.850 -29.299 3.024 1.00 48.89 C ATOM 2429 O LEU A 738 33.330 -30.312 2.576 1.00 50.20 O ATOM 2430 CB LEU A 738 32.818 -27.116 2.451 1.00 41.40 C ATOM 2431 CG LEU A 738 31.674 -26.155 2.680 1.00 41.25 C ATOM 2432 CD1 LEU A 738 31.869 -24.939 1.778 1.00 45.35 C ATOM 2433 CD2 LEU A 738 30.343 -26.830 2.401 1.00 43.15 C ATOM 2434 H LEU A 738 33.821 -26.556 4.740 1.00 0.00 H ATOM 2435 N LEU A 739 35.165 -29.148 3.140 1.00 43.95 N ATOM 2436 CA LEU A 739 36.098 -30.221 2.826 1.00 50.31 C ATOM 2437 C LEU A 739 35.893 -31.433 3.708 1.00 48.10 C ATOM 2438 O LEU A 739 36.087 -32.535 3.250 1.00 47.46 O ATOM 2439 CB LEU A 739 37.550 -29.767 2.970 1.00 47.37 C ATOM 2440 CG LEU A 739 37.988 -28.698 1.972 1.00 55.12 C ATOM 2441 CD1 LEU A 739 39.329 -28.081 2.382 1.00 56.45 C ATOM 2442 CD2 LEU A 739 38.057 -29.297 0.592 1.00 50.72 C ATOM 2443 H LEU A 739 35.540 -28.234 3.465 1.00 0.00 H ATOM 2444 N ALA A 740 35.578 -31.238 4.985 1.00 43.24 N ATOM 2445 CA ALA A 740 35.448 -32.374 5.883 1.00 48.35 C ATOM 2446 C ALA A 740 34.139 -33.124 5.656 1.00 57.47 C ATOM 2447 O ALA A 740 34.020 -34.275 6.057 1.00 59.46 O ATOM 2448 CB ALA A 740 35.594 -31.956 7.340 1.00 43.04 C ATOM 2449 H ALA A 740 35.425 -30.273 5.341 1.00 0.00 H ATOM 2450 N VAL A 741 33.168 -32.496 4.997 1.00 59.05 N ATOM 2451 CA VAL A 741 31.885 -33.141 4.746 1.00 67.56 C ATOM 2452 C VAL A 741 31.990 -33.994 3.485 1.00 85.46 C ATOM 2453 O VAL A 741 31.433 -33.645 2.448 1.00 98.70 O ATOM 2454 CB VAL A 741 30.742 -32.102 4.630 1.00 66.33 C ATOM 2455 CG1 VAL A 741 29.445 -32.759 4.176 1.00 73.73 C ATOM 2456 CG2 VAL A 741 30.539 -31.408 5.965 1.00 62.67 C ATOM 2457 H VAL A 741 33.328 -31.527 4.655 1.00 0.00 H ATOM 2458 N SER A 742 32.743 -35.090 3.582 1.00 96.90 N ATOM 2459 CA SER A 742 32.813 -36.122 2.539 1.00105.02 C ATOM 2460 C SER A 742 33.039 -35.546 1.136 1.00101.30 C ATOM 2461 O SER A 742 32.094 -35.371 0.353 1.00 84.42 O ATOM 2462 CB SER A 742 31.554 -37.008 2.576 1.00107.01 C ATOM 2463 H SER A 742 33.312 -35.221 4.443 1.00 0.00 H TER 2464 SER A 742 HETATM 2465 O HOH 1 9.220 -32.418 6.021 1.00 56.69 O HETATM 2466 O HOH 2 38.211 -21.844 -0.342 1.00 36.68 O HETATM 2467 O HOH 3 8.370 -7.671 -15.435 1.00 62.82 O HETATM 2468 O HOH 4 23.002 -5.317 8.581 1.00 56.29 O HETATM 2469 O HOH 5 24.431 -7.823 17.072 1.00 38.31 O HETATM 2470 O HOH 6 27.865 -13.266 -11.975 1.00 43.69 O HETATM 2471 O HOH 7 36.128 -1.921 13.790 1.00 41.39 O HETATM 2472 O HOH 8 34.950 3.050 -17.087 1.00 41.27 O HETATM 2473 O HOH 9 16.922 7.625 -13.884 1.00 49.85 O HETATM 2474 O HOH 10 43.705 -13.098 7.597 1.00 51.17 O HETATM 2475 O HOH 11 18.463 -10.106 7.365 1.00 38.03 O HETATM 2476 O HOH 12 34.362 -5.468 4.640 1.00 38.52 O HETATM 2477 O HOH 13 40.539 -10.699 5.015 1.00 37.13 O HETATM 2478 O HOH 14 30.190 -2.606 9.334 1.00 53.49 O HETATM 2479 O HOH 15 35.209 -2.568 -14.072 1.00 39.21 O HETATM 2480 O HOH 16 23.894 -18.576 -10.564 1.00 56.38 O HETATM 2481 O HOH 17 40.027 -9.504 1.279 1.00 40.65 O HETATM 2482 O HOH 18 16.637 -13.224 9.583 1.00 56.68 O HETATM 2483 O HOH 19 36.826 -14.108 -2.451 1.00 41.22 O HETATM 2484 O HOH 20 37.295 -15.065 -5.017 1.00 54.36 O HETATM 2485 O HOH 21 25.587 -1.202 -5.091 1.00 44.91 O HETATM 2486 O HOH 22 27.489 -6.850 -19.279 1.00 42.49 O HETATM 2487 O HOH 23 9.965 -16.487 2.449 1.00 47.25 O HETATM 2488 O HOH 24 38.444 -8.969 7.379 1.00 37.21 O HETATM 2489 O HOH 25 29.507 0.757 -24.918 1.00 40.76 O HETATM 2490 O HOH 26 24.431 -5.291 17.744 1.00 40.96 O HETATM 2491 O HOH 27 42.614 -12.198 12.715 1.00 57.44 O HETATM 2492 O HOH 28 22.427 12.408 -23.899 1.00 62.04 O HETATM 2493 O HOH 29 20.468 -11.214 -14.521 1.00 46.36 O HETATM 2494 O HOH 30 31.085 -23.735 20.073 1.00 58.11 O HETATM 2495 O HOH 31 20.601 -2.119 1.526 1.00 54.21 O HETATM 2496 O HOH 32 34.086 4.319 -11.991 1.00 38.80 O HETATM 2497 O HOH 33 26.598 -2.994 10.332 1.00 53.65 O HETATM 2498 O HOH 34 11.441 -35.529 8.350 1.00 49.51 O HETATM 2499 O HOH 35 31.390 -13.969 21.473 1.00 42.24 O HETATM 2500 O HOH 36 15.352 -26.770 4.871 1.00 56.27 O HETATM 2501 O HOH 37 36.056 -12.143 -9.658 1.00 44.48 O HETATM 2502 O HOH 38 27.891 -4.780 8.071 1.00 35.08 O HETATM 2503 O HOH 39 31.035 -4.169 -8.861 1.00 34.63 O HETATM 2504 O HOH 40 43.707 -5.494 -3.056 1.00 60.71 O HETATM 2505 O HOH 41 24.803 -21.494 23.433 1.00 54.63 O HETATM 2506 O HOH 42 33.437 1.253 1.302 1.00 50.59 O HETATM 2507 O HOH 43 40.965 -4.176 18.594 1.00 44.39 O HETATM 2508 O HOH 44 39.878 -1.026 2.668 1.00 50.33 O HETATM 2509 O HOH 45 33.950 -6.467 2.392 1.00 57.24 O HETATM 2510 O HOH 46 37.316 -0.414 -5.684 1.00 50.51 O HETATM 2511 O HOH 47 34.408 -14.313 -9.336 1.00 39.27 O HETATM 2512 O HOH 48 28.686 -3.794 11.793 1.00 37.90 O HETATM 2513 O HOH 49 17.817 -14.321 -17.364 1.00 62.42 O HETATM 2514 O HOH 50 18.039 -4.333 14.205 1.00 51.70 O HETATM 2515 O HOH 51 25.270 -12.234 19.590 1.00 38.41 O HETATM 2516 O HOH 52 30.052 -5.736 -10.779 1.00 34.84 O HETATM 2517 O HOH 53 31.522 -7.900 25.343 1.00 52.73 O HETATM 2518 O HOH 54 28.337 5.556 -17.479 1.00 40.91 O HETATM 2519 O HOH 55 8.604 -1.449 -21.452 1.00 61.81 O HETATM 2520 O HOH 56 38.502 -1.239 7.745 1.00 44.27 O HETATM 2521 O HOH 57 41.657 -11.717 1.791 1.00 47.77 O HETATM 2522 O HOH 58 19.101 -15.934 -11.002 1.00 37.78 O HETATM 2523 O HOH 59 13.231 -10.058 3.908 1.00 51.27 O HETATM 2524 O HOH 60 24.427 -0.054 28.924 1.00 52.20 O HETATM 2525 O HOH 61 21.095 -14.206 -11.271 1.00 54.23 O HETATM 2526 O HOH 62 34.586 -10.345 23.788 1.00 44.00 O HETATM 2527 O HOH 63 33.970 -32.937 0.055 1.00 59.33 O HETATM 2528 O HOH 64 39.037 -3.556 10.414 1.00 58.15 O HETATM 2529 O HOH 65 37.352 -9.323 22.713 1.00 58.14 O HETATM 2530 O HOH 66 12.813 -11.893 -1.628 1.00 47.45 O HETATM 2531 O HOH 67 26.543 -15.233 26.491 1.00 50.89 O HETATM 2532 O HOH 68 16.433 -3.556 11.622 1.00 70.99 O HETATM 2533 O HOH 69 35.430 0.927 -15.858 1.00 44.34 O HETATM 2534 O HOH 70 25.329 -12.177 29.698 1.00 65.23 O HETATM 2535 O HOH 71 28.614 -24.820 21.385 1.00 59.42 O HETATM 2536 O HOH 72 35.013 -16.435 -8.066 1.00 56.91 O HETATM 2537 O HOH 73 14.016 -8.729 6.197 1.00 53.40 O HETATM 2538 O HOH 74 42.715 -13.940 14.808 1.00 69.85 O HETATM 2539 O HOH 75 39.741 -3.479 20.914 1.00 54.12 O HETATM 2540 O HOH 76 10.646 -11.180 -0.790 1.00 61.99 O HETATM 2541 C1 XL A 8 22.232 -3.737 -6.397 1.00 0.09 C HETATM 2542 C2 XL A 8 20.998 -4.384 -6.378 1.00 0.06 C HETATM 2543 C3 XL A 8 19.929 -3.968 -7.174 1.00 -0.00 C HETATM 2544 C4 XL A 8 20.116 -2.843 -7.948 1.00 0.06 C HETATM 2545 C5 XL A 8 21.336 -2.158 -7.956 1.00 0.09 C HETATM 2546 C6 XL A 8 22.392 -2.614 -7.182 1.00 -0.01 C HETATM 2547 H1 XL A 8 23.341 -2.090 -7.194 1.00 0.04 H HETATM 2548 O2 XL A 8 21.472 -1.068 -8.759 1.00 -0.32 O HETATM 2549 C8 XL A 8 22.679 -0.315 -8.698 1.00 0.06 C HETATM 2550 H5 XL A 8 22.623 0.525 -9.406 1.00 0.06 H HETATM 2551 H6 XL A 8 23.529 -0.962 -8.963 1.00 0.06 H HETATM 2552 H7 XL A 8 22.818 0.073 -7.678 1.00 0.06 H HETATM 2553 CL2 XL A 8 18.838 -2.369 -9.022 1.00 -0.10 CL HETATM 2554 C9 XL A 8 18.628 -4.736 -7.215 1.00 0.10 C HETATM 2555 O3 XL A 8 18.814 -5.959 -7.957 1.00 -0.30 O HETATM 2556 C10 XL A 8 17.986 -7.031 -7.717 1.00 0.13 C HETATM 2557 C11 XL A 8 16.708 -6.961 -7.176 1.00 0.04 C HETATM 2558 N1 XL A 8 15.965 -8.060 -7.020 1.00 -0.26 N HETATM 2559 C12 XL A 8 16.530 -9.236 -7.381 1.00 0.20 C HETATM 2560 N2 XL A 8 17.760 -9.376 -7.911 1.00 -0.26 N HETATM 2561 C13 XL A 8 18.471 -8.262 -8.088 1.00 0.04 C HETATM 2562 H11 XL A 8 19.456 -8.329 -8.536 1.00 0.08 H HETATM 2563 N3 XL A 8 15.849 -10.396 -7.165 1.00 -0.25 N HETATM 2564 C14 XL A 8 14.509 -10.531 -6.732 1.00 0.10 C HETATM 2565 C15 XL A 8 13.529 -10.975 -7.636 1.00 0.09 C HETATM 2566 C16 XL A 8 12.212 -11.067 -7.189 1.00 -0.04 C HETATM 2567 C17 XL A 8 11.892 -10.678 -5.897 1.00 0.01 C HETATM 2568 C18 XL A 8 12.844 -10.188 -5.024 1.00 -0.06 C HETATM 