USER MOD reduce.3.24.130724 H: found=0, std=0, add=718, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 718 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 426 SER OG : rot 180:sc= 0 USER MOD Single : A 428 LYS NZ :NH3+ 179:sc= -3.21! (180deg=-3.35!) USER MOD Single : A 444 THR OG1 : rot 72:sc= -0.467 USER MOD Single : A 446 SER OG : rot -95:sc= -0.666 USER MOD Single : A 459 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 460 LYS NZ :NH3+ 178:sc= -1.43! (180deg=-1.62!) USER MOD Single : A 463 SER OG : rot 180:sc= 0 USER MOD Single : A 464 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 465 SER OG : rot 180:sc= -0.122 USER MOD Single : A 466 TYR OH : rot 180:sc= 0 USER MOD Single : A 470 LYS NZ :NH3+ 154:sc= -0.133 (180deg=-0.581) USER MOD Single : A 472 TYR OH : rot 165:sc= -0.176 USER MOD Single : A 478 GLN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 481 SER OG : rot 180:sc= 0 USER MOD Single : A 482 SER OG : rot 112:sc= 0.324 USER MOD Single : A 484 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 490 CYS SG : rot 64:sc= -1.4 USER MOD Single : A 496 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 498 TYR OH : rot 30:sc= 0 USER MOD Single : A 500 CYS SG : rot 180:sc= 0 USER MOD Single : A 502 SER OG : rot 26:sc= 0.148 USER MOD Single : A 503 SER OG : rot -160:sc= 0 USER MOD Single : A 505 THR OG1 : rot 180:sc= -0.0475 USER MOD Single : A 507 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 509 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.0687) USER MOD Single : A 512 GLN : amide:sc= -0.182 K(o=-0.18,f=-1.1) USER MOD ----------------------------------------------------------------- ATOM 66 N SER A 426 -4.330 10.918 -2.572 1.00 0.00 N ATOM 67 CA SER A 426 -2.922 11.007 -2.943 1.00 0.00 C ATOM 68 C SER A 426 -2.372 9.634 -3.319 1.00 0.00 C ATOM 69 O SER A 426 -3.076 8.627 -3.237 1.00 0.00 O ATOM 70 CB SER A 426 -2.106 11.598 -1.793 1.00 0.00 C ATOM 71 OG SER A 426 -2.284 13.002 -1.710 1.00 0.00 O ATOM 0 HA SER A 426 -2.841 11.662 -3.810 1.00 0.00 H new ATOM 0 HB2 SER A 426 -2.407 11.134 -0.854 1.00 0.00 H new ATOM 0 HB3 SER A 426 -1.050 11.370 -1.938 1.00 0.00 H new ATOM 0 HG SER A 426 -1.753 13.356 -0.966 1.00 0.00 H new ATOM 77 N ARG A 427 -1.109 9.602 -3.731 1.00 0.00 N ATOM 78 CA ARG A 427 -0.464 8.354 -4.120 1.00 0.00 C ATOM 79 C ARG A 427 -0.373 7.396 -2.936 1.00 0.00 C ATOM 80 O ARG A 427 -0.660 6.206 -3.063 1.00 0.00 O ATOM 81 CB ARG A 427 0.935 8.630 -4.675 1.00 0.00 C ATOM 82 CG ARG A 427 0.958 9.679 -5.775 1.00 0.00 C ATOM 83 CD ARG A 427 2.319 9.750 -6.449 1.00 0.00 C ATOM 84 NE ARG A 427 3.269 10.551 -5.682 1.00 0.00 N ATOM 85 CZ ARG A 427 4.489 10.854 -6.110 1.00 0.00 C ATOM 86 NH1 ARG A 427 4.906 10.424 -7.293 1.00 0.00 N ATOM 87 NH2 ARG A 427 5.296 11.588 -5.354 1.00 0.00 N ATOM 0 H ARG A 427 -0.512 10.426 -3.804 1.00 0.00 H new ATOM 0 HA ARG A 427 -1.071 7.888 -4.896 1.00 0.00 H new ATOM 0 HB2 ARG A 427 1.582 8.956 -3.860 1.00 0.00 H new ATOM 0 HB3 ARG A 427 1.353 7.701 -5.062 1.00 0.00 H new ATOM 0 HG2 ARG A 427 0.195 9.446 -6.518 1.00 0.00 H new ATOM 0 HG3 ARG A 427 0.707 10.653 -5.355 1.00 0.00 H new ATOM 0 HD2 ARG A 427 2.714 8.742 -6.575 1.00 0.00 H new ATOM 0 HD3 ARG A 427 2.208 10.176 -7.446 1.00 0.00 H new ATOM 0 HE ARG A 427 2.980 10.897 -4.767 1.00 0.00 H new ATOM 0 HH11 ARG A 427 4.289 9.859 -7.877 1.00 0.00 H new ATOM 0 HH12 ARG A 427 5.844 10.658 -7.619 1.00 0.00 H new ATOM 0 HH21 ARG A 427 4.979 11.920 -4.443 1.00 0.00 H new ATOM 0 HH22 ARG A 427 6.233 11.820 -5.684 1.00 0.00 H new ATOM 101 N LYS A 428 0.029 7.924 -1.785 1.00 0.00 N ATOM 102 CA LYS A 428 0.157 7.117 -0.577 1.00 0.00 C ATOM 103 C LYS A 428 -1.153 6.406 -0.256 1.00 0.00 C ATOM 104 O LYS A 428 -2.147 7.042 0.094 1.00 0.00 O ATOM 105 CB LYS A 428 0.577 7.995 0.605 1.00 0.00 C ATOM 106 CG LYS A 428 2.075 8.228 0.688 1.00 0.00 C ATOM 107 CD LYS A 428 2.770 7.119 1.461 1.00 0.00 C ATOM 108 CE LYS A 428 4.006 7.634 2.183 1.00 0.00 C ATOM 109 NZ LYS A 428 4.996 8.220 1.238 1.00 0.00 N ATOM 0 H LYS A 428 0.272 8.907 -1.663 1.00 0.00 H new ATOM 0 HA LYS A 428 0.925 6.363 -0.753 1.00 0.00 H new ATOM 0 HB2 LYS A 428 0.072 8.958 0.529 1.00 0.00 H new ATOM 0 HB3 LYS A 428 0.238 7.530 1.531 1.00 0.00 H new ATOM 0 HG2 LYS A 428 2.491 8.288 -0.318 1.00 0.00 H new ATOM 0 HG3 LYS A 428 2.269 9.186 1.171 1.00 0.00 H new ATOM 0 HD2 LYS A 428 2.077 6.689 2.184 1.00 0.00 H new ATOM 0 HD3 LYS A 428 3.054 6.319 0.777 1.00 0.00 H new ATOM 0 HE2 LYS A 428 3.712 8.387 2.914 1.00 0.00 H new ATOM 0 HE3 LYS A 428 4.471 6.817 2.736 1.00 0.00 H new ATOM 0 HZ1 LYS A 428 5.816 8.575 1.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 428 5.309 7.490 0.566 1.00 0.00 H new ATOM 0 HZ3 LYS A 428 4.556 9.005 0.717 1.00 0.00 H new ATOM 123 N VAL A 429 -1.147 5.082 -0.375 1.00 0.00 N ATOM 124 CA VAL A 429 -2.335 4.284 -0.094 1.00 0.00 C ATOM 125 C VAL A 429 -2.117 3.381 1.115 1.00 0.00 C ATOM 126 O VAL A 429 -1.434 2.360 1.026 1.00 0.00 O ATOM 127 CB VAL A 429 -2.727 3.416 -1.305 1.00 0.00 C ATOM 128 CG1 VAL A 429 -3.967 2.592 -0.993 1.00 0.00 C ATOM 129 CG2 VAL A 429 -2.950 4.286 -2.533 1.00 0.00 C ATOM 0 H VAL A 429 -0.333 4.539 -0.664 1.00 0.00 H new ATOM 0 HA VAL A 429 -3.143 4.983 0.120 1.00 0.00 H new ATOM 0 HB VAL A 429 -1.908 2.729 -1.518 1.00 0.00 H new ATOM 0 HG11 VAL A 429 -4.228 1.986 -1.860 1.00 0.00 H new ATOM 0 HG12 VAL A 429 -3.767 1.941 -0.142 1.00 0.00 H new ATOM 0 HG13 VAL A 429 -4.796 3.258 -0.753 1.00 0.00 H new ATOM 0 HG21 VAL A 429 -3.226 3.657 -3.379 1.00 0.00 H new ATOM 0 HG22 VAL A 429 -3.751 4.998 -2.334 1.00 0.00 H new ATOM 0 HG23 VAL A 429 -2.033 4.827 -2.767 1.00 0.00 H new ATOM 139 N PHE A 430 -2.703 3.762 2.245 1.00 0.00 N ATOM 140 CA PHE A 430 -2.573 2.987 3.473 1.00 0.00 C ATOM 141 C PHE A 430 -3.314 1.659 3.359 1.00 0.00 C ATOM 142 O PHE A 430 -4.514 1.626 3.085 1.00 0.00 O ATOM 143 CB PHE A 430 -3.112 3.784 4.663 1.00 0.00 C ATOM 144 CG PHE A 430 -3.229 2.974 5.923 1.00 0.00 C ATOM 145 CD1 PHE A 430 -2.241 2.069 6.274 1.00 0.00 C ATOM 146 CD2 PHE A 430 -4.327 3.119 6.755 1.00 0.00 C ATOM 147 CE1 PHE A 430 -2.347 1.322 7.432 1.00 0.00 C ATOM 148 CE2 PHE A 430 -4.438 2.375 7.915 1.00 0.00 C ATOM 149 CZ PHE A 430 -3.446 1.476 8.254 1.00 0.00 C ATOM 0 H PHE A 430 -3.273 4.603 2.336 1.00 0.00 H new ATOM 0 HA PHE A 430 -1.515 2.780 3.632 1.00 0.00 H new ATOM 0 HB2 PHE A 430 -2.456 4.635 4.847 1.00 0.00 H new ATOM 0 HB3 PHE A 430 -4.092 4.186 4.407 1.00 0.00 H new ATOM 0 HD1 PHE A 430 -1.378 1.946 5.636 1.00 0.00 H new ATOM 0 HD2 PHE A 430 -5.105 3.821 6.495 1.00 0.00 H new ATOM 0 HE1 PHE A 430 -1.571 0.618 7.694 1.00 0.00 H new ATOM 0 HE2 PHE A 430 -5.299 2.497 8.555 1.00 0.00 H new ATOM 0 HZ PHE A 430 -3.530 0.894 9.160 1.00 0.00 H new ATOM 159 N VAL A 431 -2.591 0.564 3.570 1.00 0.00 N ATOM 160 CA VAL A 431 -3.178 -0.768 3.491 1.00 0.00 C ATOM 161 C VAL A 431 -2.990 -1.530 4.798 1.00 0.00 C ATOM 162 O VAL A 431 -1.905 -1.531 5.378 1.00 0.00 O ATOM 163 CB VAL A 431 -2.563 -1.586 2.340 1.00 0.00 C ATOM 164 CG1 VAL A 431 -3.383 -2.840 2.077 1.00 0.00 C ATOM 165 CG2 VAL A 431 -2.454 -0.737 1.082 1.00 0.00 C ATOM 0 H VAL A 431 -1.597 0.573 3.797 1.00 0.00 H new ATOM 0 HA VAL A 431 -4.243 -0.633 3.302 1.00 0.00 H new ATOM 0 HB VAL A 431 -1.559 -1.893 2.632 1.00 0.00 H new ATOM 0 HG11 VAL A 431 -2.933 -3.405 1.261 1.00 0.00 H new ATOM 0 HG12 VAL A 431 -3.404 -3.456 2.976 1.00 0.00 H new ATOM 0 HG13 VAL A 431 -4.401 -2.559 1.806 1.00 0.00 H new ATOM 0 HG21 VAL A 431 -2.017 -1.331 0.279 1.00 0.00 H new ATOM 0 HG22 VAL A 431 -3.446 -0.398 0.785 1.00 0.00 H new ATOM 0 HG23 VAL A 431 -1.820 0.127 1.280 1.00 0.00 H new ATOM 175 N GLY A 432 -4.056 -2.179 5.257 1.00 0.00 N ATOM 176 CA GLY A 432 -3.988 -2.937 6.493 1.00 0.00 C ATOM 177 C GLY A 432 -4.603 -4.316 6.363 1.00 0.00 C ATOM 178 O GLY A 432 -5.399 -4.565 5.458 1.00 0.00 O ATOM 0 H GLY A 432 -4.965 -2.193 4.795 1.00 0.00 H new ATOM 0 HA2 GLY A 432 -2.946 -3.035 6.799 1.00 0.00 H new ATOM 0 HA3 GLY A 432 -4.501 -2.387 7.282 1.00 0.00 H new ATOM 182 N GLY A 433 -4.233 -5.216 7.269 1.00 0.00 N ATOM 183 CA GLY A 433 -4.763 -6.566 7.232 1.00 0.00 C ATOM 184 C GLY A 433 -4.039 -7.446 6.232 1.00 0.00 C ATOM 185 O GLY A 433 -4.549 -8.494 5.833 1.00 0.00 O ATOM 0 H GLY A 433 -3.576 -5.034 8.028 1.00 0.00 H new ATOM 0 HA2 GLY A 433 -4.687 -7.010 8.224 1.00 0.00 H new ATOM 0 HA3 GLY A 433 -5.823 -6.530 6.979 1.00 0.00 H new ATOM 189 N LEU A 434 -2.850 -7.019 5.822 1.00 0.00 N ATOM 190 CA LEU A 434 -2.055 -7.774 4.860 1.00 0.00 C ATOM 191 C LEU A 434 -1.778 -9.184 5.371 1.00 0.00 C ATOM 192 O LEU A 434 -1.533 -9.404 6.557 1.00 0.00 O ATOM 193 CB LEU A 434 -0.736 -7.052 4.580 1.00 0.00 C ATOM 194 CG LEU A 434 -0.841 -5.744 3.795 1.00 0.00 C ATOM 195 CD1 LEU A 434 0.419 -4.911 3.975 1.00 0.00 C ATOM 196 CD2 LEU A 434 -1.089 -6.026 2.320 1.00 0.00 C ATOM 0 H LEU A 434 -2.415 -6.153 6.141 1.00 0.00 H new ATOM 0 HA LEU A 434 -2.625 -7.848 3.934 1.00 0.00 H new ATOM 0 HB2 LEU A 434 -0.250 -6.843 5.533 1.00 0.00 H new ATOM 0 HB3 LEU A 434 -0.083 -7.730 4.031 1.00 0.00 H new ATOM 0 HG LEU A 434 -1.686 -5.176 4.184 1.00 0.00 H new ATOM 0 HD11 LEU A 434 0.326 -3.984 3.409 1.00 0.00 H new ATOM 0 HD12 LEU A 434 0.554 -4.679 5.031 1.00 0.00 H new ATOM 0 HD13 LEU A 434 1.281 -5.472 3.613 1.00 0.00 H new ATOM 0 HD21 LEU A 434 -1.161 -5.084 1.777 1.00 0.00 H new ATOM 0 HD22 LEU A 434 -0.264 -6.614 1.918 1.00 0.00 H new ATOM 0 HD23 LEU A 434 -2.020 -6.582 2.207 1.00 0.00 H new ATOM 208 N PRO A 435 -1.814 -10.163 4.455 1.00 0.00 N ATOM 209 CA PRO A 435 -1.567 -11.569 4.788 1.00 0.00 C ATOM 210 C PRO A 435 -0.324 -11.749 5.654 1.00 0.00 C ATOM 211 O PRO A 435 0.663 -11.024 5.524 1.00 0.00 O ATOM 212 CB PRO A 435 -1.366 -12.228 3.422 1.00 0.00 C ATOM 213 CG PRO A 435 -2.146 -11.382 2.475 1.00 0.00 C ATOM 214 CD PRO A 435 -2.100 -9.973 3.023 1.00 0.00 C ATOM 0 HA PRO A 435 -2.383 -12.000 5.368 1.00 0.00 H new ATOM 0 HB2 PRO A 435 -0.311 -12.259 3.149 1.00 0.00 H new ATOM 0 HB3 PRO A 435 -1.726 -13.257 3.422 1.00 0.00 H new ATOM 0 HG2 PRO A 435 -1.717 -11.423 1.474 1.00 0.00 H new ATOM 0 HG3 PRO A 435 -3.174 -11.735 2.396 1.00 0.00 H new ATOM 0 HD2 PRO A 435 -1.327 -9.379 2.536 1.00 0.00 H new ATOM 0 HD3 PRO A 435 -3.045 -9.453 2.869 1.00 0.00 H new ATOM 222 N PRO A 436 -0.371 -12.738 6.559 1.00 0.00 N ATOM 223 CA PRO A 436 0.744 -13.037 7.463 1.00 0.00 C ATOM 224 