USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 573 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 Set 1.1: A 407 HIS :FLIP no HD1:sc= -0.648 F(o=-1.8,f=-0.71) USER MOD Set 1.2: A 473 LYS NZ :NH3+ 180:sc= -0.0612 (180deg=0) USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 ASN : amide:sc= -6.29! C(o=-6.3!,f=-11!) USER MOD Single : A 406 TYR OH : rot 88:sc= 0.239 USER MOD Single : A 410 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 415 GLN : amide:sc= -0.353 K(o=-0.35,f=-1.5) USER MOD Single : A 419 GLN : amide:sc=-0.00705 X(o=-0.0071,f=-0.0071) USER MOD Single : A 420 MET CE :methyl -139:sc= -0.402 (180deg=-3.18!) USER MOD Single : A 422 MET CE :methyl -152:sc= 0 (180deg=-0.155) USER MOD Single : A 426 ASN : amide:sc= -0.287 X(o=-0.29,f=0) USER MOD Single : A 429 SER OG : rot 70:sc= -2.06 USER MOD Single : A 431 LYS NZ :NH3+ 168:sc= 0.644 (180deg=0.556) USER MOD Single : A 443 CYS SG : rot 6:sc= 0.096 USER MOD Single : A 448 SER OG : rot 102:sc= 0.674 USER MOD Single : A 449 TYR OH : rot -122:sc= 0.675 USER MOD Single : A 451 ASN : amide:sc= 0.256 K(o=0.26,f=-6.1!) USER MOD Single : A 454 SER OG : rot -82:sc= 0.222 USER MOD Single : A 456 GLN : amide:sc= -0.682! C(o=-0.68!,f=-0.57!) USER MOD Single : A 460 GLN : amide:sc= -3.05! C(o=-3!,f=-2.8!) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl 156:sc= -0.0874 (180deg=-0.775) USER MOD Single : A 463 ASN : amide:sc= -0.0186 X(o=-0.019,f=-0.019) USER MOD Single : A 466 GLN : amide:sc= -1.03 X(o=-1,f=-1.5) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 LYS NZ :NH3+ -127:sc= -1.05 (180deg=-2.13!) USER MOD Single : A 475 GLN : amide:sc= -0.33 X(o=-0.33,f=-0.34) USER MOD Single : A 477 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 225 N LYS A 395 9.201 5.065 3.971 1.00 0.00 N ATOM 226 CA LYS A 395 8.927 6.468 3.680 1.00 0.00 C ATOM 227 C LYS A 395 7.474 6.664 3.264 1.00 0.00 C ATOM 228 O LYS A 395 6.717 5.701 3.147 1.00 0.00 O ATOM 229 CB LYS A 395 9.858 6.972 2.576 1.00 0.00 C ATOM 230 CG LYS A 395 9.643 6.286 1.238 1.00 0.00 C ATOM 231 CD LYS A 395 10.899 6.322 0.383 1.00 0.00 C ATOM 232 CE LYS A 395 11.096 7.686 -0.259 1.00 0.00 C ATOM 233 NZ LYS A 395 12.394 7.774 -0.985 1.00 0.00 N ATOM 0 HA LYS A 395 9.106 7.043 4.588 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.713 8.045 2.452 1.00 0.00 H new ATOM 0 HB3 LYS A 395 10.892 6.824 2.889 1.00 0.00 H new ATOM 0 HG2 LYS A 395 9.344 5.251 1.403 1.00 0.00 H new ATOM 0 HG3 LYS A 395 8.826 6.773 0.706 1.00 0.00 H new ATOM 0 HD2 LYS A 395 11.766 6.079 0.997 1.00 0.00 H new ATOM 0 HD3 LYS A 395 10.834 5.559 -0.393 1.00 0.00 H new ATOM 0 HE2 LYS A 395 10.278 7.883 -0.952 1.00 0.00 H new ATOM 0 HE3 LYS A 395 11.056 8.458 0.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 12.491 8.719 -1.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 13.176 7.611 -0.319 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 12.422 7.054 -1.735 1.00 0.00 H new ATOM 247 N GLU A 396 7.091 7.917 3.038 1.00 0.00 N ATOM 248 CA GLU A 396 5.727 8.237 2.632 1.00 0.00 C ATOM 249 C GLU A 396 5.713 9.388 1.631 1.00 0.00 C ATOM 250 O GLU A 396 6.763 9.900 1.243 1.00 0.00 O ATOM 251 CB GLU A 396 4.880 8.600 3.854 1.00 0.00 C ATOM 252 CG GLU A 396 5.509 9.665 4.736 1.00 0.00 C ATOM 253 CD GLU A 396 6.446 9.083 5.777 1.00 0.00 C ATOM 254 OE1 GLU A 396 6.201 7.942 6.223 1.00 0.00 O ATOM 255 OE2 GLU A 396 7.425 9.767 6.144 1.00 0.00 O ATOM 0 H GLU A 396 7.705 8.726 3.129 1.00 0.00 H new ATOM 0 HA GLU A 396 5.302 7.356 2.152 1.00 0.00 H new ATOM 0 HB2 GLU A 396 3.903 8.949 3.518 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.711 7.702 4.448 1.00 0.00 H new ATOM 0 HG2 GLU A 396 6.058 10.370 4.112 1.00 0.00 H new ATOM 0 HG3 GLU A 396 4.721 10.229 5.236 1.00 0.00 H new ATOM 262 N GLY A 397 4.516 9.789 1.215 1.00 0.00 N ATOM 263 CA GLY A 397 4.388 10.876 0.261 1.00 0.00 C ATOM 264 C GLY A 397 4.035 12.192 0.926 1.00 0.00 C ATOM 265 O GLY A 397 4.323 12.414 2.102 1.00 0.00 O ATOM 0 H GLY A 397 3.633 9.381 1.521 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.325 10.988 -0.285 1.00 0.00 H new ATOM 0 HA3 GLY A 397 3.620 10.625 -0.471 1.00 0.00 H new ATOM 269 N PRO A 398 3.398 13.092 0.163 1.00 0.00 N ATOM 270 CA PRO A 398 2.992 14.409 0.663 1.00 0.00 C ATOM 271 C PRO A 398 1.796 14.328 1.605 1.00 0.00 C ATOM 272 O PRO A 398 1.048 13.352 1.589 1.00 0.00 O ATOM 273 CB PRO A 398 2.621 15.173 -0.609 1.00 0.00 C ATOM 274 CG PRO A 398 2.200 14.120 -1.574 1.00 0.00 C ATOM 275 CD PRO A 398 3.022 12.894 -1.247 1.00 0.00 C ATOM 0 HA PRO A 398 3.781 14.884 1.246 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.816 15.884 -0.423 1.00 0.00 H new ATOM 0 HB3 PRO A 398 3.468 15.743 -0.990 1.00 0.00 H new ATOM 0 HG2 PRO A 398 1.134 13.910 -1.481 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.373 14.442 -2.601 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.447 11.978 -1.383 1.00 0.00 H new ATOM 0 HD3 PRO A 398 3.900 12.818 -1.889 1.00 0.00 H new ATOM 283 N GLU A 399 1.623 15.361 2.425 1.00 0.00 N ATOM 284 CA GLU A 399 0.517 15.405 3.374 1.00 0.00 C ATOM 285 C GLU A 399 -0.819 15.204 2.663 1.00 0.00 C ATOM 286 O GLU A 399 -1.218 16.017 1.830 1.00 0.00 O ATOM 287 CB GLU A 399 0.513 16.739 4.125 1.00 0.00 C ATOM 288 CG GLU A 399 -0.715 16.941 4.996 1.00 0.00 C ATOM 289 CD GLU A 399 -0.564 18.108 5.954 1.00 0.00 C ATOM 290 OE1 GLU A 399 -0.253 19.223 5.486 1.00 0.00 O ATOM 291 OE2 GLU A 399 -0.755 17.905 7.171 1.00 0.00 O ATOM 0 H GLU A 399 2.234 16.177 2.451 1.00 0.00 H new ATOM 0 HA GLU A 399 0.653 14.594 4.089 1.00 0.00 H new ATOM 0 HB2 GLU A 399 1.405 16.798 4.749 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.574 17.553 3.403 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -1.584 17.108 4.360 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.906 16.031 5.565 1.00 0.00 H new ATOM 298 N GLY A 400 -1.503 14.115 2.998 1.00 0.00 N ATOM 299 CA GLY A 400 -2.785 13.826 2.382 1.00 0.00 C ATOM 300 C GLY A 400 -2.790 12.500 1.648 1.00 0.00 C ATOM 301 O GLY A 400 -3.833 11.862 1.511 1.00 0.00 O ATOM 0 H GLY A 400 -1.193 13.428 3.685 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -3.559 13.816 3.149 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -3.038 14.625 1.685 1.00 0.00 H new ATOM 305 N ALA A 401 -1.621 12.085 1.172 1.00 0.00 N ATOM 306 CA ALA A 401 -1.495 10.827 0.447 1.00 0.00 C ATOM 307 C ALA A 401 -1.001 9.713 1.364 1.00 0.00 C ATOM 308 O ALA A 401 0.019 9.855 2.036 1.00 0.00 O ATOM 309 CB ALA A 401 -0.555 10.992 -0.738 1.00 0.00 C ATOM 0 H ALA A 401 -0.748 12.602 1.275 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.482 10.549 0.078 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.471 10.044 -1.270 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.949 11.753 -1.412 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.429 11.297 -0.382 1.00 0.00 H new ATOM 315 N ASN A 402 -1.733 8.603 1.386 1.00 0.00 N ATOM 316 CA ASN A 402 -1.370 7.465 2.222 1.00 0.00 C ATOM 317 C ASN A 402 -2.014 6.182 1.704 1.00 0.00 C ATOM 318 O ASN A 402 -2.995 6.223 0.961 1.00 0.00 O ATOM 319 CB ASN A 402 -1.795 7.713 3.671 1.00 0.00 C ATOM 320 CG ASN A 402 -1.799 9.187 4.028 1.00 0.00 C ATOM 321 OD1 ASN A 402 -2.836 9.848 3.972 1.00 0.00 O ATOM 322 ND2 ASN A 402 -0.635 9.710 4.396 1.00 0.00 N ATOM 0 H ASN A 402 -2.580 8.468 0.835 1.00 0.00 H new ATOM 0 HA ASN A 402 -0.287 7.349 2.183 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.791 7.301 3.830 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -1.119 7.181 4.341 1.00 0.00 H new ATOM 0 HD21 ASN A 402 -0.576 10.697 4.646 1.00 0.00 H new ATOM 0 HD22 ASN A 402 0.200 9.125 4.428 1.00 0.00 H new ATOM 329 N LEU A 403 -1.456 5.044 2.103 1.00 0.00 N ATOM 330 CA LEU A 403 -1.976 3.748 1.681 1.00 0.00 C ATOM 331 C LEU A 403 -1.593 2.658 2.675 1.00 0.00 C ATOM 332 O LEU A 403 -0.412 2.434 2.943 1.00 0.00 O ATOM 333 CB LEU A 403 -1.448 3.394 0.289 1.00 0.00 C ATOM 334 CG LEU A 403 -2.110 4.117 -0.885 1.00 0.00 C ATOM 335 CD1 LEU A 403 -1.573 3.592 -2.207 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.622 3.962 -0.822 1.00 0.00 C ATOM 0 H LEU A 403 -0.644 4.993 2.718 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.063 3.814 1.645 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.379 3.605 0.263 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -1.564 2.320 0.141 1.00 0.00 H new ATOM 0 HG LEU A 403 -1.870 5.178 -0.815 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -2.056 4.118 -3.031 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -0.496 3.756 -2.253 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -1.781 2.525 -2.286 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.077 4.483 -1.665 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -3.881 2.904 -0.866 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -3.993 4.388 0.110 1.00 0.00 H new ATOM 348 N PHE A 404 -2.599 1.980 3.218 1.00 0.00 N ATOM 349 CA PHE A 404 -2.368 0.911 4.183 1.00 0.00 C ATOM 350 C PHE A 404 -3.163 -0.337 