USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=16 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 Single : A 395 LYS NZ :NH3+ -118:sc= -1.34 (180deg=-3.4!) USER MOD Single : A 402 ASN : amide:sc= -5.74! C(o=-5.7!,f=-10!) USER MOD Single : A 406 TYR OH : rot 180:sc= 0 USER MOD Single : A 407 HIS :FLIP no HD1:sc= -1.69 F(o=-4.9!,f=-1.7) USER MOD Single : A 410 GLN : amide:sc= -0.813 K(o=-0.81,f=-2.1) USER MOD Single : A 415 GLN : amide:sc= -0.306 K(o=-0.31,f=-3.3!) USER MOD Single : A 419 GLN : amide:sc= -0.807 K(o=-0.81,f=-3.4!) USER MOD Single : A 420 MET CE :methyl 175:sc= -0.0739 (180deg=-0.126) USER MOD Single : A 422 MET CE :methyl 156:sc= -1.37 (180deg=-3.14!) USER MOD Single : A 426 ASN : amide:sc= -0.0186 X(o=-0.019,f=0) USER MOD Single : A 429 SER OG : rot 123:sc= -3.38! USER MOD Single : A 431 LYS NZ :NH3+ -108:sc= 1.71 (180deg=0.286) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 448 SER OG : rot -70:sc= -0.986 USER MOD Single : A 449 TYR OH : rot -94:sc= 1.11 USER MOD Single : A 451 ASN : amide:sc= -2.96! C(o=-3!,f=-3.8!) USER MOD Single : A 454 SER OG : rot 180:sc= 0 USER MOD Single : A 456 GLN :FLIP amide:sc= -0.0682 F(o=-1,f=-0.068) USER MOD Single : A 460 GLN : amide:sc= -0.38 X(o=-0.38,f=-0.38) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl -151:sc= 0 (180deg=-0.333) USER MOD Single : A 463 ASN : amide:sc= -0.031 X(o=-0.031,f=-0.31) USER MOD Single : A 466 GLN : amide:sc= -1.15 X(o=-1.2,f=-1.1) USER MOD Single : A 469 MET CE :methyl 165:sc= -0.105 (180deg=-0.554) USER MOD Single : A 470 LYS NZ :NH3+ -159:sc= -0.0462 (180deg=-0.426) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= -0.165 K(o=-0.17,f=-2.3!) USER MOD Single : A 477 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 225 N LYS A 395 9.382 5.164 4.635 1.00 0.00 N ATOM 226 CA LYS A 395 9.067 6.525 4.218 1.00 0.00 C ATOM 227 C LYS A 395 7.741 6.571 3.466 1.00 0.00 C ATOM 228 O LYS A 395 7.172 5.533 3.130 1.00 0.00 O ATOM 229 CB LYS A 395 10.186 7.081 3.334 1.00 0.00 C ATOM 230 CG LYS A 395 10.711 6.083 2.318 1.00 0.00 C ATOM 231 CD LYS A 395 11.607 6.753 1.290 1.00 0.00 C ATOM 232 CE LYS A 395 10.833 7.750 0.441 1.00 0.00 C ATOM 233 NZ LYS A 395 10.804 9.103 1.064 1.00 0.00 N ATOM 0 HA LYS A 395 8.978 7.141 5.113 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.818 7.962 2.809 1.00 0.00 H new ATOM 0 HB3 LYS A 395 11.010 7.409 3.968 1.00 0.00 H new ATOM 0 HG2 LYS A 395 11.268 5.299 2.831 1.00 0.00 H new ATOM 0 HG3 LYS A 395 9.873 5.601 1.813 1.00 0.00 H new ATOM 0 HD2 LYS A 395 12.426 7.264 1.797 1.00 0.00 H new ATOM 0 HD3 LYS A 395 12.054 5.995 0.646 1.00 0.00 H new ATOM 0 HE2 LYS A 395 11.287 7.815 -0.548 1.00 0.00 H new ATOM 0 HE3 LYS A 395 9.813 7.393 0.300 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 9.820 9.367 1.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 11.356 9.091 1.946 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 11.216 9.796 0.407 1.00 0.00 H new ATOM 247 N GLU A 396 7.256 7.780 3.204 1.00 0.00 N ATOM 248 CA GLU A 396 5.997 7.960 2.491 1.00 0.00 C ATOM 249 C GLU A 396 6.069 9.161 1.553 1.00 0.00 C ATOM 250 O GLU A 396 7.108 9.810 1.436 1.00 0.00 O ATOM 251 CB GLU A 396 4.845 8.143 3.482 1.00 0.00 C ATOM 252 CG GLU A 396 4.794 9.525 4.110 1.00 0.00 C ATOM 253 CD GLU A 396 3.997 9.552 5.399 1.00 0.00 C ATOM 254 OE1 GLU A 396 4.315 8.758 6.310 1.00 0.00 O ATOM 255 OE2 GLU A 396 3.057 10.368 5.498 1.00 0.00 O ATOM 0 H GLU A 396 7.716 8.649 3.475 1.00 0.00 H new ATOM 0 HA GLU A 396 5.816 7.065 1.895 1.00 0.00 H new ATOM 0 HB2 GLU A 396 3.902 7.952 2.969 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.935 7.398 4.272 1.00 0.00 H new ATOM 0 HG2 GLU A 396 5.810 9.867 4.308 1.00 0.00 H new ATOM 0 HG3 GLU A 396 4.354 10.226 3.401 1.00 0.00 H new ATOM 262 N GLY A 397 4.957 9.452 0.885 1.00 0.00 N ATOM 263 CA GLY A 397 4.914 10.574 -0.034 1.00 0.00 C ATOM 264 C GLY A 397 4.644 11.889 0.668 1.00 0.00 C ATOM 265 O GLY A 397 5.055 12.105 1.808 1.00 0.00 O ATOM 0 H GLY A 397 4.084 8.930 0.964 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.862 10.639 -0.568 1.00 0.00 H new ATOM 0 HA3 GLY A 397 4.139 10.399 -0.780 1.00 0.00 H new ATOM 269 N PRO A 398 3.936 12.798 -0.021 1.00 0.00 N ATOM 270 CA PRO A 398 3.596 14.115 0.523 1.00 0.00 C ATOM 271 C PRO A 398 2.483 14.042 1.563 1.00 0.00 C ATOM 272 O PRO A 398 1.633 13.153 1.515 1.00 0.00 O ATOM 273 CB PRO A 398 3.129 14.898 -0.705 1.00 0.00 C ATOM 274 CG PRO A 398 2.608 13.860 -1.640 1.00 0.00 C ATOM 275 CD PRO A 398 3.413 12.607 -1.384 1.00 0.00 C ATOM 0 HA PRO A 398 4.440 14.572 1.040 1.00 0.00 H new ATOM 0 HB2 PRO A 398 2.355 15.620 -0.444 1.00 0.00 H new ATOM 0 HB3 PRO A 398 3.950 15.458 -1.153 1.00 0.00 H new ATOM 0 HG2 PRO A 398 1.547 13.681 -1.468 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.713 14.183 -2.676 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.794 11.713 -1.453 1.00 0.00 H new ATOM 0 HD3 PRO A 398 4.219 12.494 -2.109 1.00 0.00 H new ATOM 283 N GLU A 399 2.493 14.984 2.501 1.00 0.00 N ATOM 284 CA GLU A 399 1.483 15.026 3.552 1.00 0.00 C ATOM 285 C GLU A 399 0.077 14.988 2.959 1.00 0.00 C ATOM 286 O GLU A 399 -0.385 15.963 2.367 1.00 0.00 O ATOM 287 CB GLU A 399 1.654 16.284 4.406 1.00 0.00 C ATOM 288 CG GLU A 399 0.866 16.251 5.704 1.00 0.00 C ATOM 289 CD GLU A 399 1.173 17.432 6.604 1.00 0.00 C ATOM 290 OE1 GLU A 399 1.545 18.500 6.073 1.00 0.00 O ATOM 291 OE2 GLU A 399 1.041 17.290 7.837 1.00 0.00 O ATOM 0 H GLU A 399 3.189 15.728 2.555 1.00 0.00 H new ATOM 0 HA GLU A 399 1.617 14.147 4.182 1.00 0.00 H new ATOM 0 HB2 GLU A 399 2.711 16.416 4.636 1.00 0.00 H new ATOM 0 HB3 GLU A 399 1.344 17.152 3.825 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -0.200 16.240 5.477 1.00 0.00 H new ATOM 0 HG3 GLU A 399 1.089 15.326 6.236 1.00 0.00 H new ATOM 298 N GLY A 400 -0.597 13.853 3.121 1.00 0.00 N ATOM 299 CA GLY A 400 -1.941 13.709 2.595 1.00 0.00 C ATOM 300 C GLY A 400 -2.121 12.425 1.809 1.00 0.00 C ATOM 301 O GLY A 400 -3.223 11.880 1.739 1.00 0.00 O ATOM 0 H GLY A 400 -0.236 13.032 3.607 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -2.655 13.730 3.419 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -2.170 14.560 1.953 1.00 0.00 H new ATOM 305 N ALA A 401 -1.036 11.941 1.213 1.00 0.00 N ATOM 306 CA ALA A 401 -1.079 10.713 0.427 1.00 0.00 C ATOM 307 C ALA A 401 -0.605 9.519 1.249 1.00 0.00 C ATOM 308 O ALA A 401 0.480 9.545 1.828 1.00 0.00 O ATOM 309 CB ALA A 401 -0.235 10.861 -0.829 1.00 0.00 C ATOM 0 H ALA A 401 -0.117 12.380 1.259 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.114 10.532 0.136 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.276 9.937 -1.406 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.621 11.683 -1.432 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.798 11.069 -0.551 1.00 0.00 H new ATOM 315 N ASN A 402 -1.427 8.475 1.295 1.00 0.00 N ATOM 316 CA ASN A 402 -1.091 7.272 2.048 1.00 0.00 C ATOM 317 C ASN A 402 -1.891 6.075 1.543 1.00 0.00 C ATOM 318 O ASN A 402 -2.889 6.233 0.841 1.00 0.00 O ATOM 319 CB ASN A 402 -1.357 7.486 3.538 1.00 0.00 C ATOM 320 CG ASN A 402 -1.213 8.939 3.949 1.00 0.00 C ATOM 321 OD1 ASN A 402 -2.195 9.679 4.012 1.00 0.00 O ATOM 322 ND2 ASN A 402 0.016 9.356 4.229 1.00 0.00 N ATOM 0 H ASN A 402 -2.329 8.438 0.820 1.00 0.00 H new ATOM 0 HA ASN A 402 -0.031 7.066 1.902 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.363 7.142 3.778 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -0.665 6.877 4.119 1.00 0.00 H new ATOM 0 HD21 ASN A 402 0.175 10.324 4.509 1.00 0.00 H new ATOM 0 HD22 ASN A 402 0.801 8.709 4.164 1.00 0.00 H new ATOM 329 N LEU A 403 -1.444 4.877 1.907 1.00 0.00 N ATOM 330 CA LEU A 403 -2.119 3.652 1.493 1.00 0.00 C ATOM 331 C LEU A 403 -1.733 2.486 2.397 1.00 0.00 C ATOM 332 O LEU A 403 -0.611 1.982 2.334 1.00 0.00 O ATOM 333 CB LEU A 403 -1.772 3.322 0.040 1.00 0.00 C ATOM 334 CG LEU A 403 -2.483 4.157 -1.026 1.00 0.00 C ATOM 335 CD1 LEU A 403 -2.132 3.656 -2.418 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.989 4.128 -0.810 1.00 0.00 C ATOM 0 H LEU A 403 -0.618 4.729 2.487 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.194 3.812 1.576 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.697 3.441 -0.092 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -2.001 2.271 -0.138 1.00 0.00 H new ATOM 0 HG LEU A 403 -2.144 5.189 -0.938 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -2.647 4.262 -3.163 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -1.055 3.730 -2.571 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -2.442 2.616 -2.519 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.478 4.727 -1.578 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.346 3.100 -0.870 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -4.223 4.536 0.173 1.00 0.00 H new ATOM 348 N PHE A 404 -2.671 2.059 3.237 1.00 0.00 N ATOM 349 CA PHE A 404 -2.430 0.952 4.154 1.00 0.00 C ATOM 350 C PHE A 404 -3.266 -0.266 3.768 1.00 0.00 C ATOM 351 O PHE A 