C PRO A 436 1.841 -13.849 6.782 1.00 0.00 C ATOM 225 O PRO A 436 2.815 -14.249 7.419 1.00 0.00 O ATOM 226 CB PRO A 436 0.087 -13.855 8.578 1.00 0.00 C ATOM 227 CG PRO A 436 -1.080 -14.514 7.927 1.00 0.00 C ATOM 228 CD PRO A 436 -1.514 -13.642 6.768 1.00 0.00 C ATOM 0 HA PRO A 436 1.238 -12.131 7.814 1.00 0.00 H new ATOM 0 HB2 PRO A 436 0.778 -14.591 8.989 1.00 0.00 H new ATOM 0 HB3 PRO A 436 -0.228 -13.217 9.404 1.00 0.00 H new ATOM 0 HG2 PRO A 436 -0.810 -15.510 7.576 1.00 0.00 H new ATOM 0 HG3 PRO A 436 -1.896 -14.637 8.639 1.00 0.00 H new ATOM 0 HD2 PRO A 436 -1.722 -14.235 5.878 1.00 0.00 H new ATOM 0 HD3 PRO A 436 -2.423 -13.089 7.003 1.00 0.00 H new ATOM 236 N ASP A 437 1.676 -14.088 5.486 1.00 0.00 N ATOM 237 CA ASP A 437 2.653 -14.851 4.719 1.00 0.00 C ATOM 238 C ASP A 437 2.986 -14.145 3.408 1.00 0.00 C ATOM 239 O ASP A 437 3.298 -14.790 2.406 1.00 0.00 O ATOM 240 CB ASP A 437 2.125 -16.258 4.435 1.00 0.00 C ATOM 241 CG ASP A 437 2.016 -17.099 5.692 1.00 0.00 C ATOM 242 OD1 ASP A 437 2.737 -16.803 6.668 1.00 0.00 O ATOM 243 OD2 ASP A 437 1.211 -18.054 5.699 1.00 0.00 O ATOM 0 H ASP A 437 0.875 -13.764 4.944 1.00 0.00 H new ATOM 0 HA ASP A 437 3.564 -14.927 5.312 1.00 0.00 H new ATOM 0 HB2 ASP A 437 1.145 -16.187 3.963 1.00 0.00 H new ATOM 0 HB3 ASP A 437 2.786 -16.755 3.725 1.00 0.00 H new ATOM 248 N ILE A 438 2.915 -12.818 3.421 1.00 0.00 N ATOM 249 CA ILE A 438 3.208 -12.026 2.233 1.00 0.00 C ATOM 250 C ILE A 438 4.514 -11.256 2.395 1.00 0.00 C ATOM 251 O ILE A 438 5.010 -11.082 3.508 1.00 0.00 O ATOM 252 CB ILE A 438 2.073 -11.031 1.926 1.00 0.00 C ATOM 253 CG1 ILE A 438 2.249 -10.440 0.526 1.00 0.00 C ATOM 254 CG2 ILE A 438 2.038 -9.927 2.973 1.00 0.00 C ATOM 255 CD1 ILE A 438 0.989 -9.811 -0.027 1.00 0.00 C ATOM 0 H ILE A 438 2.657 -12.269 4.241 1.00 0.00 H new ATOM 0 HA ILE A 438 3.302 -12.725 1.402 1.00 0.00 H new ATOM 0 HB ILE A 438 1.123 -11.565 1.958 1.00 0.00 H new ATOM 0 HG12 ILE A 438 3.038 -9.689 0.554 1.00 0.00 H new ATOM 0 HG13 ILE A 438 2.581 -11.226 -0.152 1.00 0.00 H new ATOM 0 HG21 ILE A 438 1.231 -9.232 2.742 1.00 0.00 H new ATOM 0 HG22 ILE A 438 1.870 -10.364 3.957 1.00 0.00 H new ATOM 0 HG23 ILE A 438 2.988 -9.393 2.971 1.00 0.00 H new ATOM 0 HD11 ILE A 438 1.188 -9.413 -1.022 1.00 0.00 H new ATOM 0 HD12 ILE A 438 0.203 -10.564 -0.088 1.00 0.00 H new ATOM 0 HD13 ILE A 438 0.667 -9.003 0.630 1.00 0.00 H new ATOM 267 N ASP A 439 5.065 -10.795 1.277 1.00 0.00 N ATOM 268 CA ASP A 439 6.313 -10.040 1.295 1.00 0.00 C ATOM 269 C ASP A 439 6.168 -8.733 0.521 1.00 0.00 C ATOM 270 O ASP A 439 5.078 -8.390 0.065 1.00 0.00 O ATOM 271 CB ASP A 439 7.447 -10.876 0.700 1.00 0.00 C ATOM 272 CG ASP A 439 7.224 -11.197 -0.765 1.00 0.00 C ATOM 273 OD1 ASP A 439 7.042 -10.250 -1.559 1.00 0.00 O ATOM 274 OD2 ASP A 439 7.231 -12.395 -1.117 1.00 0.00 O ATOM 0 H ASP A 439 4.667 -10.931 0.348 1.00 0.00 H new ATOM 0 HA ASP A 439 6.552 -9.803 2.332 1.00 0.00 H new ATOM 0 HB2 ASP A 439 8.388 -10.338 0.812 1.00 0.00 H new ATOM 0 HB3 ASP A 439 7.543 -11.805 1.262 1.00 0.00 H new ATOM 279 N GLU A 440 7.273 -8.009 0.380 1.00 0.00 N ATOM 280 CA GLU A 440 7.268 -6.739 -0.336 1.00 0.00 C ATOM 281 C GLU A 440 6.806 -6.930 -1.778 1.00 0.00 C ATOM 282 O GLU A 440 5.792 -6.370 -2.196 1.00 0.00 O ATOM 283 CB GLU A 440 8.663 -6.110 -0.315 1.00 0.00 C ATOM 284 CG GLU A 440 8.730 -4.756 -1.000 1.00 0.00 C ATOM 285 CD GLU A 440 10.138 -4.194 -1.044 1.00 0.00 C ATOM 286 OE1 GLU A 440 11.093 -4.972 -0.842 1.00 0.00 O ATOM 287 OE2 GLU A 440 10.284 -2.977 -1.281 1.00 0.00 O ATOM 0 H GLU A 440 8.183 -8.280 0.752 1.00 0.00 H new ATOM 0 HA GLU A 440 6.569 -6.071 0.166 1.00 0.00 H new ATOM 0 HB2 GLU A 440 8.988 -6.001 0.720 1.00 0.00 H new ATOM 0 HB3 GLU A 440 9.366 -6.788 -0.800 1.00 0.00 H new ATOM 0 HG2 GLU A 440 8.347 -4.848 -2.017 1.00 0.00 H new ATOM 0 HG3 GLU A 440 8.079 -4.055 -0.477 1.00 0.00 H new ATOM 294 N ASP A 441 7.557 -7.723 -2.534 1.00 0.00 N ATOM 295 CA ASP A 441 7.226 -7.989 -3.929 1.00 0.00 C ATOM 296 C ASP A 441 5.743 -8.311 -4.083 1.00 0.00 C ATOM 297 O ASP A 441 4.997 -7.558 -4.708 1.00 0.00 O ATOM 298 CB ASP A 441 8.070 -9.146 -4.464 1.00 0.00 C ATOM 299 CG ASP A 441 9.529 -9.030 -4.069 1.00 0.00 C ATOM 300 OD1 ASP A 441 9.888 -9.513 -2.975 1.00 0.00 O ATOM 301 OD2 ASP A 441 10.313 -8.454 -4.853 1.00 0.00 O ATOM 0 H ASP A 441 8.400 -8.193 -2.204 1.00 0.00 H new ATOM 0 HA ASP A 441 7.447 -7.092 -4.507 1.00 0.00 H new ATOM 0 HB2 ASP A 441 7.669 -10.088 -4.089 1.00 0.00 H new ATOM 0 HB3 ASP A 441 7.992 -9.176 -5.551 1.00 0.00 H new ATOM 306 N GLU A 442 5.324 -9.435 -3.510 1.00 0.00 N ATOM 307 CA GLU A 442 3.930 -9.857 -3.586 1.00 0.00 C ATOM 308 C GLU A 442 2.995 -8.651 -3.568 1.00 0.00 C ATOM 309 O GLU A 442 2.242 -8.422 -4.514 1.00 0.00 O ATOM 310 CB GLU A 442 3.594 -10.795 -2.425 1.00 0.00 C ATOM 311 CG GLU A 442 4.460 -12.042 -2.379 1.00 0.00 C ATOM 312 CD GLU A 442 3.883 -13.183 -3.194 1.00 0.00 C ATOM 313 OE1 GLU A 442 2.783 -13.663 -2.848 1.00 0.00 O ATOM 314 OE2 GLU A 442 4.532 -13.597 -4.178 1.00 0.00 O ATOM 0 H GLU A 442 5.929 -10.069 -2.989 1.00 0.00 H new ATOM 0 HA GLU A 442 3.789 -10.390 -4.526 1.00 0.00 H new ATOM 0 HB2 GLU A 442 3.704 -10.252 -1.487 1.00 0.00 H new ATOM 0 HB3 GLU A 442 2.548 -11.092 -2.500 1.00 0.00 H new ATOM 0 HG2 GLU A 442 5.456 -11.802 -2.751 1.00 0.00 H new ATOM 0 HG3 GLU A 442 4.575 -12.362 -1.343 1.00 0.00 H new ATOM 321 N ILE A 443 3.049 -7.884 -2.484 1.00 0.00 N ATOM 322 CA ILE A 443 2.208 -6.703 -2.342 1.00 0.00 C ATOM 323 C ILE A 443 2.210 -5.870 -3.619 1.00 0.00 C ATOM 324 O ILE A 443 1.167 -5.386 -4.061 1.00 0.00 O ATOM 325 CB ILE A 443 2.669 -5.821 -1.167 1.00 0.00 C ATOM 326 CG1 ILE A 443 2.597 -6.603 0.146 1.00 0.00 C ATOM 327 CG2 ILE A 443 1.821 -4.560 -1.085 1.00 0.00 C ATOM 328 CD1 ILE A 443 3.433 -6.003 1.254 1.00 0.00 C ATOM 0 H ILE A 443 3.667 -8.060 -1.692 1.00 0.00 H new ATOM 0 HA ILE A 443 1.197 -7.058 -2.144 1.00 0.00 H new ATOM 0 HB ILE A 443 3.705 -5.528 -1.338 1.00 0.00 H new ATOM 0 HG12 ILE A 443 1.558 -6.654 0.473 1.00 0.00 H new ATOM 0 HG13 ILE A 443 2.926 -7.627 -0.032 1.00 0.00 H new ATOM 0 HG21 ILE A 443 2.160 -3.948 -0.249 1.00 0.00 H new ATOM 0 HG22 ILE A 443 1.919 -3.995 -2.012 1.00 0.00 H new ATOM 0 HG23 ILE A 443 0.777 -4.833 -0.935 1.00 0.00 H new ATOM 0 HD11 ILE A 443 3.333 -6.610 2.154 1.00 0.00 H new ATOM 0 HD12 ILE A 443 4.479 -5.977 0.948 1.00 0.00 H new ATOM 0 HD13 ILE A 443 3.090 -4.989 1.460 1.00 0.00 H new ATOM 340 N THR A 444 3.389 -5.707 -4.211 1.00 0.00 N ATOM 341 CA THR A 444 3.528 -4.933 -5.439 1.00 0.00 C ATOM 342 C THR A 444 2.723 -5.555 -6.574 1.00 0.00 C ATOM 343 O THR A 444 1.816 -4.928 -7.120 1.00 0.00 O ATOM 344 CB THR A 444 5.003 -4.824 -5.870 1.00 0.00 C ATOM 345 OG1 THR A 444 5.791 -4.306 -4.793 1.00 0.00 O ATOM 346 CG2 THR A 444 5.145 -3.923 -7.087 1.00 0.00 C ATOM 0 H THR A 444 4.262 -6.101 -3.860 1.00 0.00 H new ATOM 0 HA THR A 444 3.144 -3.935 -5.229 1.00 0.00 H new ATOM 0 HB THR A 444 5.357 -5.821 -6.132 1.00 0.00 H new ATOM 0 HG1 THR A 444 5.881 -4.989 -4.095 1.00 0.00 H new ATOM 0 HG21 THR A 444 6.195 -3.861 -7.373 1.00 0.00 H new ATOM 0 HG22 THR A 444 4.567 -4.335 -7.914 1.00 0.00 H new ATOM 0 HG23 THR A 444 4.775 -2.926 -6.847 1.00 0.00 H new ATOM 354 N ALA A 445 3.061 -6.792 -6.925 1.00 0.00 N ATOM 355 CA ALA A 445 2.367 -7.499 -7.994 1.00 0.00 C ATOM 356 C ALA A 445 0.864 -7.541 -7.739 1.00 0.00 C ATOM 357 O ALA A 445 0.069 -7.653 -8.673 1.00 0.00 O ATOM 358 CB ALA A 445 2.919 -8.910 -8.138 1.00 0.00 C ATOM 0 H ALA A 445 3.811 -7.325 -6.484 1.00 0.00 H new ATOM 0 HA ALA A 445 2.536 -6.957 -8.924 1.00 0.00 H new ATOM 0 HB1 ALA A 445 2.392 -9.427 -8.940 1.00 0.00 H new ATOM 0 HB2 ALA A 445 3.982 -8.862 -8.374 1.00 0.00 H new ATOM 0 HB3 ALA A 445 2.779 -9.453 -7.203 1.00 0.00 H new ATOM 364 N SER A 446 0.481 -7.452 -6.470 1.00 0.00 N ATOM 365 CA SER A 446 -0.928 -7.484 -6.092 1.00 0.00 C ATOM 366 C SER A 446 -1.612 -6.165 -6.435 1.00 0.00 C ATOM 367 O SER A 446 -2.830 -6.111 -6.608 1.00 0.00 O ATOM 368 CB SER A 446 -1.070 -7.772 -4.596 1.00 0.00 C ATOM 369 OG SER A 446 -2.406 -7.580 -4.165 1.00 0.00 O ATOM 0 H SER A 446 1.126 -7.357 -5.686 1.00 0.00 H new ATOM 0 HA SER A 446 -1.412 -8.281 -6.656 1.00 0.00 H new ATOM 0 HB2 SER A 446 -0.761 -8.797 -4.389 1.00 0.00 H new ATOM 0 HB3 SER A 446 -0.405 -7.118 -4.032 1.00 0.00 H new ATOM 0 HG SER A 446 -2.505 -6.676 -3.799 1.00 0.00 H new ATOM 375 N PHE A 447 -0.820 -5.102 -6.533 1.00 0.00 N ATOM 376 CA PHE A 447 -1.349 -3.782 -6.855 1.00 0.00 C ATOM 377 C PHE A 447 -0.699 -3.229 -8.120 1.00 0.00 C ATOM 378 O PHE A 447 -0.736 -2.025 -8.375 1.00 0.00 O ATOM 379 CB PHE A 447 -1.119 -2.819 -5.688 1.00 0.00 C ATOM 380 CG PHE A 447 -2.011 -3.083 -4.509 1.00 0.00 C ATOM 381 CD1 PHE A 447 -1.796 -4.182 -3.693 1.00 0.00 C ATOM 382 CD2 PHE A 447 -3.064 -2.231 -4.215 1.00 0.00 C ATOM 383 CE1 PHE A 447 -2.615 -4.427 -2.607 1.00 0.00 C ATOM 384 CE2 PHE A 447 -3.887 -2.471 -3.131 1.00 0.00 C ATOM 385 CZ PHE A 447 -3.661 -3.570 -2.325 1.00 0.00 C ATOM 0 H PHE A 447 0.190 -5.129 -6.394 1.00 0.00 H new ATOM 0 HA PHE A 447 -2.420 -3.880 -7.031 1.00 0.00 H new ATOM 0 HB2 PHE A 447 -0.079 -2.889 -5.369 1.00 0.00 H new ATOM 0 HB3 PHE A 447 -1.279 -1.798 -6.033 1.00 0.00 H new ATOM 0 HD1 PHE A 447 -0.979 -4.855 -3.908 1.00 0.00 H new ATOM 0 HD2 PHE A 447 -3.244 -1.369 -4.841 1.00 0.00 H new ATOM 0 HE1 PHE A 447 -2.437 -5.288 -1.979 1.00 0.00 H new ATOM 0 HE2 PHE A 447 -4.705 -1.800 -2.914 1.00 0.00 H new ATOM 0 HZ PHE A 447 -4.301 -3.759 -1.476 1.00 0.00 H new ATOM 395 N ARG A 448 -0.105 -4.118 -8.910 1.00 0.00 N ATOM 396 CA ARG A 448 0.554 -3.720 -10.147 1.00 0.00 C ATOM 397 C ARG A 448 -0.452 -3.613 -11.289 1.00 0.00 C ATOM 398 O ARG A 448 -0.213 -2.918 -12.277 1.00 0.00 O ATOM 399 CB ARG A 448 1.650 -4.724 -10.512 1.00 0.00 C ATOM 400 CG ARG A 448 3.007 -4.386 -9.917 1.00 0.00 C ATOM 401 CD ARG A 448 3.676 -3.245 -10.667 1.00 0.00 C ATOM 402 NE ARG A 448 4.212 -3.677 -11.955 1.00 0.00 N ATOM 403 CZ ARG A 448 5.320 -4.399 -12.086 1.00 0.00 C ATOM 404 NH1 ARG A 448 6.005 -4.768 -11.012 1.00 0.00 N ATOM 405 NH2 ARG A 448 5.744 -4.753 -13.292 1.00 0.00 N ATOM 0 H ARG A 448 -0.067 -5.118 -8.715 1.00 0.00 H new ATOM 0 HA ARG A 448 1.005 -2.740 -9.990 1.00 0.00 H new ATOM 0 HB2 ARG A 448 1.351 -5.716 -10.173 1.00 0.00 H new ATOM 0 HB3 ARG A 448 1.740 -4.772 -11.597 1.00 0.00 H new ATOM 0 HG2 ARG