3.811 1.00 0.00 C ATOM 351 O PHE A 404 -4.391 -0.353 3.897 1.00 0.00 O ATOM 352 CB PHE A 404 -2.752 1.373 5.590 1.00 0.00 C ATOM 353 CG PHE A 404 -1.701 2.219 6.251 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.554 3.554 5.912 1.00 0.00 C ATOM 355 CD2 PHE A 404 -0.861 1.678 7.211 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.587 4.334 6.518 1.00 0.00 C ATOM 357 CE2 PHE A 404 0.108 2.454 7.820 1.00 0.00 C ATOM 358 CZ PHE A 404 0.245 3.783 7.474 1.00 0.00 C ATOM 0 H PHE A 404 -3.582 2.152 3.006 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.307 0.664 4.167 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.682 1.939 5.537 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -2.946 0.498 6.211 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -2.202 3.990 5.166 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -0.964 0.639 7.487 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.482 5.373 6.244 1.00 0.00 H new ATOM 0 HE2 PHE A 404 0.757 2.020 8.566 1.00 0.00 H new ATOM 0 HZ PHE A 404 1.001 4.391 7.949 1.00 0.00 H new ATOM 368 N ILE A 405 -2.452 -1.382 3.398 1.00 0.00 N ATOM 369 CA ILE A 405 -3.090 -2.635 3.013 1.00 0.00 C ATOM 370 C ILE A 405 -3.205 -3.582 4.204 1.00 0.00 C ATOM 371 O ILE A 405 -2.264 -3.730 4.986 1.00 0.00 O ATOM 372 CB ILE A 405 -2.314 -3.340 1.886 1.00 0.00 C ATOM 373 CG1 ILE A 405 -2.142 -2.398 0.692 1.00 0.00 C ATOM 374 CG2 ILE A 405 -3.031 -4.613 1.464 1.00 0.00 C ATOM 375 CD1 ILE A 405 -1.125 -1.303 0.926 1.00 0.00 C ATOM 0 H ILE A 405 -1.435 -1.385 3.322 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.088 -2.383 2.653 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.326 -3.611 2.258 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -1.842 -2.980 -0.179 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -3.105 -1.944 0.456 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.469 -5.100 0.666 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -3.108 -5.287 2.317 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -4.030 -4.366 1.106 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.056 -0.675 0.038 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -1.433 -0.696 1.777 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.152 -1.748 1.132 1.00 0.00 H new ATOM 387 N TYR A 406 -4.361 -4.221 4.335 1.00 0.00 N ATOM 388 CA TYR A 406 -4.599 -5.154 5.430 1.00 0.00 C ATOM 389 C TYR A 406 -5.178 -6.467 4.912 1.00 0.00 C ATOM 390 O TYR A 406 -5.629 -6.552 3.770 1.00 0.00 O ATOM 391 CB TYR A 406 -5.548 -4.535 6.457 1.00 0.00 C ATOM 392 CG TYR A 406 -5.037 -3.243 7.054 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.201 -3.251 8.164 1.00 0.00 C ATOM 394 CD2 TYR A 406 -5.388 -2.015 6.508 1.00 0.00 C ATOM 395 CE1 TYR A 406 -3.732 -2.073 8.714 1.00 0.00 C ATOM 396 CE2 TYR A 406 -4.923 -0.833 7.049 1.00 0.00 C ATOM 397 CZ TYR A 406 -4.095 -0.867 8.152 1.00 0.00 C ATOM 398 OH TYR A 406 -3.630 0.309 8.695 1.00 0.00 O ATOM 0 H TYR A 406 -5.149 -4.110 3.697 1.00 0.00 H new ATOM 0 HA TYR A 406 -3.643 -5.364 5.909 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -6.512 -4.350 5.983 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -5.720 -5.253 7.259 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -3.913 -4.194 8.604 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -6.036 -1.984 5.645 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -3.085 -2.097 9.579 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -5.206 0.113 6.611 1.00 0.00 H new ATOM 0 HH TYR A 406 -2.764 0.534 8.295 1.00 0.00 H new ATOM 408 N HIS A 407 -5.161 -7.489 5.762 1.00 0.00 N ATOM 409 CA HIS A 407 -5.686 -8.798 5.391 1.00 0.00 C ATOM 410 C HIS A 407 -4.953 -9.353 4.174 1.00 0.00 C ATOM 411 O HIS A 407 -5.576 -9.730 3.180 1.00 0.00 O ATOM 412 CB HIS A 407 -7.185 -8.709 5.102 1.00 0.00 C ATOM 413 CG HIS A 407 -7.984 -8.165 6.247 1.00 0.00 C ATOM 414 ND1 HIS A 407 -7.981 -6.941 6.825 1.00 0.00 N flip ATOM 415 CD2 HIS A 407 -8.919 -8.910 6.933 1.00 0.00 C flip ATOM 416 CE1 HIS A 407 -8.906 -6.968 7.840 1.00 0.00 C flip ATOM 417 NE2 HIS A 407 -9.458 -8.167 7.884 1.00 0.00 N flip ATOM 0 H HIS A 407 -4.790 -7.436 6.711 1.00 0.00 H new ATOM 0 HA HIS A 407 -5.526 -9.476 6.230 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.341 -8.077 4.228 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.558 -9.702 4.849 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -9.172 -9.939 6.726 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -9.143 -6.143 8.495 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -10.178 -8.468 8.540 1.00 0.00 H new ATOM 425 N LEU A 408 -3.627 -9.399 4.256 1.00 0.00 N ATOM 426 CA LEU A 408 -2.810 -9.906 3.160 1.00 0.00 C ATOM 427 C LEU A 408 -2.485 -11.382 3.361 1.00 0.00 C ATOM 428 O LEU A 408 -2.175 -11.830 4.465 1.00 0.00 O ATOM 429 CB LEU A 408 -1.516 -9.098 3.046 1.00 0.00 C ATOM 430 CG LEU A 408 -1.626 -7.751 2.330 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.446 -6.860 2.686 1.00 0.00 C ATOM 432 CD2 LEU A 408 -1.710 -7.954 0.825 1.00 0.00 C ATOM 0 H LEU A 408 -3.096 -9.091 5.070 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.379 -9.801 2.236 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -1.131 -8.922 4.051 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -0.777 -9.705 2.523 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.540 -7.257 2.661 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.541 -5.906 2.168 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.431 -6.688 3.762 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.481 -7.346 2.384 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -1.788 -6.985 0.331 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -0.814 -8.468 0.477 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.588 -8.554 0.587 1.00 0.00 H new ATOM 444 N PRO A 409 -2.555 -12.158 2.269 1.00 0.00 N ATOM 445 CA PRO A 409 -2.269 -13.595 2.300 1.00 0.00 C ATOM 446 C PRO A 409 -0.946 -13.909 2.990 1.00 0.00 C ATOM 447 O PRO A 409 -0.313 -13.025 3.567 1.00 0.00 O ATOM 448 CB PRO A 409 -2.203 -13.975 0.818 1.00 0.00 C ATOM 449 CG PRO A 409 -3.060 -12.970 0.131 1.00 0.00 C ATOM 450 CD PRO A 409 -2.918 -11.691 0.920 1.00 0.00 C ATOM 0 HA PRO A 409 -3.021 -14.148 2.863 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -1.179 -13.942 0.446 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -2.570 -14.988 0.652 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -2.743 -12.828 -0.902 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -4.099 -13.298 0.103 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -2.149 -11.043 0.499 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.846 -11.120 0.929 1.00 0.00 H new ATOM 458 N GLN A 410 -0.533 -15.171 2.923 1.00 0.00 N ATOM 459 CA GLN A 410 0.715 -15.599 3.543 1.00 0.00 C ATOM 460 C GLN A 410 1.877 -15.487 2.560 1.00 0.00 C ATOM 461 O GLN A 410 2.962 -15.031 2.918 1.00 0.00 O ATOM 462 CB GLN A 410 0.593 -17.039 4.044 1.00 0.00 C ATOM 463 CG GLN A 410 -0.070 -17.154 5.408 1.00 0.00 C ATOM 464 CD GLN A 410 0.115 -18.523 6.032 1.00 0.00 C ATOM 465 OE1 GLN A 410 1.194 -18.852 6.526 1.00 0.00 O ATOM 466 NE2 GLN A 410 -0.941 -19.329 6.014 1.00 0.00 N ATOM 0 H GLN A 410 -1.044 -15.914 2.446 1.00 0.00 H new ATOM 0 HA GLN A 410 0.914 -14.943 4.390 1.00 0.00 H new ATOM 0 HB2 GLN A 410 0.020 -17.619 3.321 1.00 0.00 H new ATOM 0 HB3 GLN A 410 1.587 -17.483 4.094 1.00 0.00 H new ATOM 0 HG2 GLN A 410 0.343 -16.396 6.074 1.00 0.00 H new ATOM 0 HG3 GLN A 410 -1.135 -16.945 5.309 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -1.816 -19.014 5.594 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -0.877 -20.262 6.420 1.00 0.00 H new ATOM 475 N GLU A 411 1.640 -15.908 1.322 1.00 0.00 N ATOM 476 CA GLU A 411 2.667 -15.855 0.288 1.00 0.00 C ATOM 477 C GLU A 411 3.089 -14.415 0.013 1.00 0.00 C ATOM 478 O GLU A 411 4.262 -14.136 -0.239 1.00 0.00 O ATOM 479 CB GLU A 411 2.160 -16.505 -1.000 1.00 0.00 C ATOM 480 CG GLU A 411 0.903 -15.855 -1.555 1.00 0.00 C ATOM 481 CD GLU A 411 0.481 -16.447 -2.886 1.00 0.00 C ATOM 482 OE1 GLU A 411 0.092 -17.634 -2.911 1.00 0.00 O ATOM 483 OE2 GLU A 411 0.537 -15.723 -3.903 1.00 0.00 O ATOM 0 H GLU A 411 0.747 -16.289 1.011 1.00 0.00 H new ATOM 0 HA GLU A 411 3.536 -16.407 0.647 1.00 0.00 H new ATOM 0 HB2 GLU A 411 2.946 -16.459 -1.754 1.00 0.00 H new ATOM 0 HB3 GLU A 411 1.961 -17.560 -0.811 1.00 0.00 H new ATOM 0 HG2 GLU A 411 0.091 -15.970 -0.837 1.00 0.00 H new ATOM 0 HG3 GLU A 411 1.074 -14.785 -1.675 1.00 0.00 H new ATOM 490 N PHE A 412 2.124 -13.502 0.062 1.00 0.00 N ATOM 491 CA PHE A 412 2.393 -12.091 -0.184 1.00 0.00 C ATOM 492 C PHE A 412 3.549 -11.598 0.682 1.00 0.00 C ATOM 493 O PHE A 412 3.585 -11.845 1.886 1.00 0.00 O ATOM 494 CB PHE A 412 1.141 -11.255 0.092 1.00 0.00 C ATOM 495 CG PHE A 412 0.245 -11.105 -1.103 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.385 -12.208 -1.656 1.00 0.00 C ATOM 497 CD2 PHE A 412 0.033 -9.860 -1.676 1.00 0.00 C ATOM 498 CE1 PHE A 412 -1.212 -12.074 -2.755 1.00 0.00 C ATOM 499 CE2 PHE A 412 -0.792 -9.720 -2.775 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.414 -10.828 -3.317 1.00 0.00 C ATOM 0 H PHE A 412 1.148 -13.715 0.270 1.00 0.00 H new ATOM 0 HA PHE A 412 2.673 -11.978 -1.231 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.577 -11.716 0.903 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.443 -10.266 0.436 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -0.228 -13.185 -1.223 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.518 -8.990 -1.258 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.700 -12.942 -3.174 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -0.951 -8.745 -3.210 1.00 0.00 H new ATOM 0 HZ PHE A 412 -2.057 -10.721 -4.178 1.00 0.00 H new ATOM 510 N GLY A 413 4.493 -10.900 0.059 1.00 0.00 N ATOM 511 CA GLY A 413 5.637 -10.385 0.787 1.00 0.00 C ATOM 512 C GLY A 413 5.839 -8.897 0.575 1.00 0.00 C ATOM 513 O GLY A 413 4.898 -8.113 0.699 1.00 0.00 O ATOM 0 H GLY A 413 4.486 -10.682 -0.937 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.505 -10.582 1.851 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.534 -10.919 0.472 1.00 0.00 H new ATOM 517 N ASP A 414 7.067 -8.508 0.254 1.00 0.00 N ATOM 518 CA ASP A 414 7.390 -7.104 0.024 1.00 0.00 C ATOM 519 C ASP A 414 7.211 -6.740 -1.446 1.00 0.00 C ATOM 520 O ASP A 414 6.378 -5.902 -1.790 1.00 0.00 O ATOM 521 CB ASP A 414 8.825 -6.810 0.465 1.00 0.00 C ATOM 522 CG ASP A 414 9.733 -8.014 0.324 1.00 0.00 C ATOM 523 OD1 ASP A 414 9.631 -8.937 1.160 1.00 0.00 O ATOM 524 OD2 ASP A 414 10.546 -8.036 -0.624 1.00 0.00 O ATOM 0 H ASP A 414 7.856 -9.145 0.147 1.00 0.00 H new ATOM 0 HA ASP A 414 6.705 -6.497 0.616 1.00 0.00 H new ATOM 0 HB2 ASP A 414 9.223 -5.987 -0.129 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.822 -6.481 1.504 1.00 0.00 H new ATOM 529 N GLN A 415 8.000 -7.375 -2.308 1.00 0.00 N ATOM 530 CA GLN A 415 7.929 -7.115 -3.741 1.00 0.00 C ATOM 531 C GLN A 415 6.483 -7.120 -4.225 1.00 0.00 C ATOM 532 O GLN A 415 6.001 -6.134 -4.783 1.00 0.00 O ATOM 533 CB GLN A 415 8.739 -8.159 -4.510 1.00 0.00 C ATOM 534 CG GLN A 415 10.216 -7.814 -4.633 1.00 0.00 C ATOM 535 CD GLN A 415 10.449 -6.493 -5.339 1.00 0.00 C ATOM 536 OE1 GLN A 415 9.595 -6.017 -6.088 1.00 0.00 O ATOM 537 NE2 GLN A 415 11.611 -5.894 -5.105 1.00 0.00 N ATOM 0 H GLN A 415 8.694 -8.072 -2.039 1.00 0.00 H new ATOM 0 HA GLN A 415 8.351 -6.127 -3.926 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.640 -9.123 -4.011 1.00 0.00 H new ATOM 0 HB3 GLN A 415 8.316 -8.272 -5.508 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.660 -7.773 -3.638 1.00 0.00 H new ATOM 0 HG3 GLN A 415 10.727 -8.608 -5.178 1.00 0.00 H new ATOM 0 HE21 GLN A 415 12.289 -6.325 -4.477 1.00 0.00 H new ATOM 0 HE22 GLN A 415 11.825 -5.003 -5.553 1.00 0.00 H new ATOM 546 N ASP A 416 5.795 -8.236 -4.007 1.00 0.00 N ATOM 547 CA ASP A 416 4.403 -8.369 -4.420 1.00 0.00 C ATOM 548 C ASP A 416 3.658 -7.048 -4.255 1.00 0.00 C ATOM 549 O ASP A 416 3.327 -6.383 -5.237 1.00 0.00 O ATOM 550 CB ASP A 416 3.710 -9.465 -3.609 1.00 0.00 C ATOM 551 CG ASP A 416 4.335 -10.830 -3.827 1.00 0.00 C ATOM 552 OD1 ASP A 416 4.519 -11.217 -5.000 1.00 0.00 O ATOM 553 OD2 ASP A 416 4.638 -11.510 -2.825 1.00 0.00 O ATOM 0 H ASP A 416 6.179 -9.061 -3.547 1.00 0.00 H new ATOM 0 HA ASP A 416 4.388 -8.644 -5.475 1.00 0.00 H new ATOM 0 HB2 ASP A 416 3.756 -9.213 -2.550 1.00 0.00 H new ATOM 0 HB3 ASP A 416 2.656 -9.504 -3.882 1.00 0.00 H new ATOM 558 N LEU A 417 3.397 -6.676 -3.006 1.00 0.00 N ATOM 559 CA LEU A 417 2.690 -5.434 -2.712 1.00 0.00 C ATOM 560 C LEU A 417 3.107 -4.327 -3.676 1.00 0.00 C ATOM 561 O LEU A 417 2.264 -3.697 -4.317 1.00 0.00 O ATOM 562 CB LEU A 417 2.961 -4.999 -1.270 1.00 0.00 C ATOM 563 CG LEU A 417 2.093 -3.859 -0.738 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.642 -4.299 -0.627 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.612 -3.378 0.609 1.00 0.00 C ATOM 0 H LEU A 417 3.664 -7.215 -2.182 1.00 0.00 H new ATOM 0 HA LEU A 417 1.622 -5.615 -2.837 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.828 -5.864 -0.620 1.00 0.00 H new ATOM 0 HB3 LEU A 417 4.006 -4.700 -1.192 1.00 0.00 H new ATOM 0 HG LEU A 417 2.145 -3.029 -1.442 1.00 0.00 H new ATOM 0 HD11 LEU A 417 0.040 -3.474 -0.247 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.275 -4.593 -1.610 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.570 -5.146 0.056 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.982 -2.566 0.973 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.590 -4.202 1.322 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.636 -3.021 0.498 1.00 0.00 H new ATOM 577 N LEU A 418 4.411 -4.097 -3.775 1.00 0.00 N ATOM 578 CA LEU A 418 4.940 -3.068 -4.662 1.00 0.00 C ATOM 579 C LEU A 418 4.450 -3.276 -6.092 1.00 0.00 C ATOM 580 O LEU A 418 4.005 -2.336 -6.748 1.00 0.00 O ATOM 581 CB LEU A 418 6.470 -3.075 -4.629 1.00 0.00 C ATOM 582 CG LEU A 418 7.166 -2.081 -5.559 1.00 0.00 C ATOM 583 CD1 LEU A 418 7.035 -0.665 -5.022 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.631 -2.454 -5.737 1.00 0.00 C ATOM 0 H LEU A 418 5.121 -4.609 -3.252 1.00 0.00 H new ATOM 0 HA LEU A 418 4.579 -2.101 -4.311 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.792 -2.873 -3.608 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.814 -4.078 -4.879 1.00 0.00 H new ATOM 0 HG LEU A 418 6.680 -2.123 -6.534 1.00 0.00 H new ATOM 0 HD11 LEU A 418 7.537 0.028 -5.697 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.980 -0.400 -4.948 1.00 0.00 H new ATOM 0 HD13 LEU A 418 7.494 -0.606 -4.035 1.00 0.00 H new ATOM 0 HD21 LEU A 418 9.111 -1.736 -6.402 1.00 0.00 H new ATOM 0 HD22 LEU A 418 9.130 -2.441 -4.768 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.702 -3.452 -6.169 1.00 0.00 H new ATOM 596 N GLN A 419 4.534 -4.515 -6.565 1.00 0.00 N ATOM 597 CA GLN A 419 4.097 -4.847 -7.916 1.00 0.00 C ATOM 598 C GLN A 419 2.575 -4.894 -8.000 1.00 0.00 C ATOM 599 O GLN A 419 2.005 -4.943 -9.090 1.00 0.00 O ATOM 600 CB GLN A 419 4.686 -6.191 -8.349 1.00 0.00 C ATOM 601 CG GLN A 419 6.196 -6.168 -8.519 1.00 0.00 C ATOM 602 CD GLN A 419 6.630 -5.455 -9.785 1.00 0.00 C ATOM 603 OE1 GLN A 419 6.629 -6.036 -10.870 1.00 0.00 O ATOM 604 NE2 GLN A 419 7.006 -4.188 -9.652 1.00 0.00 N ATOM 0 H GLN A 419 4.900 -5.305 -6.034 1.00 0.00 H new ATOM 0 HA GLN A 419 4.455 -4.068 -8.589 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.424 -6.948 -7.610 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.227 -6.493 -9.291 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.647 -5.677 -7.657 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.572 -7.191 -8.536 1.00 0.00 H new ATOM 0 HE21 GLN A 419 6.991 -3.745 -8.733 1.00 0.00 H new ATOM 0 HE22 GLN A 419 7.309 -3.658 -10.469 1.00 0.00 H new ATOM 613 N MET A 420 1.923 -4.879 -6.843 1.00 0.00 N ATOM 614 CA MET A 420 0.467 -4.920 -6.786 1.00 0.00 C ATOM 615 C MET A 420 -0.121 -3.516 -6.889 1.00 0.00 C ATOM 616 O MET A 420 -1.240 -3.334 -7.367 1.00 0.00 O ATOM 617 CB MET A 420 0.003 -5.585 -5.488 1.00 0.00 C ATOM 618 CG MET A 420 -1.504 -5.549 -5.291 1.00 0.00 C ATOM 619 SD MET A 420 -2.343 -6.929 -6.093 1.00 0.00 S ATOM 620 CE MET A 420 -2.974 -7.814 -4.669 1.00 0.00 C ATOM 0 H MET A 420 2.380 -4.839 -5.932 1.00 0.00 H new ATOM 0 HA MET A 420 0.113 -5.507 -7.633 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.337 -6.622 -5.481 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.483 -5.090 -4.644 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.727 -5.564 -4.224 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.896 -4.612 -5.686 1.00 0.00 H new ATOM 0 HE1 MET A 420 -2.849 -8.886 -4.822 1.00 0.00 H new ATOM 0 HE2 MET A 420 -2.426 -7.508 -3.778 1.00 0.00 H new ATOM 0 HE3 MET A 420 -4.032 -7.587 -4.539 1.00 0.00 H new ATOM 630 N PHE A 421 0.641 -2.526 -6.437 1.00 0.00 N ATOM 631 CA PHE A 421 0.196 -1.138 -6.478 1.00 0.00 C ATOM 632 C PHE A 421 0.933 -0.361 -7.565 1.00 0.00 C ATOM 633 O PHE A 421 0.563 0.763 -7.899 1.00 0.00 O ATOM 634 CB PHE A 421 0.416 -0.469 -5.119 1.00 0.00 C ATOM 635 CG PHE A 421 -0.637 -0.812 -4.105 1.00 0.00 C ATOM 636 CD1 PHE A 421 -0.932 -2.134 -3.812 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.334 0.188 -3.446 1.00 0.00 C ATOM 638 CE1 PHE A 421 -1.901 -2.452 -2.878 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.304 -0.125 -2.511 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.588 -1.446 -2.228 1.00 0.00 C ATOM 0 H PHE A 421 1.570 -2.659 -6.038 1.00 0.00 H new ATOM 0 HA PHE A 421 -0.869 -1.132 -6.711 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.392 -0.763 -4.732 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.440 0.612 -5.255 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.399 -2.925 -4.319 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -1.117 1.223 -3.665 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -2.120 -3.486 -2.657 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -2.839 0.664 -2.003 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.346 -1.692 -1.499 1.00 0.00 H new ATOM 650 N MET A 422 1.980 -0.970 -8.112 1.00 0.00 N ATOM 651 CA MET A 422 2.770 -0.337 -9.161 1.00 0.00 C ATOM 652 C MET A 422 1.909 -0.039 -10.384 1.00 0.00 C ATOM 653 O MET A 422 1.961 1.049 -10.959 1.00 0.00 O ATOM 654 CB MET A 422 3.945 -1.234 -9.557 1.00 0.00 C ATOM 655 CG MET A 422 5.225 -0.931 -8.794 1.00 0.00 C ATOM 656 SD MET A 422 6.205 0.368 -9.569 1.00 0.00 S ATOM 657 CE MET A 422 7.842 -0.038 -8.968 1.00 0.00 C ATOM 0 H MET A 422 2.301 -1.901 -7.846 1.00 0.00 H new ATOM 0 HA MET A 422 3.157 0.605 -8.772 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.669 -2.275 -9.389 1.00 0.00 H new ATOM 0 HB3 MET A 422 4.133 -1.122 -10.625 1.00 0.00 H new ATOM 0 HG2 MET A 422 4.974 -0.633 -7.776 1.00 0.00 H new ATOM 0 HG3 MET A 422 5.824 -1.839 -8.722 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.446 0.868 -8.918 1.00 0.00 H new ATOM 0 HE2 MET A 422 7.766 -0.479 -7.974 1.00 0.00 H new ATOM 0 HE3 MET A 422 8.312 -0.750 -9.646 1.00 0.00 H new ATOM 667 N PRO A 423 1.098 -1.025 -10.793 1.00 0.00 N ATOM 668 CA PRO A 423 0.210 -0.891 -11.952 1.00 0.00 C ATOM 669 C PRO A 423 -0.588 0.409 -11.923 1.00 0.00 C ATOM 670 O PRO A 423 -0.650 1.132 -12.917 1.00 0.00 O ATOM 671 CB PRO A 423 -0.726 -2.095 -11.824 1.00 0.00 C ATOM 672 CG PRO A 423 0.060 -3.105 -11.059 1.00 0.00 C ATOM 673 CD PRO A 423 0.984 -2.348 -10.155 1.00 0.00 C ATOM 0 HA PRO A 423 0.765 -0.864 -12.890 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -1.644 -1.829 -11.301 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.016 -2.477 -12.803 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.601 -3.751 -10.481 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.623 -3.748 -11.735 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.581 -2.271 -9.145 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.954 -2.838 -10.075 1.00 0.00 H new ATOM 681 N PHE A 424 -1.198 0.698 -10.779 1.00 0.00 N ATOM 682 CA PHE A 424 -1.993 1.911 -10.621 1.00 0.00 C ATOM 683 C PHE A 424 -1.138 3.155 -10.849 1.00 0.00 C ATOM 684 O PHE A 424 -1.611 4.155 -11.386 1.00 0.00 O ATOM 685 CB PHE A 424 -2.619 1.957 -9.226 1.00 0.00 C ATOM 686 CG PHE A 424 -3.626 0.870 -8.985 1.00 0.00 C ATOM 687 CD1 PHE A 424 -4.946 1.030 -9.377 1.00 0.00 C ATOM 688 CD2 PHE A 424 -3.254 -0.313 -8.366 1.00 0.00 C ATOM 689 CE1 PHE A 424 -5.875 0.031 -9.156 1.00 0.00 C ATOM 690 CE2 PHE A 424 -4.179 -1.316 -8.143 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.491 -1.143 -8.538 1.00 0.00 C ATOM 0 H PHE A 424 -1.157 0.109 -9.947 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.787 1.896 -11.368 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -1.829 1.881 -8.479 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -3.100 2.925 -9.084 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -5.252 1.946 -9.861 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -2.229 -0.453 -8.054 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -6.900 0.168 -9.466 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -3.876 -2.234 -7.661 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.216 -1.925 -8.364 1.00 0.00 H new ATOM 701 N GLY A 425 0.124 3.082 -10.436 1.00 0.00 N ATOM 702 CA GLY A 425 1.025 4.208 -10.604 1.00 0.00 C ATOM 703 C GLY A 425 2.383 3.962 -9.979 1.00 0.00 C ATOM 704 O GLY A 425 2.679 2.851 -9.538 1.00 0.00 O ATOM 0 H GLY A 425 0.538 2.264 -9.989 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.150 4.414 -11.667 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.578 5.096 -10.157 1.00 0.00 H new ATOM 708 N ASN A 426 3.213 4.999 -9.940 1.00 0.00 N ATOM 709 CA ASN A 426 4.548 4.889 -9.367 1.00 0.00 C ATOM 710 C ASN A 426 4.494 4.954 -7.843 1.00 0.00 C ATOM 711 O ASN A 426 4.286 6.020 -7.262 1.00 0.00 O ATOM 712 CB ASN A 426 5.451 6.003 -9.903 1.00 0.00 C ATOM 713 CG ASN A 426 6.729 6.149 -9.100 1.00 0.00 C ATOM 714 OD1 ASN A 426 7.707 5.439 -9.336 1.00 0.00 O ATOM 715 ND2 ASN A 426 6.726 7.073 -8.147 1.00 0.00 N ATOM 0 H ASN A 426 2.984 5.926 -10.299 1.00 0.00 H new ATOM 0 HA ASN A 426 4.961 3.923 -9.658 1.00 0.00 H new ATOM 0 HB2 ASN A 426 5.701 5.795 -10.943 1.00 0.00 H new ATOM 0 HB3 ASN A 426 4.906 6.947 -9.888 1.00 0.00 H new ATOM 0 HD21 ASN A 426 7.558 7.218 -7.574 1.00 0.00 H new ATOM 0 HD22 ASN A 426 5.892 7.638 -7.987 1.00 0.00 H new ATOM 722 N VAL A 427 4.682 3.806 -7.199 1.00 0.00 N ATOM 723 CA VAL A 427 4.655 3.732 -5.744 1.00 0.00 C ATOM 724 C VAL A 427 5.896 4.379 -5.138 1.00 0.00 C ATOM 725 O VAL A 427 7.025 4.040 -5.495 1.00 0.00 O ATOM 726 CB VAL A 427 4.563 2.273 -5.257 1.00 0.00 C ATOM 727 CG1 VAL A 427 4.617 2.212 -3.739 1.00 0.00 C ATOM 728 CG2 VAL A 427 3.293 1.618 -5.781 1.00 0.00 C ATOM 0 H VAL A 427 4.855 2.914 -7.663 1.00 0.00 H new ATOM 0 HA VAL A 427 3.768 4.274 -5.417 1.00 0.00 H new ATOM 0 HB VAL A 427 5.418 1.722 -5.648 1.00 0.00 H new ATOM 0 HG11 VAL A 427 4.551 1.174 -3.414 1.00 0.00 H new ATOM 0 HG12 VAL A 427 5.556 2.642 -3.391 1.00 0.00 H new ATOM 0 HG13 VAL A 427 3.783 2.777 -3.322 1.00 0.00 H new ATOM 0 HG21 VAL A 427 3.243 0.588 -5.428 1.00 0.00 H new ATOM 0 HG22 VAL A 427 2.424 2.168 -5.420 1.00 0.00 H new ATOM 0 HG23 VAL A 427 3.301 1.628 -6.871 1.00 0.00 H new ATOM 738 N VAL A 428 5.679 5.314 -4.219 1.00 0.00 N ATOM 739 CA VAL A 428 6.779 6.010 -3.561 1.00 0.00 C ATOM 740 C VAL A 428 7.307 5.206 -2.377 1.00 0.00 C ATOM 741 O VAL A 428 8.512 5.166 -2.129 1.00 0.00 O ATOM 742 CB VAL A 428 6.349 7.404 -3.070 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.477 8.072 -2.300 1.00 0.00 C ATOM 744 CG2 VAL A 428 5.907 8.269 -4.241 1.00 0.00 C ATOM 0 H VAL A 428 4.751 5.607 -3.913 1.00 0.00 H new ATOM 0 HA VAL A 428 7.570 6.123 -4.302 1.00 0.00 H new ATOM 0 HB VAL A 428 5.502 7.285 -2.395 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.153 9.056 -1.961 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.741 7.460 -1.437 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.347 8.179 -2.948 1.00 0.00 H new ATOM 0 HG21 VAL A 428 5.607 9.251 -3.875 1.00 0.00 H new ATOM 0 HG22 VAL A 428 6.733 8.381 -4.943 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.064 7.796 -4.745 1.00 0.00 H new ATOM 754 N SER A 429 6.397 4.568 -1.648 1.00 0.00 N ATOM 755 CA SER A 429 6.771 3.768 -0.488 1.00 0.00 C ATOM 756 C SER A 429 5.987 2.460 -0.455 1.00 0.00 C ATOM 757 O SER A 429 4.797 2.429 -0.768 1.00 0.00 O ATOM 758 CB SER A 429 6.525 4.555 0.801 1.00 0.00 C ATOM 759 OG SER A 429 6.763 5.939 0.606 1.00 0.00 O ATOM 0 H SER A 429 5.396 4.590 -1.840 1.00 0.00 H new ATOM 0 HA SER A 429 7.833 3.534 -0.566 1.00 0.00 H new ATOM 0 HB2 SER A 429 5.498 4.403 1.134 1.00 0.00 H new ATOM 0 HB3 SER A 429 7.175 4.178 1.591 1.00 0.00 H new ATOM 0 HG SER A 429 6.063 6.314 0.032 1.00 0.00 H new ATOM 765 N ALA A 430 6.663 1.381 -0.073 1.00 0.00 N ATOM 766 CA ALA A 430 6.031 0.070 0.003 1.00 0.00 C ATOM 767 C ALA A 430 6.828 -0.872 0.898 1.00 0.00 C ATOM 768 O ALA A 430 7.962 -1.233 0.584 1.00 0.00 O ATOM 769 CB ALA A 430 5.878 -0.523 -1.389 1.00 0.00 C ATOM 0 H ALA A 430 7.649 1.390 0.189 1.00 0.00 H new ATOM 0 HA ALA A 430 5.042 0.195 0.443 1.00 0.00 H new ATOM 0 HB1 ALA A 430 5.405 -1.502 -1.317 1.00 0.00 H new ATOM 0 HB2 ALA A 430 5.259 0.135 -1.999 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.860 -0.628 -1.850 1.00 0.00 H new ATOM 775 N LYS A 431 6.228 -1.267 2.017 1.00 0.00 N ATOM 776 CA LYS A 431 6.881 -2.169 2.958 1.00 0.00 C ATOM 777 C LYS A 431 5.856 -2.854 3.856 1.00 0.00 C ATOM 778 O LYS A 431 4.953 -2.209 4.388 1.00 0.00 O ATOM 779 CB LYS A 431 7.891 -1.401 3.814 1.00 0.00 C ATOM 780 CG LYS A 431 8.273 -2.120 5.096 1.00 0.00 C ATOM 781 CD LYS A 431 7.327 -1.771 6.233 1.00 0.00 C ATOM 782 CE LYS A 431 7.995 -1.949 7.588 1.00 0.00 C ATOM 783 NZ LYS A 431 7.437 -1.018 8.607 1.00 0.00 N ATOM 0 H LYS A 431 5.290 -0.976 2.294 1.00 0.00 H new ATOM 0 HA LYS A 431 7.405 -2.934 2.385 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.791 -1.222 3.226 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.475 -0.425 4.065 1.00 0.00 H new ATOM 0 HG2 LYS A 431 8.260 -3.197 4.928 1.00 0.00 H new ATOM 0 HG3 LYS A 431 9.292 -1.853 5.374 1.00 0.00 H new ATOM 0 HD2 LYS A 431 6.991 -0.740 6.125 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.441 -2.403 6.177 1.00 0.00 H new ATOM 0 HE2 LYS A 431 7.864 -2.977 7.925 1.00 0.00 H new ATOM 0 HE3 LYS A 431 9.067 -1.780 7.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 7.765 -1.301 9.