USER MOD reduce.3.24.130724 H: found=0, std=0, add=572, rem=0, adj=14 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 402 ASN :FLIP amide:sc= -2.36 F(o=-3.8!,f=-2.4) USER MOD Single : A 406 TYR OH : rot 180:sc= -0.868 USER MOD Single : A 407 HIS :FLIP no HD1:sc= -0.199 F(o=-1.3,f=-0.2) USER MOD Single : A 410 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 415 GLN : amide:sc= -0.537 X(o=-0.54,f=-0.97) USER MOD Single : A 419 GLN : amide:sc=-0.00583 K(o=-0.0058,f=-0.58) USER MOD Single : A 420 MET CE :methyl -142:sc= -0.0604 (180deg=-1.33) USER MOD Single : A 422 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 426 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 429 SER OG : rot 176:sc= 0.35 USER MOD Single : A 431 LYS NZ :NH3+ 151:sc= -0.575 (180deg=-1.73!) USER MOD Single : A 443 CYS SG : rot 180:sc= 0 USER MOD Single : A 448 SER OG : rot 99:sc= 1.05 USER MOD Single : A 449 TYR OH : rot -119:sc= -0.753 USER MOD Single : A 451 ASN : amide:sc= -0.695 K(o=-0.69,f=-5.3!) USER MOD Single : A 454 SER OG : rot 180:sc= 0 USER MOD Single : A 456 GLN : amide:sc= -0.0915 K(o=-0.092,f=-2) USER MOD Single : A 460 GLN : amide:sc= 0 K(o=0,f=-0.94) USER MOD Single : A 461 SER OG : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl -152:sc= -0.0705 (180deg=-0.264) USER MOD Single : A 463 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 466 GLN : amide:sc= -1.02 X(o=-1,f=-1.3) USER MOD Single : A 469 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 470 LYS NZ :NH3+ 165:sc= -0.0783 (180deg=-0.451) USER MOD Single : A 473 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 475 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 477 LYS NZ :NH3+ 162:sc= -0.0481 (180deg=-0.313) USER MOD ----------------------------------------------------------------- ATOM 225 N LYS A 395 8.728 5.120 4.448 1.00 0.00 N ATOM 226 CA LYS A 395 8.515 6.510 4.064 1.00 0.00 C ATOM 227 C LYS A 395 7.122 6.704 3.473 1.00 0.00 C ATOM 228 O LYS A 395 6.459 5.740 3.094 1.00 0.00 O ATOM 229 CB LYS A 395 9.576 6.949 3.051 1.00 0.00 C ATOM 230 CG LYS A 395 9.312 6.452 1.640 1.00 0.00 C ATOM 231 CD LYS A 395 10.118 7.232 0.615 1.00 0.00 C ATOM 232 CE LYS A 395 11.595 6.875 0.680 1.00 0.00 C ATOM 233 NZ LYS A 395 12.446 7.915 0.038 1.00 0.00 N ATOM 0 HA LYS A 395 8.599 7.125 4.960 1.00 0.00 H new ATOM 0 HB2 LYS A 395 9.627 8.038 3.040 1.00 0.00 H new ATOM 0 HB3 LYS A 395 10.551 6.587 3.378 1.00 0.00 H new ATOM 0 HG2 LYS A 395 9.563 5.393 1.573 1.00 0.00 H new ATOM 0 HG3 LYS A 395 8.249 6.542 1.414 1.00 0.00 H new ATOM 0 HD2 LYS A 395 9.736 7.024 -0.385 1.00 0.00 H new ATOM 0 HD3 LYS A 395 9.993 8.301 0.789 1.00 0.00 H new ATOM 0 HE2 LYS A 395 11.894 6.753 1.721 1.00 0.00 H new ATOM 0 HE3 LYS A 395 11.759 5.917 0.187 1.00 0.00 H new ATOM 0 HZ1 LYS A 395 13.445 7.635 0.103 1.00 0.00 H new ATOM 0 HZ2 LYS A 395 12.179 8.014 -0.962 1.00 0.00 H new ATOM 0 HZ3 LYS A 395 12.309 8.824 0.524 1.00 0.00 H new ATOM 