A 448 2.888 -4.113 -8.868 1.00 0.00 H new ATOM 0 HG3 ARG A 448 3.648 -5.267 -9.946 1.00 0.00 H new ATOM 0 HD2 ARG A 448 2.955 -2.443 -10.825 1.00 0.00 H new ATOM 0 HD3 ARG A 448 4.482 -2.834 -10.058 1.00 0.00 H new ATOM 0 HE ARG A 448 3.708 -3.410 -12.801 1.00 0.00 H new ATOM 0 HH11 ARG A 448 5.682 -4.498 -10.083 1.00 0.00 H new ATOM 0 HH12 ARG A 448 6.855 -5.322 -11.115 1.00 0.00 H new ATOM 0 HH21 ARG A 448 5.219 -4.471 -14.120 1.00 0.00 H new ATOM 0 HH22 ARG A 448 6.595 -5.307 -13.391 1.00 0.00 H new ATOM 419 N ARG A 449 -1.577 -4.306 -11.147 1.00 0.00 N ATOM 420 CA ARG A 449 -2.619 -4.290 -12.167 1.00 0.00 C ATOM 421 C ARG A 449 -3.003 -2.858 -12.529 1.00 0.00 C ATOM 422 O ARG A 449 -3.344 -2.567 -13.675 1.00 0.00 O ATOM 423 CB ARG A 449 -3.852 -5.053 -11.679 1.00 0.00 C ATOM 424 CG ARG A 449 -4.457 -4.482 -10.406 1.00 0.00 C ATOM 425 CD ARG A 449 -5.667 -5.285 -9.956 1.00 0.00 C ATOM 426 NE ARG A 449 -5.287 -6.586 -9.411 1.00 0.00 N ATOM 427 CZ ARG A 449 -6.160 -7.465 -8.931 1.00 0.00 C ATOM 428 NH1 ARG A 449 -7.456 -7.183 -8.927 1.00 0.00 N ATOM 429 NH2 ARG A 449 -5.738 -8.628 -8.452 1.00 0.00 N ATOM 0 H ARG A 449 -1.790 -4.886 -10.335 1.00 0.00 H new ATOM 0 HA ARG A 449 -2.227 -4.779 -13.059 1.00 0.00 H new ATOM 0 HB2 ARG A 449 -4.607 -5.047 -12.465 1.00 0.00 H new ATOM 0 HB3 ARG A 449 -3.580 -6.094 -11.507 1.00 0.00 H new ATOM 0 HG2 ARG A 449 -3.707 -4.478 -9.615 1.00 0.00 H new ATOM 0 HG3 ARG A 449 -4.749 -3.445 -10.574 1.00 0.00 H new ATOM 0 HD2 ARG A 449 -6.216 -4.722 -9.201 1.00 0.00 H new ATOM 0 HD3 ARG A 449 -6.342 -5.428 -10.800 1.00 0.00 H new ATOM 0 HE ARG A 449 -4.297 -6.833 -9.398 1.00 0.00 H new ATOM 0 HH11 ARG A 449 -7.785 -6.289 -9.293 1.00 0.00 H new ATOM 0 HH12 ARG A 449 -8.124 -7.860 -8.558 1.00 0.00 H new ATOM 0 HH21 ARG A 449 -4.742 -8.848 -8.452 1.00 0.00 H new ATOM 0 HH22 ARG A 449 -6.409 -9.302 -8.084 1.00 0.00 H new ATOM 443 N PHE A 450 -2.947 -1.969 -11.543 1.00 0.00 N ATOM 444 CA PHE A 450 -3.290 -0.568 -11.757 1.00 0.00 C ATOM 445 C PHE A 450 -2.128 0.185 -12.398 1.00 0.00 C ATOM 446 O PHE A 450 -2.331 1.145 -13.140 1.00 0.00 O ATOM 447 CB PHE A 450 -3.673 0.094 -10.431 1.00 0.00 C ATOM 448 CG PHE A 450 -4.756 -0.634 -9.689 1.00 0.00 C ATOM 449 CD1 PHE A 450 -6.076 -0.549 -10.103 1.00 0.00 C ATOM 450 CD2 PHE A 450 -4.455 -1.404 -8.576 1.00 0.00 C ATOM 451 CE1 PHE A 450 -7.075 -1.218 -9.420 1.00 0.00 C ATOM 452 CE2 PHE A 450 -5.450 -2.075 -7.890 1.00 0.00 C ATOM 453 CZ PHE A 450 -6.761 -1.982 -8.314 1.00 0.00 C ATOM 0 H PHE A 450 -2.667 -2.194 -10.588 1.00 0.00 H new ATOM 0 HA PHE A 450 -4.143 -0.528 -12.434 1.00 0.00 H new ATOM 0 HB2 PHE A 450 -2.789 0.157 -9.797 1.00 0.00 H new ATOM 0 HB3 PHE A 450 -4.000 1.116 -10.625 1.00 0.00 H new ATOM 0 HD1 PHE A 450 -6.327 0.046 -10.968 1.00 0.00 H new ATOM 0 HD2 PHE A 450 -3.431 -1.480 -8.241 1.00 0.00 H new ATOM 0 HE1 PHE A 450 -8.100 -1.143 -9.752 1.00 0.00 H new ATOM 0 HE2 PHE A 450 -5.203 -2.671 -7.024 1.00 0.00 H new ATOM 0 HZ PHE A 450 -7.540 -2.507 -7.781 1.00 0.00 H new ATOM 463 N GLY A 451 -0.910 -0.258 -12.105 1.00 0.00 N ATOM 464 CA GLY A 451 0.267 0.385 -12.659 1.00 0.00 C ATOM 465 C GLY A 451 1.463 0.305 -11.731 1.00 0.00 C ATOM 466 O GLY A 451 1.328 0.085 -10.527 1.00 0.00 O ATOM 0 H GLY A 451 -0.717 -1.051 -11.493 1.00 0.00 H new ATOM 0 HA2 GLY A 451 0.518 -0.082 -13.611 1.00 0.00 H new ATOM 0 HA3 GLY A 451 0.042 1.431 -12.867 1.00 0.00 H new ATOM 470 N PRO A 452 2.667 0.486 -12.294 1.00 0.00 N ATOM 471 CA PRO A 452 3.915 0.436 -11.527 1.00 0.00 C ATOM 472 C PRO A 452 3.819 1.204 -10.213 1.00 0.00 C ATOM 473 O PRO A 452 3.440 2.376 -10.194 1.00 0.00 O ATOM 474 CB PRO A 452 4.932 1.098 -12.460 1.00 0.00 C ATOM 475 CG PRO A 452 4.409 0.844 -13.832 1.00 0.00 C ATOM 476 CD PRO A 452 2.903 0.752 -13.723 1.00 0.00 C ATOM 0 HA PRO A 452 4.178 -0.583 -11.242 1.00 0.00 H new ATOM 0 HB2 PRO A 452 5.016 2.166 -12.260 1.00 0.00 H new ATOM 0 HB3 PRO A 452 5.926 0.670 -12.330 1.00 0.00 H new ATOM 0 HG2 PRO A 452 4.698 1.648 -14.509 1.00 0.00 H new ATOM 0 HG3 PRO A 452 4.823 -0.079 -14.237 1.00 0.00 H new ATOM 0 HD2 PRO A 452 2.422 1.677 -14.042 1.00 0.00 H new ATOM 0 HD3 PRO A 452 2.505 -0.047 -14.349 1.00 0.00 H new ATOM 484 N LEU A 453 4.164 0.538 -9.117 1.00 0.00 N ATOM 485 CA LEU A 453 4.116 1.158 -7.798 1.00 0.00 C ATOM 486 C LEU A 453 5.226 0.617 -6.901 1.00 0.00 C ATOM 487 O LEU A 453 5.876 -0.375 -7.231 1.00 0.00 O ATOM 488 CB LEU A 453 2.754 0.915 -7.146 1.00 0.00 C ATOM 489 CG LEU A 453 2.513 -0.494 -6.602 1.00 0.00 C ATOM 490 CD1 LEU A 453 1.387 -0.485 -5.579 1.00 0.00 C ATOM 491 CD2 LEU A 453 2.197 -1.457 -7.737 1.00 0.00 C ATOM 0 H LEU A 453 4.480 -0.432 -9.116 1.00 0.00 H new ATOM 0 HA LEU A 453 4.265 2.231 -7.923 1.00 0.00 H new ATOM 0 HB2 LEU A 453 2.633 1.625 -6.327 1.00 0.00 H new ATOM 0 HB3 LEU A 453 1.978 1.138 -7.878 1.00 0.00 H new ATOM 0 HG LEU A 453 3.423 -0.833 -6.108 1.00 0.00 H new ATOM 0 HD11 LEU A 453 1.229 -1.496 -5.203 1.00 0.00 H new ATOM 0 HD12 LEU A 453 1.652 0.173 -4.752 1.00 0.00 H new ATOM 0 HD13 LEU A 453 0.471 -0.126 -6.049 1.00 0.00 H new ATOM 0 HD21 LEU A 453 2.028 -2.455 -7.331 1.00 0.00 H new ATOM 0 HD22 LEU A 453 1.301 -1.122 -8.260 1.00 0.00 H new ATOM 0 HD23 LEU A 453 3.035 -1.485 -8.434 1.00 0.00 H new ATOM 503 N VAL A 454 5.435 1.274 -5.765 1.00 0.00 N ATOM 504 CA VAL A 454 6.463 0.857 -4.819 1.00 0.00 C ATOM 505 C VAL A 454 5.901 0.760 -3.405 1.00 0.00 C ATOM 506 O VAL A 454 5.210 1.664 -2.936 1.00 0.00 O ATOM 507 CB VAL A 454 7.655 1.832 -4.820 1.00 0.00 C ATOM 508 CG1 VAL A 454 7.219 3.210 -4.344 1.00 0.00 C ATOM 509 CG2 VAL A 454 8.784 1.293 -3.954 1.00 0.00 C ATOM 0 H VAL A 454 4.906 2.097 -5.477 1.00 0.00 H new ATOM 0 HA VAL A 454 6.807 -0.127 -5.138 1.00 0.00 H new ATOM 0 HB VAL A 454 8.024 1.927 -5.841 1.00 0.00 H new ATOM 0 HG11 VAL A 454 8.075 3.885 -4.351 1.00 0.00 H new ATOM 0 HG12 VAL A 454 6.446 3.597 -5.008 1.00 0.00 H new ATOM 0 HG13 VAL A 454 6.824 3.137 -3.331 1.00 0.00 H new ATOM 0 HG21 VAL A 454 9.618 1.994 -3.966 1.00 0.00 H new ATOM 0 HG22 VAL A 454 8.430 1.168 -2.931 1.00 0.00 H new ATOM 0 HG23 VAL A 454 9.114 0.330 -4.344 1.00 0.00 H new ATOM 519 N VAL A 455 6.203 -0.345 -2.729 1.00 0.00 N ATOM 520 CA VAL A 455 5.730 -0.560 -1.366 1.00 0.00 C ATOM 521 C VAL A 455 6.680 0.062 -0.350 1.00 0.00 C ATOM 522 O VAL A 455 7.891 0.109 -0.564 1.00 0.00 O ATOM 523 CB VAL A 455 5.577 -2.061 -1.057 1.00 0.00 C ATOM 524 CG1 VAL A 455 4.696 -2.267 0.166 1.00 0.00 C ATOM 525 CG2 VAL A 455 5.011 -2.798 -2.261 1.00 0.00 C ATOM 0 H VAL A 455 6.772 -1.104 -3.103 1.00 0.00 H new ATOM 0 HA VAL A 455 4.755 -0.079 -1.289 1.00 0.00 H new ATOM 0 HB VAL A 455 6.563 -2.471 -0.839 1.00 0.00 H new ATOM 0 HG11 VAL A 455 4.599 -3.334 0.369 1.00 0.00 H new ATOM 0 HG12 VAL A 455 5.147 -1.773 1.027 1.00 0.00 H new ATOM 0 HG13 VAL A 455 3.710 -1.842 -0.020 1.00 0.00 H new ATOM 0 HG21 VAL A 455 4.910 -3.857 -2.025 1.00 0.00 H new ATOM 0 HG22 VAL A 455 4.033 -2.387 -2.512 1.00 0.00 H new ATOM 0 HG23 VAL A 455 5.684 -2.679 -3.110 1.00 0.00 H new ATOM 535 N ASP A 456 6.122 0.539 0.758 1.00 0.00 N ATOM 536 CA ASP A 456 6.920 1.159 1.810 1.00 0.00 C ATOM 537 C ASP A 456 6.117 1.278 3.102 1.00 0.00 C ATOM 538 O ASP A 456 5.196 2.090 3.199 1.00 0.00 O ATOM 539 CB ASP A 456 7.404 2.540 1.366 1.00 0.00 C ATOM 540 CG ASP A 456 8.664 2.972 2.090 1.00 0.00 C ATOM 541 OD1 ASP A 456 8.580 3.267 3.300 1.00 0.00 O ATOM 542 OD2 ASP A 456 9.733 3.015 1.447 1.00 0.00 O ATOM 0 H ASP A 456 5.121 0.508 0.951 1.00 0.00 H new ATOM 0 HA ASP A 456 7.785 0.523 1.998 1.00 0.00 H new ATOM 0 HB2 ASP A 456 7.591 2.528 0.292 1.00 0.00 H new ATOM 0 HB3 ASP A 456 6.617 3.272 1.544 1.00 0.00 H new ATOM 547 N TRP A 457 6.470 0.464 4.089 1.00 0.00 N ATOM 548 CA TRP A 457 5.782 0.478 5.375 1.00 0.00 C ATOM 549 C TRP A 457 6.564 1.287 6.403 1.00 0.00 C ATOM 550 O TRP A 457 7.786 1.417 6.326 1.00 0.00 O ATOM 551 CB TRP A 457 5.575 -0.951 5.881 1.00 0.00 C ATOM 552 CG TRP A 457 6.785 -1.820 5.716 1.00 0.00 C ATOM 553 CD1 TRP A 457 7.650 -2.216 6.695 1.00 0.00 C ATOM 554 CD2 TRP A 457 7.263 -2.400 4.497 1.00 0.00 C ATOM 555 NE1 TRP A 457 8.638 -3.006 6.159 1.00 0.00 N ATOM 556 CE2 TRP A 457 8.422 -3.135 4.812 1.00 0.00 C ATOM 557 CE3 TRP A 457 6.823 -2.371 3.171 1.00 0.00 C ATOM 558 CZ2 TRP A 457 9.146 -3.833 3.849 1.00 0.00 C ATOM 559 CZ3 TRP A 457 7.543 -3.064 2.216 1.00 0.00 C ATOM 560 CH2 TRP A 457 8.693 -3.788 2.558 1.00 0.00 C ATOM 0 H TRP A 457 7.229 -0.215 4.024 1.00 0.00 H new ATOM 0 HA TRP A 457 4.810 0.950 5.234 1.00 0.00 H new ATOM 0 HB2 TRP A 457 5.300 -0.919 6.935 1.00 0.00 H new ATOM 0 HB3 TRP A 457 4.738 -1.400 5.347 1.00 0.00 H new ATOM 0 HD1 TRP A 457 7.569 -1.948 7.738 1.00 0.00 H new ATOM 0 HE1 TRP A 457 9.407 -3.428 6.679 1.00 0.00 H new ATOM 0 HE3 TRP A 457 5.937 -1.817 2.897 1.00 0.00 H new ATOM 0 HZ2 TRP A 457 10.033 -4.390 4.111 1.00 0.00 H new ATOM 0 HZ3 TRP A 457 7.213 -3.047 1.188 1.00 0.00 H new ATOM 0 HH2 TRP A 457 9.232 -4.321 1.789 1.00 0.00 H new ATOM 571 N PRO A 458 5.847 1.844 7.390 1.00 0.00 N ATOM 572 CA PRO A 458 6.455 2.650 8.453 1.00 0.00 C ATOM 573 C PRO A 458 7.704 1.995 9.034 1.00 0.00 C ATOM 574 O PRO A 458 8.799 2.556 8.966 1.00 0.00 O ATOM 575 CB PRO A 458 5.352 2.730 9.512 1.00 0.00 C ATOM 576 CG PRO A 458 4.081 2.596 8.746 1.00 0.00 C ATOM 577 CD PRO A 458 4.387 1.730 7.544 1.00 0.00 C ATOM 0 HA PRO A 458 6.787 3.622 8.089 1.00 0.00 H new ATOM 0 HB2 PRO A 458 5.454 1.935 10.251 1.00 0.00 H new ATOM 0 HB3 PRO A 458 5.390 3.675 10.053 1.00 0.00 H new ATOM 0 HG2 PRO A 458 3.304 2.143 9.362 1.00 0.00 H new ATOM 0 HG3 PRO A 458 3.712 3.573 8.435 1.00 0.00 H new ATOM 0 HD2 PRO A 458 4.082 0.697 7.708 1.00 0.00 H new ATOM 0 HD3 PRO A 458 3.863 2.080 6.655 1.00 0.00 H new ATOM 585 N HIS A 459 7.533 0.807 9.604 1.00 0.00 N ATOM 586 CA HIS A 459 8.648 0.076 10.195 1.00 0.00 C ATOM 587 C HIS A 459 9.457 -0.644 9.121 1.00 0.00 C ATOM 588 O HIS A 459 9.419 -1.871 9.017 1.00 0.00 O ATOM 589 CB HIS A 459 8.136 -0.931 11.225 1.00 0.00 C ATOM 590 CG HIS A 459 7.950 -0.348 12.592 1.00 0.00 C ATOM 591 ND1 HIS A 459 8.351 -0.991 13.745 1.00 0.00 N ATOM 592 CD2 HIS A 459 7.405 0.826 12.987 1.00 0.00 C ATOM 593 CE1 HIS A 459 8.058 -0.238 14.790 1.00 0.00 C ATOM 594 NE2 HIS A 459 7.484 0.870 14.358 1.00 0.00 N ATOM 0 H HIS A 459 6.634 0.330 9.669 1.00 0.00 H new ATOM 0 HA HIS A 459 9.298 0.795 10.693 1.00 0.00 H new ATOM 0 HB2 HIS A 459 7.186 -1.339 10.881 1.00 0.00 H new ATOM 0 HB3 HIS A 459 8.837 -1.764 11.286 1.00 0.00 H new ATOM 0 HD2 HIS A 459 6.986 1.586 12.345 1.00 0.00 H new ATOM 0 HE1 HIS A 459 8.255 -0.486 15.823 1.00 0.00 H new ATOM 0 HE2 HIS A 459 7.153 1.634 14.947 1.00 0.00 H new ATOM 602 N LYS A 460 10.189 0.126 8.322 1.00 0.00 N ATOM 603 CA LYS A 460 11.008 -0.438 7.255 1.00 0.00 C ATOM 604 C LYS A 460 12.474 -0.061 7.438 1.00 0.00 C ATOM 605 O LYS A 460 13.310 -0.911 7.743 1.00 0.00 O ATOM 606 CB LYS A 460 10.511 0.049 5.892 1.00 0.00 C ATOM 607 CG LYS A 460 11.135 -0.687 4.719 1.00 0.00 C ATOM 608 CD LYS A 460 11.188 0.187 3.477 1.00 0.00 C ATOM 609 CE LYS A 460 11.500 -0.631 2.233 1.00 0.00 C ATOM 610 NZ LYS A 460 10.471 -1.678 1.985 1.00 0.00 N ATOM 0 H LYS A 460 10.232 1.143 8.393 1.00 0.00 H new ATOM 0 HA LYS A 460 10.922 -1.524 7.300 1.00 0.00 H new ATOM 0 HB2 LYS A 460 9.428 -0.065 5.847 1.00 0.00 H new ATOM 0 HB3 LYS A 460 10.723 1.114 5.796 1.00 0.00 H new ATOM 0 HG2 LYS A 460 12.143 -1.007 4.983 1.00 0.00 H new ATOM 0 HG3 LYS A 460 10.560 -1.588 4.506 1.00 0.00 H new ATOM 0 HD2 LYS A 460 10.233 0.697 3.349 1.00 0.00 H new ATOM 0 HD3 LYS A 460 11.947 0.959 3.606 1.00 0.00 H new ATOM 0 HE2 LYS A 460 11.560 0.031 1.369 1.00 0.00 H new ATOM 0 HE3 LYS A 460 12.477 -1.101 2.