2569 C19 XL A 8 14.162 -10.138 -5.443 1.00 0.05 C HETATM 2570 CL3 XL A 8 15.370 -9.589 -4.325 1.00 -0.08 CL HETATM 2571 H14 XL A 8 12.565 -9.850 -4.033 1.00 0.05 H HETATM 2572 CL4 XL A 8 10.237 -10.738 -5.350 1.00 -0.09 CL HETATM 2573 H13 XL A 8 11.439 -11.442 -7.850 1.00 0.05 H HETATM 2574 N4 XL A 8 13.967 -11.417 -8.914 1.00 -0.24 N HETATM 2575 C20 XL A 8 13.281 -11.356 -10.079 1.00 0.20 C HETATM 2576 C21 XL A 8 13.984 -11.936 -11.292 1.00 0.04 C HETATM 2577 C22 XL A 8 15.481 -11.681 -11.370 1.00 -0.05 C HETATM 2578 H18 XL A 8 15.884 -12.143 -12.283 1.00 0.03 H HETATM 2579 H19 XL A 8 15.974 -12.118 -10.489 1.00 0.03 H HETATM 2580 H20 XL A 8 15.668 -10.597 -11.394 1.00 0.03 H HETATM 2581 H16 XL A 8 13.520 -11.503 -12.191 1.00 0.05 H HETATM 2582 H17 XL A 8 13.826 -13.025 -11.286 1.00 0.05 H HETATM 2583 O4 XL A 8 12.126 -10.960 -10.128 1.00 -0.39 O HETATM 2584 H15 XL A 8 14.883 -11.817 -8.957 1.00 0.22 H HETATM 2585 H12 XL A 8 16.366 -11.270 -7.336 1.00 0.21 H HETATM 2586 H10 XL A 8 16.308 -5.999 -6.876 1.00 0.08 H HETATM 2587 H8 XL A 8 17.856 -4.124 -7.705 1.00 0.08 H HETATM 2588 H9 XL A 8 18.311 -4.974 -6.189 1.00 0.08 H HETATM 2589 CL1 XL A 8 20.809 -5.800 -5.401 1.00 -0.10 CL HETATM 2590 O1 XL A 8 23.222 -4.191 -5.575 1.00 -0.32 O HETATM 2591 C7 XL A 8 24.554 -4.276 -6.071 1.00 0.06 C HETATM 2592 H2 XL A 8 25.216 -4.659 -5.280 1.00 0.06 H HETATM 2593 H3 XL A 8 24.894 -3.277 -6.382 1.00 0.06 H HETATM 2594 H4 XL A 8 24.581 -4.958 -6.934 1.00 0.06 H CONECT 1 2 6 7 8 CONECT 6 1 CONECT 7 1 CONECT 8 1 CONECT 1542 1543 1548 1549 1550 CONECT 1549 1542 CONECT 1550 1542 CONECT 2541 2542 2546 2590 CONECT 2542 2541 2543 2589 CONECT 2543 2542 2544 2554 CONECT 2544 2543 2545 2553 CONECT 2545 2544 2546 2548 CONECT 2546 2541 2545 2547 CONECT 2547 2546 CONECT 2548 2545 2549 CONECT 2549 2548 2550 2551 2552 CONECT 2550 2549 CONECT 2551 2549 CONECT 2552 2549 CONECT 2553 2544 CONECT 2554 2543 2555 2587 2588 CONECT 2555 2554 2556 CONECT 2556 2555 2557 2561 CONECT 2557 2556 2558 2586 CONECT 2558 2557 2559 CONECT 2559 2558 2560 2563 CONECT 2560 2559 2561 CONECT 2561 2556 2560 2562 CONECT 2562 2561 CONECT 2563 2559 2564 2585 CONECT 2564 2563 2565 2569 CONECT 2565 2564 2566 2574 CONECT 2566 2565 2567 2573 CONECT 2567 2566 2568 2572 CONECT 2568 2567 2569 2571 CONECT 2569 2564 2568 2570 CONECT 2570 2569 CONECT 2571 2568 CONECT 2572 2567 CONECT 2573 2566 CONECT 2574 2565 2575 2584 CONECT 2575 2574 2576 2583 CONECT 2576 2575 2577 2581 2582 CONECT 2577 2576 2578 2579 2580 CONECT 2578 2577 CONECT 2579 2577 CONECT 2580 2577 CONECT 2581 2576 CONECT 2582 2576 CONECT 2583 2575 CONECT 2584 2574 CONECT 2585 2563 CONECT 2586 2557 CONECT 2587 2554 CONECT 2588 2554 CONECT 2589 2542 CONECT 2590 2541 2591 CONECT 2591 2590 2592 2593 2594 CONECT 2592 2591 CONECT 2593 2591 CONECT 2594 2591 MASTER 0 0 0 0 0 0 0 0 2592 2 61 22 END