247 N GLU A 396 6.686 7.958 3.399 1.00 0.00 N ATOM 248 CA GLU A 396 5.372 8.277 2.854 1.00 0.00 C ATOM 249 C GLU A 396 5.466 9.405 1.830 1.00 0.00 C ATOM 250 O GLU A 396 6.556 9.878 1.510 1.00 0.00 O ATOM 251 CB GLU A 396 4.411 8.672 3.978 1.00 0.00 C ATOM 252 CG GLU A 396 4.952 9.765 4.884 1.00 0.00 C ATOM 253 CD GLU A 396 3.966 10.169 5.963 1.00 0.00 C ATOM 254 OE1 GLU A 396 2.760 9.890 5.798 1.00 0.00 O ATOM 255 OE2 GLU A 396 4.400 10.764 6.971 1.00 0.00 O ATOM 0 H GLU A 396 7.223 8.768 3.709 1.00 0.00 H new ATOM 0 HA GLU A 396 4.989 7.387 2.354 1.00 0.00 H new ATOM 0 HB2 GLU A 396 3.471 9.007 3.540 1.00 0.00 H new ATOM 0 HB3 GLU A 396 4.187 7.791 4.579 1.00 0.00 H new ATOM 0 HG2 GLU A 396 5.875 9.421 5.351 1.00 0.00 H new ATOM 0 HG3 GLU A 396 5.205 10.638 4.283 1.00 0.00 H new ATOM 262 N GLY A 397 4.315 9.831 1.319 1.00 0.00 N ATOM 263 CA GLY A 397 4.289 10.899 0.338 1.00 0.00 C ATOM 264 C GLY A 397 3.934 12.240 0.949 1.00 0.00 C ATOM 265 O GLY A 397 4.274 12.534 2.095 1.00 0.00 O ATOM 0 H GLY A 397 3.400 9.455 1.567 1.00 0.00 H new ATOM 0 HA2 GLY A 397 5.264 10.970 -0.143 1.00 0.00 H new ATOM 0 HA3 GLY A 397 3.566 10.655 -0.441 1.00 0.00 H new ATOM 269 N PRO A 398 3.236 13.083 0.173 1.00 0.00 N ATOM 270 CA PRO A 398 2.821 14.414 0.623 1.00 0.00 C ATOM 271 C PRO A 398 1.684 14.355 1.637 1.00 0.00 C ATOM 272 O PRO A 398 0.872 13.432 1.619 1.00 0.00 O ATOM 273 CB PRO A 398 2.353 15.095 -0.666 1.00 0.00 C ATOM 274 CG PRO A 398 1.914 13.976 -1.547 1.00 0.00 C ATOM 275 CD PRO A 398 2.797 12.799 -1.205 1.00 0.00 C ATOM 0 HA PRO A 398 3.628 14.942 1.131 1.00 0.00 H new ATOM 0 HB2 PRO A 398 1.536 15.790 -0.472 1.00 0.00 H new ATOM 0 HB3 PRO A 398 3.158 15.669 -1.126 1.00 0.00 H new ATOM 0 HG2 PRO A 398 0.864 13.737 -1.378 1.00 0.00 H new ATOM 0 HG3 PRO A 398 2.015 14.246 -2.598 1.00 0.00 H new ATOM 0 HD2 PRO A 398 2.251 11.857 -1.266 1.00 0.00 H new ATOM 0 HD3 PRO A 398 3.643 12.721 -1.887 1.00 0.00 H new ATOM 283 N GLU A 399 1.634 15.347 2.521 1.00 0.00 N ATOM 284 CA GLU A 399 0.596 15.406 3.544 1.00 0.00 C ATOM 285 C GLU A 399 -0.788 15.243 2.924 1.00 0.00 C ATOM 286 O GLU A 399 -1.366 16.199 2.407 1.00 0.00 O ATOM 287 CB GLU A 399 0.673 16.732 4.304 1.00 0.00 C ATOM 288 CG GLU A 399 -0.500 16.965 5.241 1.00 0.00 C ATOM 289 CD GLU A 399 -0.279 18.142 6.171 1.00 0.00 C ATOM 290 OE1 GLU A 399 0.594 18.045 7.057 1.00 0.00 O ATOM 291 OE2 GLU A 399 -0.982 19.163 6.011 1.00 0.00 O ATOM 0 H GLU A 399 2.299 16.120 2.549 1.00 0.00 H new ATOM 0 HA GLU A 399 0.762 14.585 4.242 1.00 0.00 H new ATOM 0 HB2 GLU A 399 1.598 16.758 4.880 1.00 0.00 H new ATOM 0 HB3 GLU A 399 0.722 17.551 3.586 1.00 0.00 H new ATOM 0 HG2 GLU A 399 -1.402 17.136 4.653 1.00 0.00 H new ATOM 0 HG3 GLU A 399 -0.671 16.066 5.833 1.00 0.00 H new ATOM 298 N GLY A 400 -1.314 14.022 2.978 1.00 0.00 N ATOM 299 CA GLY A 400 -2.626 13.755 2.418 1.00 0.00 C ATOM 300 C GLY A 400 -2.672 12.449 1.649 1.00 0.00 C ATOM 301 O GLY A 400 -3.733 