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 460 10.702 -2.191 1.110 1.00 0.00 H new ATOM 0 HZ2 LYS A 460 10.454 -2.344 2.783 1.00 0.00 H new ATOM 0 HZ3 LYS A 460 9.537 -1.231 1.888 1.00 0.00 H new ATOM 624 N ALA A 461 12.779 1.220 7.252 1.00 0.00 N ATOM 625 CA ALA A 461 14.144 1.709 7.401 1.00 0.00 C ATOM 626 C ALA A 461 14.708 1.356 8.772 1.00 0.00 C ATOM 627 O ALA A 461 15.806 0.811 8.880 1.00 0.00 O ATOM 628 CB ALA A 461 14.192 3.214 7.180 1.00 0.00 C ATOM 0 H ALA A 461 12.099 1.937 6.998 1.00 0.00 H new ATOM 0 HA ALA A 461 14.762 1.222 6.647 1.00 0.00 H new ATOM 0 HB1 ALA A 461 15.217 3.566 7.294 1.00 0.00 H new ATOM 0 HB2 ALA A 461 13.839 3.446 6.175 1.00 0.00 H new ATOM 0 HB3 ALA A 461 13.554 3.710 7.912 1.00 0.00 H new ATOM 634 N GLU A 462 13.949 1.669 9.818 1.00 0.00 N ATOM 635 CA GLU A 462 14.376 1.385 11.183 1.00 0.00 C ATOM 636 C GLU A 462 14.016 -0.043 11.580 1.00 0.00 C ATOM 637 O GLU A 462 13.701 -0.317 12.738 1.00 0.00 O ATOM 638 CB GLU A 462 13.733 2.374 12.158 1.00 0.00 C ATOM 639 CG GLU A 462 14.562 3.627 12.389 1.00 0.00 C ATOM 640 CD GLU A 462 14.387 4.654 11.287 1.00 0.00 C ATOM 641 OE1 GLU A 462 13.394 5.409 11.332 1.00 0.00 O ATOM 642 OE2 GLU A 462 15.244 4.701 10.380 1.00 0.00 O ATOM 0 H GLU A 462 13.036 2.119 9.746 1.00 0.00 H new ATOM 0 HA GLU A 462 15.460 1.494 11.227 1.00 0.00 H new ATOM 0 HB2 GLU A 462 12.753 2.662 11.777 1.00 0.00 H new ATOM 0 HB3 GLU A 462 13.570 1.875 13.113 1.00 0.00 H new ATOM 0 HG2 GLU A 462 14.282 4.073 13.344 1.00 0.00 H new ATOM 0 HG3 GLU A 462 15.615 3.353 12.462 1.00 0.00 H new ATOM 649 N SER A 463 14.064 -0.951 10.609 1.00 0.00 N ATOM 650 CA SER A 463 13.738 -2.351 10.855 1.00 0.00 C ATOM 651 C SER A 463 14.800 -3.268 10.257 1.00 0.00 C ATOM 652 O SER A 463 15.703 -2.816 9.552 1.00 0.00 O ATOM 653 CB SER A 463 12.366 -2.688 10.268 1.00 0.00 C ATOM 654 OG SER A 463 11.818 -3.841 10.883 1.00 0.00 O ATOM 0 H SER A 463 14.325 -0.742 9.646 1.00 0.00 H new ATOM 0 HA SER A 463 13.712 -2.509 11.933 1.00 0.00 H new ATOM 0 HB2 SER A 463 11.691 -1.843 10.405 1.00 0.00 H new ATOM 0 HB3 SER A 463 12.457 -2.853 9.194 1.00 0.00 H new ATOM 0 HG SER A 463 10.941 -4.035 10.492 1.00 0.00 H new ATOM 660 N LYS A 464 14.685 -4.561 10.542 1.00 0.00 N ATOM 661 CA LYS A 464 15.633 -5.545 10.033 1.00 0.00 C ATOM 662 C LYS A 464 14.944 -6.524 9.088 1.00 0.00 C ATOM 663 O LYS A 464 15.469 -6.846 8.021 1.00 0.00 O ATOM 664 CB LYS A 464 16.280 -6.307 11.191 1.00 0.00 C ATOM 665 CG LYS A 464 17.060 -5.418 12.144 1.00 0.00 C ATOM 666 CD LYS A 464 18.065 -6.217 12.957 1.00 0.00 C ATOM 667 CE LYS A 464 18.313 -5.582 14.316 1.00 0.00 C ATOM 668 NZ LYS A 464 19.044 -4.289 14.200 1.00 0.00 N ATOM 0 H LYS A 464 13.944 -4.952 11.123 1.00 0.00 H new ATOM 0 HA LYS A 464 16.407 -5.015 9.478 1.00 0.00 H new ATOM 0 HB2 LYS A 464 15.504 -6.831 11.749 1.00 0.00 H new ATOM 0 HB3 LYS A 464 16.949 -7.067 10.786 1.00 0.00 H new ATOM 0 HG2 LYS A 464 17.581 -4.645 11.578 1.00 0.00 H new ATOM 0 HG3 LYS A 464 16.369 -4.910 12.816 1.00 0.00 H new ATOM 0 HD2 LYS A 464 17.699 -7.235 13.091 1.00 0.00 H new ATOM 0 HD3 LYS A 464 19.005 -6.286 12.409 1.00 0.00 H new ATOM 0 HE2 LYS A 464 17.360 -5.416 14.819 1.00 0.00 H new ATOM 0 HE3 LYS A 464 18.887 -6.269 14.938 1.00 0.00 H new ATOM 0 HZ1 LYS A 464 19.193 -3.888 15.148 1.00 0.00 H new ATOM 0 HZ2 LYS A 464 19.964 -4.450 13.743 1.00 0.00 H new ATOM 0 HZ3 LYS A 464 18.485 -3.624 13.627 1.00 0.00 H new ATOM 682 N SER A 465 13.766 -6.994 9.485 1.00 0.00 N ATOM 683 CA SER A 465 13.007 -7.939 8.674 1.00 0.00 C ATOM 684 C SER A 465 12.163 -7.208 7.634 1.00 0.00 C ATOM 685 O SER A 465 11.879 -6.018 7.775 1.00 0.00 O ATOM 686 CB SER A 465 12.108 -8.800 9.563 1.00 0.00 C ATOM 687 OG SER A 465 11.233 -9.598 8.784 1.00 0.00 O ATOM 0 H SER A 465 13.316 -6.736 10.363 1.00 0.00 H new ATOM 0 HA SER A 465 13.716 -8.583 8.154 1.00 0.00 H new ATOM 0 HB2 SER A 465 12.723 -9.440 10.195 1.00 0.00 H new ATOM 0 HB3 SER A 465 11.527 -8.160 10.227 1.00 0.00 H new ATOM 0 HG SER A 465 10.670 -10.140 9.376 1.00 0.00 H new ATOM 693 N TYR A 466 11.766 -7.928 6.591 1.00 0.00 N ATOM 694 CA TYR A 466 10.957 -7.348 5.526 1.00 0.00 C ATOM 695 C TYR A 466 9.511 -7.826 5.618 1.00 0.00 C ATOM 696 O TYR A 466 8.822 -7.959 4.606 1.00 0.00 O ATOM 697 CB TYR A 466 11.539 -7.711 4.159 1.00 0.00 C ATOM 698 CG TYR A 466 12.041 -9.135 4.073 1.00 0.00 C ATOM 699 CD1 TYR A 466 11.162 -10.190 3.863 1.00 0.00 C ATOM 700 CD2 TYR A 466 13.393 -9.425 4.204 1.00 0.00 C ATOM 701 CE1 TYR A 466 11.615 -11.493 3.785 1.00 0.00 C ATOM 702 CE2 TYR A 466 13.856 -10.724 4.125 1.00 0.00 C ATOM 703 CZ TYR A 466 12.963 -11.754 3.916 1.00 0.00 C ATOM 704 OH TYR A 466 13.419 -13.050 3.838 1.00 0.00 O ATOM 0 H TYR A 466 11.991 -8.914 6.460 1.00 0.00 H new ATOM 0 HA TYR A 466 10.971 -6.264 5.644 1.00 0.00 H new ATOM 0 HB2 TYR A 466 10.776 -7.557 3.396 1.00 0.00 H new ATOM 0 HB3 TYR A 466 12.360 -7.031 3.931 1.00 0.00 H new ATOM 0 HD1 TYR A 466 10.106 -9.988 3.759 1.00 0.00 H new ATOM 0 HD2 TYR A 466 14.094 -8.621 4.371 1.00 0.00 H new ATOM 0 HE1 TYR A 466 10.918 -12.302 3.623 1.00 0.00 H new ATOM 0 HE2 TYR A 466 14.911 -10.932 4.226 1.00 0.00 H new ATOM 0 HH TYR A 466 14.393 -13.061 3.949 1.00 0.00 H new ATOM 714 N PHE A 467 9.056 -8.084 6.840 1.00 0.00 N ATOM 715 CA PHE A 467 7.693 -8.548 7.067 1.00 0.00 C ATOM 716 C PHE A 467 6.861 -7.473 7.761 1.00 0.00 C ATOM 717 O PHE A 467 6.893 -7.319 8.982 1.00 0.00 O ATOM 718 CB PHE A 467 7.700 -9.826 7.909 1.00 0.00 C ATOM 719 CG PHE A 467 7.790 -11.082 7.090 1.00 0.00 C ATOM 720 CD1 PHE A 467 6.651 -11.649 6.540 1.00 0.00 C ATOM 721 CD2 PHE A 467 9.012 -11.695 6.870 1.00 0.00 C ATOM 722 CE1 PHE A 467 6.731 -12.806 5.787 1.00 0.00 C ATOM 723 CE2 PHE A 467 9.099 -12.852 6.118 1.00 0.00 C ATOM 724 CZ PHE A 467 7.957 -13.407 5.575 1.00 0.00 C ATOM 0 H PHE A 467 9.612 -7.979 7.689 1.00 0.00 H new ATOM 0 HA PHE A 467 7.243 -8.762 6.098 1.00 0.00 H new ATOM 0 HB2 PHE A 467 8.542 -9.791 8.601 1.00 0.00 H new ATOM 0 HB3 PHE A 467 6.793 -9.859 8.512 1.00 0.00 H new ATOM 0 HD1 PHE A 467 5.691 -11.182 6.701 1.00 0.00 H new ATOM 0 HD2 PHE A 467 9.908 -11.264 7.291 1.00 0.00 H new ATOM 0 HE1 PHE A 467 5.836 -13.239 5.365 1.00 0.00 H new ATOM 0 HE2 PHE A 467 10.058 -13.321 5.956 1.00 0.00 H new ATOM 0 HZ PHE A 467 8.022 -14.310 4.985 1.00 0.00 H new ATOM 734 N PRO A 468 6.097 -6.711 6.964 1.00 0.00 N ATOM 735 CA PRO A 468 5.242 -5.637 7.478 1.00 0.00 C ATOM 736 C PRO A 468 4.484 -6.051 8.735 1.00 0.00 C ATOM 737 O PRO A 468 3.489 -6.774 8.680 1.00 0.00 O ATOM 738 CB PRO A 468 4.266 -5.379 6.327 1.00 0.00 C ATOM 739 CG PRO A 468 5.016 -5.769 5.100 1.00 0.00 C ATOM 740 CD PRO A 468 6.009 -6.839 5.500 1.00 0.00 C ATOM 0 HA PRO A 468 5.820 -4.760 7.770 1.00 0.00 H new ATOM 0 HB2 PRO A 468 3.356 -5.969 6.439 1.00 0.00 H new ATOM 0 HB3 PRO A 468 3.964 -4.332 6.291 1.00 0.00 H new ATOM 0 HG2 PRO A 468 4.335 -6.143 4.336 1.00 0.00 H new ATOM 0 HG3 PRO A 468 5.530 -4.908 4.674 1.00 0.00 H new ATOM 0 HD2 PRO A 468 5.667 -7.831 5.206 1.00 0.00 H new ATOM 0 HD3 PRO A 468 6.978 -6.682 5.026 1.00 0.00 H new ATOM 748 N PRO A 469 4.965 -5.584 9.897 1.00 0.00 N ATOM 749 CA PRO A 469 4.347 -5.893 11.190 1.00 0.00 C ATOM 750 C PRO A 469 2.827 -5.778 11.149 1.00 0.00 C ATOM 751 O PRO A 469 2.273 -5.021 10.352 1.00 0.00 O ATOM 752 CB PRO A 469 4.938 -4.836 12.127 1.00 0.00 C ATOM 753 CG PRO A 469 6.261 -4.499 11.531 1.00 0.00 C ATOM 754 CD PRO A 469 6.148 -4.719 10.038 1.00 0.00 C ATOM 0 HA PRO A 469 4.546 -6.918 11.502 1.00 0.00 H new ATOM 0 HB2 PRO A 469 4.296 -3.957 12.188 1.00 0.00 H new ATOM 0 HB3 PRO A 469 5.047 -5.222 13.141 1.00 0.00 H new ATOM 0 HG2 PRO A 469 6.529 -3.465 11.748 1.00 0.00 H new ATOM 0 HG3 PRO A 469 7.045 -5.127 11.954 1.00 0.00 H new ATOM 0 HD2 PRO A 469 6.021 -3.777 9.504 1.00 0.00 H new ATOM 0 HD3 PRO A 469 7.042 -5.196 9.635 1.00 0.00 H new ATOM 762 N LYS A 470 2.157 -6.533 12.013 1.00 0.00 N ATOM 763 CA LYS A 470 0.701 -6.515 12.077 1.00 0.00 C ATOM 764 C LYS A 470 0.097 -6.340 10.687 1.00 0.00 C ATOM 765 O LYS A 470 -0.974 -5.755 10.534 1.00 0.00 O ATOM 766 CB LYS A 470 0.224 -5.389 12.997 1.00 0.00 C ATOM 767 CG LYS A 470 -1.244 -5.491 13.373 1.00 0.00 C ATOM 768 CD LYS A 470 -1.850 -4.122 13.630 1.00 0.00 C ATOM 769 CE LYS A 470 -3.012 -4.201 14.609 1.00 0.00 C ATOM 770 NZ LYS A 470 -2.568 -4.638 15.962 1.00 0.00 N ATOM 0 H LYS A 470 2.600 -7.166 12.679 1.00 0.00 H new ATOM 0 HA LYS A 470 0.369 -7.471 12.481 1.00 0.00 H new ATOM 0 HB2 LYS A 470 0.825 -5.395 13.907 1.00 0.00 H new ATOM 0 HB3 LYS A 470 0.399 -4.432 12.506 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -1.792 -5.988 12.572 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -1.350 -6.110 14.264 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -1.085 -3.453 14.025 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -2.194 -3.693 12.689 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -3.493 -3.225 14.682 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -3.760 -4.897 14.230 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -3.229 -4.276 16.678 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -2.549 -5.677 16.