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 Set 1.1: A 451 ASN : amide:sc= -3.33! C(o=-3.3!,f=-8.6!) USER MOD Set 1.2: A 454 SER OG : rot 180:sc= 0 USER MOD Single : A 395 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 ASN :FLIP amide:sc= -2.73 F(o=-3.4!,f=-2.7) USER MOD Single : A 406 TYR OH : rot 180:sc= 0 USER MOD Single : A 407 HIS :FLIP no HD1:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 410 GLN : amide:sc= -0.0283 X(o=-0.028,f=0) USER MOD Single : A 415 GLN : amide:sc= -0.973 K(o=-0.97,f=-3.1!) USER MOD Single : A 419 GLN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 420 MET CE :methyl -123:sc= -0.274 (180deg=-2.67!) USER MOD Single : A 422 MET CE :methyl -110:sc= -0.818 (180deg=-1.8) USER MOD Single : A 426 ASN : amide:sc= 0 X(o=0,f=-0.0037) USER MOD Single : A 429 SER OG : rot 173:sc= 0.883 USER MOD Single : A 431 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0121) USER MOD Single : A 443 CYS SG : rot 10:sc= 0.472 USER MOD Single : A 448 SER OG : rot 110:sc= -0.747 USER MOD Single : A 449 TYR OH : rot -116:sc= 0.119 USER MOD Single : A 456 GLN :FLIP amide:sc= -0.235 F(o=-2.1!,f=-0.24) USER MOD Single : A 460 GLN :FLIP amide:sc= 0 F(o=-0.64,f=0) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl -143:sc= 0 (180deg=-0.0636) USER MOD Single : A 463 ASN : amide:sc= -0.0163 X(o=-0.016,f=0) USER MOD Single : A 466 GLN : amide:sc= -2.29 K(o=-2.3,f=-4.4!) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.227) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= -0.172 K(o=-0.17,f=-2.1!) USER MOD Single : A 477 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 225 N LYS A 395 9.172 5.309 3.991 1.00 0.00 N ATOM 226 CA LYS A 395 8.907 6.694 3.619 1.00 0.00 C ATOM 227 C LYS A 395 7.485 6.853 3.090 1.00 0.00 C ATOM 228 O LYS A 395 6.835 5.873 2.731 1.00 0.00 O ATOM 229 CB LYS A 395 9.911 7.161 2.563 1.00 0.00 C ATOM 230 CG LYS A 395 9.873 6.343 1.284 1.00 0.00 C ATOM 231 CD LYS A 395 11.190 6.422 0.532 1.00 0.00 C ATOM 232 CE LYS A 395 11.346 7.759 -0.180 1.00 0.00 C ATOM 233 NZ LYS A 395 12.770 8.052 -0.503 1.00 0.00 N ATOM 0 HA LYS A 395 9.015 7.311 4.511 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.713 8.206 2.322 1.00 0.00 H new ATOM 0 HB3 LYS A 395 10.916 7.116 2.984 1.00 0.00 H new ATOM 0 HG2 LYS A 395 9.651 5.303 1.523 1.00 0.00 H new ATOM 0 HG3 LYS A 395 9.066 6.702 0.645 1.00 0.00 H new ATOM 0 HD2 LYS A 395 12.017 6.280 1.228 1.00 0.00 H new ATOM 0 HD3 LYS A 395 11.244 5.612 -0.196 1.00 0.00 H new ATOM 0 HE2 LYS A 395 10.759 7.752 -1.099 1.00 0.00 H new ATOM 0 HE3 LYS A 395 10.945 8.554 0.448 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 12.834 8.970 -0.987 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 13.326 8.084 0.375 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 13.146 7.307 -1.123 1.00 0.00 H new ATOM 247 N GLU A 396 7.011 8.094 3.045 1.00 0.00 N ATOM 248 CA GLU A 396 5.666 8.380 2.559 1.00 0.00 C ATOM 249 C GLU A 396 5.693 9.470 1.491 1.00 0.00 C ATOM 250 O GLU A 396 6.760 9.931 1.088 1.00 0.00 O ATOM 251 CB GLU A 396 4.761 8.808 3.716 1.00 0.00 C ATOM 252 CG GLU A 396 5.314 9.970 4.524 1.00 0.00 C ATOM 253 CD GLU A 396 4.257 10.638 5.382 1.00 0.00 C ATOM 254 OE1 GLU A 396 3.089 10.695 4.947 1.00 0.00 O ATOM 255 OE2 GLU A 396 4.600 11.105 6.489 1.00 0.00 O ATOM 0 H GLU A 396 7.538 8.917 3.339 1.00 0.00 H new ATOM 0 HA GLU A 396 5.268 7.468 2.114 1.00 0.00 H new ATOM 0 HB2 GLU A 396 3.784 9.085 3.319 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.606 7.957 4.379 1.00 0.00 H new ATOM 0 HG2 GLU A 396 6.122 9.612 5.162 1.00 0.00 H new ATOM 0 HG3 GLU A 396 5.745 10.707 3.846 1.00 0.00 H new ATOM 262 N GLY A 397 4.511 9.876 1.037 1.00 0.00 N ATOM 263 CA GLY A 397 4.421 10.907 0.020 1.00 0.00 C ATOM 264 C GLY A 397 4.085 12.266 0.601 1.00 0.00 C ATOM 265 O GLY A 397 4.489 12.607 1.713 1.00 0.00 O ATOM 0 H GLY A 397 3.614 9.509 1.356 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.368 10.968 -0.516 1.00 0.00 H new ATOM 0 HA3 GLY A 397 3.660 10.629 -0.709 1.00 0.00 H new ATOM 269 N PRO A 398 3.329 13.069 -0.162 1.00 0.00 N ATOM 270 CA PRO A 398 2.923 14.412 0.262 1.00 0.00 C ATOM 271 C PRO A 398 1.825 14.378 1.321 1.00 0.00 C ATOM 272 O PRO A 398 1.024 13.446 1.366 1.00 0.00 O ATOM 273 CB PRO A 398 2.401 15.049 -1.028 1.00 0.00 C ATOM 274 CG PRO A 398 1.930 13.902 -1.854 1.00 0.00 C ATOM 275 CD PRO A 398 2.812 12.728 -1.498 1.00 0.00 C ATOM 0 HA PRO A 398 3.745 14.960 0.722 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.591 15.749 -0.824 1.00 0.00 H new ATOM 0 HB3 PRO A 398 3.185 15.609 -1.538 1.00 0.00 H new ATOM 0 HG2 PRO A 398 0.884 13.678 -1.647 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.002 14.133 -2.917 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.249 11.795 -1.483 1.00 0.00 H new ATOM 0 HD3 PRO A 398 3.620 12.601 -2.219 1.00 0.00 H new ATOM 283 N GLU A 399 1.795 15.402 2.168 1.00 0.00 N ATOM 284 CA GLU A 399 0.795 15.487 3.226 1.00 0.00 C ATOM 285 C GLU A 399 -0.611 15.298 2.663 1.00 0.00 C ATOM 286 O GLU A 399 -1.169 16.202 2.042 1.00 0.00 O ATOM 287 CB GLU A 399 0.892 16.835 3.943 1.00 0.00 C ATOM 288 CG GLU A 399 -0.039 16.959 5.136 1.00 0.00 C ATOM 289 CD GLU A 399 0.465 17.947 6.171 1.00 0.00 C ATOM 290 OE1 GLU A 399 1.526 17.685 6.774 1.00 0.00 O ATOM 291 OE2 GLU A 399 -0.202 18.982 6.375 1.00 0.00 O ATOM 0 H GLU A 399 2.450 16.183 2.142 1.00 0.00 H new ATOM 0 HA GLU A 399 0.992 14.688 3.941 1.00 0.00 H new ATOM 0 HB2 GLU A 399 1.919 16.986 4.277 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.667 17.631 3.233 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -1.025 17.271 4.792 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.159 15.981 5.601 1.00 0.00 H new ATOM 298 N GLY A 400 -1.176 14.115 2.884 1.00 0.00 N ATOM 299 CA GLY A 400 -2.511 13.829 2.392 1.00 0.00 C ATOM 300 C GLY A 400 -2.583 12.511 1.646 1.00 0.00 C ATOM 301 O GLY A 400 -3.646 11.896 1.560 1.00 0.00 O ATOM 0 H GLY A 400 -0.734 13.351 3.394 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -3.207 13.807 3.230 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -2.832 14.635 1.732 1.00 0.00 H new ATOM 305 N ALA A 401 -1.450 12.076 1.104 1.00 0.00 N ATOM 306 CA ALA A 401 -1.389 10.824 0.362 1.00 0.00 C ATOM 307 C ALA A 401 -0.868 9.690 1.240 1.00 0.00 C ATOM 308 O ALA A 401 0.190 9.805 1.855 1.00 0.00 O ATOM 309 CB ALA A 401 -0.512 10.984 -0.871 1.00 0.00 C ATOM 0 H ALA A 401 -0.562 12.573 1.165 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.400 10.568 0.045 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.475 10.041 -1.416 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.927 11.759 -1.515 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.496 11.267 -0.567 1.00 0.00 H new ATOM 315 N ASN A 402 -1.622 8.597 1.294 1.00 0.00 N ATOM 316 CA ASN A 402 -1.238 7.443 2.099 1.00 0.00 C ATOM 317 C ASN A 402 -1.944 6.180 1.611 1.00 0.00 C ATOM 318 O ASN A 402 -2.920 6.251 0.863 1.00 0.00 O ATOM 319 CB ASN A 402 -1.569 7.688 3.572 1.00 0.00 C ATOM 320 CG ASN A 402 -0.500 8.499 4.277 1.00 0.00 C ATOM 321 OD1 ASN A 402 -0.596 9.820 4.177 1.00 0.00 O flip ATOM 322 ND2 ASN A 402 0.403 7.945 4.905 1.00 0.00 N flip ATOM 0 H ASN A 402 -2.502 8.486 0.790 1.00 0.00 H new ATOM 0 HA ASN A 402 -0.162 7.301 1.994 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.524 8.209 3.645 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -1.688 6.730 4.079 1.00 0.00 H new ATOM 0 HD21 ASN A 402 0.438 6.927 4.956 1.00 0.00 H new ATOM 0 HD22 ASN A 402 1.115 8.504 5.374 1.00 0.00 H new ATOM 329 N LEU A 403 -1.444 5.027 2.040 1.00 0.00 N ATOM 330 CA LEU A 403 -2.027 3.749 1.649 1.00 0.00 C ATOM 331 C LEU A 403 -1.658 2.654 2.646 1.00 0.00 C ATOM 332 O LEU A 403 -0.481 2.418 2.917 1.00 0.00 O ATOM 333 CB LEU A 403 -1.554 3.358 0.247 1.00 0.00 C ATOM 334 CG LEU A 403 -2.183 4.129 -0.913 1.00 0.00 C ATOM 335 CD1 LEU A 403 -1.668 3.605 -2.244 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.700 4.040 -0.853 1.00 0.00 C ATOM 0 H LEU A 403 -0.636 4.951 2.658 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.111 3.859 1.643 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.473 3.489 0.200 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -1.753 2.296 0.101 1.00 0.00 H new ATOM 0 HG LEU A 403 -1.898 5.177 -0.824 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -2.127 4.166 -3.058 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -0.585 3.723 -2.287 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -1.922 2.550 -2.342 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.130 4.595 -1.687 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.006 2.996 -0.916 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -4.053 4.466 0.087 1.00 0.00 H new ATOM 348 N PHE A 404 -2.673 1.987 3.186 1.00 0.00 N ATOM 349 CA PHE A 404 -2.455 0.917 4.152 1.00 0.00 C ATOM 350 C PHE A 404 -3.254 -0.327 3.774 1.00 0.00 C ATOM 351 O PHE A 404 -4.486 -0.320 3.807 1.00 0.00 O ATOM 352 