404 -4.496 -0.217 3.783 1.00 0.00 O ATOM 352 CB PHE A 404 -2.751 1.370 5.590 1.00 0.00 C ATOM 353 CG PHE A 404 -1.786 2.374 6.151 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.613 3.606 5.540 1.00 0.00 C ATOM 355 CD2 PHE A 404 -1.051 2.087 7.291 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.725 4.532 6.055 1.00 0.00 C ATOM 357 CE2 PHE A 404 -0.161 3.009 7.810 1.00 0.00 C ATOM 358 CZ PHE A 404 0.001 4.233 7.191 1.00 0.00 C ATOM 0 H PHE A 404 -3.605 2.464 3.301 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.376 0.683 4.089 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.757 1.788 5.622 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -2.753 0.485 6.226 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -2.178 3.845 4.651 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -1.175 1.132 7.779 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.599 5.488 5.569 1.00 0.00 H new ATOM 0 HE2 PHE A 404 0.407 2.773 8.698 1.00 0.00 H new ATOM 0 HZ PHE A 404 0.695 4.955 7.595 1.00 0.00 H new ATOM 368 N ILE A 405 -2.588 -1.355 3.422 1.00 0.00 N ATOM 369 CA ILE A 405 -3.268 -2.585 3.032 1.00 0.00 C ATOM 370 C ILE A 405 -3.504 -3.488 4.238 1.00 0.00 C ATOM 371 O ILE A 405 -2.615 -3.679 5.068 1.00 0.00 O ATOM 372 CB ILE A 405 -2.463 -3.361 1.973 1.00 0.00 C ATOM 373 CG1 ILE A 405 -1.882 -2.399 0.936 1.00 0.00 C ATOM 374 CG2 ILE A 405 -3.342 -4.406 1.301 1.00 0.00 C ATOM 375 CD1 ILE A 405 -2.729 -1.166 0.714 1.00 0.00 C ATOM 0 H ILE A 405 -1.570 -1.411 3.404 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.228 -2.294 2.606 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.638 -3.872 2.468 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -0.886 -2.093 1.255 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -1.766 -2.926 -0.011 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.759 -4.946 0.555 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -3.712 -5.106 2.050 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -4.186 -3.915 0.816 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -2.256 -0.529 -0.034 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -3.718 -1.462 0.365 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -2.824 -0.616 1.651 1.00 0.00 H new ATOM 387 N TYR A 406 -4.708 -4.042 4.329 1.00 0.00 N ATOM 388 CA TYR A 406 -5.062 -4.925 5.433 1.00 0.00 C ATOM 389 C TYR A 406 -5.602 -6.254 4.916 1.00 0.00 C ATOM 390 O TYR A 406 -6.219 -6.317 3.852 1.00 0.00 O ATOM 391 CB TYR A 406 -6.101 -4.256 6.335 1.00 0.00 C ATOM 392 CG TYR A 406 -5.639 -2.940 6.919 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.714 -2.904 7.954 1.00 0.00 C ATOM 394 CD2 TYR A 406 -6.130 -1.733 6.436 1.00 0.00 C ATOM 395 CE1 TYR A 406 -4.289 -1.704 8.491 1.00 0.00 C ATOM 396 CE2 TYR A 406 -5.710 -0.529 6.966 1.00 0.00 C ATOM 397 CZ TYR A 406 -4.789 -0.518 7.993 1.00 0.00 C ATOM 398 OH TYR A 406 -4.370 0.679 8.524 1.00 0.00 O ATOM 0 H TYR A 406 -5.455 -3.895 3.651 1.00 0.00 H new ATOM 0 HA TYR A 406 -4.160 -5.121 6.012 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -7.013 -4.089 5.762 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -6.355 -4.936 7.148 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -4.320 -3.830 8.346 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -6.852 -1.737 5.633 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -3.569 -1.694 9.296 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -6.101 0.400 6.578 1.00 0.00 H new ATOM 0 HH TYR A 406 -4.817 1.417 8.060 1.00 0.00 H new ATOM 408 N HIS A 407 -5.365 -7.318 5.677 1.00 0.00 N ATOM 409 CA HIS A 407 -5.827 -8.649 5.298 1.00 0.00 C ATOM 410 C HIS A 407 -5.020 -9.190 4.122 1.00 0.00 C ATOM 411 O HIS A 407 -5.582 -9.575 3.095 1.00 0.00 O ATOM 412 CB HIS A 407 -7.313 -8.612 4.938 1.00 0.00 C ATOM 413 CG HIS A 407 -8.127 -7.742 5.846 1.00 0.00 C ATOM 414 ND1 HIS A 407 -8.349 -6.406 5.829 1.00 0.00 N flip ATOM 415 CD2 HIS A 407 -8.829 -8.231 6.927 1.00 0.00 C flip ATOM 416 CE1 HIS A 407 -9.172 -6.116 6.887 1.00 0.00 C flip ATOM 417 NE2 HIS A 407 -9.448 -7.235 7.534 1.00 0.00 N flip ATOM 0 H HIS A 407 -4.856 -7.284 6.560 1.00 0.00 H new ATOM 0 HA HIS A 407 -5.683 -9.313 6.150 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.422 -8.256 3.913 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.711 -9.626 4.967 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -8.867 -9.267 7.230 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -9.535 -5.133 7.149 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -10.039 -7.316 8.362 1.00 0.00 H new ATOM 425 N LEU A 408 -3.702 -9.215 4.278 1.00 0.00 N ATOM 426 CA LEU A 408 -2.817 -9.709 3.228 1.00 0.00 C ATOM 427 C LEU A 408 -2.371 -11.138 3.519 1.00 0.00 C ATOM 428 O LEU A 408 -1.950 -11.470 4.627 1.00 0.00 O ATOM 429 CB LEU A 408 -1.594 -8.798 3.095 1.00 0.00 C ATOM 430 CG LEU A 408 -1.807 -7.498 2.320 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.649 -6.541 2.556 1.00 0.00 C ATOM 432 CD2 LEU A 408 -1.971 -7.784 0.835 1.00 0.00 C ATOM 0 H LEU A 408 -3.222 -8.899 5.121 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.370 -9.705 2.289 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -1.242 -8.547 4.096 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -0.798 -9.361 2.609 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.721 -7.026 2.682 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.818 -5.621 1.996 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.578 -6.311 3.619 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.279 -7.004 2.222 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -2.122 -6.847 0.299 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -1.075 -8.278 0.458 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.834 -8.432 0.682 1.00 0.00 H new ATOM 444 N PRO A 409 -2.463 -12.006 2.500 1.00 0.00 N ATOM 445 CA PRO A 409 -2.071 -13.413 2.620 1.00 0.00 C ATOM 446 C PRO A 409 -0.704 -13.581 3.275 1.00 0.00 C ATOM 447 O PRO A 409 -0.042 -12.598 3.609 1.00 0.00 O ATOM 448 CB PRO A 409 -2.032 -13.896 1.169 1.00 0.00 C ATOM 449 CG PRO A 409 -2.999 -13.018 0.451 1.00 0.00 C ATOM 450 CD PRO A 409 -2.955 -11.679 1.152 1.00 0.00 C ATOM 0 HA PRO A 409 -2.759 -13.975 3.252 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -1.030 -13.808 0.749 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -2.318 -14.945 1.093 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -2.727 -12.916 -0.599 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -4.004 -13.440 0.480 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -2.291 -10.982 0.642 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.940 -11.213 1.187 1.00 0.00 H new ATOM 458 N GLN A 410 -0.289 -14.830 3.455 1.00 0.00 N ATOM 459 CA GLN A 410 1.000 -15.124 4.070 1.00 0.00 C ATOM 460 C GLN A 410 2.107 -15.169 3.021 1.00 0.00 C ATOM 461 O GLN A 410 3.220 -14.704 3.261 1.00 0.00 O ATOM 462 CB GLN A 410 0.938 -16.456 4.821 1.00 0.00 C ATOM 463 CG GLN A 410 1.937 -16.557 5.962 1.00 0.00 C ATOM 464 CD GLN A 410 1.797 -15.427 6.963 1.00 0.00 C ATOM 465 OE1 GLN A 410 0.774 -14.742 7.003 1.00 0.00 O ATOM 466 NE2 GLN A 410 2.827 -15.225 7.776 1.00 0.00 N ATOM 0 H GLN A 410 -0.826 -15.654 3.184 1.00 0.00 H new ATOM 0 HA GLN A 410 1.227 -14.326 4.777 1.00 0.00 H new ATOM 0 HB2 GLN A 410 -0.068 -16.594 5.217 1.00 0.00 H new ATOM 0 HB3 GLN A 410 1.119 -17.269 4.118 1.00 0.00 H new ATOM 0 HG2 GLN A 410 1.802 -17.510 6.474 1.00 0.00 H new ATOM 0 HG3 GLN A 410 2.948 -16.554 5.556 1.00 0.00 H new ATOM 0 HE21 GLN A 410 3.655 -15.817 7.707 1.00 0.00 H new ATOM 0 HE22 GLN A 410 2.791 -14.478 8.469 1.00 0.00 H new ATOM 475 N GLU A 411 1.791 -15.733 1.859 1.00 0.00 N ATOM 476 CA GLU A 411 2.760 -15.839 0.774 1.00 0.00 C ATOM 477 C GLU A 411 3.242 -14.458 0.339 1.00 0.00 C ATOM 478 O GLU A 411 4.412 -14.274 0.001 1.00 0.00 O ATOM 479 CB GLU A 411 2.146 -16.576 -0.417 1.00 0.00 C ATOM 480 CG GLU A 411 0.902 -15.904 -0.974 1.00 0.00 C ATOM 481 CD GLU A 411 0.114 -16.810 -1.900 1.00 0.00 C ATOM 482 OE1 GLU A 411 0.728 -17.414 -2.804 1.00 0.00 O ATOM 483 OE2 GLU A 411 -1.117 -16.915 -1.720 1.00 0.00 O ATOM 0 H GLU A 411 0.873 -16.123 1.645 1.00 0.00 H new ATOM 0 HA GLU A 411 3.617 -16.405 1.139 1.00 0.00 H new ATOM 0 HB2 GLU A 411 2.891 -16.654 -1.208 1.00 0.00 H new ATOM 0 HB3 GLU A 411 1.895 -17.592 -0.114 1.00 0.00 H new ATOM 0 HG2 GLU A 411 0.263 -15.590 -0.149 1.00 0.00 H new ATOM 0 HG3 GLU A 411 1.192 -15.002 -1.514 1.00 0.00 H new ATOM 490 N PHE A 412 2.332 -13.490 0.348 1.00 0.00 N ATOM 491 CA PHE A 412 2.662 -12.125 -0.047 1.00 0.00 C ATOM 492 C PHE A 412 3.853 -11.601 0.751 1.00 0.00 C ATOM 493 O PHE A 412 4.077 -12.005 1.892 1.00 0.00 O ATOM 494 CB PHE A 412 1.455 -11.206 0.154 1.00 0.00 C ATOM 495 CG PHE A 412 0.537 -11.157 -1.034 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.173 -12.280 -1.424 1.00 0.00 C ATOM 497 CD2 PHE A 412 0.383 -9.986 -1.758 1.00 0.00 C ATOM 498 CE1 PHE A 412 -1.021 -12.237 -2.516 1.00 0.00 C ATOM 499 CE2 PHE A 412 -0.462 -9.937 -2.850 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.165 -11.064 -3.231 1.00 0.00 C ATOM 0 H PHE A 412 1.360 -13.625 0.625 1.00 0.00 H new ATOM 0 HA PHE A 412 2.930 -12.134 -1.103 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.892 -11.543 1.025 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.808 -10.198 0.373 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -0.063 -13.200 -0.869 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.930 -9.102 -1.466 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.570 -13.120 -2.809 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -0.573 -9.018 -3.406 1.00 0.00 H new ATOM 0 HZ PHE A 412 -1.825 -11.028 -4.085 1.00 0.00 H new ATOM 510 N GLY A 413 4.616 -10.698 0.141 1.00 0.00 N ATOM 511 CA GLY A 413 5.774 -10.134 0.808 1.00 0.00 C ATOM 512 C GLY A 413 5.906 -8.642 0.578 1.00 0.00 C ATOM 513 O GLY A 413 4.904 -7.930 0.487 1.00 0.00 O ATOM 0 H GLY A 413 4.452 -10.348 -0.803 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.704 -10.329 1.878 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.674 -10.634 0.452 1.00 0.00 H new ATOM 517 N ASP A 414 7.141 -8.165 0.486 1.00 0.00 N ATOM 518 CA ASP A 414 7.400 -6.747 0.266 1.00 0.00 C ATOM 519 C ASP A 414 7.225 -6.383 -1.204 1.00 0.00 C ATOM 520 O ASP A 414 6.395 -5.542 -1.550 1.00 0.00 O ATOM 521 CB ASP A 414 8.814 -6.387 0.729 1.00 0.00 C ATOM 522 CG ASP A 414 9.114 -6.895 2.125 1.00 0.00 C ATOM 523 OD1 ASP A 414 8.531 -6.358 3.090 1.00 0.00 O ATOM 524 OD2 ASP A 414 9.931 -7.831 2.252 1.00 0.00 O ATOM 0 H ASP A 414 7.980 -8.740 0.560 1.00 0.00 H new ATOM 0 HA ASP A 414 6.678 -6.177 0.850 1.00 0.00 H new ATOM 0 HB2 ASP A 414 9.539 -6.804 0.030 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.936 -5.304 0.706 1.00 0.00 H new ATOM 529 N GLN A 415 8.010 -7.023 -2.064 1.00 0.00 N ATOM 530 CA GLN A 415 7.942 -6.766 -3.498 1.00 0.00 C ATOM 531 C GLN A 415 6.538 -7.028 -4.032 1.00 0.00 C ATOM 532 O GLN A 415 5.936 -6.166 -4.672 1.00 0.00 O ATOM 533 CB GLN A 415 8.955 -7.637 -4.243 1.00 0.00 C ATOM 534 CG GLN A 415 10.397 -7.200 -4.042 1.00 0.00 C ATOM 535 CD GLN A 415 10.758 -5.980 -4.867 1.00 0.00 C ATOM 536 OE1 GLN A 415 9.888 -5.200 -5.256 1.00 0.00 O ATOM 537 NE2 GLN A 415 12.047 -5.808 -5.137 1.00 0.00 N ATOM 0 H GLN A 415 8.700 -7.723 -1.793 1.00 0.00 H new ATOM 0 HA GLN A 415 8.184 -5.717 -3.665 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.847 -8.670 -3.911 1.00 0.00 H new ATOM 0 HB3 GLN A 415 8.724 -7.619 -5.308 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.563 -6.982 -2.987 1.00 0.00 H new ATOM 0 HG3 GLN A 415 11.062 -8.022 -4.306 1.00 0.00 H new ATOM 0 HE21 GLN A 415 12.734 -6.480 -4.794 1.00 0.00 H new ATOM 0 HE22 GLN A 415 12.350 -5.004 -5.687 1.00 0.00 H new ATOM 546 N ASP A 416 6.023 -8.223 -3.765 1.00 0.00 N ATOM 547 CA ASP A 416 4.689 -8.599 -4.218 1.00 0.00 C ATOM 548 C ASP A 416 3.724 -7.423 -4.101 1.00 0.00 C ATOM 549 O ASP A 416 3.011 -7.094 -5.051 1.00 0.00 O ATOM 550 CB ASP A 416 4.167 -9.785 -3.406 1.00 0.00 C ATOM 551 CG ASP A 416 5.121 -10.963 -3.424 1.00 0.00 C ATOM 552 OD1 ASP A 416 5.617 -11.308 -4.517 1.00 0.00 O ATOM 553 OD2 ASP A 416 5.371 -11.541 -2.345 1.00 0.00 O ATOM 0 H ASP A 416 6.509 -8.948 -3.237 1.00 0.00 H new ATOM 0 HA ASP A 416 4.756 -8.888 -5.267 1.00 0.00 H new ATOM 0 HB2 ASP A 416 4.001 -9.471 -2.375 1.00 0.00 H new ATOM 0 HB3 ASP A 416 3.201 -10.097 -3.804 1.00 0.00 H new ATOM 558 N LEU A 417 3.706 -6.792 -2.933 1.00 0.00 N ATOM 559 CA LEU A 417 2.828 -5.653 -2.691 1.00 0.00 C ATOM 560 C LEU A 417 3.120 -4.523 -3.672 1.00 0.00 C ATOM 561 O LEU A 417 2.210 -3.981 -4.301 1.00 0.00 O ATOM 562 CB LEU A 417 2.993 -5.152 -1.255 1.00 0.00 C ATOM 563 CG LEU A 417 2.081 -3.998 -0.837 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.637 -4.465 -0.746 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.538 -3.410 0.489 1.00 0.00 C ATOM 0 H LEU A 417 4.290 -7.050 -2.138 1.00 0.00 H new ATOM 0 HA LEU A 417 1.799 -5.981 -2.839 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.821 -5.988 -0.578 1.00 0.00 H new ATOM 0 HB3 LEU A 417 4.028 -4.839 -1.118 1.00 0.00 H new ATOM 0 HG LEU A 417 2.142 -3.219 -1.597 1.00 0.00 H new ATOM 0 HD11 LEU A 417 0.003 -3.630 -0.447 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.313 -4.837 -1.718 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.558 -5.263 -0.007 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.877 -2.590 0.770 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.508 -4.181 1.259 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.557 -3.037 0.389 1.00 0.00 H new ATOM 577 N LEU A 418 4.395 -4.172 -3.801 1.00 0.00 N ATOM 578 CA LEU A 418 4.808 -3.107 -4.707 1.00 0.00 C ATOM 579 C LEU A 418 4.352 -3.398 -6.134 1.00 0.00 C ATOM 580 O LEU A 418 3.655 -2.592 -6.749 1.00 0.00 O ATOM 581 CB LEU A 418 6.329 -2.941 -4.671 1.00 0.00 C ATOM 582 CG LEU A 418 6.900 -1.806 -5.522 1.00 0.00 C ATOM 583 CD1 LEU A 418 6.403 -0.459 -5.021 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.421 -1.850 -5.517 1.00 0.00 C ATOM 0 H LEU A 418 5.161 -4.610 -3.289 1.00 0.00 H new ATOM 0 HA LEU A 418 4.339 -2.181 -4.376 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.633 -2.781 -3.636 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.784 -3.877 -4.996 1.00 0.00 H new ATOM 0 HG LEU A 418 6.555 -1.938 -6.547 1.00 0.00 H new ATOM 0 HD11 LEU A 418 6.820 0.336 -5.639 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.315 -0.429 -5.077 1.00 0.00 H new ATOM 0 HD13 LEU A 418 6.717 -0.317 -3.987 1.00 0.00 H new ATOM 0 HD21 LEU A 418 8.811 -1.035 -6.127 1.00 0.00 H new ATOM 0 HD22 LEU A 418 8.785 -1.744 -4.495 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.759 -2.803 -5.925 1.00 0.00 H new ATOM 596 N GLN A 419 4.747 -4.557 -6.651 1.00 0.00 N ATOM 597 CA GLN A 419 4.376 -4.955 -8.003 1.00 0.00 C ATOM 598 C GLN A 419 2.860 -5.043 -8.150 1.00 0.00 C ATOM 599 O GLN A 419 2.339 -5.146 -9.259 1.00 0.00 O ATOM 600 CB GLN A 419 5.012 -6.301 -8.354 1.00 0.00 C ATOM 601 CG GLN A 419 6.529 -6.302 -8.253 1.00 0.00 C ATOM 602 CD GLN A 419 7.106 -7.700 -8.142 1.00 0.00 C ATOM 603 OE1 GLN A 419 7.382 -8.185 -7.045 1.00 0.00 O ATOM 604 NE2 GLN A 419 7.292 -8.356 -9.282 1.00 0.00 N ATOM 0 H GLN A 419 5.323 -5.236 -6.154 1.00 0.00 H new ATOM 0 HA GLN A 419 4.746 -4.195 -8.691 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.611 -7.067 -7.690 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.724 -6.576 -9.368 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.948 -5.809 -9.130 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.832 -5.718 -7.384 1.00 0.00 H new ATOM 0 HE21 GLN A 419 7.049 -7.916 -10.169 1.00 0.00 H new ATOM 0 HE22 GLN A 419 7.678 -9.300 -9.270 1.00 0.00 H new ATOM 613 N MET A 420 2.159 -5.001 -7.021 1.00 0.00 N ATOM 614 CA MET A 420 0.703 -5.074 -7.024 1.00 0.00 C ATOM 615 C MET A 420 0.088 -3.678 -7.049 1.00 0.00 C ATOM 616 O MET A 420 -1.053 -3.499 -7.475 1.00 0.00 O ATOM 617 CB MET A 420 0.206 -5.842 -5.797 1.00 0.00 C ATOM 618 CG MET A 420 -1.298 -5.764 -5.599 1.00 0.00 C ATOM 619 SD MET A 420 -1.809 -6.285 -3.951 1.00 0.00 S ATOM 620 CE MET A 420 -2.690 -7.798 -4.332 1.00 0.00 C ATOM 0 H MET A 420 2.576 -4.917 -6.094 1.00 0.00 H new ATOM 0 HA MET A 420 0.393 -5.604 -7.925 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.498 -6.888 -5.891 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.702 -5.451 -4.909 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.631 -4.740 -5.772 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.791 -6.389 -6.343 1.00 0.00 H new ATOM 0 HE1 MET A 420 -2.992 -8.287 -3.405 1.00 0.00 H new ATOM 0 HE2 MET A 420 -3.575 -7.564 -4.924 1.00 0.00 H new ATOM 0 HE3 MET A 420 -2.040 -8.465 -4.899 1.00 0.00 H new ATOM 630 N PHE A 421 0.850 -2.693 -6.586 1.00 0.00 N ATOM 631 CA PHE A 421 0.380 -1.313 -6.554 1.00 0.00 C ATOM 632 C PHE A 421 1.122 -0.461 -7.579 1.00 0.00 C ATOM 633 O PHE A 421 0.956 0.758 -7.625 1.00 0.00 O ATOM 634 CB PHE A 421 0.563 -0.722 -5.154 1.00 0.00 C ATOM 635 CG PHE A 421 -0.504 -1.138 -4.183 1.00 0.00 C ATOM 636 CD1 PHE A 421 -0.752 -2.480 -3.938 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.261 -0.188 -3.516 1.00 0.00 C ATOM 638 CE1 PHE A 421 -1.733 -2.866 -3.045 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.243 -0.569 -2.622 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.480 -1.909 -2.386 1.00 0.00 C ATOM 0 H PHE A 421 1.796 -2.825 -6.228 1.00 0.00 H new ATOM 0 HA PHE A 421 -0.680 -1.311 -6.806 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.535 -1.025 -4.765 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.573 0.366 -5.226 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.172 -3.232 -4.451 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -1.081 0.861 -3.697 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -1.916 -3.915 -2.862 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -2.825 0.181 -2.108 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.248 -2.208 -1.688 1.00 0.00 H new ATOM 650 N MET A 422 1.941 -1.111 -8.399 1.00 0.00 N ATOM 651 CA MET A 422 2.708 -0.414 -9.425 1.00 0.00 C ATOM 652 C MET A 422 1.816 -0.022 -10.598 1.00 0.00 C ATOM 653 O MET A 422 1.864 1.102 -11.098 1.00 0.00 O ATOM 654 CB MET A 422 3.860 -1.292 -9.915 1.00 0.00 C ATOM 655 CG MET A 422 5.164 -1.055 -9.170 1.00 0.00 C ATOM 656 SD MET A 422 6.605 -1.626 -10.094 1.00 0.00 S ATOM 657 CE MET A 422 7.421 -2.635 -8.859 1.00 0.00 C ATOM 0 H MET A 422 2.091 -2.120 -8.373 1.00 0.00 H new ATOM 0 HA MET A 422 3.117 0.495 -8.984 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.577 -2.340 -9.811 1.00 0.00 H new ATOM 0 HB3 MET A 422 4.019 -1.108 -10.978 1.00 0.00 H new ATOM 0 HG2 MET A 422 5.270 0.009 -8.960 1.00 0.00 H new ATOM 0 HG3 MET A 422 5.127 -1.567 -8.209 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.052 -3.374 -9.352 1.00 0.00 H new ATOM 0 HE2 MET A 422 8.036 -2.001 -8.220 1.00 0.00 H new ATOM 0 HE3 MET A 422 6.672 -3.144 -8.252 1.00 0.00 H new ATOM 667 N PRO A 423 0.982 -0.970 -11.051 1.00 0.00 N ATOM 668 CA PRO A 423 0.063 -0.747 -12.172 1.00 0.00 C ATOM 669 C PRO A 423 -0.719 0.555 -12.030 1.00 0.00 C ATOM 670 O PRO A 423 -0.825 1.334 -12.978 1.00 0.00 O ATOM 671 CB PRO A 423 -0.881 -1.949 -12.101 1.00 0.00 C ATOM 672 CG PRO A 423 -0.087 -3.016 -11.431 1.00 0.00 C ATOM 673 CD PRO A 423 0.872 -2.333 -10.505 1.00 0.00 C ATOM 0 HA PRO A 423 0.591 -0.659 -13.121 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -1.782 -1.712 -11.535 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.202 -2.260 -13.095 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.739 -3.693 -10.880 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.448 -3.617 -12.166 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.500 -2.324 -9.480 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.839 -2.836 -10.489 1.00 0.00 H new ATOM 681 N PHE A 424 -1.263 0.786 -10.840 1.00 0.00 N ATOM 682 CA PHE A 424 -2.036 1.994 -10.574 1.00 0.00 C ATOM 683 C PHE A 424 -1.188 3.242 -10.801 1.00 0.00 C ATOM 684 O PHE A 424 -1.685 4.267 -11.268 1.00 0.00 O ATOM 685 CB PHE A 424 -2.568 1.978 -9.140 1.00 0.00 C ATOM 686 CG PHE A 424 -3.693 1.006 -8.928 1.00 0.00 C ATOM 687 CD1 PHE A 424 -5.007 1.388 -9.148 1.00 0.00 C ATOM 688 CD2 PHE A 424 -3.436 -0.290 -8.510 1.00 0.00 C ATOM 689 CE1 PHE A 424 -6.044 0.495 -8.954 1.00 0.00 C ATOM 690 CE2 PHE A 424 -4.470 -1.187 -8.315 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.775 -0.794 -8.536 1.00 0.00 C ATOM 0 H PHE A 424 -1.183 0.153 -10.044 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.878 2.018 -11.266 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -1.752 1.730 -8.461 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -2.909 2.979 -8.876 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -5.223 2.395 -9.475 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -2.417 -0.603 -8.335 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -7.064 0.805 -9.129 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -4.257 -2.195 -7.990 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.584 -1.493 -8.382 1.00 0.00 H new ATOM 701 N GLY A 425 0.095 3.149 -10.466 1.00 0.00 N ATOM 702 CA GLY A 425 0.991 4.277 -10.638 1.00 0.00 C ATOM 703 C GLY A 425 2.360 4.027 -10.038 1.00 0.00 C ATOM 704 O GLY A 425 2.666 2.914 -9.615 1.00 0.00 O ATOM 0 H GLY A 425 0.530 2.312 -10.078 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.098 4.493 -11.701 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.551 5.160 -10.175 1.00 0.00 H new ATOM 708 N ASN A 426 3.188 5.067 -10.003 1.00 0.00 N ATOM 709 CA ASN A 426 4.533 4.954 -9.451 1.00 0.00 C ATOM 710 C ASN A 426 4.508 5.059 -7.929 1.00 0.00 C ATOM 711 O ASN A 426 4.385 6.150 -7.374 1.00 0.00 O ATOM 712 CB ASN A 426 5.438 6.042 -10.035 1.00 0.00 C ATOM 713 CG ASN A 426 5.390 6.083 -11.550 1.00 0.00 C ATOM 714 OD1 ASN A 426 6.140 5.377 -12.225 1.00 0.00 O ATOM 715 ND2 ASN A 426 4.506 6.913 -12.091 1.00 0.00 N ATOM 0 H ASN A 426 2.951 5.996 -10.350 1.00 0.00 H new ATOM 0 HA ASN A 426 4.930 3.976 -9.722 1.00 0.00 H new ATOM 0 HB2 ASN A 426 5.138 7.012 -9.638 1.00 0.00 H new ATOM 0 HB3 ASN A 426 6.464 5.869 -9.711 1.00 0.00 H new ATOM 0 HD21 ASN A 426 4.428 6.985 -13.105 1.00 0.00 H new ATOM 0 HD22 ASN A 426 3.905 7.479 -11.492 1.00 0.00 H new ATOM 722 N VAL A 427 4.628 3.917 -7.262 1.00 0.00 N ATOM 723 CA VAL A 427 4.621 3.879 -5.804 1.00 0.00 C ATOM 724 C VAL A 427 5.922 4.431 -5.233 1.00 0.00 C ATOM 725 O VAL A 427 7.010 4.089 -5.698 1.00 0.00 O ATOM 726 CB VAL A 427 4.411 2.446 -5.280 1.00 0.00 C ATOM 727 CG1 VAL A 427 4.371 2.434 -3.759 1.00 0.00 C ATOM 728 CG2 VAL A 427 3.138 1.849 -5.859 1.00 0.00 C ATOM 0 H VAL A 427 4.731 3.005 -7.707 1.00 0.00 H new ATOM 0 HA VAL A 427 3.790 4.503 -5.476 1.00 0.00 H new ATOM 0 HB VAL A 427 5.252 1.833 -5.602 1.00 0.00 H new ATOM 0 HG11 VAL A 427 4.222 1.413 -3.407 1.00 0.00 H new ATOM 0 HG12 VAL A 427 5.312 2.819 -3.367 1.00 0.00 H new ATOM 0 HG13 VAL A 427 3.550 3.061 -3.412 1.00 0.00 H new ATOM 0 HG21 VAL A 427 3.005 0.836 -5.478 1.00 0.00 H new ATOM 0 HG22 VAL A 427 2.284 2.461 -5.568 1.00 0.00 H new ATOM 0 HG23 VAL A 427 3.211 1.821 -6.946 1.00 0.00 H new ATOM 738 N VAL A 428 5.804 5.288 -4.225 1.00 0.00 N ATOM 739 CA VAL A 428 6.971 5.888 -3.589 1.00 0.00 C ATOM 740 C VAL A 428 7.623 4.917 -2.610 1.00 0.00 C ATOM 741 O VAL A 428 8.838 4.717 -2.635 1.00 0.00 O ATOM 742 CB VAL A 428 6.600 7.181 -2.840 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.688 7.553 -1.844 1.00 0.00 C ATOM 744 CG2 VAL A 428 6.358 8.315 -3.825 1.00 0.00 C ATOM 0 H VAL A 428 4.911 5.583 -3.830 1.00 0.00 H new ATOM 0 HA VAL A 428 7.677 6.127 -4.385 1.00 0.00 H new ATOM 0 HB VAL A 428 5.678 7.007 -2.286 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.408 8.469 -1.324 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.809 6.748 -1.120 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.628 7.709 -2.373 1.00 0.00 H new ATOM 0 HG21 VAL A 428 6.097 9.222 -3.279 1.00 0.00 H new ATOM 0 HG22 VAL A 428 7.262 8.490 -4.408 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.541 8.047 -4.495 1.00 0.00 H new ATOM 754 N SER A 429 6.808 4.314 -1.751 1.00 0.00 N ATOM 755 CA SER A 429 7.306 3.366 -0.761 1.00 0.00 C ATOM 756 C SER A 429 6.279 2.269 -0.495 1.00 0.00 C ATOM 757 O SER A 429 5.075 2.521 -0.485 1.00 0.00 O ATOM 758 CB SER A 429 7.646 4.089 0.543 1.00 0.00 C ATOM 759 OG SER A 429 8.189 5.373 0.288 1.00 0.00 O ATOM 0 H SER A 429 5.800 4.465 -1.720 1.00 0.00 H new ATOM 0 HA SER A 429 8.210 2.905 -1.158 1.00 0.00 H new ATOM 0 HB2 SER A 429 6.748 4.185 1.154 1.00 0.00 H new ATOM 0 HB3 SER A 429 8.359 3.496 1.116 1.00 0.00 H new ATOM 0 HG SER A 429 7.647 6.053 0.740 1.00 0.00 H new ATOM 765 N ALA A 430 6.765 1.052 -0.280 1.00 0.00 N ATOM 766 CA ALA A 430 5.892 -0.084 -0.011 1.00 0.00 C ATOM 767 C ALA A 430 6.614 -1.153 0.802 1.00 0.00 C ATOM 768 O ALA A 430 7.599 -1.735 0.347 1.00 0.00 O ATOM 769 CB ALA A 430 5.375 -0.671 -1.316 1.00 0.00 C ATOM 0 H ALA A 430 7.760 0.827 -0.287 1.00 0.00 H new ATOM 0 HA ALA A 430 5.046 0.271 0.577 1.00 0.00 H new ATOM 0 HB1 ALA A 430 4.724 -1.519 -1.101 1.00 0.00 H new ATOM 0 HB2 ALA A 430 4.814 0.089 -1.860 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.216 -1.004 -1.924 1.00 0.00 H new ATOM 775 N LYS A 431 6.119 -1.405 2.009 1.00 0.00 N ATOM 776 CA LYS A 431 6.716 -2.404 2.887 1.00 0.00 C ATOM 777 C LYS A 431 5.665 -3.019 3.805 1.00 0.00 C ATOM 778 O LYS A 431 4.809 -2.318 4.344 1.00 0.00 O ATOM 779 CB LYS A 431 7.833 -1.776 3.722 1.00 0.00 C ATOM 780 CG LYS A 431 8.176 -2.567 4.974 1.00 0.00 C ATOM 781 CD LYS A 431 7.337 -2.123 6.160 1.00 0.00 C ATOM 782 CE LYS A 431 8.058 -2.370 7.477 1.00 0.00 C ATOM 783 NZ LYS A 431 7.168 -2.142 8.648 1.00 0.00 N ATOM 0 H LYS A 431 5.306 -0.931 2.401 1.00 0.00 H new ATOM 0 HA LYS A 431 7.136 -3.194 2.265 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.727 -1.682 3.106 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.537 -0.767 4.010 1.00 0.00 H new ATOM 0 HG2 LYS A 431 8.015 -3.629 4.790 1.00 0.00 H new ATOM 0 HG3 LYS A 431 9.233 -2.441 5.207 1.00 0.00 H new ATOM 0 HD2 LYS A 431 7.104 -1.063 6.065 1.00 0.00 H new ATOM 0 HD3 LYS A 431 6.388 -2.660 6.157 1.00 0.00 H new ATOM 0 HE2 LYS A 431 8.433 -3.393 7.499 1.00 0.00 H new ATOM 0 HE3 LYS A 431 8.924 -1.712 7.546 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 7.449 -1.266 9.133 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 6.183 -2.058 8.