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -1.615 -4.267 16.151 1.00 0.00 H new ATOM 784 N GLY A 471 0.792 -6.853 9.676 1.00 0.00 N ATOM 785 CA GLY A 471 0.308 -6.745 8.312 1.00 0.00 C ATOM 786 C GLY A 471 -0.188 -5.351 7.983 1.00 0.00 C ATOM 787 O GLY A 471 -1.350 -5.024 8.224 1.00 0.00 O ATOM 0 H GLY A 471 1.682 -7.341 9.777 1.00 0.00 H new ATOM 0 HA2 GLY A 471 1.108 -7.015 7.623 1.00 0.00 H new ATOM 0 HA3 GLY A 471 -0.500 -7.461 8.158 1.00 0.00 H new ATOM 791 N TYR A 472 0.695 -4.526 7.432 1.00 0.00 N ATOM 792 CA TYR A 472 0.342 -3.157 7.072 1.00 0.00 C ATOM 793 C TYR A 472 1.498 -2.467 6.354 1.00 0.00 C ATOM 794 O TYR A 472 2.659 -2.619 6.734 1.00 0.00 O ATOM 795 CB TYR A 472 -0.044 -2.363 8.321 1.00 0.00 C ATOM 796 CG TYR A 472 1.105 -2.146 9.279 1.00 0.00 C ATOM 797 CD1 TYR A 472 2.181 -1.337 8.933 1.00 0.00 C ATOM 798 CD2 TYR A 472 1.116 -2.750 10.531 1.00 0.00 C ATOM 799 CE1 TYR A 472 3.233 -1.135 9.805 1.00 0.00 C ATOM 800 CE2 TYR A 472 2.164 -2.553 11.409 1.00 0.00 C ATOM 801 CZ TYR A 472 3.220 -1.745 11.042 1.00 0.00 C ATOM 802 OH TYR A 472 4.266 -1.548 11.914 1.00 0.00 O ATOM 0 H TYR A 472 1.661 -4.781 7.225 1.00 0.00 H new ATOM 0 HA TYR A 472 -0.511 -3.195 6.395 1.00 0.00 H new ATOM 0 HB2 TYR A 472 -0.441 -1.394 8.017 1.00 0.00 H new ATOM 0 HB3 TYR A 472 -0.846 -2.887 8.841 1.00 0.00 H new ATOM 0 HD1 TYR A 472 2.195 -0.858 7.965 1.00 0.00 H new ATOM 0 HD2 TYR A 472 0.291 -3.384 10.822 1.00 0.00 H new ATOM 0 HE1 TYR A 472 4.061 -0.503 9.520 1.00 0.00 H new ATOM 0 HE2 TYR A 472 2.157 -3.029 12.378 1.00 0.00 H new ATOM 0 HH TYR A 472 4.003 -1.840 12.812 1.00 0.00 H new ATOM 812 N ALA A 473 1.171 -1.708 5.313 1.00 0.00 N ATOM 813 CA ALA A 473 2.180 -0.992 4.543 1.00 0.00 C ATOM 814 C ALA A 473 1.549 0.125 3.717 1.00 0.00 C ATOM 815 O ALA A 473 0.331 0.171 3.544 1.00 0.00 O ATOM 816 CB ALA A 473 2.937 -1.955 3.641 1.00 0.00 C ATOM 0 H ALA A 473 0.215 -1.573 4.984 1.00 0.00 H new ATOM 0 HA ALA A 473 2.882 -0.539 5.243 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.687 -1.407 3.072 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.427 -2.715 4.250 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.240 -2.435 2.954 1.00 0.00 H new ATOM 822 N PHE A 474 2.386 1.024 3.211 1.00 0.00 N ATOM 823 CA PHE A 474 1.911 2.142 2.404 1.00 0.00 C ATOM 824 C PHE A 474 2.404 2.023 0.965 1.00 0.00 C ATOM 825 O PHE A 474 3.607 1.938 0.714 1.00 0.00 O ATOM 826 CB PHE A 474 2.378 3.468 3.007 1.00 0.00 C ATOM 827 CG PHE A 474 1.604 3.877 4.228 1.00 0.00 C ATOM 828 CD1 PHE A 474 1.659 3.118 5.386 1.00 0.00 C ATOM 829 CD2 PHE A 474 0.821 5.021 4.217 1.00 0.00 C ATOM 830 CE1 PHE A 474 0.948 3.492 6.511 1.00 0.00 C ATOM 831 CE2 PHE A 474 0.109 5.400 5.339 1.00 0.00 C ATOM 832 CZ PHE A 474 0.171 4.634 6.487 1.00 0.00 C ATOM 0 H PHE A 474 3.397 1.000 3.345 1.00 0.00 H new ATOM 0 HA PHE A 474 0.821 2.117 2.399 1.00 0.00 H new ATOM 0 HB2 PHE A 474 3.434 3.388 3.266 1.00 0.00 H new ATOM 0 HB3 PHE A 474 2.293 4.251 2.253 1.00 0.00 H new ATOM 0 HD1 PHE A 474 2.264 2.224 5.410 1.00 0.00 H new ATOM 0 HD2 PHE A 474 0.767 5.623 3.322 1.00 0.00 H new ATOM 0 HE1 PHE A 474 1.000 2.892 7.408 1.00 0.00 H new ATOM 0 HE2 PHE A 474 -0.496 6.295 5.318 1.00 0.00 H new ATOM 0 HZ PHE A 474 -0.387 4.927 7.364 1.00 0.00 H new ATOM 842 N LEU A 475 1.466 2.017 0.024 1.00 0.00 N ATOM 843 CA LEU A 475 1.804 1.908 -1.391 1.00 0.00 C ATOM 844 C LEU A 475 2.026 3.287 -2.006 1.00 0.00 C ATOM 845 O LEU A 475 1.297 4.235 -1.711 1.00 0.00 O ATOM 846 CB LEU A 475 0.694 1.174 -2.145 1.00 0.00 C ATOM 847 CG LEU A 475 0.148 -0.087 -1.476 1.00 0.00 C ATOM 848 CD1 LEU A 475 -1.017 -0.654 -2.272 1.00 0.00 C ATOM 849 CD2 LEU A 475 1.248 -1.128 -1.322 1.00 0.00 C ATOM 0 H LEU A 475 0.466 2.086 0.215 1.00 0.00 H new ATOM 0 HA LEU A 475 2.730 1.339 -1.475 1.00 0.00 H new ATOM 0 HB2 LEU A 475 -0.133 1.867 -2.298 1.00 0.00 H new ATOM 0 HB3 LEU A 475 1.070 0.904 -3.132 1.00 0.00 H new ATOM 0 HG LEU A 475 -0.214 0.180 -0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 475 -1.392 -1.551 -1.780 1.00 0.00 H new ATOM 0 HD12 LEU A 475 -1.814 0.088 -2.330 1.00 0.00 H new ATOM 0 HD13 LEU A 475 -0.682 -0.906 -3.278 1.00 0.00 H new ATOM 0 HD21 LEU A 475 0.841 -2.019 -0.844 1.00 0.00 H new ATOM 0 HD22 LEU A 475 1.641 -1.390 -2.304 1.00 0.00 H new ATOM 0 HD23 LEU A 475 2.051 -0.721 -0.707 1.00 0.00 H new ATOM 861 N LEU A 476 3.036 3.391 -2.862 1.00 0.00 N ATOM 862 CA LEU A 476 3.353 4.653 -3.521 1.00 0.00 C ATOM 863 C LEU A 476 3.256 4.516 -5.037 1.00 0.00 C ATOM 864 O LEU A 476 4.267 4.370 -5.724 1.00 0.00 O ATOM 865 CB LEU A 476 4.757 5.117 -3.129 1.00 0.00 C ATOM 866 CG LEU A 476 4.880 5.809 -1.771 1.00 0.00 C ATOM 867 CD1 LEU A 476 6.335 6.134 -1.467 1.00 0.00 C ATOM 868 CD2 LEU A 476 4.031 7.071 -1.737 1.00 0.00 C ATOM 0 H LEU A 476 3.650 2.617 -3.116 1.00 0.00 H new ATOM 0 HA LEU A 476 2.626 5.397 -3.195 1.00 0.00 H new ATOM 0 HB2 LEU A 476 5.419 4.251 -3.134 1.00 0.00 H new ATOM 0 HB3 LEU A 476 5.120 5.800 -3.897 1.00 0.00 H new ATOM 0 HG LEU A 476 4.513 5.128 -1.003 1.00 0.00 H new ATOM 0 HD11 LEU A 476 6.403 6.626 -0.497 1.00 0.00 H new ATOM 0 HD12 LEU A 476 6.917 5.213 -1.448 1.00 0.00 H new ATOM 0 HD13 LEU A 476 6.729 6.796 -2.238 1.00 0.00 H new ATOM 0 HD21 LEU A 476 4.131 7.550 -0.763 1.00 0.00 H new ATOM 0 HD22 LEU A 476 4.367 7.757 -2.515 1.00 0.00 H new ATOM 0 HD23 LEU A 476 2.986 6.811 -1.908 1.00 0.00 H new ATOM 880 N PHE A 477 2.032 4.565 -5.553 1.00 0.00 N ATOM 881 CA PHE A 477 1.803 4.447 -6.988 1.00 0.00 C ATOM 882 C PHE A 477 2.575 5.518 -7.753 1.00 0.00 C ATOM 883 O PHE A 477 2.327 6.712 -7.589 1.00 0.00 O ATOM 884 CB PHE A 477 0.309 4.561 -7.298 1.00 0.00 C ATOM 885 CG PHE A 477 -0.495 3.387 -6.818 1.00 0.00 C ATOM 886 CD1 PHE A 477 -0.908 3.307 -5.498 1.00 0.00 C ATOM 887 CD2 PHE A 477 -0.836 2.362 -7.686 1.00 0.00 C ATOM 888 CE1 PHE A 477 -1.648 2.228 -5.052 1.00 0.00 C ATOM 889 CE2 PHE A 477 -1.576 1.281 -7.246 1.00 0.00 C ATOM 890 CZ PHE A 477 -1.981 1.213 -5.927 1.00 0.00 C ATOM 0 H PHE A 477 1.184 4.686 -4.999 1.00 0.00 H new ATOM 0 HA PHE A 477 2.161 3.468 -7.308 1.00 0.00 H new ATOM 0 HB2 PHE A 477 -0.081 5.470 -6.839 1.00 0.00 H new ATOM 0 HB3 PHE A 477 0.177 4.666 -8.375 1.00 0.00 H new ATOM 0 HD1 PHE A 477 -0.649 4.097 -4.809 1.00 0.00 H new ATOM 0 HD2 PHE A 477 -0.520 2.408 -8.718 1.00 0.00 H new ATOM 0 HE1 PHE A 477 -1.965 2.179 -4.021 1.00 0.00 H new ATOM 0 HE2 PHE A 477 -1.838 0.490 -7.933 1.00 0.00 H new ATOM 0 HZ PHE A 477 -2.557 0.368 -5.581 1.00 0.00 H new ATOM 900 N GLN A 478 3.513 5.081 -8.587 1.00 0.00 N ATOM 901 CA GLN A 478 4.323 6.002 -9.375 1.00 0.00 C ATOM 902 C GLN A 478 3.482 7.168 -9.885 1.00 0.00 C ATOM 903 O GLN A 478 3.901 8.323 -9.817 1.00 0.00 O ATOM 904 CB GLN A 478 4.966 5.268 -10.553 1.00 0.00 C ATOM 905 CG GLN A 478 6.020 6.089 -11.279 1.00 0.00 C ATOM 906 CD GLN A 478 6.696 5.317 -12.395 1.00 0.00 C ATOM 907 OE1 GLN A 478 6.990 4.129 -12.253 1.00 0.00 O ATOM 908 NE2 GLN A 478 6.945 5.988 -13.513 1.00 0.00 N ATOM 0 H GLN A 478 3.731 4.095 -8.734 1.00 0.00 H new ATOM 0 HA GLN A 478 5.108 6.399 -8.731 1.00 0.00 H new ATOM 0 HB2 GLN A 478 5.421 4.346 -10.191 1.00 0.00 H new ATOM 0 HB3 GLN A 478 4.188 4.983 -11.261 1.00 0.00 H new ATOM 0 HG2 GLN A 478 5.556 6.985 -11.692 1.00 0.00 H new ATOM 0 HG3 GLN A 478 6.773 6.420 -10.564 1.00 0.00 H new ATOM 0 HE21 GLN A 478 6.684 6.971 -13.587 1.00 0.00 H new ATOM 0 HE22 GLN A 478 7.397 5.520 -14.299 1.00 0.00 H new ATOM 917 N GLU A 479 2.295 6.856 -10.394 1.00 0.00 N ATOM 918 CA GLU A 479 1.396 7.878 -10.916 1.00 0.00 C ATOM 919 C GLU A 479 0.162 8.022 -10.030 1.00 0.00 C ATOM 920 O GLU A 479 -0.286 7.057 -9.411 1.00 0.00 O ATOM 921 CB GLU A 479 0.973 7.536 -12.346 1.00 0.00 C ATOM 922 CG GLU A 479 1.915 8.080 -13.407 1.00 0.00 C ATOM 923 CD GLU A 479 1.549 7.619 -14.804 1.00 0.00 C ATOM 924 OE1 GLU A 479 1.956 6.502 -15.185 1.00 0.00 O ATOM 925 OE2 GLU A 479 0.856 8.376 -15.516 1.00 0.00 O ATOM 0 H GLU A 479 1.934 5.904 -10.456 1.00 0.00 H new ATOM 0 HA GLU A 479 1.932 8.827 -10.921 1.00 0.00 H new ATOM 0 HB2 GLU A 479 0.911 6.453 -12.448 1.00 0.00 H new ATOM 0 HB3 GLU A 479 -0.027 7.930 -12.524 1.00 0.00 H new ATOM 0 HG2 GLU A 479 1.904 9.169 -13.373 1.00 0.00 H new ATOM 0 HG3 GLU A 479 2.933 7.765 -13.180 1.00 0.00 H new ATOM 932 N GLU A 480 -0.382 9.234 -9.974 1.00 0.00 N ATOM 933 CA GLU A 480 -1.562 9.504 -9.162 1.00 0.00 C ATOM 934 C GLU A 480 -2.806 8.875 -9.784 1.00 0.00 C ATOM 935 O GLU A 480 -3.638 8.296 -9.085 1.00 0.00 O ATOM 936 CB GLU A 480 -1.766 11.012 -9.004 1.00 0.00 C ATOM 937 CG GLU A 480 -0.946 11.622 -7.879 1.00 0.00 C ATOM 938 CD GLU A 480 -1.412 13.017 -7.508 1.00 0.00 C ATOM 939 OE1 GLU A 480 -2.522 13.142 -6.950 1.00 0.00 O ATOM 940 OE2 GLU A 480 -0.667 13.982 -7.776 1.00 0.00 O ATOM 0 H GLU A 480 -0.024 10.044 -10.481 1.00 0.00 H new ATOM 0 HA GLU A 480 -1.404 9.061 -8.179 1.00 0.00 H new ATOM 0 HB2 GLU A 480 -1.506 11.505 -9.941 1.00 0.00 H new ATOM 0 HB3 GLU A 480 -2.822 11.210 -8.821 1.00 0.00 H new ATOM 0 HG2 GLU A 480 -1.004 10.978 -7.001 1.00 0.00 H new ATOM 0 HG3 GLU A 480 0.102 11.660 -8.177 1.00 0.00 H new ATOM 947 N SER A 481 -2.925 8.993 -11.103 1.00 0.00 N ATOM 948 CA SER A 481 -4.068 8.440 -11.819 1.00 0.00 C ATOM 949 C SER A 481 -4.458 7.078 -11.252 1.00 0.00 C ATOM 950 O SER A 481 -5.559 6.902 -10.731 1.00 0.00 O ATOM 951 CB SER A 481 -3.749 8.312 -13.310 1.00 0.00 C ATOM 952 OG SER A 481 -4.862 7.807 -14.028 1.00 0.00 O ATOM 0 H SER A 481 -2.244 9.466 -11.697 1.00 0.00 H new ATOM 0 HA SER A 481 -4.909 9.121 -11.692 1.00 0.00 H new ATOM 0 HB2 SER A 481 -3.466 9.286 -13.709 1.00 0.00 H new ATOM 0 HB3 SER A 481 -2.893 7.651 -13.447 1.00 0.00 H new ATOM 0 HG SER A 481 -4.633 7.736 -14.978 1.00 0.00 H new ATOM 958 N SER A 482 -3.546 6.117 -11.358 1.00 0.00 N ATOM 959 CA SER A 482 -3.794 4.769 -10.860 1.00 0.00 C ATOM 960 C SER A 482 -4.636 4.807 -9.588 1.00 0.00 C ATOM 961 O SER A 482 -5.663 4.136 -9.490 1.00 0.00 O ATOM 962 CB SER A 482 -2.471 4.051 -10.588 1.00 0.00 C ATOM 963 OG SER A 482 -1.866 4.528 -9.399 1.00 0.00 O ATOM 0 H SER A 482 -2.629 6.247 -11.784 1.00 0.00 H new ATOM 0 HA SER A 482 -4.345 4.221 -11.624 1.00 0.00 H new ATOM 0 HB2 SER A 482 -2.646 2.978 -10.505 1.00 0.00 H new ATOM 0 HB3 SER A 482 -1.794 4.199 -11.429 1.00 0.00 H new ATOM 