CB PHE A 404 -2.847 1.380 5.556 1.00 0.00 C ATOM 353 CG PHE A 404 -1.806 2.240 6.216 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.642 3.564 5.840 1.00 0.00 C ATOM 355 CD2 PHE A 404 -0.992 1.725 7.211 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.685 4.355 6.444 1.00 0.00 C ATOM 357 CE2 PHE A 404 -0.032 2.512 7.819 1.00 0.00 C ATOM 358 CZ PHE A 404 0.120 3.831 7.436 1.00 0.00 C ATOM 0 H PHE A 404 -3.653 2.169 2.971 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.395 0.664 4.143 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.783 1.936 5.499 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -3.033 0.506 6.180 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -2.269 3.981 5.066 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -1.109 0.695 7.516 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.566 5.385 6.140 1.00 0.00 H new ATOM 0 HE2 PHE A 404 0.598 2.097 8.592 1.00 0.00 H new ATOM 0 HZ PHE A 404 0.866 4.450 7.911 1.00 0.00 H new ATOM 368 N ILE A 405 -2.545 -1.392 3.415 1.00 0.00 N ATOM 369 CA ILE A 405 -3.188 -2.643 3.031 1.00 0.00 C ATOM 370 C ILE A 405 -3.379 -3.556 4.238 1.00 0.00 C ATOM 371 O ILE A 405 -2.477 -3.710 5.062 1.00 0.00 O ATOM 372 CB ILE A 405 -2.372 -3.390 1.961 1.00 0.00 C ATOM 373 CG1 ILE A 405 -2.155 -2.498 0.737 1.00 0.00 C ATOM 374 CG2 ILE A 405 -3.073 -4.681 1.564 1.00 0.00 C ATOM 375 CD1 ILE A 405 -1.142 -1.398 0.963 1.00 0.00 C ATOM 0 H ILE A 405 -1.526 -1.414 3.382 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.162 -2.383 2.617 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.398 -3.642 2.380 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -1.828 -3.116 -0.099 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -3.107 -2.051 0.450 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.483 -5.197 0.807 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -3.180 -5.321 2.440 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -4.059 -4.450 1.161 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.039 -0.806 0.054 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -1.477 -0.757 1.778 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.178 -1.838 1.220 1.00 0.00 H new ATOM 387 N TYR A 406 -4.558 -4.160 4.336 1.00 0.00 N ATOM 388 CA TYR A 406 -4.867 -5.057 5.442 1.00 0.00 C ATOM 389 C TYR A 406 -5.381 -6.398 4.928 1.00 0.00 C ATOM 390 O TYR A 406 -5.841 -6.506 3.790 1.00 0.00 O ATOM 391 CB TYR A 406 -5.906 -4.421 6.367 1.00 0.00 C ATOM 392 CG TYR A 406 -5.471 -3.094 6.945 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.399 -3.016 7.825 1.00 0.00 C ATOM 394 CD2 TYR A 406 -6.131 -1.918 6.611 1.00 0.00 C ATOM 395 CE1 TYR A 406 -3.996 -1.805 8.356 1.00 0.00 C ATOM 396 CE2 TYR A 406 -5.736 -0.703 7.137 1.00 0.00 C ATOM 397 CZ TYR A 406 -4.669 -0.652 8.009 1.00 0.00 C ATOM 398 OH TYR A 406 -4.272 0.556 8.535 1.00 0.00 O ATOM 0 H TYR A 406 -5.315 -4.044 3.663 1.00 0.00 H new ATOM 0 HA TYR A 406 -3.949 -5.231 6.003 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -6.834 -4.280 5.814 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -6.123 -5.110 7.184 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -3.871 -3.917 8.099 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -6.967 -1.954 5.928 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -3.160 -1.762 9.038 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -6.260 0.202 6.867 1.00 0.00 H new ATOM 0 HH TYR A 406 -4.849 1.269 8.189 1.00 0.00 H new ATOM 408 N HIS A 407 -5.302 -7.419 5.775 1.00 0.00 N ATOM 409 CA HIS A 407 -5.760 -8.756 5.408 1.00 0.00 C ATOM 410 C HIS A 407 -4.989 -9.282 4.201 1.00 0.00 C ATOM 411 O HIS A 407 -5.582 -9.665 3.192 1.00 0.00 O ATOM 412 CB HIS A 407 -7.258 -8.737 5.103 1.00 0.00 C ATOM 413 CG HIS A 407 -8.074 -8.048 6.152 1.00 0.00 C ATOM 414 ND1 HIS A 407 -8.294 -6.733 6.381 1.00 0.00 N flip ATOM 415 CD2 HIS A 407 -8.781 -8.727 7.123 1.00 0.00 C flip ATOM 416 CE1 HIS A 407 -9.121 -6.641 7.473 1.00 0.00 C flip ATOM 417 NE2 HIS A 407 -9.400 -7.859 7.902 1.00 0.00 N flip ATOM 0 H HIS A 407 -4.925 -7.347 6.720 1.00 0.00 H new ATOM 0 HA HIS A 407 -5.576 -9.422 6.251 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.419 -8.242 4.146 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.611 -9.762 4.995 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -8.822 -9.801 7.229 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -9.484 -5.723 7.910 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -9.993 -8.090 8.699 1.00 0.00 H new ATOM 425 N LEU A 408 -3.665 -9.296 4.311 1.00 0.00 N ATOM 426 CA LEU A 408 -2.813 -9.774 3.229 1.00 0.00 C ATOM 427 C LEU A 408 -2.476 -11.251 3.412 1.00 0.00 C ATOM 428 O LEU A 408 -2.231 -11.723 4.523 1.00 0.00 O ATOM 429 CB LEU A 408 -1.526 -8.950 3.164 1.00 0.00 C ATOM 430 CG LEU A 408 -1.632 -7.594 2.463 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.485 -6.687 2.881 1.00 0.00 C ATOM 432 CD2 LEU A 408 -1.650 -7.774 0.952 1.00 0.00 C ATOM 0 H LEU A 408 -3.159 -8.982 5.139 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.359 -9.658 2.293 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -1.173 -8.784 4.182 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -0.765 -9.541 2.655 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.568 -7.123 2.763 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.576 -5.727 2.373 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.519 -6.531 3.959 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.463 -7.152 2.611 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -1.726 -6.799 0.470 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -0.731 -8.266 0.633 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.506 -8.386 0.669 1.00 0.00 H new ATOM 444 N PRO A 409 -2.459 -11.997 2.298 1.00 0.00 N ATOM 445 CA PRO A 409 -2.151 -13.430 2.310 1.00 0.00 C ATOM 446 C PRO A 409 -0.874 -13.742 3.084 1.00 0.00 C ATOM 447 O PRO A 409 -0.287 -12.860 3.710 1.00 0.00 O ATOM 448 CB PRO A 409 -1.974 -13.767 0.828 1.00 0.00 C ATOM 449 CG PRO A 409 -2.802 -12.760 0.108 1.00 0.00 C ATOM 450 CD PRO A 409 -2.742 -11.500 0.941 1.00 0.00 C ATOM 0 HA PRO A 409 -2.931 -14.011 2.803 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -0.927 -13.704 0.530 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -2.307 -14.782 0.610 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -2.416 -12.583 -0.896 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -3.830 -13.106 -0.002 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -1.962 -10.824 0.591 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.682 -10.949 0.903 1.00 0.00 H new ATOM 458 N GLN A 410 -0.450 -15.001 3.035 1.00 0.00 N ATOM 459 CA GLN A 410 0.757 -15.427 3.732 1.00 0.00 C ATOM 460 C GLN A 410 1.958 -15.428 2.792 1.00 0.00 C ATOM 461 O GLN A 410 3.074 -15.111 3.198 1.00 0.00 O ATOM 462 CB GLN A 410 0.561 -16.822 4.329 1.00 0.00 C ATOM 463 CG GLN A 410 0.367 -17.909 3.284 1.00 0.00 C ATOM 464 CD GLN A 410 -0.124 -19.213 3.882 1.00 0.00 C ATOM 465 OE1 GLN A 410 0.555 -20.237 3.809 1.00 0.00 O ATOM 466 NE2 GLN A 410 -1.310 -19.181 4.478 1.00 0.00 N ATOM 0 H GLN A 410 -0.924 -15.743 2.520 1.00 0.00 H new ATOM 0 HA GLN A 410 0.950 -14.718 4.537 1.00 0.00 H new ATOM 0 HB2 GLN A 410 1.427 -17.070 4.943 1.00 0.00 H new ATOM 0 HB3 GLN A 410 -0.305 -16.807 4.990 1.00 0.00 H new ATOM 0 HG2 GLN A 410 -0.347 -17.565 2.536 1.00 0.00 H new ATOM 0 HG3 GLN A 410 1.311 -18.083 2.767 1.00 0.00 H new ATOM 0 HE21 GLN A 410 -1.839 -18.310 4.515 1.00 0.00 H new ATOM 0 HE22 GLN A 410 -1.692 -20.028 4.899 1.00 0.00 H new ATOM 475 N GLU A 411 1.718 -15.785 1.534 1.00 0.00 N ATOM 476 CA GLU A 411 2.780 -15.828 0.537 1.00 0.00 C ATOM 477 C GLU A 411 3.148 -14.421 0.074 1.00 0.00 C ATOM 478 O GLU A 411 4.179 -14.215 -0.568 1.00 0.00 O ATOM 479 CB GLU A 411 2.351 -16.674 -0.663 1.00 0.00 C ATOM 480 CG GLU A 411 1.249 -16.039 -1.494 1.00 0.00 C ATOM 481 CD GLU A 411 -0.139 -16.397 -0.995 1.00 0.00 C ATOM 482 OE1 GLU A 411 -0.241 -16.970 0.110 1.00 0.00 O ATOM 483 OE2 GLU A 411 -1.120 -16.103 -1.708 1.00 0.00 O ATOM 0 H GLU A 411 0.798 -16.048 1.182 1.00 0.00 H new ATOM 0 HA GLU A 411 3.657 -16.283 0.998 1.00 0.00 H new ATOM 0 HB2 GLU A 411 3.218 -16.852 -1.300 1.00 0.00 H new ATOM 0 HB3 GLU A 411 2.012 -17.647 -0.308 1.00 0.00 H new ATOM 0 HG2 GLU A 411 1.368 -14.956 -1.481 1.00 0.00 H new ATOM 0 HG3 GLU A 411 1.352 -16.358 -2.531 1.00 0.00 H new ATOM 490 N PHE A 412 2.298 -13.454 0.404 1.00 0.00 N ATOM 491 CA PHE A 412 2.531 -12.066 0.022 1.00 0.00 C ATOM 492 C PHE A 412 3.676 -11.464 0.832 1.00 0.00 C ATOM 493 O PHE A 412 3.692 -11.546 2.060 1.00 0.00 O ATOM 494 CB PHE A 412 1.260 -11.239 0.221 1.00 0.00 C ATOM 495 CG PHE A 412 0.384 -11.184 -0.997 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.116 -12.346 -1.561 1.00 0.00 C ATOM 497 CD2 PHE A 412 0.061 -9.968 -1.579 1.00 0.00 C ATOM 498 CE1 PHE A 412 -0.923 -12.299 -2.682 1.00 0.00 C ATOM 499 CE2 PHE A 412 -0.746 -9.915 -2.701 