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 7.758 -0.050 8.405 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 6.398 -1.052 8.576 1.00 0.00 H new ATOM 797 N VAL A 432 6.001 -4.166 4.019 1.00 0.00 N ATOM 798 CA VAL A 432 5.089 -4.937 4.854 1.00 0.00 C ATOM 799 C VAL A 432 5.562 -4.967 6.303 1.00 0.00 C ATOM 800 O VAL A 432 6.754 -4.832 6.581 1.00 0.00 O ATOM 801 CB VAL A 432 4.948 -6.383 4.342 1.00 0.00 C ATOM 802 CG1 VAL A 432 4.014 -7.180 5.242 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.452 -6.393 2.905 1.00 0.00 C ATOM 0 H VAL A 432 6.741 -4.716 3.584 1.00 0.00 H new ATOM 0 HA VAL A 432 4.118 -4.444 4.802 1.00 0.00 H new ATOM 0 HB VAL A 432 5.930 -6.856 4.367 1.00 0.00 H new ATOM 0 HG11 VAL A 432 3.927 -8.199 4.865 1.00 0.00 H new ATOM 0 HG12 VAL A 432 4.416 -7.201 6.255 1.00 0.00 H new ATOM 0 HG13 VAL A 432 3.030 -6.711 5.252 1.00 0.00 H new ATOM 0 HG21 VAL A 432 4.358 -7.423 2.560 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.480 -5.903 2.852 1.00 0.00 H new ATOM 0 HG23 VAL A 432 5.162 -5.861 2.271 1.00 0.00 H new ATOM 813 N PHE A 433 4.620 -5.144 7.224 1.00 0.00 N ATOM 814 CA PHE A 433 4.940 -5.191 8.646 1.00 0.00 C ATOM 815 C PHE A 433 5.287 -6.612 9.078 1.00 0.00 C ATOM 816 O PHE A 433 4.844 -7.585 8.467 1.00 0.00 O ATOM 817 CB PHE A 433 3.765 -4.666 9.473 1.00 0.00 C ATOM 818 CG PHE A 433 3.684 -3.167 9.515 1.00 0.00 C ATOM 819 CD1 PHE A 433 4.135 -2.405 8.451 1.00 0.00 C ATOM 820 CD2 PHE A 433 3.156 -2.520 10.622 1.00 0.00 C ATOM 821 CE1 PHE A 433 4.062 -1.025 8.487 1.00 0.00 C ATOM 822 CE2 PHE A 433 3.079 -1.141 10.663 1.00 0.00 C ATOM 823 CZ PHE A 433 3.534 -0.392 9.595 1.00 0.00 C ATOM 0 H PHE A 433 3.629 -5.257 7.011 1.00 0.00 H new ATOM 0 HA PHE A 433 5.808 -4.555 8.819 1.00 0.00 H new ATOM 0 HB2 PHE A 433 2.836 -5.061 9.061 1.00 0.00 H new ATOM 0 HB3 PHE A 433 3.849 -5.046 10.491 1.00 0.00 H new ATOM 0 HD1 PHE A 433 4.549 -2.895 7.582 1.00 0.00 H new ATOM 0 HD2 PHE A 433 2.801 -3.100 11.461 1.00 0.00 H new ATOM 0 HE1 PHE A 433 4.417 -0.443 7.650 1.00 0.00 H new ATOM 0 HE2 PHE A 433 2.663 -0.649 11.530 1.00 0.00 H new ATOM 0 HZ PHE A 433 3.477 0.686 9.627 1.00 0.00 H new ATOM 983 N CYS A 443 -0.174 -9.599 7.925 1.00 0.00 N ATOM 984 CA CYS A 443 -1.221 -9.541 6.910 1.00 0.00 C ATOM 985 C CYS A 443 -1.599 -8.095 6.602 1.00 0.00 C ATOM 986 O CYS A 443 -2.743 -7.803 6.255 1.00 0.00 O ATOM 987 CB CYS A 443 -2.454 -10.316 7.375 1.00 0.00 C ATOM 988 SG CYS A 443 -3.171 -9.705 8.919 1.00 0.00 S ATOM 0 HA CYS A 443 -0.836 -9.999 5.999 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -3.212 -10.274 6.593 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -2.184 -11.364 7.502 1.00 0.00 H new ATOM 0 HG CYS A 443 -2.561 -8.615 9.279 1.00 0.00 H new ATOM 994 N PHE A 444 -0.630 -7.195 6.733 1.00 0.00 N ATOM 995 CA PHE A 444 -0.862 -5.780 6.472 1.00 0.00 C ATOM 996 C PHE A 444 0.453 -5.052 6.208 1.00 0.00 C ATOM 997 O PHE A 444 1.486 -5.386 6.788 1.00 0.00 O ATOM 998 CB PHE A 444 -1.589 -5.132 7.653 1.00 0.00 C ATOM 999 CG PHE A 444 -0.968 -5.450 8.983 1.00 0.00 C ATOM 1000 CD1 PHE A 444 0.258 -4.911 9.336 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -1.613 -6.285 9.882 1.00 0.00 C ATOM 1002 CE1 PHE A 444 0.831 -5.202 10.561 1.00 0.00 C ATOM 1003 CE2 PHE A 444 -1.045 -6.580 11.107 1.00 0.00 C ATOM 1004 CZ PHE A 444 0.178 -6.036 11.447 1.00 0.00 C ATOM 0 H PHE A 444 0.323 -7.421 7.018 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.487 -5.699 5.582 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -1.600 -4.051 7.515 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.627 -5.463 7.657 1.00 0.00 H new ATOM 0 HD1 PHE A 444 0.772 -4.257 8.648 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -2.571 -6.710 9.622 1.00 0.00 H new ATOM 0 HE1 PHE A 444 1.788 -4.777 10.824 1.00 0.00 H new ATOM 0 HE2 PHE A 444 -1.557 -7.235 11.797 1.00 0.00 H new ATOM 0 HZ PHE A 444 0.623 -6.263 12.405 1.00 0.00 H new ATOM 1014 N GLY A 445 0.406 -4.056 5.330 1.00 0.00 N ATOM 1015 CA GLY A 445 1.600 -3.297 5.004 1.00 0.00 C ATOM 1016 C GLY A 445 1.310 -1.826 4.787 1.00 0.00 C ATOM 1017 O GLY A 445 0.154 -1.402 4.816 1.00 0.00 O ATOM 0 H GLY A 445 -0.437 -3.760 4.838 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.327 -3.406 5.809 1.00 0.00 H new ATOM 0 HA3 GLY A 445 2.056 -3.711 4.104 1.00 0.00 H new ATOM 1021 N PHE A 446 2.362 -1.043 4.569 1.00 0.00 N ATOM 1022 CA PHE A 446 2.215 0.391 4.348 1.00 0.00 C ATOM 1023 C PHE A 446 2.592 0.763 2.918 1.00 0.00 C ATOM 1024 O PHE A 446 3.366 0.062 2.265 1.00 0.00 O ATOM 1025 CB PHE A 446 3.084 1.172 5.336 1.00 0.00 C ATOM 1026 CG PHE A 446 3.072 2.656 5.102 1.00 0.00 C ATOM 1027 CD1 PHE A 446 1.875 3.344 4.990 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.259 3.363 4.993 1.00 0.00 C ATOM 1029 CE1 PHE A 446 1.862 4.709 4.773 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.253 4.729 4.777 1.00 0.00 C ATOM 1031 CZ PHE A 446 3.051 5.402 4.669 1.00 0.00 C ATOM 0 H PHE A 446 3.325 -1.378 4.541 1.00 0.00 H new ATOM 0 HA PHE A 446 1.169 0.652 4.508 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.739 0.969 6.350 1.00 0.00 H new ATOM 0 HB3 PHE A 446 4.110 0.810 5.270 1.00 0.00 H new ATOM 0 HD1 PHE A 446 0.941 2.808 5.073 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.200 2.841 5.078 1.00 0.00 H new ATOM 0 HE1 PHE A 446 0.922 5.233 4.685 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.185 5.268 4.693 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.042 6.469 4.503 1.00 0.00 H new ATOM 1041 N VAL A 447 2.040 1.871 2.434 1.00 0.00 N ATOM 1042 CA VAL A 447 2.317 2.337 1.082 1.00 0.00 C ATOM 1043 C VAL A 447 1.968 3.813 0.927 1.00 0.00 C ATOM 1044 O VAL A 447 1.141 4.348 1.666 1.00 0.00 O ATOM 1045 CB VAL A 447 1.535 1.523 0.035 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.680 2.146 -1.345 1.00 0.00 C ATOM 1047 CG2 VAL A 447 2.002 0.076 0.029 1.00 0.00 C ATOM 0 H VAL A 447 1.397 2.463 2.960 1.00 0.00 H new ATOM 0 HA VAL A 447 3.385 2.199 0.913 1.00 0.00 H new ATOM 0 HB VAL A 447 0.479 1.538 0.303 1.00 0.00 H new ATOM 0 HG11 VAL A 447 1.120 1.556 -2.071 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.291 3.164 -1.327 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.733 2.165 -1.627 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.439 -0.485 -0.717 1.00 0.00 H new ATOM 0 HG22 VAL A 447 3.064 0.037 -0.214 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.838 -0.363 1.013 1.00 0.00 H new ATOM 1057 N SER A 448 2.603 4.468 -0.041 1.00 0.00 N ATOM 1058 CA SER A 448 2.362 5.883 -0.292 1.00 0.00 C ATOM 1059 C SER A 448 2.709 6.246 -1.732 1.00 0.00 C ATOM 1060 O SER A 448 3.555 5.608 -2.359 1.00 0.00 O ATOM 1061 CB SER A 448 3.182 6.741 0.673 1.00 0.00 C ATOM 1062 OG SER A 448 2.471 6.978 1.876 1.00 0.00 O ATOM 0 H SER A 448 3.288 4.040 -0.664 1.00 0.00 H new ATOM 0 HA SER A 448 1.302 6.079 -0.131 1.00 0.00 H new ATOM 0 HB2 SER A 448 4.125 6.242 0.897 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.429 7.691 0.200 1.00 0.00 H new ATOM 0 HG SER A 448 2.815 6.390 2.580 1.00 0.00 H new ATOM 1068 N TYR A 449 2.050 7.276 -2.252 1.00 0.00 N ATOM 1069 CA TYR A 449 2.285 7.724 -3.619 1.00 0.00 C ATOM 1070 C TYR A 449 2.868 9.133 -3.638 1.00 0.00 C ATOM 1071 O TYR A 449 3.165 9.708 -2.591 1.00 0.00 O ATOM 1072 CB TYR A 449 0.983 7.688 -4.421 1.00 0.00 C ATOM 1073 CG TYR A 449 0.618 6.308 -4.924 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.678 5.204 -4.083 1.00 0.00 C ATOM 1075 CD2 TYR A 449 0.217 6.109 -6.238 1.00 0.00 C ATOM 1076 CE1 TYR A 449 0.347 3.942 -4.537 1.00 0.00 C ATOM 1077 CE2 TYR A 449 -0.117 4.852 -6.701 1.00 0.00 C ATOM 1078 CZ TYR A 449 -0.050 3.770 -5.847 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.381 2.516 -6.304 1.00 0.00 O ATOM 0 H TYR A 449 1.348 7.817 -1.746 1.00 0.00 H new ATOM 0 HA TYR A 449 3.005 7.046 -4.077 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.172 8.064 -3.798 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.071 8.364 -5.272 1.00 0.00 H new ATOM 0 HD1 TYR A 449 0.989 5.335 -3.057 1.00 0.00 H new ATOM 0 HD2 TYR A 449 0.165 6.953 -6.910 1.00 0.00 H new ATOM 0 HE1 TYR A 449 0.399 3.094 -3.870 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -0.429 4.716 -7.726 1.00 0.00 H new ATOM 0 HH TYR A 449 0.186 2.287 -7.070 1.00 0.00 H new ATOM 1089 N ASP A 450 3.027 9.684 -4.836 1.00 0.00 N ATOM 1090 CA ASP A 450 3.573 11.027 -4.994 1.00 0.00 C ATOM 1091 C ASP A 450 2.508 12.082 -4.711 1.00 0.00 C ATOM 1092 O ASP A 450 2.825 13.219 -4.362 1.00 0.00 O ATOM 1093 CB ASP A 450 4.130 11.213 -6.406 1.00 0.00 C ATOM 1094 CG ASP A 450 4.726 12.590 -6.618 1.00 0.00 C ATOM 1095 OD1 ASP A 450 5.809 12.860 -6.059 1.00 0.00 O ATOM 1096 OD2 ASP A 450 4.110 13.397 -7.344 1.00 0.00 O ATOM 0 H ASP A 450 2.786 9.221 -5.712 1.00 0.00 H new ATOM 0 HA ASP A 450 4.383 11.150 -4.275 1.00 0.00 H new ATOM 0 HB2 ASP A 450 4.893 10.458 -6.595 1.00 0.00 H new ATOM 0 HB3 ASP A 450 3.333 11.050 -7.132 1.00 0.00 H new ATOM 1101 N ASN A 451 1.245 11.698 -4.867 1.00 0.00 N ATOM 1102 CA ASN A 451 0.134 12.613 -4.629 1.00 0.00 C ATOM 1103 C ASN A 451 -1.086 11.861 -4.104 1.00 0.00 C ATOM 1104 O ASN A 451 -1.227 10.653 -4.287 1.00 0.00 O ATOM 1105 CB ASN A 451 -0.227 13.355 -5.918 1.00 0.00 C ATOM 1106 CG ASN A 451 -0.170 12.456 -7.138 1.00 0.00 C ATOM 1107 OD1 ASN A 451 -1.132 11.755 -7.452 1.00 0.00 O ATOM 1108 ND2 ASN A 451 0.962 12.472 -7.833 1.00 0.00 N ATOM 0 H ASN A 451 0.966 10.761 -5.157 1.00 0.00 H new ATOM 0 HA ASN A 451 0.446 13.336 -3.876 