0 HG SER A 482 -1.877 3.821 -8.720 1.00 0.00 H new ATOM 969 N VAL A 483 -4.191 5.596 -8.615 1.00 0.00 N ATOM 970 CA VAL A 483 -4.903 5.723 -7.349 1.00 0.00 C ATOM 971 C VAL A 483 -6.410 5.627 -7.553 1.00 0.00 C ATOM 972 O VAL A 483 -7.095 4.881 -6.854 1.00 0.00 O ATOM 973 CB VAL A 483 -4.574 7.057 -6.652 1.00 0.00 C ATOM 974 CG1 VAL A 483 -5.358 7.189 -5.355 1.00 0.00 C ATOM 975 CG2 VAL A 483 -3.079 7.169 -6.395 1.00 0.00 C ATOM 0 H VAL A 483 -3.341 6.156 -8.679 1.00 0.00 H new ATOM 0 HA VAL A 483 -4.573 4.899 -6.716 1.00 0.00 H new ATOM 0 HB VAL A 483 -4.868 7.874 -7.311 1.00 0.00 H new ATOM 0 HG11 VAL A 483 -5.113 8.137 -4.877 1.00 0.00 H new ATOM 0 HG12 VAL A 483 -6.426 7.157 -5.571 1.00 0.00 H new ATOM 0 HG13 VAL A 483 -5.098 6.368 -4.687 1.00 0.00 H new ATOM 0 HG21 VAL A 483 -2.865 8.117 -5.902 1.00 0.00 H new ATOM 0 HG22 VAL A 483 -2.757 6.347 -5.756 1.00 0.00 H new ATOM 0 HG23 VAL A 483 -2.542 7.123 -7.343 1.00 0.00 H new ATOM 985 N GLN A 484 -6.921 6.387 -8.517 1.00 0.00 N ATOM 986 CA GLN A 484 -8.348 6.387 -8.814 1.00 0.00 C ATOM 987 C GLN A 484 -8.841 4.977 -9.120 1.00 0.00 C ATOM 988 O GLN A 484 -9.794 4.495 -8.508 1.00 0.00 O ATOM 989 CB GLN A 484 -8.645 7.312 -9.995 1.00 0.00 C ATOM 990 CG GLN A 484 -10.122 7.399 -10.344 1.00 0.00 C ATOM 991 CD GLN A 484 -10.870 8.391 -9.476 1.00 0.00 C ATOM 992 OE1 GLN A 484 -10.765 9.603 -9.666 1.00 0.00 O ATOM 993 NE2 GLN A 484 -11.631 7.881 -8.514 1.00 0.00 N ATOM 0 H GLN A 484 -6.368 7.010 -9.105 1.00 0.00 H new ATOM 0 HA GLN A 484 -8.876 6.753 -7.934 1.00 0.00 H new ATOM 0 HB2 GLN A 484 -8.275 8.311 -9.765 1.00 0.00 H new ATOM 0 HB3 GLN A 484 -8.094 6.961 -10.868 1.00 0.00 H new ATOM 0 HG2 GLN A 484 -10.228 7.686 -11.390 1.00 0.00 H new ATOM 0 HG3 GLN A 484 -10.575 6.414 -10.236 1.00 0.00 H new ATOM 0 HE21 GLN A 484 -11.689 6.870 -8.392 1.00 0.00 H new ATOM 0 HE22 GLN A 484 -12.157 8.500 -7.898 1.00 0.00 H new ATOM 1002 N ALA A 485 -8.186 4.320 -10.072 1.00 0.00 N ATOM 1003 CA ALA A 485 -8.556 2.965 -10.459 1.00 0.00 C ATOM 1004 C ALA A 485 -8.618 2.045 -9.244 1.00 0.00 C ATOM 1005 O ALA A 485 -9.396 1.090 -9.214 1.00 0.00 O ATOM 1006 CB ALA A 485 -7.574 2.421 -11.485 1.00 0.00 C ATOM 0 H ALA A 485 -7.396 4.705 -10.589 1.00 0.00 H new ATOM 0 HA ALA A 485 -9.549 3.001 -10.907 1.00 0.00 H new ATOM 0 HB1 ALA A 485 -7.864 1.408 -11.764 1.00 0.00 H new ATOM 0 HB2 ALA A 485 -7.582 3.058 -12.370 1.00 0.00 H new ATOM 0 HB3 ALA A 485 -6.572 2.407 -11.057 1.00 0.00 H new ATOM 1012 N LEU A 486 -7.794 2.338 -8.244 1.00 0.00 N ATOM 1013 CA LEU A 486 -7.755 1.536 -7.026 1.00 0.00 C ATOM 1014 C LEU A 486 -9.032 1.718 -6.212 1.00 0.00 C ATOM 1015 O LEU A 486 -9.689 0.744 -5.843 1.00 0.00 O ATOM 1016 CB LEU A 486 -6.539 1.918 -6.180 1.00 0.00 C ATOM 1017 CG LEU A 486 -6.207 0.979 -5.019 1.00 0.00 C ATOM 1018 CD1 LEU A 486 -5.782 -0.385 -5.540 1.00 0.00 C ATOM 1019 CD2 LEU A 486 -5.119 1.580 -4.141 1.00 0.00 C ATOM 0 H LEU A 486 -7.144 3.124 -8.252 1.00 0.00 H new ATOM 0 HA LEU A 486 -7.676 0.488 -7.313 1.00 0.00 H new ATOM 0 HB2 LEU A 486 -5.669 1.975 -6.835 1.00 0.00 H new ATOM 0 HB3 LEU A 486 -6.701 2.918 -5.777 1.00 0.00 H new ATOM 0 HG LEU A 486 -7.104 0.850 -4.414 1.00 0.00 H new ATOM 0 HD11 LEU A 486 -5.550 -1.039 -4.700 1.00 0.00 H new ATOM 0 HD12 LEU A 486 -6.592 -0.820 -6.125 1.00 0.00 H new ATOM 0 HD13 LEU A 486 -4.899 -0.275 -6.169 1.00 0.00 H new ATOM 0 HD21 LEU A 486 -4.896 0.898 -3.320 1.00 0.00 H new ATOM 0 HD22 LEU A 486 -4.219 1.740 -4.735 1.00 0.00 H new ATOM 0 HD23 LEU A 486 -5.462 2.533 -3.738 1.00 0.00 H new ATOM 1031 N ILE A 487 -9.379 2.971 -5.938 1.00 0.00 N ATOM 1032 CA ILE A 487 -10.580 3.280 -5.172 1.00 0.00 C ATOM 1033 C ILE A 487 -11.808 2.614 -5.782 1.00 0.00 C ATOM 1034 O ILE A 487 -12.646 2.061 -5.069 1.00 0.00 O ATOM 1035 CB ILE A 487 -10.820 4.799 -5.091 1.00 0.00 C ATOM 1036 CG1 ILE A 487 -9.605 5.498 -4.477 1.00 0.00 C ATOM 1037 CG2 ILE A 487 -12.074 5.094 -4.281 1.00 0.00 C ATOM 1038 CD1 ILE A 487 -9.585 6.992 -4.713 1.00 0.00 C ATOM 0 H ILE A 487 -8.846 3.788 -6.235 1.00 0.00 H new ATOM 0 HA ILE A 487 -10.422 2.891 -4.166 1.00 0.00 H new ATOM 0 HB ILE A 487 -10.964 5.184 -6.101 1.00 0.00 H new ATOM 0 HG12 ILE A 487 -9.590 5.308 -3.404 1.00 0.00 H new ATOM 0 HG13 ILE A 487 -8.697 5.061 -4.891 1.00 0.00 H new ATOM 0 HG21 ILE A 487 -12.231 6.172 -4.232 1.00 0.00 H new ATOM 0 HG22 ILE A 487 -12.934 4.623 -4.757 1.00 0.00 H new ATOM 0 HG23 ILE A 487 -11.957 4.699 -3.272 1.00 0.00 H new ATOM 0 HD11 ILE A 487 -8.696 7.422 -4.250 1.00 0.00 H new ATOM 0 HD12 ILE A 487 -9.568 7.191 -5.785 1.00 0.00 H new ATOM 0 HD13 ILE A 487 -10.476 7.442 -4.274 1.00 0.00 H new ATOM 1050 N ASP A 488 -11.908 2.669 -7.105 1.00 0.00 N ATOM 1051 CA ASP A 488 -13.033 2.068 -7.813 1.00 0.00 C ATOM 1052 C ASP A 488 -13.067 0.559 -7.597 1.00 0.00 C ATOM 1053 O ASP A 488 -14.120 -0.015 -7.317 1.00 0.00 O ATOM 1054 CB ASP A 488 -12.948 2.380 -9.308 1.00 0.00 C ATOM 1055 CG ASP A 488 -14.240 2.071 -10.038 1.00 0.00 C ATOM 1056 OD1 ASP A 488 -14.570 0.875 -10.177 1.00 0.00 O ATOM 1057 OD2 ASP A 488 -14.921 3.024 -10.471 1.00 0.00 O ATOM 0 H ASP A 488 -11.224 3.124 -7.710 1.00 0.00 H new ATOM 0 HA ASP A 488 -13.952 2.495 -7.413 1.00 0.00 H new ATOM 0 HB2 ASP A 488 -12.701 3.433 -9.443 1.00 0.00 H new ATOM 0 HB3 ASP A 488 -12.137 1.803 -9.751 1.00 0.00 H new ATOM 1062 N ALA A 489 -11.909 -0.079 -7.729 1.00 0.00 N ATOM 1063 CA ALA A 489 -11.806 -1.522 -7.548 1.00 0.00 C ATOM 1064 C ALA A 489 -12.069 -1.913 -6.098 1.00 0.00 C ATOM 1065 O ALA A 489 -12.661 -2.958 -5.824 1.00 0.00 O ATOM 1066 CB ALA A 489 -10.435 -2.013 -7.988 1.00 0.00 C ATOM 0 H ALA A 489 -11.028 0.381 -7.961 1.00 0.00 H new ATOM 0 HA ALA A 489 -12.566 -1.996 -8.169 1.00 0.00 H new ATOM 0 HB1 ALA A 489 -10.373 -3.092 -7.847 1.00 0.00 H new ATOM 0 HB2 ALA A 489 -10.284 -1.775 -9.041 1.00 0.00 H new ATOM 0 HB3 ALA A 489 -9.665 -1.524 -7.392 1.00 0.00 H new ATOM 1072 N CYS A 490 -11.627 -1.069 -5.173 1.00 0.00 N ATOM 1073 CA CYS A 490 -11.813 -1.327 -3.749 1.00 0.00 C ATOM 1074 C CYS A 490 -13.280 -1.178 -3.357 1.00 0.00 C ATOM 1075 O CYS A 490 -13.850 -0.090 -3.447 1.00 0.00 O ATOM 1076 CB CYS A 490 -10.952 -0.374 -2.919 1.00 0.00 C ATOM 1077 SG CYS A 490 -9.191 -0.423 -3.331 1.00 0.00 S ATOM 0 H CYS A 490 -11.137 -0.199 -5.383 1.00 0.00 H new ATOM 0 HA CYS A 490 -11.503 -2.353 -3.548 1.00 0.00 H new ATOM 0 HB2 CYS A 490 -11.318 0.643 -3.057 1.00 0.00 H new ATOM 0 HB3 CYS A 490 -11.074 -0.617 -1.863 1.00 0.00 H new ATOM 0 HG CYS A 490 -9.021 -0.027 -4.558 1.00 0.00 H new ATOM 1083 N LEU A 491 -13.885 -2.278 -2.924 1.00 0.00 N ATOM 1084 CA LEU A 491 -15.287 -2.271 -2.520 1.00 0.00 C ATOM 1085 C LEU A 491 -15.518 -1.290 -1.376 1.00 0.00 C ATOM 1086 O LEU A 491 -14.595 -0.606 -0.935 1.00 0.00 O ATOM 1087 CB LEU A 491 -15.723 -3.676 -2.098 1.00 0.00 C ATOM 1088 CG LEU A 491 -15.572 -4.771 -3.154 1.00 0.00 C ATOM 1089 CD1 LEU A 491 -15.651 -6.147 -2.512 1.00 0.00 C ATOM 1090 CD2 LEU A 491 -16.634 -4.622 -4.234 1.00 0.00 C ATOM 0 H LEU A 491 -13.427 -3.186 -2.843 1.00 0.00 H new ATOM 0 HA LEU A 491 -15.885 -1.953 -3.374 1.00 0.00 H new ATOM 0 HB2 LEU A 491 -15.147 -3.965 -1.219 1.00 0.00 H new ATOM 0 HB3 LEU A 491 -16.769 -3.634 -1.794 1.00 0.00 H new ATOM 0 HG LEU A 491 -14.592 -4.666 -3.620 1.00 0.00 H new ATOM 0 HD11 LEU A 491 -15.541 -6.913 -3.279 1.00 0.00 H new ATOM 0 HD12 LEU A 491 -14.853 -6.252 -1.778 1.00 0.00 H new ATOM 0 HD13 LEU A 491 -16.616 -6.263 -2.018 1.00 0.00 H new ATOM 0 HD21 LEU A 491 -16.511 -5.410 -4.977 1.00 0.00 H new ATOM 0 HD22 LEU A 491 -17.624 -4.699 -3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 491 -16.529 -3.650 -4.716 1.00 0.00 H new ATOM 1102 N GLU A 492 -16.757 -1.227 -0.898 1.00 0.00 N ATOM 1103 CA GLU A 492 -17.109 -0.330 0.197 1.00 0.00 C ATOM 1104 C GLU A 492 -18.119 -0.985 1.134 1.00 0.00 C ATOM 1105 O GLU A 492 -19.057 -1.645 0.689 1.00 0.00 O ATOM 1106 CB GLU A 492 -17.681 0.979 -0.352 1.00 0.00 C ATOM 1107 CG GLU A 492 -18.257 1.888 0.721 1.00 0.00 C ATOM 1108 CD GLU A 492 -19.516 1.322 1.350 1.00 0.00 C ATOM 1109 OE1 GLU A 492 -20.248 0.589 0.653 1.00 0.00 O ATOM 1110 OE2 GLU A 492 -19.768 1.613 2.538 1.00 0.00 O ATOM 0 H GLU A 492 -17.533 -1.786 -1.252 1.00 0.00 H new ATOM 0 HA GLU A 492 -16.202 -0.114 0.762 1.00 0.00 H new ATOM 0 HB2 GLU A 492 -16.895 1.514 -0.886 1.00 0.00 H new ATOM 0 HB3 GLU A 492 -18.460 0.749 -1.078 1.00 0.00 H new ATOM 0 HG2 GLU A 492 -17.508 2.048 1.497 1.00 0.00 H new ATOM 0 HG3 GLU A 492 -18.479 2.862 0.286 1.00 0.00 H new ATOM 1117 N GLU A 493 -17.918 -0.797 2.435 1.00 0.00 N ATOM 1118 CA GLU A 493 -18.811 -1.371 3.435 1.00 0.00 C ATOM 1119 C GLU A 493 -19.514 -0.275 4.230 1.00 0.00 C ATOM 1120 O GLU A 493 -20.711 -0.041 4.060 1.00 0.00 O ATOM 1121 CB GLU A 493 -18.030 -2.283 4.384 1.00 0.00 C ATOM 1122 CG GLU A 493 -18.915 -3.100 5.310 1.00 0.00 C ATOM 1123 CD GLU A 493 -18.290 -4.426 5.696 1.00 0.00 C ATOM 1124 OE1 GLU A 493 -18.400 -5.386 4.904 1.00 0.00 O ATOM 1125 OE2 GLU A 493 -17.691 -4.505 6.788 1.00 0.00 O ATOM 0 H GLU A 493 -17.146 -0.253 2.820 1.00 0.00 H new ATOM 0 HA GLU A 493 -19.566 -1.960 2.915 1.00 0.00 H new ATOM 0 HB2 GLU A 493 -17.411 -2.960 3.796 1.00 0.00 H new ATOM 0 HB3 GLU A 493 -17.354 -1.674 4.985 1.00 0.00 H new ATOM 0 HG2 GLU A 493 -19.120 -2.523 6.212 1.00 0.00 H new ATOM 0 HG3 GLU A 493 -19.873 -3.282 4.823 1.00 0.00 H new ATOM 1132 N ASP A 494 -18.763 0.393 5.098 1.00 0.00 N ATOM 1133 CA ASP A 494 -19.314 1.465 5.919 1.00 0.00 C ATOM 1134 C ASP A 494 -18.433 2.709 5.850 1.00 0.00 C ATOM 1135 O ASP A 494 -17.752 3.054 6.815 1.00 0.00 O ATOM 1136 CB ASP A 494 -19.454 1.004 7.371 1.00 0.00 C ATOM 1137 CG ASP A 494 -20.546 1.750 8.112 1.00 0.00 C ATOM 1138 OD1 ASP A 494 -21.549 2.127 7.470 1.00 0.00 O ATOM 1139 OD2 ASP A 494 -20.398 1.956 9.335 1.00 0.00 O ATOM 0 H ASP A 494 -17.771 0.211 5.252 1.00 0.00 H new ATOM 0 HA ASP A 494 -20.300 1.718 5.530 1.00 0.00 H new ATOM 0 HB2 ASP A 494 -19.670 -0.064 7.391 1.00 0.00 H new ATOM 0 HB3 ASP A 494 -18.505 1.147 7.888 1.00 0.00 H new ATOM 1144 N GLY A 495 -18.451 3.378 4.702 1.00 0.00 N ATOM 1145 CA GLY A 495 -17.650 4.576 4.528 1.00 0.00 C ATOM 1146 C GLY A 495 -16.209 4.262 4.177 1.00 0.00 C ATOM 1147 O GLY A 495 -15.513 5.087 3.583 1.00 0.00 O ATOM 0 H GLY A 495 -19.006 3.112 3.889 1.00 0.00 H new ATOM 0 HA2 GLY A 495 -18.087 5.191 3.741 1.00 0.00 H new ATOM 0 HA3 GLY A 