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.237 -11.081 -3.253 1.00 0.00 C ATOM 0 H PHE A 412 1.441 -13.606 0.936 1.00 0.00 H new ATOM 0 HA PHE A 412 2.806 -12.047 -1.033 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.690 -11.658 1.050 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.537 -10.224 0.505 1.00 0.00 H new ATOM 0 HD1 PHE A 412 0.128 -13.301 -1.119 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.443 -9.053 -1.152 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.307 -13.213 -3.111 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -0.992 -8.962 -3.145 1.00 0.00 H new ATOM 0 HZ PHE A 412 -1.866 -11.041 -4.130 1.00 0.00 H new ATOM 510 N GLY A 413 4.633 -10.859 0.135 1.00 0.00 N ATOM 511 CA GLY A 413 5.769 -10.253 0.805 1.00 0.00 C ATOM 512 C GLY A 413 5.881 -8.768 0.525 1.00 0.00 C ATOM 513 O GLY A 413 4.881 -8.103 0.253 1.00 0.00 O ATOM 0 H GLY A 413 4.642 -10.778 -0.882 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.680 -10.411 1.880 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.684 -10.750 0.484 1.00 0.00 H new ATOM 517 N ASP A 414 7.101 -8.245 0.595 1.00 0.00 N ATOM 518 CA ASP A 414 7.340 -6.828 0.348 1.00 0.00 C ATOM 519 C ASP A 414 7.198 -6.503 -1.136 1.00 0.00 C ATOM 520 O ASP A 414 6.386 -5.662 -1.521 1.00 0.00 O ATOM 521 CB ASP A 414 8.734 -6.432 0.837 1.00 0.00 C ATOM 522 CG ASP A 414 9.076 -7.056 2.175 1.00 0.00 C ATOM 523 OD1 ASP A 414 9.401 -8.262 2.201 1.00 0.00 O ATOM 524 OD2 ASP A 414 9.019 -6.340 3.198 1.00 0.00 O ATOM 0 H ASP A 414 7.939 -8.781 0.821 1.00 0.00 H new ATOM 0 HA ASP A 414 6.593 -6.257 0.900 1.00 0.00 H new ATOM 0 HB2 ASP A 414 9.475 -6.735 0.098 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.792 -5.347 0.920 1.00 0.00 H new ATOM 529 N GLN A 415 7.992 -7.175 -1.963 1.00 0.00 N ATOM 530 CA GLN A 415 7.955 -6.956 -3.404 1.00 0.00 C ATOM 531 C GLN A 415 6.542 -7.142 -3.946 1.00 0.00 C ATOM 532 O GLN A 415 6.016 -6.276 -4.645 1.00 0.00 O ATOM 533 CB GLN A 415 8.916 -7.914 -4.110 1.00 0.00 C ATOM 534 CG GLN A 415 10.379 -7.650 -3.796 1.00 0.00 C ATOM 535 CD GLN A 415 10.851 -6.302 -4.303 1.00 0.00 C ATOM 536 OE1 GLN A 415 10.391 -5.257 -3.842 1.00 0.00 O ATOM 537 NE2 GLN A 415 11.775 -6.317 -5.257 1.00 0.00 N ATOM 0 H GLN A 415 8.669 -7.876 -1.660 1.00 0.00 H new ATOM 0 HA GLN A 415 8.267 -5.930 -3.600 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.671 -8.937 -3.825 1.00 0.00 H new ATOM 0 HB3 GLN A 415 8.765 -7.839 -5.187 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.530 -7.701 -2.718 1.00 0.00 H new ATOM 0 HG3 GLN A 415 10.990 -8.435 -4.241 1.00 0.00 H new ATOM 0 HE21 GLN A 415 12.129 -7.206 -5.610 1.00 0.00 H new ATOM 0 HE22 GLN A 415 12.131 -5.440 -5.636 1.00 0.00 H new ATOM 546 N ASP A 416 5.933 -8.276 -3.621 1.00 0.00 N ATOM 547 CA ASP A 416 4.580 -8.576 -4.075 1.00 0.00 C ATOM 548 C ASP A 416 3.685 -7.346 -3.963 1.00 0.00 C ATOM 549 O ASP A 416 3.117 -6.885 -4.955 1.00 0.00 O ATOM 550 CB ASP A 416 3.989 -9.728 -3.260 1.00 0.00 C ATOM 551 CG ASP A 416 4.564 -11.073 -3.658 1.00 0.00 C ATOM 552 OD1 ASP A 416 4.623 -11.356 -4.872 1.00 0.00 O ATOM 553 OD2 ASP A 416 4.954 -11.842 -2.754 1.00 0.00 O ATOM 0 H ASP A 416 6.355 -9.004 -3.044 1.00 0.00 H new ATOM 0 HA ASP A 416 4.632 -8.872 -5.123 1.00 0.00 H new ATOM 0 HB2 ASP A 416 4.178 -9.554 -2.201 1.00 0.00 H new ATOM 0 HB3 ASP A 416 2.907 -9.745 -3.392 1.00 0.00 H new ATOM 558 N LEU A 417 3.562 -6.818 -2.750 1.00 0.00 N ATOM 559 CA LEU A 417 2.735 -5.641 -2.508 1.00 0.00 C ATOM 560 C LEU A 417 3.136 -4.494 -3.431 1.00 0.00 C ATOM 561 O LEU A 417 2.282 -3.840 -4.032 1.00 0.00 O ATOM 562 CB LEU A 417 2.854 -5.200 -1.049 1.00 0.00 C ATOM 563 CG LEU A 417 2.005 -3.996 -0.638 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.528 -4.355 -0.655 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.419 -3.496 0.737 1.00 0.00 C ATOM 0 H LEU A 417 4.024 -7.186 -1.919 1.00 0.00 H new ATOM 0 HA LEU A 417 1.699 -5.907 -2.718 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.584 -6.043 -0.413 1.00 0.00 H new ATOM 0 HB3 LEU A 417 3.899 -4.968 -0.845 1.00 0.00 H new ATOM 0 HG LEU A 417 2.171 -3.195 -1.358 1.00 0.00 H new ATOM 0 HD11 LEU A 417 -0.061 -3.487 -0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.240 -4.664 -1.660 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.344 -5.172 0.043 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.804 -2.639 1.013 1.00 0.00 H new ATOM 0 HD22 LEU A 417 2.283 -4.291 1.470 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.467 -3.198 0.715 1.00 0.00 H new ATOM 577 N LEU A 418 4.437 -4.258 -3.542 1.00 0.00 N ATOM 578 CA LEU A 418 4.953 -3.192 -4.395 1.00 0.00 C ATOM 579 C LEU A 418 4.435 -3.339 -5.821 1.00 0.00 C ATOM 580 O LEU A 418 3.837 -2.415 -6.372 1.00 0.00 O ATOM 581 CB LEU A 418 6.483 -3.202 -4.390 1.00 0.00 C ATOM 582 CG LEU A 418 7.162 -2.368 -5.476 1.00 0.00 C ATOM 583 CD1 LEU A 418 7.022 -0.884 -5.175 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.629 -2.752 -5.604 1.00 0.00 C ATOM 0 H LEU A 418 5.156 -4.790 -3.052 1.00 0.00 H new ATOM 0 HA LEU A 418 4.603 -2.240 -3.997 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.826 -2.846 -3.419 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.820 -4.234 -4.488 1.00 0.00 H new ATOM 0 HG LEU A 418 6.669 -2.573 -6.426 1.00 0.00 H new ATOM 0 HD11 LEU A 418 7.511 -0.306 -5.959 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.965 -0.619 -5.135 1.00 0.00 H new ATOM 0 HD13 LEU A 418 7.489 -0.662 -4.215 1.00 0.00 H new ATOM 0 HD21 LEU A 418 9.097 -2.148 -6.382 1.00 0.00 H new ATOM 0 HD22 LEU A 418 9.135 -2.576 -4.655 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.707 -3.807 -5.867 1.00 0.00 H new ATOM 596 N GLN A 419 4.668 -4.505 -6.413 1.00 0.00 N ATOM 597 CA GLN A 419 4.225 -4.773 -7.776 1.00 0.00 C ATOM 598 C GLN A 419 2.713 -4.967 -7.828 1.00 0.00 C ATOM 599 O GLN A 419 2.123 -5.035 -8.905 1.00 0.00 O ATOM 600 CB GLN A 419 4.929 -6.011 -8.331 1.00 0.00 C ATOM 601 CG GLN A 419 6.387 -5.773 -8.690 1.00 0.00 C ATOM 602 CD GLN A 419 7.041 -6.989 -9.315 1.00 0.00 C ATOM 603 OE1 GLN A 419 6.570 -8.116 -9.150 1.00 0.00 O ATOM 604 NE2 GLN A 419 8.133 -6.769 -10.038 1.00 0.00 N ATOM 0 H GLN A 419 5.161 -5.280 -5.970 1.00 0.00 H new ATOM 0 HA GLN A 419 4.485 -3.911 -8.391 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.871 -6.812 -7.594 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.397 -6.354 -9.218 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.454 -4.933 -9.382 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.937 -5.491 -7.792 1.00 0.00 H new ATOM 0 HE21 GLN A 419 8.489 -5.819 -10.149 1.00 0.00 H new ATOM 0 HE22 GLN A 419 8.616 -7.550 -10.483 1.00 0.00 H new ATOM 613 N MET A 420 2.092 -5.056 -6.656 1.00 0.00 N ATOM 614 CA MET A 420 0.648 -5.241 -6.569 1.00 0.00 C ATOM 615 C MET A 420 -0.080 -3.909 -6.706 1.00 0.00 C ATOM 616 O MET A 420 -1.266 -3.869 -7.039 1.00 0.00 O ATOM 617 CB MET A 420 0.278 -5.904 -5.240 1.00 0.00 C ATOM 618 CG MET A 420 -1.221 -5.994 -5.003 1.00 0.00 C ATOM 619 SD MET A 420 -2.016 -7.235 -6.043 1.00 0.00 S ATOM 620 CE MET A 420 -2.972 -8.135 -4.824 1.00 0.00 C ATOM 0 H MET A 420 2.566 -5.003 -5.754 1.00 0.00 H new ATOM 0 HA MET A 420 0.339 -5.889 -7.389 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.703 -6.907 -5.213 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.734 -5.343 -4.424 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.406 -6.231 -3.955 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.674 -5.021 -5.194 1.00 0.00 H new ATOM 0 HE1 MET A 420 -2.695 -9.189 -4.850 1.00 0.00 H new ATOM 0 HE2 MET A 420 -2.769 -7.731 -3.832 1.00 0.00 H new ATOM 0 HE3 MET A 420 -4.034 -8.033 -5.047 1.00 0.00 H new ATOM 630 N PHE A 421 0.634 -2.819 -6.448 1.00 0.00 N ATOM 631 CA PHE A 421 0.054 -1.485 -6.542 1.00 0.00 C ATOM 632 C PHE A 421 0.719 -0.680 -7.655 1.00 0.00 C ATOM 633 O PHE A 421 0.231 0.380 -8.046 1.00 0.00 O ATOM 634 CB PHE A 421 0.198 -0.748 -5.209 1.00 0.00 C ATOM 635 CG PHE A 421 -0.834 -1.142 -4.191 1.00 0.00 C ATOM 636 CD1 PHE A 421 -1.061 -2.476 -3.897 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.577 -0.179 -3.529 1.00 0.00 C ATOM 638 CE1 PHE A 421 -2.009 -2.844 -2.961 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.526 -0.539 -2.592 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.744 -1.873 -2.309 1.00 0.00 C ATOM 0 H PHE A 421 1.616 -2.833 -6.172 1.00 0.00 H new ATOM 0 HA PHE A 421 -1.005 -1.592 -6.778 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.190 -0.941 -4.802 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.130 0.325 -5.387 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.490 -3.239 -4.406 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -1.413 0.866 -3.748 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -2.175 -3.888 -2.740 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -3.097 0.222 -2.081 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.488 -2.157 -1.579 1.00 0.00 H new ATOM 650 