11.842 1.508 1.00 0.00 O ATOM 0 H GLY A 400 -0.855 13.214 3.399 1.00 0.00 H new ATOM 0 HA2 GLY A 400 -3.362 13.726 3.222 1.00 0.00 H new ATOM 0 HA3 GLY A 400 -2.909 14.573 1.756 1.00 0.00 H new ATOM 305 N ALA A 401 -1.519 12.017 1.149 1.00 0.00 N ATOM 306 CA ALA A 401 -1.433 10.774 0.392 1.00 0.00 C ATOM 307 C ALA A 401 -0.950 9.627 1.272 1.00 0.00 C ATOM 308 O ALA A 401 0.088 9.727 1.925 1.00 0.00 O ATOM 309 CB ALA A 401 -0.510 10.949 -0.805 1.00 0.00 C ATOM 0 H ALA A 401 -0.632 12.509 1.254 1.00 0.00 H new ATOM 0 HA ALA A 401 -2.432 10.525 0.034 1.00 0.00 H new ATOM 0 HB1 ALA A 401 -0.455 10.013 -1.362 1.00 0.00 H new ATOM 0 HB2 ALA A 401 -0.899 11.734 -1.453 1.00 0.00 H new ATOM 0 HB3 ALA A 401 0.486 11.225 -0.459 1.00 0.00 H new ATOM 315 N ASN A 402 -1.709 8.536 1.285 1.00 0.00 N ATOM 316 CA ASN A 402 -1.359 7.369 2.086 1.00 0.00 C ATOM 317 C ASN A 402 -2.056 6.118 1.559 1.00 0.00 C ATOM 318 O ASN A 402 -3.039 6.205 0.824 1.00 0.00 O ATOM 319 CB ASN A 402 -1.737 7.599 3.551 1.00 0.00 C ATOM 320 CG ASN A 402 -0.746 8.495 4.270 1.00 0.00 C ATOM 321 OD1 ASN A 402 -0.935 9.803 4.148 1.00 0.00 O flip ATOM 322 ND2 ASN A 402 0.178 8.014 4.927 1.00 0.00 N flip ATOM 0 H ASN A 402 -2.571 8.436 0.749 1.00 0.00 H new ATOM 0 HA ASN A 402 -0.282 7.220 2.015 1.00 0.00 H new ATOM 0 HB2 ASN A 402 -2.730 8.046 3.601 1.00 0.00 H new ATOM 0 HB3 ASN A 402 -1.793 6.639 4.064 1.00 0.00 H new ATOM 0 HD21 ASN A 402 0.284 7.002 4.993 1.00 0.00 H new ATOM 0 HD22 ASN A 402 0.837 8.628 5.406 1.00 0.00 H new ATOM 329 N LEU A 403 -1.538 4.955 1.940 1.00 0.00 N ATOM 330 CA LEU A 403 -2.110 3.685 1.508 1.00 0.00 C ATOM 331 C LEU A 403 -1.684 2.552 2.435 1.00 0.00 C ATOM 332 O LEU A 403 -0.506 2.197 2.498 1.00 0.00 O ATOM 333 CB LEU A 403 -1.682 3.373 0.073 1.00 0.00 C ATOM 334 CG LEU A 403 -2.397 4.159 -1.027 1.00 0.00 C ATOM 335 CD1 LEU A 403 -1.928 3.704 -2.400 1.00 0.00 C ATOM 336 CD2 LEU A 403 -3.906 4.003 -0.899 1.00 0.00 C ATOM 0 H LEU A 403 -0.723 4.866 2.547 1.00 0.00 H new ATOM 0 HA LEU A 403 -3.196 3.772 1.547 1.00 0.00 H new ATOM 0 HB2 LEU A 403 -0.611 3.558 -0.014 1.00 0.00 H new ATOM 0 HB3 LEU A 403 -1.838 2.310 -0.108 1.00 0.00 H new ATOM 0 HG LEU A 403 -2.149 5.214 -0.912 1.00 0.00 H new ATOM 0 HD11 LEU A 403 -2.448 4.275 -3.170 1.00 0.00 H new ATOM 0 HD12 LEU A 403 -0.854 3.867 -2.490 1.00 0.00 H new ATOM 0 HD13 LEU A 403 -2.145 2.643 -2.526 1.00 0.00 H new ATOM 0 HD21 LEU A 403 -4.399 4.569 -1.690 1.00 0.00 H new ATOM 0 HD22 LEU A 403 -4.172 2.950 -0.987 1.00 0.00 H new ATOM 0 HD23 LEU A 403 -4.230 4.379 0.072 1.00 0.00 H new ATOM 348 N PHE A 404 -2.649 1.986 3.152 1.00 0.00 N ATOM 349 CA PHE A 404 -2.374 0.892 4.076 1.00 0.00 C ATOM 350 C PHE A 404 -3.214 -0.335 3.732 1.00 0.00 C ATOM 351 O PHE A 404 -4.440 -0.312 3.847 1.00 0.00 O ATOM 352 CB PHE A 404 -2.655 1.329 5.515 1.00 0.00 C ATOM 353 CG PHE A 404 -1.552 2.151 6.118 1.00 0.00 C ATOM 354 CD1 PHE A 404 -1.554 3.531 5.995 1.00 0.00 C ATOM 355 