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 7.249 -2.943 9.307 1.00 0.00 H new ATOM 797 N VAL A 432 5.736 -4.336 3.981 1.00 0.00 N ATOM 798 CA VAL A 432 4.792 -5.045 4.836 1.00 0.00 C ATOM 799 C VAL A 432 5.267 -5.059 6.285 1.00 0.00 C ATOM 800 O VAL A 432 6.462 -4.947 6.559 1.00 0.00 O ATOM 801 CB VAL A 432 4.585 -6.495 4.362 1.00 0.00 C ATOM 802 CG1 VAL A 432 3.586 -7.213 5.257 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.128 -6.520 2.911 1.00 0.00 C ATOM 0 H VAL A 432 6.438 -4.932 3.542 1.00 0.00 H new ATOM 0 HA VAL A 432 3.844 -4.511 4.772 1.00 0.00 H new ATOM 0 HB VAL A 432 5.538 -7.020 4.429 1.00 0.00 H new ATOM 0 HG11 VAL A 432 3.453 -8.236 4.906 1.00 0.00 H new ATOM 0 HG12 VAL A 432 3.959 -7.226 6.281 1.00 0.00 H new ATOM 0 HG13 VAL A 432 2.629 -6.692 5.226 1.00 0.00 H new ATOM 0 HG21 VAL A 432 3.986 -7.553 2.592 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.187 -5.979 2.817 1.00 0.00 H new ATOM 0 HG23 VAL A 432 4.883 -6.047 2.283 1.00 0.00 H new ATOM 813 N PHE A 433 4.323 -5.198 7.210 1.00 0.00 N ATOM 814 CA PHE A 433 4.645 -5.226 8.632 1.00 0.00 C ATOM 815 C PHE A 433 4.774 -6.662 9.132 1.00 0.00 C ATOM 816 O PHE A 433 4.097 -7.565 8.639 1.00 0.00 O ATOM 817 CB PHE A 433 3.571 -4.490 9.435 1.00 0.00 C ATOM 818 CG PHE A 433 3.721 -2.995 9.408 1.00 0.00 C ATOM 819 CD1 PHE A 433 4.050 -2.340 8.232 1.00 0.00 C ATOM 820 CD2 PHE A 433 3.536 -2.246 10.559 1.00 0.00 C ATOM 821 CE1 PHE A 433 4.189 -0.965 8.205 1.00 0.00 C ATOM 822 CE2 PHE A 433 3.673 -0.871 10.537 1.00 0.00 C ATOM 823 CZ PHE A 433 4.002 -0.230 9.359 1.00 0.00 C ATOM 0 H PHE A 433 3.329 -5.293 7.000 1.00 0.00 H new ATOM 0 HA PHE A 433 5.602 -4.723 8.772 1.00 0.00 H new ATOM 0 HB2 PHE A 433 2.589 -4.756 9.043 1.00 0.00 H new ATOM 0 HB3 PHE A 433 3.604 -4.832 10.469 1.00 0.00 H new ATOM 0 HD1 PHE A 433 4.199 -2.910 7.327 1.00 0.00 H new ATOM 0 HD2 PHE A 433 3.282 -2.742 11.484 1.00 0.00 H new ATOM 0 HE1 PHE A 433 4.444 -0.466 7.282 1.00 0.00 H new ATOM 0 HE2 PHE A 433 3.523 -0.298 11.440 1.00 0.00 H new ATOM 0 HZ PHE A 433 4.113 0.844 9.340 1.00 0.00 H new ATOM 983 N CYS A 443 -0.602 -9.489 8.365 1.00 0.00 N ATOM 984 CA CYS A 443 -1.631 -9.508 7.331 1.00 0.00 C ATOM 985 C CYS A 443 -1.976 -8.093 6.881 1.00 0.00 C ATOM 986 O CYS A 443 -3.123 -7.800 6.544 1.00 0.00 O ATOM 987 CB CYS A 443 -2.887 -10.213 7.847 1.00 0.00 C ATOM 988 SG CYS A 443 -3.613 -9.448 9.315 1.00 0.00 S ATOM 0 HA CYS A 443 -1.241 -10.057 6.474 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -3.633 -10.230 7.053 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -2.641 -11.250 8.075 1.00 0.00 H new ATOM 0 HG CYS A 443 -4.670 -10.114 9.673 1.00 0.00 H new ATOM 994 N PHE A 444 -0.975 -7.218 6.880 1.00 0.00 N ATOM 995 CA PHE A 444 -1.174 -5.832 6.474 1.00 0.00 C ATOM 996 C PHE A 444 0.154 -5.179 6.102 1.00 0.00 C ATOM 997 O PHE A 444 1.191 -5.478 6.691 1.00 0.00 O ATOM 998 CB PHE A 444 -1.847 -5.040 7.598 1.00 0.00 C ATOM 999 CG PHE A 444 -0.908 -4.654 8.705 1.00 0.00 C ATOM 1000 CD1 PHE A 444 -0.085 -3.545 8.577 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -0.848 -5.397 9.872 1.00 0.00 C ATOM 1002 CE1 PHE A 444 0.780 -3.188 9.594 1.00 0.00 C ATOM 1003 CE2 PHE A 444 0.015 -5.045 10.892 1.00 0.00 C ATOM 1004 CZ PHE A 444 0.829 -3.938 10.753 1.00 0.00 C ATOM 0 H PHE A 444 -0.019 -7.444 7.155 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.821 -5.826 5.597 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -2.293 -4.138 7.179 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.661 -5.634 8.013 1.00 0.00 H new ATOM 0 HD1 PHE A 444 -0.120 -2.954 7.673 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -1.484 -6.263 9.986 1.00 0.00 H new ATOM 0 HE1 PHE A 444 1.417 -2.323 9.483 1.00 0.00 H new ATOM 0 HE2 PHE A 444 0.053 -5.634 11.796 1.00 0.00 H new ATOM 0 HZ PHE A 444 1.503 -3.659 11.549 1.00 0.00 H new ATOM 1014 N GLY A 445 0.112 -4.284 5.119 1.00 0.00 N ATOM 1015 CA GLY A 445 1.318 -3.603 4.684 1.00 0.00 C ATOM 1016 C GLY A 445 1.120 -2.108 4.539 1.00 0.00 C ATOM 1017 O GLY A 445 0.011 -1.601 4.719 1.00 0.00 O ATOM 0 H GLY A 445 -0.735 -4.019 4.617 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.117 -3.793 5.401 1.00 0.00 H new ATOM 0 HA3 GLY A 445 1.641 -4.018 3.729 1.00 0.00 H new ATOM 1021 N PHE A 446 2.195 -1.399 4.216 1.00 0.00 N ATOM 1022 CA PHE A 446 2.134 0.050 4.051 1.00 0.00 C ATOM 1023 C PHE A 446 2.574 0.455 2.647 1.00 0.00 C ATOM 1024 O PHE A 446 3.505 -0.120 2.085 1.00 0.00 O ATOM 1025 CB PHE A 446 3.015 0.741 5.093 1.00 0.00 C ATOM 1026 CG PHE A 446 3.141 2.223 4.884 1.00 0.00 C ATOM 1027 CD1 PHE A 446 2.041 3.052 5.032 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.358 2.787 4.541 1.00 0.00 C ATOM 1029 CE1 PHE A 446 2.153 4.416 4.840 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.477 4.151 4.348 1.00 0.00 C ATOM 1031 CZ PHE A 446 3.373 4.966 4.499 1.00 0.00 C ATOM 0 H PHE A 446 3.119 -1.803 4.063 1.00 0.00 H new ATOM 0 HA PHE A 446 1.100 0.364 4.194 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.604 0.556 6.085 1.00 0.00 H new ATOM 0 HB3 PHE A 446 4.009 0.293 5.071 1.00 0.00 H new ATOM 0 HD1 PHE A 446 1.085 2.627 5.301 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.225 2.154 4.423 1.00 0.00 H new ATOM 0 HE1 PHE A 446 1.287 5.051 4.957 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.432 4.578 4.080 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.463 6.032 4.351 1.00 0.00 H new ATOM 1041 N VAL A 447 1.896 1.451 2.085 1.00 0.00 N ATOM 1042 CA VAL A 447 2.216 1.936 0.748 1.00 0.00 C ATOM 1043 C VAL A 447 1.919 3.425 0.617 1.00 0.00 C ATOM 1044 O VAL A 447 0.990 3.941 1.238 1.00 0.00 O ATOM 1045 CB VAL A 447 1.426 1.170 -0.330 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.811 1.655 -1.720 1.00 0.00 C ATOM 1047 CG2 VAL A 447 1.658 -0.328 -0.197 1.00 0.00 C ATOM 0 H VAL A 447 1.121 1.938 2.536 1.00 0.00 H new ATOM 0 HA VAL A 447 3.282 1.767 0.597 1.00 0.00 H new ATOM 0 HB VAL A 447 0.364 1.365 -0.184 1.00 0.00 H new ATOM 0 HG11 VAL A 447 1.243 1.103 -2.468 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.590 2.719 -1.809 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.877 1.492 -1.880 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.092 -0.854 -0.966 1.00 0.00 H new ATOM 0 HG22 VAL A 447 2.720 -0.544 -0.316 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.328 -0.661 0.787 1.00 0.00 H new ATOM 1057 N SER A 448 2.715 4.112 -0.196 1.00 0.00 N ATOM 1058 CA SER A 448 2.539 5.544 -0.407 1.00 0.00 C ATOM 1059 C SER A 448 2.817 5.919 -1.859 1.00 0.00 C ATOM 1060 O SER A 448 3.623 5.276 -2.534 1.00 0.00 O ATOM 1061 CB SER A 448 3.465 6.335 0.521 1.00 0.00 C ATOM 1062 OG SER A 448 4.805 6.292 0.062 1.00 0.00 O ATOM 0 H SER A 448 3.488 3.700 -0.719 1.00 0.00 H new ATOM 0 HA SER A 448 1.503 5.795 -0.177 1.00 0.00 H new ATOM 0 HB2 SER A 448 3.130 7.371 0.578 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.410 5.926 1.530 1.00 0.00 H new ATOM 0 HG SER A 448 5.164 5.388 0.185 1.00 0.00 H new ATOM 1068 N TYR A 449 2.145 6.961 -2.335 1.00 0.00 N ATOM 1069 CA TYR A 449 2.316 7.420 -3.708 1.00 0.00 C ATOM 1070 C TYR A 449 2.971 8.797 -3.745 1.00 0.00 C ATOM 1071 O TYR A 449 3.367 9.336 -2.710 1.00 0.00 O ATOM 1072 CB TYR A 449 0.966 7.466 -4.424 1.00 0.00 C ATOM 1073 CG TYR A 449 0.498 6.116 -4.922 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.610 4.983 -4.125 1.00 0.00 C ATOM 1075 CD2 TYR A 449 -0.054 5.974 -6.189 1.00 0.00 C ATOM 1076 CE1 TYR A 449 0.184 3.748 -4.575 1.00 0.00 C ATOM 1077 CE2 TYR A 449 -0.484 4.743 -6.646 1.00 0.00 C ATOM 1078 CZ TYR A 449 -0.362 3.634 -5.836 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.787 2.406 -6.290 1.00 0.00 O ATOM 0 H TYR A 449 1.476 7.504 -1.789 1.00 0.00 H new ATOM 0 HA TYR A 449 2.968 6.714 -4.221 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.217 7.873 -3.744 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.035 8.151 -5.269 1.00 0.00 H new ATOM 0 HD1 TYR A 449 1.037 5.069 -3.137 1.00 0.00 H new ATOM 0 HD2 TYR A 449 -0.149 6.840 -6.827 1.00 0.00 H new ATOM 0 HE1 TYR A 449 0.278 2.877 -3.943 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -0.913 4.650 -7.633 1.00 0.00 H new ATOM 0 HH TYR A 449 -0.066 1.977 -6.796 1.00 0.00 H new ATOM 1089 N ASP A 450 3.080 9.361 -4.942 1.00 0.00 N ATOM 1090 CA ASP A 450 3.684 10.676 -5.115 1.00 0.00 C ATOM 1091 C ASP A 450 2.682 11.782 -4.799 1.00 0.00 C ATOM 1092 O ASP A 450 3.061 12.923 -4.542 1.00 0.00 O ATOM 1093 CB ASP A 450 4.206 10.838 -6.544 1.00 0.00 C ATOM 1094 CG ASP A 450 3.212 10.357 -7.582 1.00 0.00 C ATOM 1095 OD1 ASP A 450 2.024 10.189 -7.232 1.00 0.00 O ATOM 1096 OD2 ASP A 450 3.619 10.149 -8.744 1.00 0.00 O ATOM 0 H ASP A 450 2.758 8.928 -5.807 1.00 0.00 H new ATOM 0 HA ASP A 450 4.519 10.758 -4.419 1.00 0.00 H new ATOM 0 HB2 ASP A 450 4.438 11.887 -6.726 1.00 0.00 H new ATOM 0 HB3 ASP A 450 5.137 10.282 -6.652 1.00 0.00 H new ATOM 1101 N ASN A 451 1.399 11.434 -4.821 1.00 0.00 N ATOM 1102 CA ASN A 451 0.340 12.397 -4.539 1.00 0.00 C ATOM 1103 C ASN A 451 -0.908 11.695 -4.014 1.00 0.00 C ATOM 1104 O ASN A 451 -1.145 10.516 -4.279 1.00 0.00 O ATOM 1105 CB ASN A 451 0.000 13.195 -5.799 1.00 0.00 C ATOM 1106 CG ASN A 451 1.231 13.552 -6.608 1.00 0.00 C ATOM 1107 OD1 ASN A 451 2.037 14.387 -6.196 1.00 0.00 O ATOM 1108 ND2 ASN A 451 1.381 12.919 -7.766 1.00 0.00 N ATOM 0 H ASN A 451 1.068 10.492 -5.031 1.00 0.00 H new ATOM 0 HA ASN A 451 0.700 13.081 -3.770 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -0.683 