N MET A 422 1.836 -1.192 -8.162 1.00 0.00 N ATOM 651 CA MET A 422 2.568 -0.523 -9.230 1.00 0.00 C ATOM 652 C MET A 422 1.654 -0.233 -10.417 1.00 0.00 C ATOM 653 O MET A 422 1.652 0.863 -10.977 1.00 0.00 O ATOM 654 CB MET A 422 3.753 -1.378 -9.681 1.00 0.00 C ATOM 655 CG MET A 422 5.051 -1.046 -8.963 1.00 0.00 C ATOM 656 SD MET A 422 6.472 -1.910 -9.659 1.00 0.00 S ATOM 657 CE MET A 422 7.820 -1.062 -8.841 1.00 0.00 C ATOM 0 H MET A 422 2.254 -2.069 -7.850 1.00 0.00 H new ATOM 0 HA MET A 422 2.941 0.424 -8.841 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.515 -2.429 -9.517 1.00 0.00 H new ATOM 0 HB3 MET A 422 3.897 -1.248 -10.754 1.00 0.00 H new ATOM 0 HG2 MET A 422 5.224 0.029 -9.013 1.00 0.00 H new ATOM 0 HG3 MET A 422 4.955 -1.305 -7.909 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.360 -0.453 -9.566 1.00 0.00 H new ATOM 0 HE2 MET A 422 7.423 -0.421 -8.054 1.00 0.00 H new ATOM 0 HE3 MET A 422 8.499 -1.794 -8.404 1.00 0.00 H new ATOM 667 N PRO A 423 0.859 -1.239 -10.810 1.00 0.00 N ATOM 668 CA PRO A 423 -0.074 -1.116 -11.935 1.00 0.00 C ATOM 669 C PRO A 423 -0.910 0.157 -11.858 1.00 0.00 C ATOM 670 O PRO A 423 -1.231 0.763 -12.881 1.00 0.00 O ATOM 671 CB PRO A 423 -0.967 -2.351 -11.792 1.00 0.00 C ATOM 672 CG PRO A 423 -0.124 -3.346 -11.070 1.00 0.00 C ATOM 673 CD PRO A 423 0.809 -2.573 -10.190 1.00 0.00 C ATOM 0 HA PRO A 423 0.446 -1.057 -12.891 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -1.874 -2.121 -11.233 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.279 -2.729 -12.766 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.744 -4.019 -10.478 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.433 -3.963 -11.775 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.442 -2.523 -9.165 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.796 -3.033 -10.153 1.00 0.00 H new ATOM 681 N PHE A 424 -1.259 0.557 -10.640 1.00 0.00 N ATOM 682 CA PHE A 424 -2.059 1.759 -10.430 1.00 0.00 C ATOM 683 C PHE A 424 -1.224 3.015 -10.660 1.00 0.00 C ATOM 684 O PHE A 424 -1.742 4.050 -11.076 1.00 0.00 O ATOM 685 CB PHE A 424 -2.639 1.771 -9.015 1.00 0.00 C ATOM 686 CG PHE A 424 -3.731 0.761 -8.806 1.00 0.00 C ATOM 687 CD1 PHE A 424 -3.425 -0.562 -8.531 1.00 0.00 C ATOM 688 CD2 PHE A 424 -5.063 1.135 -8.884 1.00 0.00 C ATOM 689 CE1 PHE A 424 -4.428 -1.494 -8.339 1.00 0.00 C ATOM 690 CE2 PHE A 424 -6.070 0.208 -8.692 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.752 -1.108 -8.418 1.00 0.00 C ATOM 0 H PHE A 424 -1.001 0.067 -9.783 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.877 1.751 -11.150 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -1.838 1.581 -8.301 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -3.029 2.766 -8.799 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -2.391 -0.869 -8.466 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -5.317 2.163 -9.097 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -4.177 -2.523 -8.127 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -7.104 0.512 -8.756 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.537 -1.834 -8.266 1.00 0.00 H new ATOM 701 N GLY A 425 0.074 2.914 -10.387 1.00 0.00 N ATOM 702 CA GLY A 425 0.961 4.048 -10.569 1.00 0.00 C ATOM 703 C GLY A 425 2.318 3.831 -9.931 1.00 0.00 C ATOM 704 O GLY A 425 2.627 2.732 -9.472 1.00 0.00 O ATOM 0 H GLY A 425 0.526 2.067 -10.043 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.090 4.237 -11.635 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.500 4.938 -10.141 1.00 0.00 H new ATOM 708 N ASN A 426 3.133 4.880 -9.904 1.00 0.00 N ATOM 709 CA ASN A 426 4.467 4.798 -9.320 1.00 0.00 C ATOM 710 C ASN A 426 4.398 4.852 -7.797 1.00 0.00 C ATOM 711 O ASN A 426 4.287 5.927 -7.207 1.00 0.00 O ATOM 712 CB ASN A 426 5.345 5.937 -9.842 1.00 0.00 C ATOM 713 CG ASN A 426 5.508 5.898 -11.349 1.00 0.00 C ATOM 714 OD1 ASN A 426 5.905 4.879 -11.915 1.00 0.00 O ATOM 715 ND2 ASN A 426 5.201 7.010 -12.006 1.00 0.00 N ATOM 0 H ASN A 426 2.893 5.797 -10.280 1.00 0.00 H new ATOM 0 HA ASN A 426 4.907 3.845 -9.613 1.00 0.00 H new ATOM 0 HB2 ASN A 426 4.907 6.892 -9.551 1.00 0.00 H new ATOM 0 HB3 ASN A 426 6.327 5.880 -9.372 1.00 0.00 H new ATOM 0 HD21 ASN A 426 5.290 7.044 -13.022 1.00 0.00 H new ATOM 0 HD22 ASN A 426 4.876 7.831 -11.495 1.00 0.00 H new ATOM 722 N VAL A 427 4.464 3.684 -7.166 1.00 0.00 N ATOM 723 CA VAL A 427 4.411 3.597 -5.711 1.00 0.00 C ATOM 724 C VAL A 427 5.661 4.198 -5.079 1.00 0.00 C ATOM 725 O VAL A 427 6.767 3.687 -5.256 1.00 0.00 O ATOM 726 CB VAL A 427 4.262 2.138 -5.241 1.00 0.00 C ATOM 727 CG1 VAL A 427 4.260 2.063 -3.722 1.00 0.00 C ATOM 728 CG2 VAL A 427 2.995 1.520 -5.816 1.00 0.00 C ATOM 0 H VAL A 427 4.554 2.785 -7.639 1.00 0.00 H new ATOM 0 HA VAL A 427 3.537 4.165 -5.392 1.00 0.00 H new ATOM 0 HB VAL A 427 5.116 1.568 -5.607 1.00 0.00 H new ATOM 0 HG11 VAL A 427 4.154 1.024 -3.409 1.00 0.00 H new ATOM 0 HG12 VAL A 427 5.197 2.464 -3.337 1.00 0.00 H new ATOM 0 HG13 VAL A 427 3.427 2.647 -3.330 1.00 0.00 H new ATOM 0 HG21 VAL A 427 2.905 0.489 -5.474 1.00 0.00 H new ATOM 0 HG22 VAL A 427 2.128 2.090 -5.482 1.00 0.00 H new ATOM 0 HG23 VAL A 427 3.043 1.538 -6.905 1.00 0.00 H new ATOM 738 N VAL A 428 5.479 5.286 -4.338 1.00 0.00 N ATOM 739 CA VAL A 428 6.592 5.957 -3.676 1.00 0.00 C ATOM 740 C VAL A 428 7.198 5.075 -2.591 1.00 0.00 C ATOM 741 O VAL A 428 8.417 4.947 -2.489 1.00 0.00 O ATOM 742 CB VAL A 428 6.150 7.293 -3.051 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.165 7.760 -2.018 1.00 0.00 C ATOM 744 CG2 VAL A 428 5.952 8.347 -4.130 1.00 0.00 C ATOM 0 H VAL A 428 4.571 5.722 -4.181 1.00 0.00 H new ATOM 0 HA VAL A 428 7.343 6.154 -4.441 1.00 0.00 H new ATOM 0 HB VAL A 428 5.196 7.140 -2.546 1.00 0.00 H new ATOM 0 HG11 VAL A 428 6.836 8.706 -1.587 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.252 7.012 -1.230 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.135 7.897 -2.497 1.00 0.00 H new ATOM 0 HG21 VAL A 428 5.640 9.285 -3.670 1.00 0.00 H new ATOM 0 HG22 VAL A 428 6.889 8.500 -4.665 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.185 8.013 -4.829 1.00 0.00 H new ATOM 754 N SER A 429 6.335 4.468 -1.780 1.00 0.00 N ATOM 755 CA SER A 429 6.786 3.599 -0.698 1.00 0.00 C ATOM 756 C SER A 429 5.952 2.323 -0.644 1.00 0.00 C ATOM 757 O SER A 429 4.751 2.341 -0.910 1.00 0.00 O ATOM 758 CB SER A 429 6.702 4.334 0.642 1.00 0.00 C ATOM 759 OG SER A 429 7.237 3.545 1.690 1.00 0.00 O ATOM 0 H SER A 429 5.322 4.562 -1.852 1.00 0.00 H new ATOM 0 HA SER A 429 7.824 3.326 -0.891 1.00 0.00 H new ATOM 0 HB2 SER A 429 7.246 5.277 0.578 1.00 0.00 H new ATOM 0 HB3 SER A 429 5.663 4.580 0.861 1.00 0.00 H new ATOM 0 HG SER A 429 7.278 4.077 2.512 1.00 0.00 H new ATOM 765 N ALA A 430 6.601 1.216 -0.297 1.00 0.00 N ATOM 766 CA ALA A 430 5.920 -0.071 -0.206 1.00 0.00 C ATOM 767 C ALA A 430 6.675 -1.027 0.710 1.00 0.00 C ATOM 768 O ALA A 430 7.727 -1.552 0.347 1.00 0.00 O ATOM 769 CB ALA A 430 5.757 -0.681 -1.590 1.00 0.00 C ATOM 0 H ALA A 430 7.596 1.184 -0.075 1.00 0.00 H new ATOM 0 HA ALA A 430 4.932 0.098 0.223 1.00 0.00 H new ATOM 0 HB1 ALA A 430 5.247 -1.641 -1.507 1.00 0.00 H new ATOM 0 HB2 ALA A 430 5.168 -0.011 -2.216 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.739 -0.829 -2.040 1.00 0.00 H new ATOM 775 N LYS A 431 6.130 -1.249 1.903 1.00 0.00 N ATOM 776 CA LYS A 431 6.751 -2.143 2.873 1.00 0.00 C ATOM 777 C LYS A 431 5.695 -2.938 3.634 1.00 0.00 C ATOM 778 O LYS A 431 4.616 -2.428 3.933 1.00 0.00 O ATOM 779 CB LYS A 431 7.610 -1.344 3.856 1.00 0.00 C ATOM 780 CG LYS A 431 7.932 -2.099 5.135 1.00 0.00 C ATOM 781 CD LYS A 431 6.871 -1.872 6.198 1.00 0.00 C ATOM 782 CE LYS A 431 7.309 -2.421 7.547 1.00 0.00 C ATOM 783 NZ LYS A 431 8.308 -1.537 8.209 1.00 0.00 N ATOM 0 H LYS A 431 5.260 -0.822 2.220 1.00 0.00 H new ATOM 0 HA LYS A 431 7.386 -2.843 2.330 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.542 -1.062 3.366 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.092 -0.419 4.110 1.00 0.00 H new ATOM 0 HG2 LYS A 431 8.011 -3.165 4.920 1.00 0.00 H new ATOM 0 HG3 LYS A 431 8.902 -1.778 5.514 1.00 0.00 H new ATOM 0 HD2 LYS A 431 6.666 -0.805 6.287 1.00 0.00 H new ATOM 0 HD3 LYS A 431 5.941 -2.351 5.893 1.00 0.00 H new ATOM 0 HE2 LYS A 431 6.438 -2.533 8.193 1.00 0.00 H new ATOM 0 HE3 LYS A 431 7.736 -3.415 7.413 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 8.505 -1.892 9.