CD2 PHE A 404 -0.515 1.545 6.807 1.00 0.00 C ATOM 356 CE1 PHE A 404 -0.541 4.291 6.548 1.00 0.00 C ATOM 357 CE2 PHE A 404 0.501 2.299 7.364 1.00 0.00 C ATOM 358 CZ PHE A 404 0.488 3.674 7.234 1.00 0.00 C ATOM 0 H PHE A 404 -3.629 2.267 3.111 1.00 0.00 H new ATOM 0 HA PHE A 404 -1.321 0.627 3.983 1.00 0.00 H new ATOM 0 HB2 PHE A 404 -3.580 1.905 5.537 1.00 0.00 H new ATOM 0 HB3 PHE A 404 -2.816 0.444 6.130 1.00 0.00 H new ATOM 0 HD1 PHE A 404 -2.356 4.018 5.461 1.00 0.00 H new ATOM 0 HD2 PHE A 404 -0.500 0.470 6.911 1.00 0.00 H new ATOM 0 HE1 PHE A 404 -0.553 5.366 6.444 1.00 0.00 H new ATOM 0 HE2 PHE A 404 1.303 1.814 7.900 1.00 0.00 H new ATOM 0 HZ PHE A 404 1.280 4.266 7.668 1.00 0.00 H new ATOM 368 N ILE A 405 -2.546 -1.402 3.306 1.00 0.00 N ATOM 369 CA ILE A 405 -3.230 -2.637 2.945 1.00 0.00 C ATOM 370 C ILE A 405 -3.345 -3.572 4.145 1.00 0.00 C ATOM 371 O ILE A 405 -2.391 -3.743 4.905 1.00 0.00 O ATOM 372 CB ILE A 405 -2.501 -3.370 1.804 1.00 0.00 C ATOM 373 CG1 ILE A 405 -2.468 -2.499 0.548 1.00 0.00 C ATOM 374 CG2 ILE A 405 -3.178 -4.703 1.514 1.00 0.00 C ATOM 375 CD1 ILE A 405 -1.349 -1.481 0.546 1.00 0.00 C ATOM 0 H ILE A 405 -1.532 -1.436 3.203 1.00 0.00 H new ATOM 0 HA ILE A 405 -4.228 -2.359 2.607 1.00 0.00 H new ATOM 0 HB ILE A 405 -1.474 -3.565 2.114 1.00 0.00 H new ATOM 0 HG12 ILE A 405 -2.365 -3.141 -0.327 1.00 0.00 H new ATOM 0 HG13 ILE A 405 -3.421 -1.979 0.451 1.00 0.00 H new ATOM 0 HG21 ILE A 405 -2.652 -5.210 0.705 1.00 0.00 H new ATOM 0 HG22 ILE A 405 -3.154 -5.325 2.409 1.00 0.00 H new ATOM 0 HG23 ILE A 405 -4.213 -4.529 1.220 1.00 0.00 H new ATOM 0 HD11 ILE A 405 -1.388 -0.899 -0.375 1.00 0.00 H new ATOM 0 HD12 ILE A 405 -1.462 -0.814 1.401 1.00 0.00 H new ATOM 0 HD13 ILE A 405 -0.390 -1.995 0.611 1.00 0.00 H new ATOM 387 N TYR A 406 -4.516 -4.177 4.306 1.00 0.00 N ATOM 388 CA TYR A 406 -4.756 -5.095 5.412 1.00 0.00 C ATOM 389 C TYR A 406 -5.303 -6.427 4.907 1.00 0.00 C ATOM 390 O TYR A 406 -5.928 -6.493 3.848 1.00 0.00 O ATOM 391 CB TYR A 406 -5.734 -4.477 6.413 1.00 0.00 C ATOM 392 CG TYR A 406 -5.504 -3.002 6.654 1.00 0.00 C ATOM 393 CD1 TYR A 406 -4.349 -2.554 7.284 1.00 0.00 C ATOM 394 CD2 TYR A 406 -6.439 -2.057 6.252 1.00 0.00 C ATOM 395 CE1 TYR A 406 -4.133 -1.208 7.507 1.00 0.00 C ATOM 396 CE2 TYR A 406 -6.231 -0.709 6.469 1.00 0.00 C ATOM 397 CZ TYR A 406 -5.078 -0.289 7.097 1.00 0.00 C ATOM 398 OH TYR A 406 -4.867 1.053 7.317 1.00 0.00 O ATOM 0 H TYR A 406 -5.314 -4.048 3.684 1.00 0.00 H new ATOM 0 HA TYR A 406 -3.804 -5.279 5.910 1.00 0.00 H new ATOM 0 HB2 TYR A 406 -6.752 -4.623 6.051 1.00 0.00 H new ATOM 0 HB3 TYR A 406 -5.654 -5.008 7.361 1.00 0.00 H new ATOM 0 HD1 TYR A 406 -3.607 -3.271 7.605 1.00 0.00 H new ATOM 0 HD2 TYR A 406 -7.344 -2.382 5.761 1.00 0.00 H new ATOM 0 HE1 TYR A 406 -3.230 -0.877 7.999 1.00 0.00 H new ATOM 0 HE2 TYR A 406 -6.968 0.012 6.148 1.00 0.00 H new ATOM 0 HH TYR A 406 -5.626 1.565 6.968 1.00 0.00 H new ATOM 408 N HIS A 