12.615 -6.419 1.00 0.00 H new ATOM 0 HB3 ASN A 451 -0.523 14.109 -5.517 1.00 0.00 H new ATOM 0 HD21 ASN A 451 2.190 13.117 -8.355 1.00 0.00 H new ATOM 0 HD22 ASN A 451 0.687 12.235 -8.067 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.727 12.434 -3.251 1.00 0.00 N ATOM 1116 CA PRO A 452 -2.966 11.904 -2.675 1.00 0.00 C ATOM 1117 C PRO A 452 -4.078 11.777 -3.709 1.00 0.00 C ATOM 1118 O PRO A 452 -5.122 11.181 -3.443 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.337 12.944 -1.615 1.00 0.00 C ATOM 1120 CG PRO A 452 -2.745 14.218 -2.110 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.506 13.846 -2.894 1.00 0.00 C ATOM 0 HA PRO A 452 -2.833 10.898 -2.277 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.418 13.027 -1.503 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -2.935 12.674 -0.638 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.454 14.755 -2.739 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -2.494 14.877 -1.279 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.391 14.470 -3.781 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -0.602 13.971 -2.297 1.00 0.00 H new ATOM 1129 N VAL A 453 -3.849 12.342 -4.891 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.833 12.290 -5.966 1.00 0.00 C ATOM 1131 C VAL A 453 -4.746 10.973 -6.728 1.00 0.00 C ATOM 1132 O VAL A 453 -5.740 10.489 -7.269 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.645 13.456 -6.954 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.654 13.362 -8.089 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.764 14.790 -6.233 1.00 0.00 C ATOM 0 H VAL A 453 -2.991 12.841 -5.128 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.815 12.372 -5.501 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.645 13.389 -7.382 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.506 14.194 -8.777 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.516 12.421 -8.622 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.664 13.403 -7.682 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.628 15.603 -6.947 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.750 14.870 -5.775 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -3.999 14.855 -5.459 1.00 0.00 H new ATOM 1145 N SER A 454 -3.548 10.395 -6.766 1.00 0.00 N ATOM 1146 CA SER A 454 -3.329 9.135 -7.466 1.00 0.00 C ATOM 1147 C SER A 454 -3.535 7.950 -6.526 1.00 0.00 C ATOM 1148 O SER A 454 -4.032 6.901 -6.933 1.00 0.00 O ATOM 1149 CB SER A 454 -1.918 9.093 -8.055 1.00 0.00 C ATOM 1150 OG SER A 454 -1.746 10.098 -9.039 1.00 0.00 O ATOM 0 H SER A 454 -2.715 10.780 -6.320 1.00 0.00 H new ATOM 0 HA SER A 454 -4.055 9.066 -8.276 1.00 0.00 H new ATOM 0 HB2 SER A 454 -1.185 9.229 -7.260 1.00 0.00 H new ATOM 0 HB3 SER A 454 -1.733 8.113 -8.495 1.00 0.00 H new ATOM 0 HG SER A 454 -0.836 10.051 -9.399 1.00 0.00 H new ATOM 1156 N ALA A 455 -3.151 8.127 -5.267 1.00 0.00 N ATOM 1157 CA ALA A 455 -3.295 7.075 -4.268 1.00 0.00 C ATOM 1158 C ALA A 455 -4.748 6.625 -4.152 1.00 0.00 C ATOM 1159 O ALA A 455 -5.025 5.448 -3.922 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.779 7.553 -2.919 1.00 0.00 C ATOM 0 H ALA A 455 -2.737 8.990 -4.914 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.701 6.219 -4.589 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -2.893 6.757 -2.183 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.725 7.819 -3.006 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.348 8.426 -2.600 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.670 7.569 -4.309 1.00 0.00 N ATOM 1167 CA GLN A 456 -7.094 7.268 -4.220 1.00 0.00 C ATOM 1168 C GLN A 456 -7.506 6.263 -5.291 1.00 0.00 C ATOM 1169 O GLN A 456 -8.319 5.375 -5.041 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.917 8.550 -4.362 1.00 0.00 C ATOM 1171 CG GLN A 456 -8.148 9.273 -3.045 1.00 0.00 C ATOM 1172 CD GLN A 456 -9.106 8.533 -2.133 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -8.628 8.156 -0.952 1.00 0.00 O flip ATOM 1174 NE2 GLN A 456 -10.263 8.303 -2.485 1.00 0.00 N flip ATOM 0 H GLN A 456 -5.457 8.548 -4.498 1.00 0.00 H new ATOM 0 HA GLN A 456 -7.287 6.827 -3.242 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.409 9.223 -5.052 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.882 8.305 -4.807 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -7.194 9.403 -2.534 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.541 10.270 -3.246 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.588 8.611 -3.401 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -10.897 7.804 -1.860 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.939 6.411 -6.484 1.00 0.00 N ATOM 1184 CA ALA A 457 -7.246 5.516 -7.592 1.00 0.00 C ATOM 1185 C ALA A 457 -7.177 4.057 -7.155 1.00 0.00 C ATOM 1186 O ALA A 457 -7.997 3.236 -7.566 1.00 0.00 O ATOM 1187 CB ALA A 457 -6.296 5.767 -8.753 1.00 0.00 C ATOM 0 H ALA A 457 -6.264 7.143 -6.707 1.00 0.00 H new ATOM 0 HA ALA A 457 -8.265 5.722 -7.920 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -6.537 5.091 -9.573 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.398 6.798 -9.090 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -5.270 5.592 -8.428 1.00 0.00 H new ATOM 1193 N ALA A 458 -6.192 3.741 -6.319 1.00 0.00 N ATOM 1194 CA ALA A 458 -6.017 2.380 -5.825 1.00 0.00 C ATOM 1195 C ALA A 458 -7.203 1.951 -4.967 1.00 0.00 C ATOM 1196 O ALA A 458 -7.977 1.076 -5.356 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.722 2.269 -5.034 1.00 0.00 C ATOM 0 H ALA A 458 -5.504 4.408 -5.970 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.963 1.711 -6.684 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -4.604 1.248 -4.671 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.880 2.525 -5.677 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.753 2.954 -4.187 1.00 0.00 H new ATOM 1203 N ILE A 459 -7.336 2.571 -3.799 1.00 0.00 N ATOM 1204 CA ILE A 459 -8.428 2.251 -2.888 1.00 0.00 C ATOM 1205 C ILE A 459 -9.743 2.087 -3.640 1.00 0.00 C ATOM 1206 O ILE A 459 -10.493 1.141 -3.399 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.599 3.340 -1.811 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -7.331 3.449 -0.959 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.805 3.035 -0.936 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -7.342 4.625 -0.009 1.00 0.00 C ATOM 0 H ILE A 459 -6.703 3.296 -3.462 1.00 0.00 H new ATOM 0 HA ILE A 459 -8.169 1.309 -2.405 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.766 4.297 -2.306 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -7.208 2.530 -0.386 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.466 3.532 -1.617 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.912 3.813 -0.180 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -10.703 3.002 -1.553 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -9.665 2.071 -0.447 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -6.414 4.640 0.562 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -7.434 5.551 -0.577 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -8.187 4.533 0.674 1.00 0.00 H new ATOM 1222 N GLN A 460 -10.016 3.013 -4.553 1.00 0.00 N ATOM 1223 CA GLN A 460 -11.241 2.969 -5.343 1.00 0.00 C ATOM 1224 C GLN A 460 -11.546 1.545 -5.796 1.00 0.00 C ATOM 1225 O GLN A 460 -12.684 1.084 -5.705 1.00 0.00 O ATOM 1226 CB GLN A 460 -11.123 3.889 -6.559 1.00 0.00 C ATOM 1227 CG GLN A 460 -11.288 5.363 -6.225 1.00 0.00 C ATOM 1228 CD GLN A 460 -12.553 5.643 -5.436 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -13.663 5.492 -5.947 1.00 0.00 O ATOM 1230 NE2 GLN A 460 -12.391 6.055 -4.184 1.00 0.00 N ATOM 0 H GLN A 460 -9.406 3.803 -4.764 1.00 0.00 H new ATOM 0 HA GLN A 460 -12.061 3.314 -4.714 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -10.150 3.738 -7.026 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -11.876 3.605 -7.294 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -10.424 5.701 -5.652 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -11.304 5.942 -7.149 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -11.452 6.166 -3.801 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -13.205 6.260 -3.605 1.00 0.00 H new ATOM 1239 N SER A 461 -10.522 0.853 -6.285 1.00 0.00 N ATOM 1240 CA SER A 461 -10.681 -0.518 -6.757 1.00 0.00 C ATOM 1241 C SER A 461 -10.174 -1.512 -5.718 1.00 0.00 C ATOM 1242 O SER A 461 -10.911 -2.391 -5.273 1.00 0.00 O ATOM 1243 CB SER A 461 -9.933 -0.715 -8.077 1.00 0.00 C ATOM 1244 OG SER A 461 -10.479 -1.795 -8.816 1.00 0.00 O ATOM 0 H SER A 461 -9.573 1.219 -6.365 1.00 0.00 H new ATOM 0 HA SER A 461 -11.743 -0.700 -6.919 1.00 0.00 H new ATOM 0 HB2 SER A 461 -9.986 0.199 -8.669 1.00 0.00 H new ATOM 0 HB3 SER A 461 -8.878 -0.904 -7.876 1.00 0.00 H new ATOM 0 HG SER A 461 -9.985 -1.899 -9.656 1.00 0.00 H new ATOM 1250 N MET A 462 -8.909 -1.366 -5.336 1.00 0.00 N ATOM 1251 CA MET A 462 -8.303 -2.251 -4.348 1.00 0.00 C ATOM 1252 C MET A 462 -9.251 -2.490 -3.177 1.00 0.00 C ATOM 1253 O MET A 