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 9.188 -1.531 7.655 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 7.930 -0.570 8.269 1.00 0.00 H new ATOM 797 N VAL A 432 6.014 -4.191 3.945 1.00 0.00 N ATOM 798 CA VAL A 432 5.093 -5.055 4.674 1.00 0.00 C ATOM 799 C VAL A 432 5.638 -5.396 6.056 1.00 0.00 C ATOM 800 O VAL A 432 6.850 -5.487 6.253 1.00 0.00 O ATOM 801 CB VAL A 432 4.824 -6.362 3.904 1.00 0.00 C ATOM 802 CG1 VAL A 432 4.035 -7.336 4.766 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.087 -6.072 2.605 1.00 0.00 C ATOM 0 H VAL A 432 6.903 -4.630 3.704 1.00 0.00 H new ATOM 0 HA VAL A 432 4.158 -4.505 4.781 1.00 0.00 H new ATOM 0 HB VAL A 432 5.781 -6.823 3.658 1.00 0.00 H new ATOM 0 HG11 VAL A 432 3.854 -8.253 4.206 1.00 0.00 H new ATOM 0 HG12 VAL A 432 4.603 -7.567 5.667 1.00 0.00 H new ATOM 0 HG13 VAL A 432 3.082 -6.886 5.043 1.00 0.00 H new ATOM 0 HG21 VAL A 432 3.905 -7.006 2.074 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.135 -5.589 2.827 1.00 0.00 H new ATOM 0 HG23 VAL A 432 4.692 -5.413 1.983 1.00 0.00 H new ATOM 813 N PHE A 433 4.734 -5.585 7.012 1.00 0.00 N ATOM 814 CA PHE A 433 5.123 -5.916 8.377 1.00 0.00 C ATOM 815 C PHE A 433 5.359 -7.415 8.528 1.00 0.00 C ATOM 816 O PHE A 433 4.672 -8.228 7.908 1.00 0.00 O ATOM 817 CB PHE A 433 4.045 -5.456 9.363 1.00 0.00 C ATOM 818 CG PHE A 433 3.982 -3.966 9.529 1.00 0.00 C ATOM 819 CD1 PHE A 433 3.894 -3.135 8.425 1.00 0.00 C ATOM 820 CD2 PHE A 433 4.011 -3.395 10.792 1.00 0.00 C ATOM 821 CE1 PHE A 433 3.835 -1.762 8.575 1.00 0.00 C ATOM 822 CE2 PHE A 433 3.952 -2.022 10.948 1.00 0.00 C ATOM 823 CZ PHE A 433 3.865 -1.205 9.839 1.00 0.00 C ATOM 0 H PHE A 433 3.727 -5.514 6.866 1.00 0.00 H new ATOM 0 HA PHE A 433 6.055 -5.396 8.598 1.00 0.00 H new ATOM 0 HB2 PHE A 433 3.075 -5.817 9.022 1.00 0.00 H new ATOM 0 HB3 PHE A 433 4.233 -5.914 10.334 1.00 0.00 H new ATOM 0 HD1 PHE A 433 3.871 -3.565 7.434 1.00 0.00 H new ATOM 0 HD2 PHE A 433 4.080 -4.029 11.663 1.00 0.00 H new ATOM 0 HE1 PHE A 433 3.766 -1.126 7.705 1.00 0.00 H new ATOM 0 HE2 PHE A 433 3.974 -1.589 11.937 1.00 0.00 H new ATOM 0 HZ PHE A 433 3.820 -0.133 9.959 1.00 0.00 H new ATOM 983 N CYS A 443 -0.089 -9.685 7.779 1.00 0.00 N ATOM 984 CA CYS A 443 -1.208 -9.577 6.850 1.00 0.00 C ATOM 985 C CYS A 443 -1.582 -8.117 6.617 1.00 0.00 C ATOM 986 O CYS A 443 -2.750 -7.792 6.396 1.00 0.00 O ATOM 987 CB CYS A 443 -2.417 -10.346 7.385 1.00 0.00 C ATOM 988 SG CYS A 443 -3.074 -9.701 8.941 1.00 0.00 S ATOM 0 HA CYS A 443 -0.902 -10.011 5.898 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -3.207 -10.327 6.634 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -2.136 -11.390 7.527 1.00 0.00 H new ATOM 0 HG CYS A 443 -2.508 -8.563 9.213 1.00 0.00 H new ATOM 994 N PHE A 444 -0.585 -7.240 6.667 1.00 0.00 N ATOM 995 CA PHE A 444 -0.809 -5.814 6.464 1.00 0.00 C ATOM 996 C PHE A 444 0.495 -5.103 6.115 1.00 0.00 C ATOM 997 O PHE A 444 1.576 -5.537 6.511 1.00 0.00 O ATOM 998 CB PHE A 444 -1.424 -5.189 7.718 1.00 0.00 C ATOM 999 CG PHE A 444 -0.825 -5.699 8.998 1.00 0.00 C ATOM 1000 CD1 PHE A 444 0.494 -5.421 9.320 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -1.581 -6.456 9.879 1.00 0.00 C ATOM 1002 CE1 PHE A 444 1.047 -5.889 10.496 1.00 0.00 C ATOM 1003 CE2 PHE A 444 -1.033 -6.927 11.056 1.00 0.00 C ATOM 1004 CZ PHE A 444 0.283 -6.643 11.366 1.00 0.00 C ATOM 0 H PHE A 444 0.387 -7.492 6.847 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.501 -5.696 5.631 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -1.299 -4.107 7.674 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.496 -5.386 7.724 1.00 0.00 H new ATOM 0 HD1 PHE A 444 1.096 -4.832 8.644 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -2.611 -6.680 9.642 1.00 0.00 H new ATOM 0 HE1 PHE A 444 2.076 -5.666 10.735 1.00 0.00 H new ATOM 0 HE2 PHE A 444 -1.633 -7.517 11.733 1.00 0.00 H new ATOM 0 HZ PHE A 444 0.714 -7.009 12.286 1.00 0.00 H new ATOM 1014 N GLY A 445 0.383 -4.007 5.370 1.00 0.00 N ATOM 1015 CA GLY A 445 1.560 -3.253 4.979 1.00 0.00 C ATOM 1016 C GLY A 445 1.258 -1.786 4.746 1.00 0.00 C ATOM 1017 O GLY A 445 0.106 -1.360 4.835 1.00 0.00 O ATOM 0 H GLY A 445 -0.501 -3.628 5.031 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.321 -3.345 5.754 1.00 0.00 H new ATOM 0 HA3 GLY A 445 1.978 -3.684 4.069 1.00 0.00 H new ATOM 1021 N PHE A 446 2.295 -1.011 4.448 1.00 0.00 N ATOM 1022 CA PHE A 446 2.135 0.419 4.204 1.00 0.00 C ATOM 1023 C PHE A 446 2.505 0.770 2.767 1.00 0.00 C ATOM 1024 O PHE A 446 3.269 0.055 2.118 1.00 0.00 O ATOM 1025 CB PHE A 446 3.000 1.224 5.177 1.00 0.00 C ATOM 1026 CG PHE A 446 3.016 2.697 4.887 1.00 0.00 C ATOM 1027 CD1 PHE A 446 1.864 3.455 5.022 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.182 3.324 4.481 1.00 0.00 C ATOM 1029 CE1 PHE A 446 1.875 4.811 4.755 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.199 4.680 4.213 1.00 0.00 C ATOM 1031 CZ PHE A 446 3.045 5.424 4.351 1.00 0.00 C ATOM 0 H PHE A 446 3.255 -1.348 4.369 1.00 0.00 H new ATOM 0 HA PHE A 446 1.087 0.674 4.363 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.635 1.066 6.192 1.00 0.00 H new ATOM 0 HB3 PHE A 446 4.021 0.844 5.143 1.00 0.00 H new ATOM 0 HD1 PHE A 446 0.947 2.981 5.339 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.088 2.747 4.372 1.00 0.00 H new ATOM 0 HE1 PHE A 446 0.970 5.391 4.862 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.115 5.157 3.896 1.00 0.00 H new ATOM 0 HZ PHE A 446 3.057 6.484 4.143 1.00 0.00 H new ATOM 1041 N VAL A 447 1.956 1.876 2.274 1.00 0.00 N ATOM 1042 CA VAL A 447 2.228 2.324 0.914 1.00 0.00 C ATOM 1043 C VAL A 447 1.938 3.812 0.756 1.00 0.00 C ATOM 1044 O VAL A 447 1.099 4.369 1.465 1.00 0.00 O ATOM 1045 CB VAL A 447 1.393 1.537 -0.114 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.483 2.187 -1.486 1.00 0.00 C ATOM 1047 CG2 VAL A 447 1.848 0.086 -0.172 1.00 0.00 C ATOM 0 H VAL A 447 1.320 2.478 2.797 1.00 0.00 H new ATOM 0 HA VAL A 447 3.286 2.142 0.727 1.00 0.00 H new ATOM 0 HB VAL A 447 0.350 1.555 0.202 1.00 0.00 H new ATOM 0 HG11 VAL A 447 0.887 1.617 -2.199 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.104 3.208 -1.431 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.522 2.203 -1.814 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.247 -0.455 -0.903 1.00 0.00 H new ATOM 0 HG22 VAL A 447 2.898 0.045 -0.463 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.726 -0.373 0.809 1.00 0.00 H new ATOM 1057 N SER A 448 2.636 4.451 -0.178 1.00 0.00 N ATOM 1058 CA SER A 448 2.456 5.875 -0.426 1.00 0.00 C ATOM 1059 C SER A 448 2.763 6.216 -1.881 1.00 0.00 C ATOM 1060 O SER A 448 3.555 5.539 -2.536 1.00 0.00 O ATOM 1061 CB SER A 448 3.355 6.694 0.501 1.00 0.00 C ATOM 1062 OG SER A 448 4.697 6.690 0.045 1.00 0.00 O ATOM 0 H SER A 448 3.332 4.004 -0.775 1.00 0.00 H new ATOM 0 HA SER A 448 1.414 6.124 -0.224 1.00 0.00 H new ATOM 0 HB2 SER A 448 2.989 7.719 0.555 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.310 6.286 1.511 1.00 0.00 H new ATOM 0 HG SER A 448 4.931 7.580 -0.291 1.00 0.00 H new ATOM 1068 N TYR A 449 2.128 7.271 -2.381 1.00 0.00 N ATOM 1069 CA TYR A 449 2.329 7.701 -3.760 1.00 0.00 C ATOM 1070 C TYR A 449 2.921 9.106 -3.811 1.00 0.00 C ATOM 1071 O TYR A 449 3.206 9.710 -2.777 1.00 0.00 O ATOM 1072 CB TYR A 449 1.007 7.664 -4.527 1.00 0.00 C ATOM 1073 CG TYR A 449 0.624 6.281 -5.007 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.644 5.195 -4.142 1.00 0.00 C ATOM 1075 CD2 TYR A 449 0.245 6.063 -6.325 1.00 0.00 C ATOM 1076 CE1 TYR A 449 0.296 3.930 -4.577 1.00 0.00 C ATOM 1077 CE2 TYR A 449 -0.106 4.802 -6.768 1.00 0.00 C ATOM 1078 CZ TYR A 449 -0.079 3.739 -5.890 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.427 2.481 -6.327 1.00 0.00 O ATOM 0 H TYR A 449 1.470 7.844 -1.852 1.00 0.00 H new ATOM 0 HA TYR A 449 3.032 7.013 -4.229 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.214 8.050 -3.886 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.076 8.332 -5.386 1.00 0.00 H new ATOM 0 HD1 TYR A 449 0.936 5.341 -3.113 1.00 0.00 H new ATOM 0 HD2 TYR A 449 0.224 6.893 -7.016 1.00 0.00 H new ATOM 0 HE1 TYR A 449 0.318 3.095 -3.892 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -0.400 4.650 -7.796 1.00 0.00 H new ATOM 0 HH TYR A 449 0.212 2.183 -7.008 1.00 0.00 H new ATOM 1089 N ASP A 450 3.100 9.623 -5.022 1.00 0.00 N ATOM 1090 CA ASP A 450 3.654 10.958 -5.211 1.00 0.00 C ATOM 1091 C ASP A 450 2.595 12.026 -4.959 1.00 0.00 C ATOM 1092 O ASP A 450 2.910 13.209 -4.839 1.00 0.00 O ATOM 1093 CB ASP A 450 4.218 11.104 -6.625 1.00 0.00 C ATOM 1094 CG ASP A 450 3.179 11.590 -7.615 1.00 0.00 C ATOM 1095 OD1 ASP A 450 2.953 12.816 -7.687 1.00 0.00 O ATOM 1096 OD2 ASP A 450 2.591 10.743 -8.320 1.00 0.00 O ATOM 0 H ASP A 450 2.869 9.137 -5.888 1.00 0.00 H new ATOM 0 HA ASP A 450 4.461 11.095 -4.491 1.00 0.00 H new ATOM 0 HB2 ASP A 450 5.055 11.802 -6.609 1.00 0.00 H new ATOM 0 HB3 ASP A 450 4.611 10.143 -6.957 1.00 0.00 H new ATOM 1101 N ASN A 451 1.339 11.600 -4.881 1.00 0.00 N ATOM 1102 CA ASN A 451 0.233 12.521 -4.644 1.00 0.00 C ATOM 1103 C ASN A 451 -0.984 11.781 -4.099 1.00 0.00 C ATOM 1104 O ASN A 451 -1.118 10.565 -4.242 1.00 0.00 O ATOM 1105 CB ASN A 451 -0.136 13.250 -5.938 1.00 0.00 C ATOM 1106 CG ASN A 451 0.108 12.401 -7.170 1.00 0.00 C ATOM 1107 OD1 ASN A 451 0.259 11.182 -7.078 1.00 0.00 O ATOM 1108 ND2 ASN A 451 0.150 13.042 -8.332 1.00 0.00 N ATOM 0 H ASN A 451 1.061 10.623 -4.978 1.00 0.00 H new ATOM 0 HA ASN A 451 0.554 13.252 -3.901 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -1.186 13.539 -5.902 1.00 0.00 H new