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Structure:
Ligand 2D
Ligand 3D
Protein
Pocket-Ligand
Protein-Ligand
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Protein Sequence Similarity
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323aa, >4QQ5_1|Chain... *
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PDBbind
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RCSB PDB
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PDBbind
300aa, >6NVJ_1|Chain... at 97%
6nvi
RCSB PDB
PDBbind
300aa, >6NVI_1|Chain... at 97%
6nvh
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PDBbind
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6jpj
RCSB PDB
PDBbind
311aa, >6JPJ_1|Chain... at 99%
6iup
RCSB PDB
PDBbind
322aa, >6IUP_1|Chain... at 99%
6iuo
RCSB PDB
PDBbind
322aa, >6IUO_1|Chain... at 99%
5xfj
RCSB PDB
PDBbind
311aa, >5XFJ_1|Chain... at 98%
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PDBbind
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Complexes with the same small molecule ligand
PDB Code
Check Database
Ligand Name
No complexes with the same small molecule ligand are found!
Entry Information
PDB ID
6nvg
Complex Type
Protein-Ligand
PDBbind Subset
general set
Protein Name
FGFR4
Ligand Name
XL8
EC.Number
E.C.2.7.10.1
Resolution
1.99(Å)
Affinity (Kd/Ki/IC50)
IC50=8.5nM
Release Year
2019
Protein/NA Sequence
Check fasta file
Primary Reference
(2019) Acs Med.Chem.Lett. Vol. 10: pp. 1180-1186
Ligand Properties
Formula
C
2
2
H
2
0
Cl
4
N
4
O
4
Molecular Weight
546.231
Exact Mass
544.024
No. of atoms
54
No. of bonds
56
Polar Surface Area
94.6
LOGP Value
5.64 (
Computed with XLOGP3
)
6.92 (
Computed with Open Babel
)
Drug likeness
No. of Hydrogen Bond Donors: 2
No. of Hydrogen Bond Acceptors: 3
No. of Rotatable Bonds: 10
No. of Nitrogen and Oxygen Atoms: 8
No. of Rings: 3
Canonical SMILES
CCC(=O)Nc1cc(Cl)cc(c1Nc1ncc(cn1)OCc1c(Cl)c(OC)cc(c1Cl)OC)Cl
InChI String
InChI=1S/C22H20Cl4N4O4/c1-4-18(31)29-15-6-11(23)5-14(24)21(15)30-22-27-8-12(9-28-22)34-10-13-19(25)16(32-2)7-17(33-3)20(13)26/h5-9H,4,10H2,1-3H3,(H,29,31)(H,27,28,30)
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UniProtKB AC
UniProt accession number (AC):
P22455
Entrez Gene ID
NCBI Entrez Gene ID:
2264
ASD
Information of known allosteric effects of PDB entries
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