462 -9.416 -3.621 -2.722 1.00 0.00 O ATOM 1254 CB MET A 462 -6.987 -1.657 -3.841 1.00 0.00 C ATOM 1255 CG MET A 462 -5.944 -1.469 -4.930 1.00 0.00 C ATOM 1256 SD MET A 462 -5.697 -2.957 -5.918 1.00 0.00 S ATOM 1257 CE MET A 462 -5.005 -4.065 -4.695 1.00 0.00 C ATOM 0 H MET A 462 -8.285 -0.644 -5.695 1.00 0.00 H new ATOM 0 HA MET A 462 -8.101 -3.208 -4.829 1.00 0.00 H new ATOM 0 HB2 MET A 462 -7.189 -0.693 -3.373 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.579 -2.307 -3.067 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.249 -0.651 -5.582 1.00 0.00 H new ATOM 0 HG3 MET A 462 -4.997 -1.178 -4.475 1.00 0.00 H new ATOM 0 HE1 MET A 462 -4.348 -4.783 -5.185 1.00 0.00 H new ATOM 0 HE2 MET A 462 -4.435 -3.491 -3.965 1.00 0.00 H new ATOM 0 HE3 MET A 462 -5.811 -4.597 -4.189 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.871 -1.418 -2.696 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.802 -1.513 -1.577 1.00 0.00 C ATOM 1269 C ASN A 463 -11.751 -2.694 -1.758 1.00 0.00 C ATOM 1270 O ASN A 463 -12.645 -2.661 -2.602 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.604 -0.216 -1.442 1.00 0.00 C ATOM 1272 CG ASN A 463 -12.679 -0.310 -0.377 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -13.774 -0.812 -0.627 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -12.370 0.178 0.819 1.00 0.00 N ATOM 0 H ASN A 463 -9.746 -0.474 -3.063 1.00 0.00 H new ATOM 0 HA ASN A 463 -10.223 -1.671 -0.667 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.927 0.603 -1.200 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -12.065 0.024 -2.400 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -13.054 0.145 1.575 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -11.449 0.585 0.981 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.549 -3.736 -0.957 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.395 -4.913 -1.044 1.00 0.00 C ATOM 1283 C GLY A 464 -11.969 -5.851 -2.156 1.00 0.00 C ATOM 1284 O GLY A 464 -12.783 -6.613 -2.679 1.00 0.00 O ATOM 0 H GLY A 464 -10.815 -3.786 -0.250 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.370 -5.446 -0.094 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.427 -4.604 -1.209 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.693 -5.795 -2.520 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.162 -6.645 -3.580 1.00 0.00 C ATOM 1290 C PHE A 465 -10.235 -8.116 -3.185 1.00 0.00 C ATOM 1291 O PHE A 465 -9.496 -8.572 -2.312 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.714 -6.260 -3.894 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.088 -7.110 -4.963 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.663 -8.398 -4.682 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -7.923 -6.618 -6.248 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.085 -9.182 -5.664 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -7.347 -7.397 -7.233 1.00 0.00 C ATOM 1298 CZ PHE A 465 -6.927 -8.680 -6.940 1.00 0.00 C ATOM 0 H PHE A 465 -10.007 -5.170 -2.097 1.00 0.00 H new ATOM 0 HA PHE A 465 -10.772 -6.496 -4.471 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.683 -5.216 -4.206 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.120 -6.338 -2.984 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -7.784 -8.795 -3.685 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -8.248 -5.615 -6.482 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -6.758 -10.185 -5.433 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -7.225 -7.003 -8.231 1.00 0.00 H new ATOM 0 HZ PHE A 465 -6.475 -9.290 -7.709 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.129 -8.855 -3.834 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.300 -10.274 -3.549 1.00 0.00 C ATOM 1310 C GLN A 466 -10.029 -11.051 -3.876 1.00 0.00 C ATOM 1311 O GLN A 466 -9.625 -11.137 -5.036 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.477 -10.838 -4.347 1.00 0.00 C ATOM 1313 CG GLN A 466 -13.023 -12.141 -3.787 1.00 0.00 C ATOM 1314 CD GLN A 466 -12.108 -13.320 -4.052 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -11.719 -13.574 -5.193 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -11.758 -14.049 -2.998 1.00 0.00 N ATOM 0 H GLN A 466 -11.746 -8.494 -4.561 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.507 -10.383 -2.484 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.277 -10.098 -4.370 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -12.162 -10.999 -5.378 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -13.172 -12.036 -2.712 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -14.001 -12.339 -4.226 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -12.103 -13.803 -2.070 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -11.144 -14.855 -3.116 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.404 -11.614 -2.849 1.00 0.00 N ATOM 1326 CA ILE A 467 -8.180 -12.385 -3.028 1.00 0.00 C ATOM 1327 C ILE A 467 -8.297 -13.761 -2.384 1.00 0.00 C ATOM 1328 O ILE A 467 -8.624 -13.881 -1.205 1.00 0.00 O ATOM 1329 CB ILE A 467 -6.963 -11.653 -2.432 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -5.664 -12.283 -2.940 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -7.016 -11.689 -0.912 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.439 -11.435 -2.679 1.00 0.00 C ATOM 0 H ILE A 467 -9.725 -11.551 -1.883 1.00 0.00 H new ATOM 0 HA ILE A 467 -8.034 -12.502 -4.102 1.00 0.00 H new ATOM 0 HB ILE A 467 -6.990 -10.612 -2.753 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.531 -13.255 -2.465 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -5.751 -12.461 -4.012 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -6.149 -11.168 -0.505 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -7.928 -11.201 -0.568 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -7.009 -12.725 -0.572 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.556 -11.943 -3.065 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.550 -10.472 -3.177 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.327 -11.278 -1.606 1.00 0.00 H new ATOM 1344 N GLY A 468 -8.026 -14.801 -3.168 1.00 0.00 N ATOM 1345 CA GLY A 468 -8.105 -16.157 -2.657 1.00 0.00 C ATOM 1346 C GLY A 468 -9.499 -16.516 -2.179 1.00 0.00 C ATOM 1347 O GLY A 468 -10.354 -16.901 -2.976 1.00 0.00 O ATOM 0 H GLY A 468 -7.753 -14.728 -4.148 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -7.801 -16.854 -3.437 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -7.401 -16.273 -1.833 1.00 0.00 H new ATOM 1351 N MET A 469 -9.725 -16.392 -0.876 1.00 0.00 N ATOM 1352 CA MET A 469 -11.026 -16.707 -0.294 1.00 0.00 C ATOM 1353 C MET A 469 -11.518 -15.565 0.588 1.00 0.00 C ATOM 1354 O MET A 469 -12.641 -15.594 1.091 1.00 0.00 O ATOM 1355 CB MET A 469 -10.942 -17.999 0.523 1.00 0.00 C ATOM 1356 CG MET A 469 -12.300 -18.603 0.844 1.00 0.00 C ATOM 1357 SD MET A 469 -12.173 -20.251 1.565 1.00 0.00 S ATOM 1358 CE MET A 469 -11.143 -19.918 2.991 1.00 0.00 C ATOM 0 H MET A 469 -9.026 -16.076 -0.203 1.00 0.00 H new ATOM 0 HA MET A 469 -11.737 -16.845 -1.108 1.00 0.00 H new ATOM 0 HB2 MET A 469 -10.349 -18.730 -0.027 1.00 0.00 H new ATOM 0 HB3 MET A 469 -10.414 -17.797 1.455 1.00 0.00 H new ATOM 0 HG2 MET A 469 -12.831 -17.948 1.535 1.00 0.00 H new ATOM 0 HG3 MET A 469 -12.895 -18.654 -0.068 1.00 0.00 H new ATOM 0 HE1 MET A 469 -11.190 -20.762 3.679 1.00 0.00 H new ATOM 0 HE2 MET A 469 -10.112 -19.769 2.669 1.00 0.00 H new ATOM 0 HE3 MET A 469 -11.499 -19.019 3.495 1.00 0.00 H new ATOM 1368 N LYS A 470 -10.671 -14.558 0.772 1.00 0.00 N ATOM 1369 CA LYS A 470 -11.019 -13.404 1.593 1.00 0.00 C ATOM 1370 C LYS A 470 -10.935 -12.115 0.782 1.00 0.00 C ATOM 1371 O LYS A 470 -10.540 -12.129 -0.384 1.00 0.00 O ATOM 1372 CB LYS A 470 -10.092 -13.318 2.807 1.00 0.00 C ATOM 1373 CG LYS A 470 -8.624 -13.182 2.443 1.00 0.00 C ATOM 1374 CD LYS A 470 -7.770 -12.899 3.668 1.00 0.00 C ATOM 1375 CE LYS A 470 -6.313 -13.263 3.428 1.00 0.00 C ATOM 1376 NZ LYS A 470 -6.129 -14.732 3.262 1.00 0.00 N ATOM 0 H LYS A 470 -9.737 -14.518 0.363 1.00 0.00 H new ATOM 0 HA LYS A 470 -12.046 -13.530 1.937 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.386 -12.465 3.419 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -10.225 -14.210 3.419 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.281 -14.098 1.963 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.501 -12.377 1.718 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -7.844 -11.843 3.928 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -8.152 -13.465 4.518 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -5.952 -12.749 2.537 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -5.709 -12.913 4.265 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -5.138 -14.982 3.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -6.749 -15.237 3.