407 -5.061 -7.486 5.672 1.00 0.00 N ATOM 409 CA HIS A 407 -5.529 -8.818 5.304 1.00 0.00 C ATOM 410 C HIS A 407 -4.772 -9.343 4.086 1.00 0.00 C ATOM 411 O HIS A 407 -5.378 -9.758 3.097 1.00 0.00 O ATOM 412 CB HIS A 407 -7.030 -8.792 5.013 1.00 0.00 C ATOM 413 CG HIS A 407 -7.828 -8.069 6.053 1.00 0.00 C ATOM 414 ND1 HIS A 407 -8.270 -6.790 6.101 1.00 0.00 N flip ATOM 415 CD2 HIS A 407 -8.263 -8.666 7.218 1.00 0.00 C flip ATOM 416 CE1 HIS A 407 -8.956 -6.639 7.280 1.00 0.00 C flip ATOM 417 NE2 HIS A 407 -8.938 -7.786 7.936 1.00 0.00 N flip ATOM 0 H HIS A 407 -4.544 -7.448 6.550 1.00 0.00 H new ATOM 0 HA HIS A 407 -5.341 -9.487 6.144 1.00 0.00 H new ATOM 0 HB2 HIS A 407 -7.196 -8.319 4.045 1.00 0.00 H new ATOM 0 HB3 HIS A 407 -7.394 -9.816 4.934 1.00 0.00 H new ATOM 0 HD2 HIS A 407 -8.080 -9.693 7.499 1.00 0.00 H new ATOM 0 HE1 HIS A 407 -9.433 -5.730 7.617 1.00 0.00 H new ATOM 0 HE2 HIS A 407 -9.371 -7.962 8.842 1.00 0.00 H new ATOM 425 N LEU A 408 -3.447 -9.319 4.164 1.00 0.00 N ATOM 426 CA LEU A 408 -2.607 -9.791 3.069 1.00 0.00 C ATOM 427 C LEU A 408 -2.178 -11.237 3.296 1.00 0.00 C ATOM 428 O LEU A 408 -1.716 -11.611 4.374 1.00 0.00 O ATOM 429 CB LEU A 408 -1.373 -8.898 2.925 1.00 0.00 C ATOM 430 CG LEU A 408 -1.583 -7.580 2.179 1.00 0.00 C ATOM 431 CD1 LEU A 408 -0.476 -6.592 2.518 1.00 0.00 C ATOM 432 CD2 LEU A 408 -1.644 -7.819 0.678 1.00 0.00 C ATOM 0 H LEU A 408 -2.930 -8.978 4.974 1.00 0.00 H new ATOM 0 HA LEU A 408 -3.191 -9.744 2.150 1.00 0.00 H new ATOM 0 HB2 LEU A 408 -0.994 -8.672 3.922 1.00 0.00 H new ATOM 0 HB3 LEU A 408 -0.597 -9.464 2.410 1.00 0.00 H new ATOM 0 HG LEU A 408 -2.534 -7.153 2.497 1.00 0.00 H new ATOM 0 HD11 LEU A 408 -0.642 -5.660 1.978 1.00 0.00 H new ATOM 0 HD12 LEU A 408 -0.479 -6.396 3.590 1.00 0.00 H new ATOM 0 HD13 LEU A 408 0.487 -7.012 2.229 1.00 0.00 H new ATOM 0 HD21 LEU A 408 -1.794 -6.869 0.164 1.00 0.00 H new ATOM 0 HD22 LEU A 408 -0.710 -8.269 0.343 1.00 0.00 H new ATOM 0 HD23 LEU A 408 -2.472 -8.490 0.450 1.00 0.00 H new ATOM 444 N PRO A 409 -2.332 -12.071 2.256 1.00 0.00 N ATOM 445 CA PRO A 409 -1.964 -13.488 2.317 1.00 0.00 C ATOM 446 C PRO A 409 -0.571 -13.701 2.899 1.00 0.00 C ATOM 447 O PRO A 409 0.198 -12.753 3.053 1.00 0.00 O ATOM 448 CB PRO A 409 -2.003 -13.928 0.851 1.00 0.00 C ATOM 449 CG PRO A 409 -2.983 -13.009 0.207 1.00 0.00 C ATOM 450 CD PRO A 409 -2.877 -11.693 0.941 1.00 0.00 C ATOM 0 HA PRO A 409 -2.633 -14.055 2.965 1.00 0.00 H new ATOM 0 HB2 PRO A 409 -1.020 -13.847 0.387 1.00 0.00 H new ATOM 0 HB3 PRO A 409 -2.315 -14.968 0.758 1.00 0.00 H new ATOM 0 HG2 PRO A 409 -2.759 -12.882 -0.852 1.00 0.00 H new ATOM 0 HG3 PRO A 409 -3.994 -13.411 0.273 1.00 0.00 H new ATOM 0 HD2 PRO A 409 -2.220 -10.996 0.421 1.00 0.00 H new ATOM 0 HD3 PRO A 409 -3.848 -11.207 1.034 1.00 0.00 H new ATOM 458 N GLN A 410 -0.254 -14.951 3.222 1.00 0.00 N ATOM 459 CA GLN A 410 1.047 -15.287 3.787 1.00 0.00 C ATOM 460 C GLN A 410 2.149 -15.146 2.742 1.00 