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -1.229 13.773 -5.825 1.00 0.00 H new ATOM 0 HB3 ASN A 451 0.456 14.193 -6.055 1.00 0.00 H new ATOM 0 HD21 ASN A 451 1.059 11.888 -8.663 1.00 0.00 H new ATOM 0 HD22 ASN A 451 1.734 13.069 -7.536 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.989 12.594 -3.435 1.00 0.00 N ATOM 1116 CA PRO A 452 -3.213 12.018 -2.870 1.00 0.00 C ATOM 1117 C PRO A 452 -4.253 11.706 -3.940 1.00 0.00 C ATOM 1118 O PRO A 452 -5.326 11.180 -3.642 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.722 13.117 -1.933 1.00 0.00 C ATOM 1120 CG PRO A 452 -3.200 14.384 -2.517 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.884 14.040 -3.180 1.00 0.00 C ATOM 0 HA PRO A 452 -3.024 11.067 -2.371 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.811 13.123 -1.884 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -3.358 12.970 -0.916 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.903 14.796 -3.241 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -3.059 15.139 -1.743 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.743 14.600 -4.104 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -1.037 14.272 -2.534 1.00 0.00 H new ATOM 1129 N VAL A 453 -3.930 12.032 -5.187 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.837 11.785 -6.302 1.00 0.00 C ATOM 1131 C VAL A 453 -4.602 10.404 -6.905 1.00 0.00 C ATOM 1132 O VAL A 453 -5.548 9.705 -7.268 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.676 12.848 -7.404 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.599 12.549 -8.574 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.943 14.238 -6.844 1.00 0.00 C ATOM 0 H VAL A 453 -3.047 12.468 -5.451 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.850 11.838 -5.903 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.649 12.818 -7.767 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.471 13.311 -9.343 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.356 11.571 -8.989 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.634 12.550 -8.231 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.825 14.978 -7.636 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.959 14.284 -6.453 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -4.236 14.449 -6.042 1.00 0.00 H new ATOM 1145 N SER A 454 -3.334 10.017 -7.009 1.00 0.00 N ATOM 1146 CA SER A 454 -2.973 8.722 -7.571 1.00 0.00 C ATOM 1147 C SER A 454 -3.270 7.598 -6.582 1.00 0.00 C ATOM 1148 O SER A 454 -3.746 6.530 -6.964 1.00 0.00 O ATOM 1149 CB SER A 454 -1.493 8.702 -7.953 1.00 0.00 C ATOM 1150 OG SER A 454 -1.184 7.566 -8.742 1.00 0.00 O ATOM 0 H SER A 454 -2.540 10.583 -6.711 1.00 0.00 H new ATOM 0 HA SER A 454 -3.574 8.563 -8.466 1.00 0.00 H new ATOM 0 HB2 SER A 454 -1.244 9.609 -8.504 1.00 0.00 H new ATOM 0 HB3 SER A 454 -0.882 8.699 -7.051 1.00 0.00 H new ATOM 0 HG SER A 454 -1.047 6.790 -8.159 1.00 0.00 H new ATOM 1156 N ALA A 455 -2.985 7.850 -5.308 1.00 0.00 N ATOM 1157 CA ALA A 455 -3.223 6.862 -4.264 1.00 0.00 C ATOM 1158 C ALA A 455 -4.643 6.313 -4.339 1.00 0.00 C ATOM 1159 O ALA A 455 -4.885 5.148 -4.026 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.962 7.470 -2.894 1.00 0.00 C ATOM 0 H ALA A 455 -2.589 8.729 -4.975 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.533 6.032 -4.420 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -3.144 6.721 -2.123 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.927 7.806 -2.836 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.628 8.319 -2.740 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.578 7.160 -4.757 1.00 0.00 N ATOM 1167 CA GLN A 456 -6.976 6.759 -4.874 1.00 0.00 C ATOM 1168 C GLN A 456 -7.135 5.627 -5.883 1.00 0.00 C ATOM 1169 O GLN A 456 -7.598 4.538 -5.542 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.838 7.952 -5.286 1.00 0.00 C ATOM 1171 CG GLN A 456 -8.292 8.808 -4.116 1.00 0.00 C ATOM 1172 CD GLN A 456 -8.781 7.981 -2.943 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -9.666 7.138 -3.088 1.00 0.00 O ATOM 1174 NE2 GLN A 456 -8.204 8.218 -1.770 1.00 0.00 N ATOM 0 H GLN A 456 -5.393 8.128 -5.020 1.00 0.00 H new ATOM 0 HA GLN A 456 -7.308 6.401 -3.900 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.275 8.573 -5.983 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.715 7.588 -5.821 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -7.466 9.440 -3.791 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -9.091 9.473 -4.445 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -7.474 8.926 -1.695 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -8.491 7.692 -0.945 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.750 5.892 -7.127 1.00 0.00 N ATOM 1184 CA ALA A 457 -6.849 4.895 -8.186 1.00 0.00 C ATOM 1185 C ALA A 457 -6.558 3.497 -7.653 1.00 0.00 C ATOM 1186 O ALA A 457 -7.085 2.507 -8.159 1.00 0.00 O ATOM 1187 CB ALA A 457 -5.897 5.237 -9.323 1.00 0.00 C ATOM 0 H ALA A 457 -6.367 6.789 -7.426 1.00 0.00 H new ATOM 0 HA ALA A 457 -7.871 4.905 -8.566 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -5.981 4.484 -10.107 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.153 6.215 -9.730 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -4.874 5.257 -8.947 1.00 0.00 H new ATOM 1193 N ALA A 458 -5.714 3.423 -6.628 1.00 0.00 N ATOM 1194 CA ALA A 458 -5.354 2.145 -6.025 1.00 0.00 C ATOM 1195 C ALA A 458 -6.421 1.684 -5.038 1.00 0.00 C ATOM 1196 O ALA A 458 -6.816 0.518 -5.037 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.003 2.249 -5.334 1.00 0.00 C ATOM 0 H ALA A 458 -5.267 4.233 -6.198 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.287 1.403 -6.820 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -3.747 1.288 -4.888 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.242 2.525 -6.063 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.051 3.009 -4.554 1.00 0.00 H new ATOM 1203 N ILE A 459 -6.883 2.606 -4.200 1.00 0.00 N ATOM 1204 CA ILE A 459 -7.904 2.293 -3.208 1.00 0.00 C ATOM 1205 C ILE A 459 -9.253 2.039 -3.870 1.00 0.00 C ATOM 1206 O ILE A 459 -9.923 1.049 -3.577 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.055 3.428 -2.178 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -6.690 3.805 -1.597 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.013 3.014 -1.071 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -6.670 5.163 -0.934 1.00 0.00 C ATOM 0 H ILE A 459 -6.566 3.576 -4.188 1.00 0.00 H new ATOM 0 HA ILE A 459 -7.578 1.389 -2.694 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.468 4.303 -2.681 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -6.393 3.050 -0.869 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -5.947 3.788 -2.395 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.110 3.826 -0.351 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -9.990 2.791 -1.500 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -8.627 2.127 -0.568 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -5.672 5.364 -0.545 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -6.936 5.928 -1.664 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -7.388 5.178 -0.114 1.00 0.00 H new ATOM 1222 N GLN A 460 -9.647 2.939 -4.765 1.00 0.00 N ATOM 1223 CA GLN A 460 -10.917 2.812 -5.470 1.00 0.00 C ATOM 1224 C GLN A 460 -11.216 1.352 -5.792 1.00 0.00 C ATOM 1225 O GLN A 460 -12.337 0.880 -5.598 1.00 0.00 O ATOM 1226 CB GLN A 460 -10.894 3.638 -6.758 1.00 0.00 C ATOM 1227 CG GLN A 460 -9.798 3.224 -7.726 1.00 0.00 C ATOM 1228 CD GLN A 460 -9.913 3.917 -9.069 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -9.816 3.282 -10.119 1.00 0.00 O ATOM 1230 NE2 GLN A 460 -10.121 5.229 -9.042 1.00 0.00 N ATOM 0 H GLN A 460 -9.105 3.765 -5.019 1.00 0.00 H new ATOM 0 HA GLN A 460 -11.706 3.190 -4.819 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -11.860 3.547 -7.255 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -10.764 4.690 -6.503 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -8.826 3.450 -7.287 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -9.838 2.145 -7.874 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -10.195 5.715 -8.148 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -10.207 5.750 -9.915 1.00 0.00 H new ATOM 1239 N SER A 461 -10.207 0.641 -6.286 1.00 0.00 N ATOM 1240 CA SER A 461 -10.364 -0.765 -6.640 1.00 0.00 C ATOM 1241 C SER A 461 -9.947 -1.666 -5.481 1.00 0.00 C ATOM 1242 O SER A 461 -10.712 -2.524 -5.041 1.00 0.00 O ATOM 1243 CB SER A 461 -9.534 -1.096 -7.882 1.00 0.00 C ATOM 1244 OG SER A 461 -10.283 -0.883 -9.066 1.00 0.00 O ATOM 0 H SER A 461 -9.273 1.015 -6.450 1.00 0.00 H new ATOM 0 HA SER A 461 -11.417 -0.944 -6.857 1.00 0.00 H new ATOM 0 HB2 SER A 461 -8.637 -0.478 -7.899 1.00 0.00 H new ATOM 0 HB3 SER A 461 -9.205 -2.134 -7.838 1.00 0.00 H new ATOM 0 HG SER A 461 -9.731 -1.100 -9.846 1.00 0.00 H new ATOM 1250 N MET A 462 -8.728 -1.464 -4.992 1.00 0.00 N ATOM 1251 CA MET A 462 -8.208 -2.257 -3.883 1.00 0.00 C ATOM 1252 C MET A 462 -9.258 -2.412 -2.787 1.00 0.00 C ATOM 