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -6.371 -15.004 2.288 1.00 0.00 H new ATOM 1390 N ARG A 471 -11.307 -11.003 1.408 1.00 0.00 N ATOM 1391 CA ARG A 471 -11.271 -9.705 0.744 1.00 0.00 C ATOM 1392 C ARG A 471 -10.145 -8.839 1.301 1.00 0.00 C ATOM 1393 O ARG A 471 -9.535 -9.174 2.317 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.612 -8.986 0.912 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.741 -9.606 0.105 1.00 0.00 C ATOM 1396 CD ARG A 471 -14.853 -8.604 -0.158 1.00 0.00 C ATOM 1397 NE ARG A 471 -15.856 -8.609 0.903 1.00 0.00 N ATOM 1398 CZ ARG A 471 -16.847 -7.727 0.983 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -16.966 -6.775 0.068 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -17.721 -7.797 1.979 1.00 0.00 N ATOM 0 H ARG A 471 -11.636 -10.975 2.373 1.00 0.00 H new ATOM 0 HA ARG A 471 -11.085 -9.873 -0.317 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -12.887 -8.989 1.967 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.495 -7.943 0.616 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.351 -9.976 -0.843 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -14.144 -10.465 0.641 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -14.427 -7.605 -0.249 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -15.331 -8.835 -1.110 1.00 0.00 H new ATOM 0 HE ARG A 471 -15.793 -9.329 1.623 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -16.296 -6.718 -0.699 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -17.727 -6.099 0.131 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -17.633 -8.528 2.684 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -18.481 -7.119 2.039 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.874 -7.726 0.628 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.820 -6.812 1.056 1.00 0.00 C ATOM 1416 C LEU A 472 -9.402 -5.461 1.460 1.00 0.00 C ATOM 1417 O LEU A 472 -10.506 -5.101 1.052 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.797 -6.623 -0.066 1.00 0.00 C ATOM 1419 CG LEU A 472 -6.979 -7.859 -0.443 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -6.050 -7.550 -1.607 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -6.187 -8.361 0.755 1.00 0.00 C ATOM 0 H LEU A 472 -10.369 -7.435 -0.215 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.324 -7.248 1.923 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.323 -6.275 -0.955 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -7.108 -5.831 0.227 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.667 -8.645 -0.753 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.476 -8.441 -1.861 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.639 -7.239 -2.470 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.368 -6.748 -1.325 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -5.611 -9.241 0.468 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -5.509 -7.579 1.096 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -6.873 -8.623 1.561 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.652 -4.717 2.265 1.00 0.00 N ATOM 1434 CA LYS A 473 -9.090 -3.405 2.724 1.00 0.00 C ATOM 1435 C LYS A 473 -7.942 -2.401 2.680 1.00 0.00 C ATOM 1436 O LYS A 473 -7.021 -2.459 3.496 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.645 -3.498 4.147 1.00 0.00 C ATOM 1438 CG LYS A 473 -9.970 -2.148 4.763 1.00 0.00 C ATOM 1439 CD LYS A 473 -10.851 -2.294 5.992 1.00 0.00 C ATOM 1440 CE LYS A 473 -10.609 -1.169 6.988 1.00 0.00 C ATOM 1441 NZ LYS A 473 -11.153 0.129 6.502 1.00 0.00 N ATOM 0 H LYS A 473 -7.736 -5.001 2.613 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.878 -3.059 2.055 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -10.547 -4.110 4.137 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.919 -4.011 4.778 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -9.045 -1.639 5.035 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -10.473 -1.522 4.026 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -11.899 -2.296 5.692 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -10.654 -3.254 6.470 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -11.072 -1.422 7.942 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -9.539 -1.069 7.170 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -10.968 0.869 7.209 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -10.693 0.384 5.605 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -12.179 0.042 6.353 1.00 0.00 H new ATOM 1455 N VAL A 474 -8.002 -1.480 1.723 1.00 0.00 N ATOM 1456 CA VAL A 474 -6.968 -0.464 1.574 1.00 0.00 C ATOM 1457 C VAL A 474 -7.491 0.913 1.970 1.00 0.00 C ATOM 1458 O VAL A 474 -8.594 1.302 1.586 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.442 -0.404 0.128 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -5.363 0.660 -0.005 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -5.917 -1.765 -0.303 1.00 0.00 C ATOM 0 H VAL A 474 -8.756 -1.417 1.039 1.00 0.00 H new ATOM 0 HA VAL A 474 -6.150 -0.745 2.238 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.268 -0.133 -0.530 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -5.004 0.687 -1.034 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.777 1.633 0.261 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.534 0.423 0.662 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.549 -1.705 -1.327 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.104 -2.067 0.358 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -6.721 -2.499 -0.249 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.692 1.645 2.740 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.076 2.978 3.187 1.00 0.00 C ATOM 1473 C GLN A 475 -5.845 3.812 3.530 1.00 0.00 C ATOM 1474 O GLN A 475 -4.888 3.311 4.122 1.00 0.00 O ATOM 1475 CB GLN A 475 -7.998 2.886 4.404 1.00 0.00 C ATOM 1476 CG GLN A 475 -8.871 4.115 4.600 1.00 0.00 C ATOM 1477 CD GLN A 475 -10.071 4.133 3.674 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -10.036 3.565 2.582 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -11.143 4.787 4.107 1.00 0.00 N ATOM 0 H GLN A 475 -5.776 1.337 3.067 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.610 3.467 2.372 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -8.637 2.009 4.300 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.392 2.734 5.298 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -9.214 4.151 5.634 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -8.273 5.011 4.431 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -11.128 5.243 5.019 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -11.981 4.833 3.527 1.00 0.00 H new ATOM 1488 N LEU A 476 -5.877 5.086 3.157 1.00 0.00 N ATOM 1489 CA LEU A 476 -4.763 5.990 3.424 1.00 0.00 C ATOM 1490 C LEU A 476 -4.849 6.556 4.838 1.00 0.00 C ATOM 1491 O LEU A 476 -5.892 7.060 5.254 1.00 0.00 O ATOM 1492 CB LEU A 476 -4.751 7.131 2.406 1.00 0.00 C ATOM 1493 CG LEU A 476 -5.726 8.279 2.672 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.163 9.225 3.721 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -6.033 9.028 1.384 1.00 0.00 C ATOM 0 H LEU A 476 -6.662 5.517 2.669 1.00 0.00 H new ATOM 0 HA LEU A 476 -3.837 5.422 3.335 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -3.742 7.541 2.362 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -4.970 6.716 1.422 1.00 0.00 H new ATOM 0 HG LEU A 476 -6.656 7.859 3.054 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -5.870 10.035 3.897 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -4.996 8.680 4.650 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.218 9.638 3.368 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -6.728 9.841 1.593 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.110 9.436 0.972 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.481 8.344 0.663 1.00 0.00 H new ATOM 1507 N LYS A 477 -3.745 6.470 5.573 1.00 0.00 N ATOM 1508 CA LYS A 477 -3.693 6.976 6.939 1.00 0.00 C ATOM 1509 C LYS A 477 -4.569 8.214 7.095 1.00 0.00 C ATOM 1510 O LYS A 477 -4.267 9.273 6.544 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.250 7.307 7.327 1.00 0.00 C ATOM 1512 CG LYS A 477 -2.054 7.515 8.819 1.00 0.00 C ATOM 1513 CD LYS A 477 -0.624 7.223 9.239 1.00 0.00 C ATOM 1514 CE LYS A 477 -0.366 7.653 10.675 1.00 0.00 C ATOM 1515 NZ LYS A 477 0.978 7.221 11.151 1.00 0.00 N ATOM 0 H LYS A 477 -2.874 6.054 5.245 1.00 0.00 H new ATOM 0 HA LYS A 477 -4.073 6.199 7.602 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.598 6.500 6.992 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -1.938 8.208 6.799 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -2.309 8.542 9.081 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -2.736 6.867 9.370 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.424 6.156 9.136 1.00 0.00 H new ATOM 0 HD3 LYS A 477 0.065 7.742 8.573 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -0.446 8.738 10.749 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -1.134 7.231 11.324 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 1.115 7.533 12.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 1.046 6.184 11.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 1.712 7.644 10.548 1.00 0.00 H new