ATOM 0 HB3 ASN A 451 0.445 14.169 -6.012 1.00 0.00 H new ATOM 0 HD21 ASN A 451 0.313 12.523 -9.195 1.00 0.00 H new ATOM 0 HD22 ASN A 451 0.020 14.053 -8.362 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.895 12.530 -3.461 1.00 0.00 N ATOM 1116 CA PRO A 452 -3.119 11.966 -2.883 1.00 0.00 C ATOM 1117 C PRO A 452 -4.159 11.625 -3.945 1.00 0.00 C ATOM 1118 O PRO A 452 -5.070 10.833 -3.705 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.631 13.086 -1.974 1.00 0.00 C ATOM 1120 CG PRO A 452 -3.113 14.340 -2.591 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.802 13.985 -3.254 1.00 0.00 C ATOM 0 HA PRO A 452 -2.928 11.028 -2.361 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.720 13.089 -1.925 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -3.266 12.966 -0.954 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.821 14.735 -3.319 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -2.969 15.113 -1.836 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.674 14.516 -4.197 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -0.952 14.246 -2.624 1.00 0.00 H new ATOM 1129 N VAL A 453 -4.015 12.227 -5.121 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.941 11.986 -6.222 1.00 0.00 C ATOM 1131 C VAL A 453 -4.726 10.603 -6.827 1.00 0.00 C ATOM 1132 O VAL A 453 -5.683 9.886 -7.117 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.788 13.048 -7.327 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.765 12.782 -8.462 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.990 14.444 -6.756 1.00 0.00 C ATOM 0 H VAL A 453 -3.266 12.885 -5.336 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.948 12.046 -5.809 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.776 12.987 -7.728 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.642 13.542 -9.233 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.569 11.798 -8.888 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.785 12.815 -8.079 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.878 15.182 -7.551 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.989 14.521 -6.327 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -4.247 14.631 -5.980 1.00 0.00 H new ATOM 1145 N SER A 454 -3.462 10.236 -7.017 1.00 0.00 N ATOM 1146 CA SER A 454 -3.121 8.940 -7.591 1.00 0.00 C ATOM 1147 C SER A 454 -3.304 7.826 -6.565 1.00 0.00 C ATOM 1148 O SER A 454 -3.861 6.772 -6.870 1.00 0.00 O ATOM 1149 CB SER A 454 -1.679 8.949 -8.101 1.00 0.00 C ATOM 1150 OG SER A 454 -1.576 9.642 -9.332 1.00 0.00 O ATOM 0 H SER A 454 -2.658 10.818 -6.782 1.00 0.00 H new ATOM 0 HA SER A 454 -3.794 8.752 -8.428 1.00 0.00 H new ATOM 0 HB2 SER A 454 -1.031 9.419 -7.361 1.00 0.00 H new ATOM 0 HB3 SER A 454 -1.328 7.925 -8.227 1.00 0.00 H new ATOM 0 HG SER A 454 -0.644 9.634 -9.635 1.00 0.00 H new ATOM 1156 N ALA A 455 -2.830 8.068 -5.347 1.00 0.00 N ATOM 1157 CA ALA A 455 -2.942 7.087 -4.276 1.00 0.00 C ATOM 1158 C ALA A 455 -4.381 6.609 -4.116 1.00 0.00 C ATOM 1159 O ALA A 455 -4.628 5.445 -3.799 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.432 7.673 -2.968 1.00 0.00 C ATOM 0 H ALA A 455 -2.365 8.935 -5.078 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.328 6.226 -4.541 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -2.522 6.929 -2.177 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.386 7.959 -3.081 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.022 8.552 -2.708 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.329 7.515 -4.339 1.00 0.00 N ATOM 1167 CA GLN A 456 -6.744 7.185 -4.218 1.00 0.00 C ATOM 1168 C GLN A 456 -7.149 6.139 -5.251 1.00 0.00 C ATOM 1169 O GLN A 456 -7.858 5.183 -4.937 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.598 8.443 -4.387 1.00 0.00 C ATOM 1171 CG GLN A 456 -7.713 9.275 -3.119 1.00 0.00 C ATOM 1172 CD GLN A 456 -8.889 8.865 -2.256 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -8.609 8.148 -1.174 1.00 0.00 O flip ATOM 1174 NE2 GLN A 456 -10.038 9.190 -2.558 1.00 0.00 N flip ATOM 0 H GLN A 456 -5.142 8.482 -4.604 1.00 0.00 H new ATOM 0 HA GLN A 456 -6.911 6.771 -3.224 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.170 9.059 -5.178 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.597 8.153 -4.713 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -6.793 9.180 -2.542 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -7.813 10.327 -3.387 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -10.208 9.742 -3.399 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -10.820 8.907 -1.967 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.693 6.326 -6.486 1.00 0.00 N ATOM 1184 CA ALA A 457 -7.006 5.397 -7.565 1.00 0.00 C ATOM 1185 C ALA A 457 -6.916 3.952 -7.088 1.00 0.00 C ATOM 1186 O ALA A 457 -7.743 3.115 -7.453 1.00 0.00 O ATOM 1187 CB ALA A 457 -6.072 5.624 -8.744 1.00 0.00 C ATOM 0 H ALA A 457 -6.106 7.112 -6.764 1.00 0.00 H new ATOM 0 HA ALA A 457 -8.031 5.583 -7.886 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -6.317 4.924 -9.542 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.188 6.645 -9.109 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -5.041 5.467 -8.427 1.00 0.00 H new ATOM 1193 N ALA A 458 -5.909 3.664 -6.271 1.00 0.00 N ATOM 1194 CA ALA A 458 -5.713 2.319 -5.743 1.00 0.00 C ATOM 1195 C ALA A 458 -6.896 1.890 -4.881 1.00 0.00 C ATOM 1196 O ALA A 458 -7.654 0.994 -5.252 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.421 2.249 -4.944 1.00 0.00 C ATOM 0 H ALA A 458 -5.216 4.344 -5.960 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.643 1.631 -6.585 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -4.288 1.239 -4.556 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.580 2.504 -5.589 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.468 2.954 -4.114 1.00 0.00 H new ATOM 1203 N ILE A 459 -7.046 2.534 -3.728 1.00 0.00 N ATOM 1204 CA ILE A 459 -8.137 2.219 -2.815 1.00 0.00 C ATOM 1205 C ILE A 459 -9.460 2.095 -3.560 1.00 0.00 C ATOM 1206 O ILE A 459 -10.221 1.153 -3.340 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.277 3.288 -1.715 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -7.000 3.360 -0.875 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.480 2.988 -0.834 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -6.878 4.633 -0.068 1.00 0.00 C ATOM 0 H ILE A 459 -6.426 3.276 -3.405 1.00 0.00 H new ATOM 0 HA ILE A 459 -7.894 1.263 -2.352 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.431 4.257 -2.190 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -6.972 2.506 -0.198 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.136 3.273 -1.534 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.565 3.752 -0.062 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -10.385 2.984 -1.442 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -9.354 2.012 -0.366 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -5.949 4.615 0.502 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -6.874 5.491 -0.740 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -7.723 4.712 0.616 1.00 0.00 H new ATOM 1222 N GLN A 460 -9.728 3.051 -4.444 1.00 0.00 N ATOM 1223 CA GLN A 460 -10.960 3.048 -5.223 1.00 0.00 C ATOM 1224 C GLN A 460 -11.330 1.632 -5.650 1.00 0.00 C ATOM 1225 O GLN A 460 -12.463 1.190 -5.453 1.00 0.00 O ATOM 1226 CB GLN A 460 -10.811 3.942 -6.455 1.00 0.00 C ATOM 1227 CG GLN A 460 -10.763 5.425 -6.129 1.00 0.00 C ATOM 1228 CD GLN A 460 -11.323 6.287 -7.244 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -10.652 6.279 -8.390 1.00 0.00 O flip ATOM 1230 NE2 GLN A 460 -12.345 6.951 -7.077 1.00 0.00 N flip ATOM 0 H GLN A 460 -9.108 3.837 -4.638 1.00 0.00 H new ATOM 0 HA GLN A 460 -11.759 3.439 -4.594 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.900 3.666 -6.986 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -11.644 3.754 -7.132 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -11.326 5.610 -5.214 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -9.731 5.717 -5.933 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -12.828 6.927 -6.179 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -12.709 7.526 -7.837 1.00 0.00 H new ATOM 1239 N SER A 461 -10.369 0.924 -6.234 1.00 0.00 N ATOM 1240 CA SER A 461 -10.596 -0.442 -6.692 1.00 0.00 C ATOM 1241 C SER A 461 -10.108 -1.451 -5.657 1.00 0.00 C ATOM 1242 O SER A 461 -10.870 -2.296 -5.191 1.00 0.00 O ATOM 1243 CB SER A 461 -9.886 -0.679 -8.026 1.00 0.00 C ATOM 1244 OG SER A 461 -10.709 -0.302 -9.117 1.00 0.00 O ATOM 0 H SER A 461 -9.425 1.273 -6.401 1.00 0.00 H new ATOM 0 HA SER A 461 -11.669 -0.579 -6.829 1.00 0.00 H new ATOM 0 HB2 SER A 461 -8.957 -0.109 -8.053 1.00 0.00 H new ATOM 0 HB3 SER A 461 -9.617 -1.731 -8.116 1.00 0.00 H new ATOM 0 HG SER A 461 -10.231 -0.462 -9.958 1.00 0.00 H new ATOM 1250 N MET A 462 -8.831 -1.354 -5.302 1.00 0.00 N ATOM 1251 CA MET A 462 -8.240 -2.256 -4.320 1.00 0.00 C ATOM 1252 C MET A 462 -9.185 -2.470 -3.141 1.00 0.00 C ATOM 1253 O MET A 462 -9.387 -3.598 -2.694 