1253 O MET A 462 -9.625 -3.527 -2.420 1.00 0.00 O ATOM 1254 CB MET A 462 -6.948 -1.608 -3.310 1.00 0.00 C ATOM 1255 CG MET A 462 -5.733 -1.734 -4.215 1.00 0.00 C ATOM 1256 SD MET A 462 -4.750 -3.202 -3.859 1.00 0.00 S ATOM 1257 CE MET A 462 -5.410 -4.353 -5.062 1.00 0.00 C ATOM 0 H MET A 462 -8.082 -0.759 -5.346 1.00 0.00 H new ATOM 0 HA MET A 462 -7.956 -3.247 -4.264 1.00 0.00 H new ATOM 0 HB2 MET A 462 -7.145 -0.552 -3.125 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.721 -2.063 -2.346 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.061 -1.764 -5.254 1.00 0.00 H new ATOM 0 HG3 MET A 462 -5.108 -0.848 -4.103 1.00 0.00 H new ATOM 0 HE1 MET A 462 -4.669 -5.124 -5.273 1.00 0.00 H new ATOM 0 HE2 MET A 462 -6.313 -4.817 -4.665 1.00 0.00 H new ATOM 0 HE3 MET A 462 -5.650 -3.820 -5.982 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.737 -1.286 -2.270 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.744 -1.298 -1.214 1.00 0.00 C ATOM 1269 C ASN A 463 -11.758 -2.416 -1.442 1.00 0.00 C ATOM 1270 O ASN A 463 -12.705 -2.262 -2.212 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.462 0.052 -1.150 1.00 0.00 C ATOM 1272 CG ASN A 463 -12.743 -0.013 -0.341 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -13.839 0.146 -0.878 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -12.609 -0.246 0.960 1.00 0.00 N ATOM 0 H ASN A 463 -9.445 -0.354 -2.564 1.00 0.00 H new ATOM 0 HA ASN A 463 -10.238 -1.478 -0.265 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.796 0.795 -0.711 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -11.691 0.387 -2.162 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -13.435 -0.299 1.556 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -11.680 -0.372 1.363 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.551 -3.542 -0.766 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.454 -4.668 -0.908 1.00 0.00 C ATOM 1283 C GLY A 464 -12.116 -5.536 -2.104 1.00 0.00 C ATOM 1284 O GLY A 464 -13.005 -6.084 -2.755 1.00 0.00 O ATOM 0 H GLY A 464 -10.774 -3.694 -0.123 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.420 -5.274 -0.002 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.475 -4.300 -1.007 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.825 -5.662 -2.396 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.371 -6.467 -3.524 1.00 0.00 C ATOM 1290 C PHE A 465 -10.544 -7.955 -3.234 1.00 0.00 C ATOM 1291 O PHE A 465 -10.062 -8.460 -2.221 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.904 -6.164 -3.836 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.358 -6.966 -4.982 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.851 -8.238 -4.774 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -8.349 -6.447 -6.267 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.346 -8.980 -5.827 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -7.847 -7.184 -7.323 1.00 0.00 C ATOM 1298 CZ PHE A 465 -7.344 -8.451 -7.102 1.00 0.00 C ATOM 0 H PHE A 465 -10.075 -5.217 -1.867 1.00 0.00 H new ATOM 0 HA PHE A 465 -10.980 -6.210 -4.391 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.801 -5.103 -4.063 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.304 -6.359 -2.947 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -7.850 -8.656 -3.778 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -8.739 -5.456 -6.445 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -6.954 -9.971 -5.652 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -7.848 -6.769 -8.320 1.00 0.00 H new ATOM 0 HZ PHE A 465 -6.950 -9.027 -7.926 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.235 -8.649 -4.131 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.473 -10.079 -3.972 1.00 0.00 C ATOM 1310 C GLN A 466 -10.187 -10.872 -4.179 1.00 0.00 C ATOM 1311 O GLN A 466 -9.606 -10.858 -5.265 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.542 -10.553 -4.959 1.00 0.00 C ATOM 1313 CG GLN A 466 -13.136 -11.908 -4.608 1.00 0.00 C ATOM 1314 CD GLN A 466 -12.219 -13.058 -4.972 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -11.650 -13.093 -6.064 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -12.068 -14.009 -4.057 1.00 0.00 N ATOM 0 H GLN A 466 -11.640 -8.245 -4.975 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.825 -10.251 -2.955 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.342 -9.814 -4.998 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -12.106 -10.604 -5.957 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -13.348 -11.942 -3.539 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -14.087 -12.029 -5.126 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -12.558 -13.941 -3.165 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -11.462 -14.807 -4.246 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.748 -11.561 -3.131 1.00 0.00 N ATOM 1326 CA ILE A 467 -8.531 -12.360 -3.200 1.00 0.00 C ATOM 1327 C ILE A 467 -8.705 -13.691 -2.477 1.00 0.00 C ATOM 1328 O ILE A 467 -9.204 -13.738 -1.354 1.00 0.00 O ATOM 1329 CB ILE A 467 -7.330 -11.611 -2.590 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -6.017 -12.218 -3.086 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -7.398 -11.651 -1.070 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.815 -11.327 -2.858 1.00 0.00 C ATOM 0 H ILE A 467 -10.216 -11.582 -2.225 1.00 0.00 H new ATOM 0 HA ILE A 467 -8.335 -12.546 -4.256 1.00 0.00 H new ATOM 0 HB ILE A 467 -7.370 -10.570 -2.909 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.854 -13.171 -2.583 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -6.104 -12.431 -4.151 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -6.543 -11.118 -0.653 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -8.320 -11.177 -0.734 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -7.379 -12.687 -0.732 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.919 -11.821 -3.234 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.957 -10.383 -3.384 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.702 -11.134 -1.791 1.00 0.00 H new ATOM 1344 N GLY A 468 -8.287 -14.772 -3.130 1.00 0.00 N ATOM 1345 CA GLY A 468 -8.404 -16.090 -2.533 1.00 0.00 C ATOM 1346 C GLY A 468 -9.803 -16.371 -2.018 1.00 0.00 C ATOM 1347 O GLY A 468 -10.709 -16.666 -2.795 1.00 0.00 O ATOM 0 H GLY A 468 -7.870 -14.758 -4.061 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -8.133 -16.845 -3.271 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -7.693 -16.178 -1.711 1.00 0.00 H new ATOM 1351 N MET A 469 -9.977 -16.281 -0.703 1.00 0.00 N ATOM 1352 CA MET A 469 -11.275 -16.528 -0.086 1.00 0.00 C ATOM 1353 C MET A 469 -11.621 -15.426 0.910 1.00 0.00 C ATOM 1354 O MET A 469 -12.387 -15.643 1.850 1.00 0.00 O ATOM 1355 CB MET A 469 -11.277 -17.886 0.618 1.00 0.00 C ATOM 1356 CG MET A 469 -11.712 -19.034 -0.280 1.00 0.00 C ATOM 1357 SD MET A 469 -13.502 -19.130 -0.468 1.00 0.00 S ATOM 1358 CE MET A 469 -13.891 -20.457 0.672 1.00 0.00 C ATOM 0 H MET A 469 -9.236 -16.039 -0.045 1.00 0.00 H new ATOM 0 HA MET A 469 -12.029 -16.533 -0.873 1.00 0.00 H new ATOM 0 HB2 MET A 469 -10.276 -18.091 0.997 1.00 0.00 H new ATOM 0 HB3 MET A 469 -11.941 -17.838 1.481 1.00 0.00 H new ATOM 0 HG2 MET A 469 -11.253 -18.916 -1.262 1.00 0.00 H new ATOM 0 HG3 MET A 469 -11.343 -19.973 0.133 1.00 0.00 H new ATOM 0 HE1 MET A 469 -14.966 -20.636 0.669 1.00 0.00 H new ATOM 0 HE2 MET A 469 -13.371 -21.365 0.365 1.00 0.00 H new ATOM 0 HE3 MET A 469 -13.573 -20.179 1.677 1.00 0.00 H new ATOM 1368 N LYS A 470 -11.053 -14.243 0.700 1.00 0.00 N ATOM 1369 CA LYS A 470 -11.302 -13.107 1.578 1.00 0.00 C ATOM 1370 C LYS A 470 -11.298 -11.800 0.791 1.00 0.00 C ATOM 1371 O LYS A 470 -11.092 -11.796 -0.423 1.00 0.00 O ATOM 1372 CB LYS A 470 -10.249 -13.051 2.686 1.00 0.00 C ATOM 1373 CG LYS A 470 -8.842 -12.787 2.175 1.00 0.00 C ATOM 1374 CD LYS A 470 -7.803 -13.018 3.259 1.00 0.00 C ATOM 1375 CE LYS A 470 -6.393 -12.792 2.737 1.00 0.00 C ATOM 1376 NZ LYS A 470 -5.406 -12.660 3.844 1.00 0.00 N ATOM 0 H LYS A 470 -10.416 -14.047 -0.072 1.00 0.00 H new ATOM 0 HA LYS A 470 -12.286 -13.237 2.028 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.521 -12.270 3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -10.257 -13.994 3.232 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.634 -13.438 1.326 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.771 -11.761 1.815 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -7.994 -12.347 4.096 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -7.893 -14.036 3.639 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -6.107 -13.623 2.093 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -6.373 -11.891 2.123 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -4.862 -11.782 3.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -5.907 -12.633 4.