0.00 C ATOM 461 O GLN A 410 3.215 -14.600 3.021 1.00 0.00 O ATOM 462 CB GLN A 410 1.033 -16.713 4.341 1.00 0.00 C ATOM 463 CG GLN A 410 2.049 -16.946 5.447 1.00 0.00 C ATOM 464 CD GLN A 410 1.972 -18.345 6.026 1.00 0.00 C ATOM 465 OE1 GLN A 410 2.792 -19.207 5.708 1.00 0.00 O ATOM 466 NE2 GLN A 410 0.983 -18.579 6.880 1.00 0.00 N ATOM 0 H GLN A 410 -0.880 -15.747 3.102 1.00 0.00 H new ATOM 0 HA GLN A 410 1.252 -14.590 4.600 1.00 0.00 H new ATOM 0 HB2 GLN A 410 0.036 -16.936 4.722 1.00 0.00 H new ATOM 0 HB3 GLN A 410 1.227 -17.412 3.527 1.00 0.00 H new ATOM 0 HG2 GLN A 410 3.052 -16.774 5.056 1.00 0.00 H new ATOM 0 HG3 GLN A 410 1.888 -16.218 6.242 1.00 0.00 H new ATOM 0 HE21 GLN A 410 0.326 -17.835 7.115 1.00 0.00 H new ATOM 0 HE22 GLN A 410 0.880 -19.502 7.301 1.00 0.00 H new ATOM 475 N GLU A 411 1.882 -15.642 1.538 1.00 0.00 N ATOM 476 CA GLU A 411 2.852 -15.571 0.452 1.00 0.00 C ATOM 477 C GLU A 411 3.180 -14.120 0.108 1.00 0.00 C ATOM 478 O GLU A 411 4.331 -13.780 -0.163 1.00 0.00 O ATOM 479 CB GLU A 411 2.316 -16.292 -0.788 1.00 0.00 C ATOM 480 CG GLU A 411 1.060 -15.661 -1.363 1.00 0.00 C ATOM 481 CD GLU A 411 0.410 -16.522 -2.428 1.00 0.00 C ATOM 482 OE1 GLU A 411 0.479 -17.763 -2.310 1.00 0.00 O ATOM 483 OE2 GLU A 411 -0.167 -15.955 -3.379 1.00 0.00 O ATOM 0 H GLU A 411 1.003 -16.097 1.290 1.00 0.00 H new ATOM 0 HA GLU A 411 3.766 -16.063 0.783 1.00 0.00 H new ATOM 0 HB2 GLU A 411 3.091 -16.303 -1.555 1.00 0.00 H new ATOM 0 HB3 GLU A 411 2.106 -17.330 -0.532 1.00 0.00 H new ATOM 0 HG2 GLU A 411 0.346 -15.484 -0.559 1.00 0.00 H new ATOM 0 HG3 GLU A 411 1.308 -14.689 -1.789 1.00 0.00 H new ATOM 490 N PHE A 412 2.158 -13.270 0.123 1.00 0.00 N ATOM 491 CA PHE A 412 2.336 -11.857 -0.189 1.00 0.00 C ATOM 492 C PHE A 412 3.417 -11.237 0.694 1.00 0.00 C ATOM 493 O PHE A 412 3.244 -11.105 1.904 1.00 0.00 O ATOM 494 CB PHE A 412 1.017 -11.102 -0.005 1.00 0.00 C ATOM 495 CG PHE A 412 0.180 -11.047 -1.250 1.00 0.00 C ATOM 496 CD1 PHE A 412 -0.380 -12.200 -1.776 1.00 0.00 C ATOM 497 CD2 PHE A 412 -0.047 -9.842 -1.895 1.00 0.00 C ATOM 498 CE1 PHE A 412 -1.150 -12.153 -2.923 1.00 0.00 C ATOM 499 CE2 PHE A 412 -0.818 -9.789 -3.041 1.00 0.00 C ATOM 500 CZ PHE A 412 -1.370 -10.945 -3.556 1.00 0.00 C ATOM 0 H PHE A 412 1.199 -13.535 0.348 1.00 0.00 H new ATOM 0 HA PHE A 412 2.651 -11.777 -1.230 1.00 0.00 H new ATOM 0 HB2 PHE A 412 0.442 -11.579 0.789 1.00 0.00 H new ATOM 0 HB3 PHE A 412 1.232 -10.085 0.324 1.00 0.00 H new ATOM 0 HD1 PHE A 412 -0.213 -13.147 -1.284 1.00 0.00 H new ATOM 0 HD2 PHE A 412 0.383 -8.934 -1.498 1.00 0.00 H new ATOM 0 HE1 PHE A 412 -1.579 -13.059 -3.324 1.00 0.00 H new ATOM 0 HE2 PHE A 412 -0.989 -8.843 -3.534 1.00 0.00 H new ATOM 0 HZ PHE A 412 -1.972 -10.905 -4.452 1.00 0.00 H new ATOM 510 N GLY A 413 4.532 -10.860 0.076 1.00 0.00 N ATOM 511 CA GLY A 413 5.625 -10.260 0.819 1.00 0.00 C ATOM 512 C GLY A 413 5.717 -8.762 0.606 1.00 0.00 C ATOM 513 O GLY A 413 4.699 -8.072 