1.00 0.00 O ATOM 1254 CB MET A 462 -6.904 -1.701 -3.825 1.00 0.00 C ATOM 1255 CG MET A 462 -5.871 -1.527 -4.925 1.00 0.00 C ATOM 1256 SD MET A 462 -5.791 -2.948 -6.033 1.00 0.00 S ATOM 1257 CE MET A 462 -5.078 -4.182 -4.949 1.00 0.00 C ATOM 0 H MET A 462 -8.186 -0.660 -5.679 1.00 0.00 H new ATOM 0 HA MET A 462 -8.068 -3.218 -4.804 1.00 0.00 H new ATOM 0 HB2 MET A 462 -7.076 -0.738 -3.345 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.502 -2.370 -3.064 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.108 -0.634 -5.503 1.00 0.00 H new ATOM 0 HG3 MET A 462 -4.891 -1.366 -4.476 1.00 0.00 H new ATOM 0 HE1 MET A 462 -4.392 -4.811 -5.516 1.00 0.00 H new ATOM 0 HE2 MET A 462 -4.536 -3.688 -4.143 1.00 0.00 H new ATOM 0 HE3 MET A 462 -5.872 -4.799 -4.528 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.760 -1.381 -2.644 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.682 -1.451 -1.516 1.00 0.00 C ATOM 1269 C ASN A 463 -11.659 -2.610 -1.684 1.00 0.00 C ATOM 1270 O ASN A 463 -12.558 -2.562 -2.521 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.452 -0.135 -1.378 1.00 0.00 C ATOM 1272 CG ASN A 463 -12.542 -0.212 -0.327 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -12.280 -0.057 0.866 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -13.772 -0.450 -0.766 1.00 0.00 N ATOM 0 H ASN A 463 -9.604 -0.439 -3.004 1.00 0.00 H new ATOM 0 HA ASN A 463 -10.099 -1.619 -0.611 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.757 0.664 -1.119 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -11.895 0.126 -2.339 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -14.547 -0.511 -0.105 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -13.943 -0.572 -1.764 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.476 -3.652 -0.879 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.349 -4.809 -0.953 1.00 0.00 C ATOM 1283 C GLY A 464 -12.010 -5.717 -2.119 1.00 0.00 C ATOM 1284 O GLY A 464 -12.888 -6.377 -2.676 1.00 0.00 O ATOM 0 H GLY A 464 -10.739 -3.716 -0.177 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.278 -5.374 -0.024 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.383 -4.475 -1.045 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.735 -5.749 -2.490 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.283 -6.582 -3.600 1.00 0.00 C ATOM 1290 C PHE A 465 -10.393 -8.063 -3.249 1.00 0.00 C ATOM 1291 O PHE A 465 -9.713 -8.549 -2.346 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.837 -6.239 -3.965 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.300 -7.050 -5.110 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.715 -8.286 -4.885 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -8.380 -6.577 -6.409 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.220 -9.035 -5.935 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -7.887 -7.322 -7.464 1.00 0.00 C ATOM 1298 CZ PHE A 465 -7.305 -8.553 -7.227 1.00 0.00 C ATOM 0 H PHE A 465 -9.996 -5.209 -2.040 1.00 0.00 H new ATOM 0 HA PHE A 465 -10.925 -6.382 -4.458 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.776 -5.181 -4.219 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.204 -6.394 -3.092 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -7.645 -8.668 -3.877 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -8.833 -5.615 -6.600 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -6.767 -9.997 -5.746 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -7.957 -6.942 -8.473 1.00 0.00 H new ATOM 0 HZ PHE A 465 -6.918 -9.136 -8.049 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.255 -8.772 -3.970 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.456 -10.196 -3.735 1.00 0.00 C ATOM 1310 C GLN A 466 -10.207 -10.992 -4.106 1.00 0.00 C ATOM 1311 O GLN A 466 -9.888 -11.148 -5.285 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.655 -10.705 -4.539 1.00 0.00 C ATOM 1313 CG GLN A 466 -13.172 -12.055 -4.071 1.00 0.00 C ATOM 1314 CD GLN A 466 -12.327 -13.209 -4.572 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -11.511 -13.048 -5.479 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -12.517 -14.383 -3.981 1.00 0.00 N ATOM 0 H GLN A 466 -11.825 -8.384 -4.721 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.653 -10.337 -2.672 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.461 -9.974 -4.475 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -12.373 -10.777 -5.589 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -13.195 -12.073 -2.981 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -14.198 -12.185 -4.414 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -13.204 -14.472 -3.233 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -11.976 -15.196 -4.275 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.507 -11.489 -3.093 1.00 0.00 N ATOM 1326 CA ILE A 467 -8.294 -12.267 -3.313 1.00 0.00 C ATOM 1327 C ILE A 467 -8.371 -13.616 -2.606 1.00 0.00 C ATOM 1328 O ILE A 467 -8.622 -13.686 -1.404 1.00 0.00 O ATOM 1329 CB ILE A 467 -7.044 -11.512 -2.821 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -5.776 -12.175 -3.364 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -7.016 -11.469 -1.301 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.531 -11.334 -3.184 1.00 0.00 C ATOM 0 H ILE A 467 -9.758 -11.367 -2.112 1.00 0.00 H new ATOM 0 HA ILE A 467 -8.212 -12.427 -4.388 1.00 0.00 H new ATOM 0 HB ILE A 467 -7.085 -10.488 -3.193 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.633 -13.133 -2.864 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -5.912 -12.387 -4.425 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -6.127 -10.933 -0.968 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -7.906 -10.958 -0.935 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -6.994 -12.486 -0.909 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.671 -11.865 -3.591 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.653 -10.386 -3.708 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.371 -11.144 -2.123 1.00 0.00 H new ATOM 1344 N GLY A 468 -8.149 -14.687 -3.363 1.00 0.00 N ATOM 1345 CA GLY A 468 -8.196 -16.020 -2.792 1.00 0.00 C ATOM 1346 C GLY A 468 -9.577 -16.385 -2.282 1.00 0.00 C ATOM 1347 O GLY A 468 -10.472 -16.699 -3.066 1.00 0.00 O ATOM 0 H GLY A 468 -7.938 -14.655 -4.360 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -7.887 -16.745 -3.545 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -7.480 -16.086 -1.973 1.00 0.00 H new ATOM 1351 N MET A 469 -9.750 -16.344 -0.965 1.00 0.00 N ATOM 1352 CA MET A 469 -11.030 -16.673 -0.352 1.00 0.00 C ATOM 1353 C MET A 469 -11.526 -15.525 0.522 1.00 0.00 C ATOM 1354 O MET A 469 -12.586 -15.616 1.142 1.00 0.00 O ATOM 1355 CB MET A 469 -10.908 -17.950 0.483 1.00 0.00 C ATOM 1356 CG MET A 469 -10.766 -19.211 -0.353 1.00 0.00 C ATOM 1357 SD MET A 469 -9.998 -20.565 0.559 1.00 0.00 S ATOM 1358 CE MET A 469 -11.386 -21.150 1.528 1.00 0.00 C ATOM 0 H MET A 469 -9.019 -16.086 -0.302 1.00 0.00 H new ATOM 0 HA MET A 469 -11.754 -16.838 -1.150 1.00 0.00 H new ATOM 0 HB2 MET A 469 -10.045 -17.862 1.143 1.00 0.00 H new ATOM 0 HB3 MET A 469 -11.788 -18.043 1.120 1.00 0.00 H new ATOM 0 HG2 MET A 469 -11.750 -19.524 -0.701 1.00 0.00 H new ATOM 0 HG3 MET A 469 -10.170 -18.990 -1.239 1.00 0.00 H new ATOM 0 HE1 MET A 469 -11.070 -21.990 2.147 1.00 0.00 H new ATOM 0 HE2 MET A 469 -11.749 -20.345 2.167 1.00 0.00 H new ATOM 0 HE3 MET A 469 -12.185 -21.472 0.861 1.00 0.00 H new ATOM 1368 N LYS A 470 -10.753 -14.446 0.568 1.00 0.00 N ATOM 1369 CA LYS A 470 -11.112 -13.279 1.365 1.00 0.00 C ATOM 1370 C LYS A 470 -10.986 -12.000 0.544 1.00 0.00 C ATOM 1371 O LYS A 470 -10.623 -12.039 -0.632 1.00 0.00 O ATOM 1372 CB LYS A 470 -10.223 -13.191 2.607 1.00 0.00 C ATOM 1373 CG LYS A 470 -8.768 -13.534 2.339 1.00 0.00 C ATOM 1374 CD LYS A 470 -7.973 -12.308 1.922 1.00 0.00 C ATOM 1375 CE LYS A 470 -6.498 -12.459 2.258 1.00 0.00 C ATOM 1376 NZ LYS A 470 -5.956 -13.768 1.801 1.00 0.00 N ATOM 0 H LYS A 470 -9.872 -14.355 0.062 1.00 0.00 H new ATOM 0 HA LYS A 470 -12.151 -13.388 1.677 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.281 -12.181 3.014 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -10.612 -13.865 3.370 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.325 -13.968 3.235 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.710 -14.290 1.556 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -8.088 -12.146 0.850 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -8.373 -11.426 2.423 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -5.935 -11.650 1.792 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -6.359 -12.365 3.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -4.917 -13.748 1.846 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -6.315 -14.526 2.