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -4.758 -13.473 3.830 1.00 0.00 H new ATOM 1390 N ARG A 471 -11.523 -10.692 1.490 1.00 0.00 N ATOM 1391 CA ARG A 471 -11.544 -9.380 0.856 1.00 0.00 C ATOM 1392 C ARG A 471 -10.481 -8.468 1.459 1.00 0.00 C ATOM 1393 O ARG A 471 -10.471 -8.221 2.667 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.926 -8.739 1.006 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.977 -9.334 0.083 1.00 0.00 C ATOM 1396 CD ARG A 471 -15.368 -8.823 0.421 1.00 0.00 C ATOM 1397 NE ARG A 471 -15.904 -9.452 1.625 1.00 0.00 N ATOM 1398 CZ ARG A 471 -17.173 -9.350 2.003 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -18.032 -8.649 1.275 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -17.586 -9.951 3.112 1.00 0.00 N ATOM 0 H ARG A 471 -11.693 -10.677 2.496 1.00 0.00 H new ATOM 0 HA ARG A 471 -11.326 -9.513 -0.204 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -13.258 -8.848 2.039 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.845 -7.670 0.809 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.738 -9.085 -0.951 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.958 -10.421 0.161 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -15.333 -7.743 0.561 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -16.038 -9.014 -0.417 1.00 0.00 H new ATOM 0 HE ARG A 471 -15.270 -9.999 2.207 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -17.719 -8.186 0.422 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -19.006 -8.573 1.568 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -16.929 -10.491 3.674 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -18.561 -9.872 3.402 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.586 -7.969 0.613 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.516 -7.085 1.062 1.00 0.00 C ATOM 1416 C LEU A 472 -9.084 -5.777 1.605 1.00 0.00 C ATOM 1417 O LEU A 472 -10.207 -5.391 1.277 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.549 -6.796 -0.087 1.00 0.00 C ATOM 1419 CG LEU A 472 -6.587 -7.926 -0.453 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -5.775 -7.557 -1.685 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -5.668 -8.245 0.717 1.00 0.00 C ATOM 0 H LEU A 472 -9.580 -8.162 -0.389 1.00 0.00 H new ATOM 0 HA LEU A 472 -7.976 -7.587 1.864 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.133 -6.542 -0.972 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -6.962 -5.915 0.172 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.173 -8.816 -0.682 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.096 -8.373 -1.931 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.447 -7.379 -2.524 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.199 -6.654 -1.484 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -4.990 -9.052 0.438 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -5.089 -7.359 0.977 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -6.265 -8.553 1.575 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.301 -5.097 2.435 1.00 0.00 N ATOM 1434 CA LYS A 473 -8.722 -3.830 3.021 1.00 0.00 C ATOM 1435 C LYS A 473 -7.617 -2.785 2.909 1.00 0.00 C ATOM 1436 O LYS A 473 -6.575 -2.896 3.554 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.105 -4.026 4.489 1.00 0.00 C ATOM 1438 CG LYS A 473 -9.208 -2.728 5.271 1.00 0.00 C ATOM 1439 CD LYS A 473 -9.979 -2.915 6.566 1.00 0.00 C ATOM 1440 CE LYS A 473 -9.099 -3.502 7.659 1.00 0.00 C ATOM 1441 NZ LYS A 473 -9.879 -3.822 8.886 1.00 0.00 N ATOM 0 H LYS A 473 -7.370 -5.403 2.718 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.592 -3.474 2.469 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -10.061 -4.547 4.540 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.365 -4.669 4.966 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -8.208 -2.356 5.493 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -9.701 -1.972 4.659 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -10.378 -1.955 6.895 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -10.831 -3.572 6.392 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -8.616 -4.406 7.290 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -8.307 -2.795 7.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -9.244 -4.220 9.607 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -10.320 -2.955 9.253 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -10.619 -4.516 8.656 1.00 0.00 H new ATOM 1455 N VAL A 474 -7.853 -1.767 2.086 1.00 0.00 N ATOM 1456 CA VAL A 474 -6.879 -0.700 1.891 1.00 0.00 C ATOM 1457 C VAL A 474 -7.477 0.659 2.235 1.00 0.00 C ATOM 1458 O VAL A 474 -8.615 0.957 1.871 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.362 -0.669 0.441 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -5.201 0.304 0.307 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -5.954 -2.064 -0.009 1.00 0.00 C ATOM 0 H VAL A 474 -8.710 -1.659 1.544 1.00 0.00 H new ATOM 0 HA VAL A 474 -6.045 -0.907 2.561 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.169 -0.324 -0.206 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -4.850 0.311 -0.725 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.531 1.305 0.585 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.389 -0.006 0.964 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.591 -2.023 -1.036 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.163 -2.439 0.641 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -6.815 -2.730 0.046 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.703 1.480 2.937 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.158 2.809 3.330 1.00 0.00 C ATOM 1473 C GLN A 475 -5.973 3.730 3.603 1.00 0.00 C ATOM 1474 O GLN A 475 -4.960 3.308 4.162 1.00 0.00 O ATOM 1475 CB GLN A 475 -8.045 2.721 4.572 1.00 0.00 C ATOM 1476 CG GLN A 475 -9.092 3.820 4.651 1.00 0.00 C ATOM 1477 CD GLN A 475 -10.051 3.800 3.478 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -10.640 2.767 3.160 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -10.212 4.945 2.825 1.00 0.00 N ATOM 0 H GLN A 475 -5.759 1.249 3.245 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.738 3.225 2.506 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -8.545 1.753 4.583 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.416 2.765 5.461 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -9.656 3.713 5.578 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -8.594 4.789 4.691 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -9.704 5.778 3.123 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -10.844 4.992 2.026 1.00 0.00 H new ATOM 1488 N LEU A 476 -6.107 4.990 3.203 1.00 0.00 N ATOM 1489 CA LEU A 476 -5.047 5.973 3.404 1.00 0.00 C ATOM 1490 C LEU A 476 -5.136 6.595 4.794 1.00 0.00 C ATOM 1491 O LEU A 476 -6.176 7.130 5.181 1.00 0.00 O ATOM 1492 CB LEU A 476 -5.130 7.067 2.338 1.00 0.00 C ATOM 1493 CG LEU A 476 -6.174 8.159 2.576 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.668 9.165 3.597 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -6.527 8.853 1.268 1.00 0.00 C ATOM 0 H LEU A 476 -6.938 5.355 2.738 1.00 0.00 H new ATOM 0 HA LEU A 476 -4.089 5.460 3.316 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -4.151 7.540 2.255 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.339 6.596 1.378 1.00 0.00 H new ATOM 0 HG LEU A 476 -7.077 7.694 2.971 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -6.423 9.935 3.754 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -5.466 8.656 4.540 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.751 9.626 3.230 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -7.271 9.627 1.456 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.631 9.306 0.843 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.932 8.123 0.567 1.00 0.00 H new ATOM 1507 N LYS A 477 -4.040 6.521 5.541 1.00 0.00 N ATOM 1508 CA LYS A 477 -3.992 7.079 6.887 1.00 0.00 C ATOM 1509 C LYS A 477 -4.842 8.342 6.984 1.00 0.00 C ATOM 1510 O LYS A 477 -4.487 9.384 6.432 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.547 7.392 7.280 1.00 0.00 C ATOM 1512 CG LYS A 477 -2.283 7.276 8.771 1.00 0.00 C ATOM 1513 CD LYS A 477 -1.996 5.840 9.176 1.00 0.00 C ATOM 1514 CE LYS A 477 -1.599 5.742 10.641 1.00 0.00 C ATOM 1515 NZ LYS A 477 -0.150 6.022 10.843 1.00 0.00 N ATOM 0 H LYS A 477 -3.172 6.080 5.237 1.00 0.00 H new ATOM 0 HA LYS A 477 -4.397 6.337 7.575 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.880 6.714 6.748 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -2.301 8.403 6.954 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -1.437 7.907 9.042 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -3.146 7.645 9.324 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -2.879 5.227 8.996 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -1.196 5.438 8.554 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -2.190 6.447 11.225 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -1.832 4.745 11.014 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 0.081 5.945 11.854 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 0.415 5.334 10.306 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 0.068 6.983 10.510 1.00 0.00 H new