0.549 1.00 0.00 O ATOM 0 H GLY A 413 4.698 -10.959 -0.925 1.00 0.00 H new ATOM 0 HA2 GLY A 413 5.494 -10.465 1.881 1.00 0.00 H new ATOM 0 HA3 GLY A 413 6.564 -10.725 0.518 1.00 0.00 H new ATOM 517 N ASP A 414 6.941 -8.258 0.489 1.00 0.00 N ATOM 518 CA ASP A 414 7.163 -6.831 0.281 1.00 0.00 C ATOM 519 C ASP A 414 6.961 -6.457 -1.183 1.00 0.00 C ATOM 520 O ASP A 414 6.095 -5.647 -1.513 1.00 0.00 O ATOM 521 CB ASP A 414 8.572 -6.442 0.731 1.00 0.00 C ATOM 522 CG ASP A 414 9.570 -7.569 0.549 1.00 0.00 C ATOM 523 OD1 ASP A 414 9.406 -8.619 1.206 1.00 0.00 O ATOM 524 OD2 ASP A 414 10.514 -7.402 -0.251 1.00 0.00 O ATOM 0 H ASP A 414 7.794 -8.816 0.535 1.00 0.00 H new ATOM 0 HA ASP A 414 6.435 -6.284 0.880 1.00 0.00 H new ATOM 0 HB2 ASP A 414 8.904 -5.572 0.165 1.00 0.00 H new ATOM 0 HB3 ASP A 414 8.547 -6.149 1.780 1.00 0.00 H new ATOM 529 N GLN A 415 7.767 -7.053 -2.057 1.00 0.00 N ATOM 530 CA GLN A 415 7.678 -6.780 -3.487 1.00 0.00 C ATOM 531 C GLN A 415 6.255 -6.993 -3.994 1.00 0.00 C ATOM 532 O GLN A 415 5.615 -6.063 -4.485 1.00 0.00 O ATOM 533 CB GLN A 415 8.647 -7.676 -4.260 1.00 0.00 C ATOM 534 CG GLN A 415 10.043 -7.089 -4.392 1.00 0.00 C ATOM 535 CD GLN A 415 10.941 -7.450 -3.225 1.00 0.00 C ATOM 536 OE1 GLN A 415 11.499 -6.574 -2.563 1.00 0.00 O ATOM 537 NE2 GLN A 415 11.084 -8.744 -2.964 1.00 0.00 N ATOM 0 H GLN A 415 8.488 -7.727 -1.800 1.00 0.00 H new ATOM 0 HA GLN A 415 7.950 -5.737 -3.650 1.00 0.00 H new ATOM 0 HB2 GLN A 415 8.714 -8.642 -3.760 1.00 0.00 H new ATOM 0 HB3 GLN A 415 8.243 -7.860 -5.256 1.00 0.00 H new ATOM 0 HG2 GLN A 415 10.496 -7.444 -5.318 1.00 0.00 H new ATOM 0 HG3 GLN A 415 9.971 -6.004 -4.468 1.00 0.00 H new ATOM 0 HE21 GLN A 415 10.603 -9.436 -3.538 1.00 0.00 H new ATOM 0 HE22 GLN A 415 11.675 -9.046 -2.189 1.00 0.00 H new ATOM 546 N ASP A 416 5.767 -8.222 -3.871 1.00 0.00 N ATOM 547 CA ASP A 416 4.419 -8.558 -4.316 1.00 0.00 C ATOM 548 C ASP A 416 3.468 -7.385 -4.100 1.00 0.00 C ATOM 549 O ASP A 416 2.857 -6.885 -5.046 1.00 0.00 O ATOM 550 CB ASP A 416 3.905 -9.791 -3.571 1.00 0.00 C ATOM 551 CG ASP A 416 4.883 -10.948 -3.623 1.00 0.00 C ATOM 552 OD1 ASP A 416 5.304 -11.320 -4.738 1.00 0.00 O ATOM 553 OD2 ASP A 416 5.227 -11.482 -2.548 1.00 0.00 O ATOM 0 H ASP A 416 6.284 -9.003 -3.467 1.00 0.00 H new ATOM 0 HA ASP A 416 4.459 -8.779 -5.383 1.00 0.00 H new ATOM 0 HB2 ASP A 416 3.712 -9.529 -2.531 1.00 0.00 H new ATOM 0 HB3 ASP A 416 2.954 -10.103 -4.003 1.00 0.00 H new ATOM 558 N LEU A 417 3.346 -6.950 -2.851 1.00 0.00 N ATOM 559 CA LEU A 417 2.468 -5.836 -2.510 1.00 0.00 C ATOM 560 C LEU A 417 2.748 -4.630 -3.401 1.00 0.00 C ATOM 561 O LEU A 417 1.824 -3.959 -3.864 1.00 0.00 O ATOM 562 CB LEU A 417 2.647 -5.451 -1.041 1.00 0.00 C ATOM 563 CG LEU A 417 1.798 -4.278 -0.546 1.00 0.00 C ATOM 564 CD1 LEU A 417 0.318 -4.607 -0.656 1.00 0.00 C ATOM 565 CD2 LEU A 417 2.164 -3.924 0.889 1.00 0.00 C ATOM 0 H LEU A 417 3.844 -7.352 -2.057 1.00 0.00 H new ATOM 0 HA