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -6.257 -13.946 0.822 1.00 0.00 H new ATOM 1390 N ARG A 471 -11.286 -10.867 1.172 1.00 0.00 N ATOM 1391 CA ARG A 471 -11.206 -9.576 0.500 1.00 0.00 C ATOM 1392 C ARG A 471 -10.088 -8.724 1.091 1.00 0.00 C ATOM 1393 O ARG A 471 -9.583 -9.010 2.178 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.540 -8.836 0.610 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.498 -9.133 -0.532 1.00 0.00 C ATOM 1396 CD ARG A 471 -14.928 -8.758 -0.172 1.00 0.00 C ATOM 1397 NE ARG A 471 -15.886 -9.240 -1.163 1.00 0.00 N ATOM 1398 CZ ARG A 471 -16.094 -8.646 -2.332 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -15.415 -7.554 -2.656 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -16.984 -9.145 -3.183 1.00 0.00 N ATOM 0 H ARG A 471 -11.587 -10.818 2.145 1.00 0.00 H new ATOM 0 HA ARG A 471 -10.984 -9.755 -0.552 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -13.018 -9.104 1.552 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.349 -7.763 0.643 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.189 -8.582 -1.420 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.451 -10.193 -0.782 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -15.177 -9.173 0.805 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -15.008 -7.674 -0.087 1.00 0.00 H new ATOM 0 HE ARG A 471 -16.425 -10.078 -0.945 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -14.730 -7.168 -2.006 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -15.577 -7.100 -3.555 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -17.508 -9.985 -2.938 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -17.143 -8.688 -4.081 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.705 -7.676 0.370 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.646 -6.780 0.823 1.00 0.00 C ATOM 1416 C LEU A 472 -9.229 -5.481 1.369 1.00 0.00 C ATOM 1417 O LEU A 472 -10.310 -5.053 0.964 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.682 -6.478 -0.326 1.00 0.00 C ATOM 1419 CG LEU A 472 -6.891 -7.667 -0.869 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -5.905 -7.211 -1.933 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -6.167 -8.388 0.259 1.00 0.00 C ATOM 0 H LEU A 472 -10.112 -7.425 -0.531 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.101 -7.277 1.626 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.252 -6.041 -1.146 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -6.975 -5.720 0.010 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.591 -8.365 -1.327 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.351 -8.071 -2.308 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.447 -6.742 -2.754 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.209 -6.492 -1.500 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -5.609 -9.232 -0.147 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -5.478 -7.699 0.748 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -6.895 -8.750 0.985 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.504 -4.856 2.291 1.00 0.00 N ATOM 1434 CA LYS A 473 -8.946 -3.603 2.892 1.00 0.00 C ATOM 1435 C LYS A 473 -7.834 -2.559 2.853 1.00 0.00 C ATOM 1436 O LYS A 473 -6.926 -2.574 3.684 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.391 -3.836 4.338 1.00 0.00 C ATOM 1438 CG LYS A 473 -9.779 -2.561 5.067 1.00 0.00 C ATOM 1439 CD LYS A 473 -9.654 -2.720 6.573 1.00 0.00 C ATOM 1440 CE LYS A 473 -10.685 -1.879 7.310 1.00 0.00 C ATOM 1441 NZ LYS A 473 -10.277 -0.449 7.394 1.00 0.00 N ATOM 0 H LYS A 473 -7.608 -5.197 2.638 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.791 -3.230 2.314 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -10.240 -4.520 4.343 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.584 -4.325 4.883 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -9.143 -1.742 4.733 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -10.804 -2.293 4.812 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -9.780 -3.769 6.841 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -8.652 -2.429 6.889 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -11.646 -1.953 6.800 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -10.826 -2.276 8.315 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -11.006 0.091 7.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -9.373 -0.375 7.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -10.167 -0.062 6.435 1.00 0.00 H new ATOM 1455 N VAL A 474 -7.911 -1.654 1.884 1.00 0.00 N ATOM 1456 CA VAL A 474 -6.914 -0.602 1.738 1.00 0.00 C ATOM 1457 C VAL A 474 -7.488 0.758 2.122 1.00 0.00 C ATOM 1458 O VAL A 474 -8.639 1.065 1.814 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.378 -0.531 0.295 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -5.070 0.243 0.249 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -6.200 -1.930 -0.275 1.00 0.00 C ATOM 0 H VAL A 474 -8.655 -1.628 1.187 1.00 0.00 H new ATOM 0 HA VAL A 474 -6.093 -0.850 2.411 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.106 -0.002 -0.320 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -4.707 0.283 -0.778 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.234 1.256 0.615 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.331 -0.255 0.877 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.821 -1.862 -1.295 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.492 -2.486 0.339 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -7.160 -2.446 -0.279 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.678 1.567 2.796 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.106 2.894 3.222 1.00 0.00 C ATOM 1473 C GLN A 475 -5.905 3.807 3.449 1.00 0.00 C ATOM 1474 O GLN A 475 -4.836 3.354 3.859 1.00 0.00 O ATOM 1475 CB GLN A 475 -7.938 2.798 4.502 1.00 0.00 C ATOM 1476 CG GLN A 475 -8.647 4.093 4.866 1.00 0.00 C ATOM 1477 CD GLN A 475 -9.893 3.862 5.698 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -10.443 2.760 5.721 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -10.345 4.902 6.389 1.00 0.00 N ATOM 0 H GLN A 475 -5.722 1.327 3.059 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.720 3.322 2.429 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -8.680 2.008 4.385 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.288 2.505 5.327 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -7.961 4.736 5.417 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -8.917 4.624 3.953 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -9.858 5.797 6.341 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -11.179 4.806 6.968 1.00 0.00 H new ATOM 1488 N LEU A 476 -6.090 5.095 3.181 1.00 0.00 N ATOM 1489 CA LEU A 476 -5.021 6.073 3.356 1.00 0.00 C ATOM 1490 C LEU A 476 -5.106 6.733 4.728 1.00 0.00 C ATOM 1491 O LEU A 476 -6.151 7.256 5.115 1.00 0.00 O ATOM 1492 CB LEU A 476 -5.092 7.137 2.260 1.00 0.00 C ATOM 1493 CG LEU A 476 -6.123 8.248 2.469 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.632 9.244 3.507 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -6.425 8.950 1.153 1.00 0.00 C ATOM 0 H LEU A 476 -6.969 5.486 2.842 1.00 0.00 H new ATOM 0 HA LEU A 476 -4.068 5.549 3.284 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -4.108 7.596 2.162 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.308 6.641 1.314 1.00 0.00 H new ATOM 0 HG LEU A 476 -7.045 7.797 2.837 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -6.379 10.027 3.642 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -5.469 8.731 4.455 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.696 9.690 3.170 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -7.160 9.737 1.321 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.509 9.388 0.756 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.822 8.229 0.439 1.00 0.00 H new ATOM 1507 N LYS A 477 -3.997 6.708 5.461 1.00 0.00 N ATOM 1508 CA LYS A 477 -3.944 7.306 6.790 1.00 0.00 C ATOM 1509 C LYS A 477 -4.804 8.565 6.855 1.00 0.00 C ATOM 1510 O LYS A 477 -4.476 9.585 6.247 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.499 7.644 7.162 1.00 0.00 C ATOM 1512 CG LYS A 477 -2.310 7.969 8.633 1.00 0.00 C ATOM 1513 CD LYS A 477 -0.895 8.443 8.922 1.00 0.00 C ATOM 1514 CE LYS A 477 -0.506 8.185 10.370 1.00 0.00 C ATOM 1515 NZ LYS A 477 -0.943 9.290 11.267 1.00 0.00 N ATOM 0 H LYS A 477 -3.123 6.280 5.157 1.00 0.00 H new ATOM 0 HA LYS A 477 -4.337 6.581 7.503 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.859 6.802 6.899 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -2.168 8.494 6.565 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -3.021 8.740 8.931 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -2.528 7.085 9.233 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.196 7.932 8.260 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -0.816 9.509 8.707 1.00 0.00 H new ATOM 0 HE2 LYS A 477 -0.952 7.248 10.704 1.00 0.00 H new ATOM 0 HE3 LYS A 477 0.575 8.067 10.440 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 -0.659 9.076 12.244 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -0.498 10.180 10.964 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -1.977 9.387 11.220 1.00 0.00 H new