495 -17.678 5.165 5.445 1.00 0.00 H new ATOM 1151 N LYS A 496 -15.758 3.068 4.545 1.00 0.00 N ATOM 1152 CA LYS A 496 -14.390 2.647 4.266 1.00 0.00 C ATOM 1153 C LYS A 496 -14.348 1.679 3.088 1.00 0.00 C ATOM 1154 O LYS A 496 -15.318 0.970 2.820 1.00 0.00 O ATOM 1155 CB LYS A 496 -13.775 1.988 5.503 1.00 0.00 C ATOM 1156 CG LYS A 496 -13.484 2.963 6.631 1.00 0.00 C ATOM 1157 CD LYS A 496 -13.574 2.289 7.989 1.00 0.00 C ATOM 1158 CE LYS A 496 -14.980 2.373 8.562 1.00 0.00 C ATOM 1159 NZ LYS A 496 -15.249 1.281 9.537 1.00 0.00 N ATOM 0 H LYS A 496 -16.320 2.374 5.038 1.00 0.00 H new ATOM 0 HA LYS A 496 -13.810 3.533 4.007 1.00 0.00 H new ATOM 0 HB2 LYS A 496 -14.452 1.216 5.867 1.00 0.00 H new ATOM 0 HB3 LYS A 496 -12.849 1.490 5.216 1.00 0.00 H new ATOM 0 HG2 LYS A 496 -12.488 3.386 6.499 1.00 0.00 H new ATOM 0 HG3 LYS A 496 -14.191 3.792 6.588 1.00 0.00 H new ATOM 0 HD2 LYS A 496 -13.279 1.244 7.897 1.00 0.00 H new ATOM 0 HD3 LYS A 496 -12.871 2.759 8.677 1.00 0.00 H new ATOM 0 HE2 LYS A 496 -15.116 3.338 9.051 1.00 0.00 H new ATOM 0 HE3 LYS A 496 -15.706 2.322 7.751 1.00 0.00 H new ATOM 0 HZ1 LYS A 496 -16.218 1.374 9.904 1.00 0.00 H new ATOM 0 HZ2 LYS A 496 -15.145 0.360 9.065 1.00 0.00 H new ATOM 0 HZ3 LYS A 496 -14.573 1.344 10.325 1.00 0.00 H new ATOM 1173 N LEU A 497 -13.219 1.654 2.389 1.00 0.00 N ATOM 1174 CA LEU A 497 -13.050 0.772 1.240 1.00 0.00 C ATOM 1175 C LEU A 497 -12.381 -0.536 1.651 1.00 0.00 C ATOM 1176 O LEU A 497 -11.906 -0.674 2.778 1.00 0.00 O ATOM 1177 CB LEU A 497 -12.220 1.464 0.157 1.00 0.00 C ATOM 1178 CG LEU A 497 -12.737 2.822 -0.319 1.00 0.00 C ATOM 1179 CD1 LEU A 497 -11.654 3.568 -1.083 1.00 0.00 C ATOM 1180 CD2 LEU A 497 -13.977 2.647 -1.183 1.00 0.00 C ATOM 0 H LEU A 497 -12.407 2.235 2.598 1.00 0.00 H new ATOM 0 HA LEU A 497 -14.038 0.544 0.841 1.00 0.00 H new ATOM 0 HB2 LEU A 497 -11.205 1.595 0.533 1.00 0.00 H new ATOM 0 HB3 LEU A 497 -12.157 0.799 -0.705 1.00 0.00 H new ATOM 0 HG LEU A 497 -13.008 3.413 0.556 1.00 0.00 H new ATOM 0 HD11 LEU A 497 -12.040 4.532 -1.414 1.00 0.00 H new ATOM 0 HD12 LEU A 497 -10.793 3.726 -0.433 1.00 0.00 H new ATOM 0 HD13 LEU A 497 -11.351 2.982 -1.950 1.00 0.00 H new ATOM 0 HD21 LEU A 497 -14.331 3.624 -1.513 1.00 0.00 H new ATOM 0 HD22 LEU A 497 -13.732 2.037 -2.053 1.00 0.00 H new ATOM 0 HD23 LEU A 497 -14.758 2.155 -0.603 1.00 0.00 H new ATOM 1192 N TYR A 498 -12.345 -1.491 0.729 1.00 0.00 N ATOM 1193 CA TYR A 498 -11.734 -2.788 0.995 1.00 0.00 C ATOM 1194 C TYR A 498 -11.388 -3.505 -0.306 1.00 0.00 C ATOM 1195 O TYR A 498 -12.222 -3.623 -1.205 1.00 0.00 O ATOM 1196 CB TYR A 498 -12.674 -3.656 1.834 1.00 0.00 C ATOM 1197 CG TYR A 498 -13.105 -3.005 3.129 1.00 0.00 C ATOM 1198 CD1 TYR A 498 -12.355 -3.157 4.289 1.00 0.00 C ATOM 1199 CD2 TYR A 498 -14.261 -2.237 3.193 1.00 0.00 C ATOM 1200 CE1 TYR A 498 -12.745 -2.564 5.474 1.00 0.00 C ATOM 1201 CE2 TYR A 498 -14.658 -1.640 4.373 1.00 0.00 C ATOM 1202 CZ TYR A 498 -13.897 -1.807 5.512 1.00 0.00 C ATOM 1203 OH TYR A 498 -14.289 -1.214 6.690 1.00 0.00 O ATOM 0 H TYR A 498 -12.732 -1.392 -0.210 1.00 0.00 H new ATOM 0 HA TYR A 498 -10.812 -2.619 1.552 1.00 0.00 H new ATOM 0 HB2 TYR A 498 -13.559 -3.893 1.244 1.00 0.00 H new ATOM 0 HB3 TYR A 498 -12.179 -4.600 2.059 1.00 0.00 H new ATOM 0 HD1 TYR A 498 -11.452 -3.749 4.264 1.00 0.00 H new ATOM 0 HD2 TYR A 498 -14.860 -2.105 2.304 1.00 0.00 H new ATOM 0 HE1 TYR A 498 -12.151 -2.693 6.366 1.00 0.00 H new ATOM 0 HE2 TYR A 498 -15.559 -1.046 4.404 1.00 0.00 H new ATOM 0 HH TYR A 498 -13.498 -1.006 7.230 1.00 0.00 H new ATOM 1213 N LEU A 499 -10.151 -3.982 -0.400 1.00 0.00 N ATOM 1214 CA LEU A 499 -9.692 -4.689 -1.590 1.00 0.00 C ATOM 1215 C LEU A 499 -9.166 -6.075 -1.232 1.00 0.00 C ATOM 1216 O LEU A 499 -8.352 -6.224 -0.320 1.00 0.00 O ATOM 1217 CB LEU A 499 -8.601 -3.883 -2.297 1.00 0.00 C ATOM 1218 CG LEU A 499 -8.115 -4.441 -3.635 1.00 0.00 C ATOM 1219 CD1 LEU A 499 -9.113 -4.128 -4.738 1.00 0.00 C ATOM 1220 CD2 LEU A 499 -6.743 -3.880 -3.980 1.00 0.00 C ATOM 0 H LEU A 499 -9.448 -3.892 0.334 1.00 0.00 H new ATOM 0 HA LEU A 499 -10.542 -4.807 -2.263 1.00 0.00 H new ATOM 0 HB2 LEU A 499 -8.973 -2.872 -2.461 1.00 0.00 H new ATOM 0 HB3 LEU A 499 -7.745 -3.803 -1.627 1.00 0.00 H new ATOM 0 HG LEU A 499 -8.031 -5.524 -3.546 1.00 0.00 H new ATOM 0 HD11 LEU A 499 -8.750 -4.533 -5.683 1.00 0.00 H new ATOM 0 HD12 LEU A 499 -10.076 -4.578 -4.496 1.00 0.00 H new ATOM 0 HD13 LEU A 499 -9.230 -3.048 -4.827 1.00 0.00 H new ATOM 0 HD21 LEU A 499 -6.413 -4.288 -4.935 1.00 0.00 H new ATOM 0 HD22 LEU A 499 -6.801 -2.794 -4.050 1.00 0.00 H new ATOM 0 HD23 LEU A 499 -6.031 -4.156 -3.202 1.00 0.00 H new ATOM 1232 N CYS A 500 -9.635 -7.085 -1.956 1.00 0.00 N ATOM 1233 CA CYS A 500 -9.210 -8.460 -1.715 1.00 0.00 C ATOM 1234 C CYS A 500 -7.858 -8.733 -2.365 1.00 0.00 C ATOM 1235 O CYS A 500 -7.575 -8.248 -3.461 1.00 0.00 O ATOM 1236 CB CYS A 500 -10.255 -9.440 -2.252 1.00 0.00 C ATOM 1237 SG CYS A 500 -11.886 -9.270 -1.490 1.00 0.00 S ATOM 0 H CYS A 500 -10.309 -6.978 -2.714 1.00 0.00 H new ATOM 0 HA CYS A 500 -9.110 -8.600 -0.639 1.00 0.00 H new ATOM 0 HB2 CYS A 500 -10.352 -9.298 -3.328 1.00 0.00 H new ATOM 0 HB3 CYS A 500 -9.897 -10.458 -2.096 1.00 0.00 H new ATOM 0 HG CYS A 500 -12.701 -10.139 -2.011 1.00 0.00 H new ATOM 1243 N VAL A 501 -7.025 -9.512 -1.682 1.00 0.00 N ATOM 1244 CA VAL A 501 -5.702 -9.849 -2.192 1.00 0.00 C ATOM 1245 C VAL A 501 -5.398 -11.330 -1.996 1.00 0.00 C ATOM 1246 O VAL A 501 -5.261 -11.802 -0.867 1.00 0.00 O ATOM 1247 CB VAL A 501 -4.605 -9.016 -1.503 1.00 0.00 C ATOM 1248 CG1 VAL A 501 -4.593 -7.595 -2.046 1.00 0.00 C ATOM 1249 CG2 VAL A 501 -4.804 -9.017 0.005 1.00 0.00 C ATOM 0 H VAL A 501 -7.244 -9.921 -0.774 1.00 0.00 H new ATOM 0 HA VAL A 501 -5.706 -9.620 -3.258 1.00 0.00 H new ATOM 0 HB VAL A 501 -3.638 -9.470 -1.720 1.00 0.00 H new ATOM 0 HG11 VAL A 501 -3.812 -7.022 -1.547 1.00 0.00 H new ATOM 0 HG12 VAL A 501 -4.399 -7.617 -3.118 1.00 0.00 H new ATOM 0 HG13 VAL A 501 -5.560 -7.127 -1.862 1.00 0.00 H new ATOM 0 HG21 VAL A 501 -4.020 -8.424 0.476 1.00 0.00 H new ATOM 0 HG22 VAL A 501 -5.777 -8.588 0.244 1.00 0.00 H new ATOM 0 HG23 VAL A 501 -4.758 -10.040 0.377 1.00 0.00 H new ATOM 1259 N SER A 502 -5.294 -12.059 -3.102 1.00 0.00 N ATOM 1260 CA SER A 502 -5.009 -13.488 -3.052 1.00 0.00 C ATOM 1261 C SER A 502 -3.505 -13.743 -3.042 1.00 0.00 C ATOM 1262 O SER A 502 -2.763 -13.179 -3.846 1.00 0.00 O ATOM 1263 CB SER A 502 -5.650 -14.200 -4.246 1.00 0.00 C ATOM 1264 OG SER A 502 -5.076 -13.765 -5.466 1.00 0.00 O ATOM 0 H SER A 502 -5.403 -11.684 -4.044 1.00 0.00 H new ATOM 0 HA SER A 502 -5.433 -13.885 -2.130 1.00 0.00 H new ATOM 0 HB2 SER A 502 -5.521 -15.277 -4.143 1.00 0.00 H new ATOM 0 HB3 SER A 502 -6.723 -14.007 -4.256 1.00 0.00 H new ATOM 0 HG SER A 502 -4.163 -13.447 -5.303 1.00 0.00 H new ATOM 1270 N SER A 503 -3.062 -14.597 -2.124 1.00 0.00 N ATOM 1271 CA SER A 503 -1.646 -14.925 -2.005 1.00 0.00 C ATOM 1272 C SER A 503 -1.404 -16.403 -2.295 1.00 0.00 C ATOM 1273 O SER A 503 -2.299 -17.240 -2.174 1.00 0.00 O ATOM 1274 CB SER A 503 -1.137 -14.578 -0.605 1.00 0.00 C ATOM 1275 OG SER A 503 -1.116 -13.176 -0.402 1.00 0.00 O ATOM 0 H SER A 503 -3.663 -15.074 -1.452 1.00 0.00 H new ATOM 0 HA SER A 503 -1.099 -14.335 -2.740 1.00 0.00 H new ATOM 0 HB2 SER A 503 -1.775 -15.047 0.144 1.00 0.00 H new ATOM 0 HB3 SER A 503 -0.134 -14.983 -0.469 1.00 0.00 H new ATOM 0 HG SER A 503 -0.512 -12.962 0.339 1.00 0.00 H new ATOM 1281 N PRO A 504 -0.165 -16.732 -2.689 1.00 0.00 N ATOM 1282 CA PRO A 504 0.225 -18.110 -3.005 1.00 0.00 C ATOM 1283 C PRO A 504 -0.266 -19.105 -1.959 1.00 0.00 C ATOM 1284 O PRO A 504 -0.399 -20.298 -2.236 1.00 0.00 O ATOM 1285 CB PRO A 504 1.755 -18.052 -3.012 1.00 0.00 C ATOM 1286 CG PRO A 504 2.079 -16.645 -3.380 1.00 0.00 C ATOM 1287 CD PRO A 504 0.951 -15.786 -2.856 1.00 0.00 C ATOM 0 HA PRO A 504 -0.207 -18.451 -3.946 1.00 0.00 H new ATOM 0 HB2 PRO A 504 2.165 -18.310 -2.036 1.00 0.00 H new ATOM 0 HB3 PRO A 504 2.175 -18.756 -3.731 1.00 0.00 H new ATOM 0 HG2 PRO A 504 3.031 -16.341 -2.945 1.00 0.00 H new ATOM 0 HG3 PRO A 504 2.175 -16.540 -4.461 1.00 0.00 H new ATOM 0 HD2 PRO A 504 1.216 -15.310 -1.912 1.00 0.00 H new ATOM 0 HD3 PRO A 504 0.698 -14.989 -3.555 1.00 0.00 H new ATOM 1295 N THR A 505 -0.534 -18.608 -0.755 1.00 0.00 N ATOM 1296 CA THR A 505 -1.009 -19.454 0.332 1.00 0.00 C ATOM 1297 C THR A 505 -2.369 -18.988 0.837 1.00 0.00 C ATOM 1298 O THR A 505 -3.359 -19.715 0.743 1.00 0.00 O ATOM 1299 CB THR A 505 -0.015 -19.468 1.509 1.00 0.00 C ATOM 1300 OG1 THR A 505 0.255 -18.129 1.938 1.00 0.00 O ATOM 1301 CG2 THR A 505 1.286 -20.150 1.110 1.00 0.00 C ATOM 0 H THR A 505 -0.430 -17.624 -0.509 1.00 0.00 H new ATOM 0 HA THR A 505 -1.099 -20.463 -0.070 1.00 0.00 H new ATOM 0 HB THR A 505 -0.464 -20.028 2.329 1.00 0.00 H new ATOM 0 HG1 THR A 505 0.886 -18.147 2.687 1.00 0.00 H new ATOM 0 HG21 THR A 505 1.972 -20.148 1.957 1.00 0.00 H new ATOM 0 HG22 THR A 505 1.081 -21.178 0.811 1.00 0.00 H new ATOM 0 HG23 THR A 505 1.737 -19.613 0.276 1.00 0.00 H new ATOM 1309 N ILE A 506 -2.412 -17.773 1.372 1.00 0.00 N ATOM 1310 CA ILE A 506 -3.653 -17.210 1.890 1.00 0.00 C ATOM 1311 C ILE A 506 -4.648 -16.946 0.765 1.00 0.00 C ATOM 1312 O ILE A 506 -4.264 -16.588 -0.348 1.00 0.00 O ATOM 1313 CB ILE A 506 -3.399 -15.898 2.655 1.00 0.00 C ATOM 1314 CG1 ILE A 506 -2.400 -16.128 3.791 1.00 0.00 C ATOM 1315 CG2 ILE A 506 -4.707 -15.340 3.198 1.00 0.00 C ATOM 1316 CD1 ILE A 506 -2.981 -16.891 4.961 1.00 0.00 C ATOM 0 H ILE A 506 -1.602 -17.159 1.458 1.00 0.00 H new ATOM 0 HA ILE A 506 -4.072 -17.946 2.577 1.00 0.00 H new ATOM 0 HB ILE A 506 -2.973 -15.170 1.965 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -1.540 -16.674 3.403 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -2.033 -15.164 4.143 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -4.511 -14.413 3.736 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -5.389 -15.143 2.371 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -5.158 -16.065 3.876 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -2.217 -17.017 5.728 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -3.823 -16.336 5.375 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -3.322 -17.870 4.624 1.00 0.00 H new ATOM 1328 N LYS A 507 -5.931 -17.122 1.064 1.00 0.00 N ATOM 1329 CA LYS A 507 -6.984 -16.900 0.080 1.00 0.00 C ATOM 1330 C LYS A 507 -7.376 -15.427 0.027 1.00 0.00 C ATOM 1331 O LYS A 507 -7.017 -14.647 0.909 1.00 0.00 O ATOM 1332 CB LYS A 507 -8.209 -17.754 0.413 1.00 0.00 C ATOM 1333 CG LYS A 507 -8.186 -19.129 -0.231 1.00 0.00 C ATOM 1334 CD LYS A 507 -8.430 -19.046 -1.729 1.00 0.00 C ATOM 1335 CE LYS A 507 -9.915 -19.076 -2.055 1.00 0.00 C ATOM 1336 NZ LYS A 507 -10.160 -19.107 -3.523 1.00 0.00 N ATOM 0 H LYS A 507 -6.267 -17.418 1.981 1.00 0.00 H new ATOM 0 HA LYS A 507 -6.601 -17.191 -0.898 1.00 0.00 H new ATOM 0 HB2 LYS A 507 -8.277 -17.870 1.495 1.00 0.00 H new ATOM 0 HB3 LYS A 507 -9.107 -17.227 0.092 1.00 0.00 H new ATOM 0 HG2 LYS A 507 -7.223 -19.604 -0.044 1.00 0.00 H new ATOM 0 HG3 LYS A 507 -8.947 -19.760 0.228 1.00 0.00 H new ATOM 0 HD2 LYS A 507 -7.989 -18.129 -2.120 1.00 0.00 H new ATOM 0 HD3 LYS A 507 -7.930 -19.877 -2.227 1.00 0.00 H new ATOM 0 HE2 LYS A 507 -10.371 -19.951 -1.592 1.00 0.00 H new ATOM 0 HE3 LYS A 507 -10.399 -18.199 -1.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 507 -11.184 -19.127 -3.704 1.00 0.00 H new ATOM 0 HZ2 LYS A 507 -9.747 -18.259 -3.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 507 -9.720 -19.957 -3.931 1.00 0.00 H new ATOM 1350 N ASP A 508 -8.116 -15.054 -1.012 1.00 0.00 N ATOM 1351 CA ASP A 508 -8.560 -13.675 -1.178 1.00 0.00 C ATOM 1352 C ASP A 508 -8.852 -13.031 0.173 1.00 0.00 C ATOM 1353 O ASP A 508 -9.882 -13.301 0.792 1.00 0.00 O ATOM 1354 CB ASP A 508 -9.806 -13.621 -2.063 1.00 0.00 C ATOM 1355 CG ASP A 508 -10.796 -14.722 -1.736 1.00 0.00 C ATOM 1356 OD1 ASP A 508 -10.685 -15.815 -2.329 1.00 0.00 O ATOM 1357 OD2 ASP A 508 -11.683 -14.489 -0.888 1.00 0.00 O ATOM 0 H ASP A 508 -8.421 -15.687 -1.751 1.00 0.00 H new ATOM 0 HA ASP A 508 -7.757 -13.117 -1.660 1.00 0.00 H new ATOM 0 HB2 ASP A 508 -10.291 -12.652 -1.943 1.00 0.00 H new ATOM 0 HB3 ASP A 508 -9.509 -13.702 -3.109 1.00 0.00 H new ATOM 1362 N LYS A 509 -7.940 -12.178 0.626 1.00 0.00 N ATOM 1363 CA LYS A 509 -8.099 -11.495 1.905 1.00 0.00 C ATOM 1364 C LYS A 509 -8.425 -10.020 1.696 1.00 0.00 C ATOM 1365 O LYS A 509 -7.765 -9.315 0.932 1.00 0.00 O ATOM 1366 CB LYS A 509 -6.825 -11.633 2.742 1.00 0.00 C ATOM 1367 CG LYS A 509 -7.038 -11.366 4.222 1.00 0.00 C ATOM 1368 CD LYS A 509 -7.596 -12.587 4.934 1.00 0.00 C ATOM 1369 CE LYS A 509 -7.157 -12.633 6.389 1.00 0.00 C ATOM 1370 NZ LYS A 509 -5.726 -13.022 6.524 1.00 0.00 N ATOM 0 H LYS A 509 -7.082 -11.943 0.126 1.00 0.00 H new ATOM 0 HA LYS A 509 -8.928 -11.961 2.437 1.00 0.00 H new ATOM 0 HB2 LYS A 509 -6.425 -12.639 2.617 1.00 0.00 H new ATOM 0 HB3 LYS A 509 -6.073 -10.942 2.361 1.00 0.00 H new ATOM 0 HG2 LYS A 509 -6.092 -11.077 4.680 1.00 0.00 H new ATOM 0 HG3 LYS A 509 -7.722 -10.527 4.347 1.00 0.00 H new ATOM 0 HD2 LYS A 509 -8.685 -12.574 4.882 1.00 0.00 H new ATOM 0 HD3 LYS A 509 -7.263 -13.491 4.424 1.00 0.00 H new ATOM 0 HE2 LYS A 509 -7.313 -11.656 6.846 1.00 0.00 H new ATOM 0 HE3 LYS A 509 -7.779 -13.343 6.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 509 -5.526 -13.272 7.513 1.00 0.00 H new ATOM 0 HZ2 LYS A 509 -5.530 -13.841 5.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 509 -5.121 -12.225 6.240 1.00 0.00 H new ATOM 1384 N PRO A 510 -9.467 -9.539 2.391 1.00 0.00 N ATOM 1385 CA PRO A 510 -9.903 -8.143 2.299 1.00 0.00 C ATOM 1386 C PRO A 510 -9.025 -7.206 3.122 1.00 0.00 C ATOM 1387 O PRO A 510 -9.160 -7.126 4.343 1.00 0.00 O ATOM 1388 CB PRO A 510 -11.325 -8.177 2.865 1.00 0.00 C ATOM 1389 CG PRO A 510 -11.329 -9.328 3.811 1.00 0.00 C ATOM 1390 CD PRO A 510 -10.299 -10.322 3.319 1.00 0.00 C ATOM 0 HA PRO A 510 -9.845 -7.765 1.278 1.00 0.00 H new ATOM 0 HB2 PRO A 510 -11.571 -7.245 3.374 1.00 0.00 H new ATOM 0 HB3 PRO A 510 -12.063 -8.312 2.074 1.00 0.00 H new ATOM 0 HG2 PRO A 510 -11.090 -8.995 4.821 1.00 0.00 H new ATOM 0 HG3 PRO A 510 -12.317 -9.787 3.852 1.00 0.00 H new ATOM 0 HD2 PRO A 510 -9.709 -10.726 4.141 1.00 0.00 H new ATOM 0 HD3 PRO A 510 -10.768 -11.169 2.818 1.00 0.00 H new ATOM 1398 N VAL A 511 -8.126 -6.498 2.446 1.00 0.00 N ATOM 1399 CA VAL A 511 -7.227 -5.566 3.114 1.00 0.00 C ATOM 1400 C VAL A 511 -7.770 -4.142 3.057 1.00 0.00 C ATOM 1401 O VAL A 511 -8.073 -3.626 1.982 1.00 0.00 O ATOM 1402 CB VAL A 511 -5.821 -5.593 2.486 1.00 0.00 C ATOM 1403 CG1 VAL A 511 -5.050 -6.817 2.955 1.00 0.00 C ATOM 1404 CG2 VAL A 511 -5.916 -5.562 0.968 1.00 0.00 C ATOM 0 H VAL A 511 -8.001 -6.553 1.435 1.00 0.00 H new ATOM 0 HA VAL A 511 -7.158 -5.884 4.154 1.00 0.00 H new ATOM 0 HB VAL A 511 -5.279 -4.705 2.812 1.00 0.00 H new ATOM 0 HG11 VAL A 511 -4.059 -6.819 2.501 1.00 0.00 H new ATOM 0 HG12 VAL A 511 -4.952 -6.791 4.040 1.00 0.00 H new ATOM 0 HG13 VAL A 511 -5.586 -7.719 2.660 1.00 0.00 H new ATOM 0 HG21 VAL A 511 -4.914 -5.582 0.540 1.00 0.00 H new ATOM 0 HG22 VAL A 511 -6.476 -6.430 0.621 1.00 0.00 H new ATOM 0 HG23 VAL A 511 -6.427 -4.652 0.654 1.00 0.00 H new ATOM 1414 N GLN A 512 -7.889 -3.513 4.222 1.00 0.00 N ATOM 1415 CA GLN A 512 -8.396 -2.149 4.304 1.00 0.00 C ATOM 1416 C GLN A 512 -7.547 -1.201 3.464 1.00 0.00 C ATOM 1417 O GLN A 512 -6.324 -1.330 3.410 1.00 0.00 O ATOM 1418 CB GLN A 512 -8.419 -1.677 5.759 1.00 0.00 C ATOM 1419 CG GLN A 512 -9.732 -1.962 6.471 1.00 0.00 C ATOM 1420 CD GLN A 512 -9.550 -2.202 7.957 1.00 0.00 C ATOM 1421 OE1 GLN A 512 -8.498 -1.902 8.522 1.00 0.00 O ATOM 1422 NE2 GLN A 512 -10.578 -2.745 8.599 1.00 0.00 N ATOM 0 H GLN A 512 -7.641 -3.926 5.121 1.00 0.00 H new ATOM 0 HA GLN A 512 -9.413 -2.143 3.911 1.00 0.00 H new ATOM 0 HB2 GLN A 512 -7.608 -2.162 6.302 1.00 0.00 H new ATOM 0 HB3 GLN A 512 -8.225 -0.605 5.787 1.00 0.00 H new ATOM 0 HG2 GLN A 512 -10.411 -1.122 6.323 1.00 0.00 H new ATOM 0 HG3 GLN A 512 -10.203 -2.836 6.021 1.00 0.00 H new ATOM 0 HE21 GLN A 512 -11.431 -2.978 8.091 1.00 0.00 H new ATOM 0 HE22 GLN A 512 -10.514 -2.929 9.600 1.00 0.00 H new ATOM 1431 N ILE A 513 -8.204 -0.250 2.808 1.00 0.00 N ATOM 1432 CA ILE A 513 -7.509 0.719 1.971 1.00 0.00 C ATOM 1433 C ILE A 513 -7.911 2.146 2.331 1.00 0.00 C ATOM 1434 O ILE A 513 -9.097 2.466 2.412 1.00 0.00 O ATOM 1435 CB ILE A 513 -7.794 0.480 0.476 1.00 0.00 C ATOM 1436 CG1 ILE A 513 -7.656 -1.007 0.140 1.00 0.00 C ATOM 1437 CG2 ILE A 513 -6.854 1.312 -0.383 1.00 0.00 C ATOM 1438 CD1 ILE A 513 -6.251 -1.538 0.315 1.00 0.00 C ATOM 0 H ILE A 513 -9.216 -0.130 2.840 1.00 0.00 H new ATOM 0 HA ILE A 513 -6.443 0.586 2.155 1.00 0.00 H new ATOM 0 HB ILE A 513 -8.817 0.789 0.263 1.00 0.00 H new ATOM 0 HG12 ILE A 513 -8.333 -1.579 0.774 1.00 0.00 H new ATOM 0 HG13 ILE A 513 -7.971 -1.169 -0.891 1.00 0.00 H new ATOM 0 HG21 ILE A 513 -7.068 1.132 -1.436 1.00 0.00 H new ATOM 0 HG22 ILE A 513 -6.997 2.369 -0.159 1.00 0.00 H new ATOM 0 HG23 ILE A 513 -5.822 1.032 -0.170 1.00 0.00 H new ATOM 0 HD11 ILE A 513 -6.228 -2.597 0.059 1.00 0.00 H new ATOM 0 HD12 ILE A 513 -5.572 -0.992 -0.339 1.00 0.00 H new ATOM 0 HD13 ILE A 513 -5.939 -1.408 1.351 1.00 0.00 H new ATOM 1450 N ARG A 514 -6.914 2.999 2.545 1.00 0.00 N ATOM 1451 CA ARG A 514 -7.164 4.392 2.896 1.00 0.00 C ATOM 1452 C ARG A 514 -6.099 5.303 2.294 1.00 0.00 C ATOM 1453 O ARG A 514 -4.962 5.364 2.761 1.00 0.00 O ATOM 1454 CB ARG A 514 -7.193 4.559 4.417 1.00 0.00 C ATOM 1455 CG ARG A 514 -6.992 5.995 4.875 1.00 0.00 C ATOM 1456 CD ARG A 514 -7.714 6.267 6.186 1.00 0.00 C ATOM 1457 NE ARG A 514 -7.305 7.535 6.783 1.00 0.00 N ATOM 1458 CZ ARG A 514 -7.540 7.861 8.049 1.00 0.00 C ATOM 1459 NH1 ARG A 514 -8.178 7.016 8.847 1.00 0.00 N ATOM 1460 NH2 ARG A 514 -7.136 9.034 8.520 1.00 0.00 N ATOM 0 H ARG A 514 -5.927 2.750 2.482 1.00 0.00 H new ATOM 0 HA ARG A 514 -8.134 4.676 2.487 1.00 0.00 H new ATOM 0 HB2 ARG A 514 -8.148 4.196 4.796 1.00 0.00 H new ATOM 0 HB3 ARG A 514 -6.417 3.934 4.858 1.00 0.00 H new ATOM 0 HG2 ARG A 514 -5.927 6.194 4.997 1.00 0.00 H new ATOM 0 HG3 ARG A 514 -7.358 6.678 4.108 1.00 0.00 H new ATOM 0 HD2 ARG A 514 -8.790 6.279 6.012 1.00 0.00 H new ATOM 0 HD3 ARG A 514 -7.513 5.456 6.886 1.00 0.00 H new ATOM 0 HE ARG A 514 -6.812 8.207 6.196 1.00 0.00 H new ATOM 0 HH11 ARG A 514 -8.490 6.113 8.489 1.00 0.00 H new ATOM 0 HH12 ARG A 514 -8.357 7.269 9.819 1.00 0.00 H new ATOM 0 HH21 ARG A 514 -6.644 9.687 7.910 1.00 0.00 H new ATOM 0 HH22 ARG A 514 -7.317 9.283 9.492 1.00 0.00 H new ATOM 1474 N PRO A 515 -6.474 6.030 1.230 1.00 0.00 N ATOM 1475 CA PRO A 515 -5.566 6.951 0.541 1.00 0.00 C ATOM 1476 C PRO A 515 -4.926 7.955 1.494 1.00 0.00 C ATOM 1477 O PRO A 515 -5.339 9.113 1.559 1.00 0.00 O ATOM 1478 CB PRO A 515 -6.479 7.668 -0.457 1.00 0.00 C ATOM 1479 CG PRO A 515 -7.597 6.714 -0.701 1.00 0.00 C ATOM 1480 CD PRO A 515 -7.814 6.008 0.620 1.00 0.00 C ATOM 0 HA PRO A 515 -4.730 6.428 0.076 1.00 0.00 H new ATOM 0 HB2 PRO A 515 -6.845 8.611 -0.052 1.00 0.00 H new ATOM 0 HB3 PRO A 515 -5.950 7.902 -1.381 1.00 0.00 H new ATOM 0 HG2 PRO A 515 -8.498 7.237 -1.020 1.00 0.00 H new ATOM 0 HG3 PRO A 515 -7.344 6.005 -1.489 1.00 0.00 H new ATOM 0 HD2 PRO A 515 -8.548 6.525 1.238 1.00 0.00 H new ATOM 0 HD3 PRO A 515 -8.177 4.990 0.479 1.00 0.00 H new ATOM 1488 N TRP A 516 -3.916 7.505 2.229 1.00 0.00 N ATOM 1489 CA TRP A 516 -3.219 8.365 3.178 1.00 0.00 C ATOM 1490 C TRP A 516 -2.904 9.720 2.555 1.00 0.00 C ATOM 1491 O TRP A 516 -1.888 9.882 1.880 1.00 0.00 O ATOM 1492 CB TRP A 516 -1.928 7.695 3.652 1.00 0.00 C ATOM 1493 CG TRP A 516 -1.177 8.503 4.666 1.00 0.00 C ATOM 1494 CD1 TRP A 516 0.007 9.159 4.479 1.00 0.00 C ATOM 1495 CD2 TRP A 516 -1.558 8.740 6.026 1.00 0.00 C ATOM 1496 NE1 TRP A 516 0.384 9.788 5.640 1.00 0.00 N ATOM 1497 CE2 TRP A 516 -0.559 9.548 6.604 1.00 0.00 C ATOM 1498 CE3 TRP A 516 -2.646 8.350 6.811 1.00 0.00 C ATOM 1499 CZ2 TRP A 516 -0.618 9.969 7.929 1.00 0.00 C ATOM 1500 CZ3 TRP A 516 -2.703 8.769 8.126 1.00 0.00 C ATOM 1501 CH2 TRP A 516 -1.695 9.573 8.675 1.00 0.00 C ATOM 0 H TRP A 516 -3.561 6.550 2.186 1.00 0.00 H new ATOM 0 HA TRP A 516 -3.873 8.524 4.035 1.00 0.00 H new ATOM 0 HB2 TRP A 516 -2.168 6.721 4.079 1.00 0.00 H new ATOM 0 HB3 TRP A 516 -1.283 7.515 2.792 1.00 0.00 H new ATOM 0 HD1 TRP A 516 0.564 9.180 3.554 1.00 0.00 H new ATOM 0 HE1 TRP A 516 1.230 10.344 5.764 1.00 0.00 H new ATOM 0 HE3 TRP A 516 -3.429 7.732 6.397 1.00 0.00 H new ATOM 0 HZ2 TRP A 516 0.159 10.587 8.354 1.00 0.00 H new ATOM 0 HZ3 TRP A 516 -3.539 8.472 8.742 1.00 0.00 H new ATOM 0 HH2 TRP A 516 -1.769 9.886 9.706 1.00 0.00 H new