LEU A 417 1.438 -6.154 -2.673 1.00 0.00 H new ATOM 0 HB2 LEU A 417 2.419 -6.323 -0.427 1.00 0.00 H new ATOM 0 HB3 LEU A 417 3.697 -5.209 -0.875 1.00 0.00 H new ATOM 0 HG LEU A 417 2.004 -3.413 -1.176 1.00 0.00 H new ATOM 0 HD11 LEU A 417 -0.270 -3.761 -0.300 1.00 0.00 H new ATOM 0 HD12 LEU A 417 0.067 -4.811 -1.697 1.00 0.00 H new ATOM 0 HD13 LEU A 417 0.095 -5.485 -0.050 1.00 0.00 H new ATOM 0 HD21 LEU A 417 1.551 -3.088 1.225 1.00 0.00 H new ATOM 0 HD22 LEU A 417 1.987 -4.786 1.533 1.00 0.00 H new ATOM 0 HD23 LEU A 417 3.216 -3.645 0.938 1.00 0.00 H new ATOM 577 N LEU A 418 4.026 -4.361 -3.640 1.00 0.00 N ATOM 578 CA LEU A 418 4.429 -3.238 -4.479 1.00 0.00 C ATOM 579 C LEU A 418 4.025 -3.470 -5.931 1.00 0.00 C ATOM 580 O LEU A 418 3.321 -2.654 -6.527 1.00 0.00 O ATOM 581 CB LEU A 418 5.941 -3.023 -4.387 1.00 0.00 C ATOM 582 CG LEU A 418 6.554 -2.100 -5.441 1.00 0.00 C ATOM 583 CD1 LEU A 418 6.297 -0.643 -5.089 1.00 0.00 C ATOM 584 CD2 LEU A 418 8.046 -2.364 -5.578 1.00 0.00 C ATOM 0 H LEU A 418 4.802 -4.906 -3.264 1.00 0.00 H new ATOM 0 HA LEU A 418 3.919 -2.345 -4.117 1.00 0.00 H new ATOM 0 HB2 LEU A 418 6.171 -2.619 -3.401 1.00 0.00 H new ATOM 0 HB3 LEU A 418 6.431 -3.994 -4.455 1.00 0.00 H new ATOM 0 HG LEU A 418 6.080 -2.309 -6.400 1.00 0.00 H new ATOM 0 HD11 LEU A 418 6.740 -0.001 -5.850 1.00 0.00 H new ATOM 0 HD12 LEU A 418 5.223 -0.464 -5.044 1.00 0.00 H new ATOM 0 HD13 LEU A 418 6.743 -0.419 -4.120 1.00 0.00 H new ATOM 0 HD21 LEU A 418 8.466 -1.698 -6.332 1.00 0.00 H new ATOM 0 HD22 LEU A 418 8.537 -2.184 -4.622 1.00 0.00 H new ATOM 0 HD23 LEU A 418 8.206 -3.399 -5.878 1.00 0.00 H new ATOM 596 N GLN A 419 4.474 -4.587 -6.493 1.00 0.00 N ATOM 597 CA GLN A 419 4.156 -4.926 -7.876 1.00 0.00 C ATOM 598 C GLN A 419 2.648 -4.970 -8.094 1.00 0.00 C ATOM 599 O GLN A 419 2.176 -4.999 -9.230 1.00 0.00 O ATOM 600 CB GLN A 419 4.776 -6.275 -8.247 1.00 0.00 C ATOM 601 CG GLN A 419 6.294 -6.293 -8.158 1.00 0.00 C ATOM 602 CD GLN A 419 6.954 -5.523 -9.285 1.00 0.00 C ATOM 603 OE1 GLN A 419 6.517 -5.587 -10.435 1.00 0.00 O ATOM 604 NE2 GLN A 419 8.013 -4.790 -8.961 1.00 0.00 N ATOM 0 H GLN A 419 5.058 -5.272 -6.014 1.00 0.00 H new ATOM 0 HA GLN A 419 4.574 -4.151 -8.519 1.00 0.00 H new ATOM 0 HB2 GLN A 419 4.373 -7.044 -7.588 1.00 0.00 H new ATOM 0 HB3 GLN A 419 4.477 -6.536 -9.262 1.00 0.00 H new ATOM 0 HG2 GLN A 419 6.603 -5.868 -7.203 1.00 0.00 H new ATOM 0 HG3 GLN A 419 6.643 -7.325 -8.175 1.00 0.00 H new ATOM 0 HE21 GLN A 419 8.341 -4.766 -7.995 1.00 0.00 H new ATOM 0 HE22 GLN A 419 8.499 -4.251 -9.678 1.00 0.00 H new ATOM 613 N MET A 420 1.897 -4.974 -6.998 1.00 0.00 N ATOM 614 CA MET A 420 0.441 -5.012 -7.070 1.00 0.00 C ATOM 615 C MET A 420 -0.134 -3.605 -7.210 1.00 0.00 C ATOM 616 O MET A 420 -1.182 -3.412 -7.828 1.00 0.00 O ATOM 617 CB MET A 420 -0.134 -5.690 -5.825 1.00 0.00 C ATOM 618 CG MET A 420 -1.648 -5.591 -5.725 1.00 0.00 C ATOM 619 SD MET A 420 -2.490 -6.970 -6.527 1.00 0.00 S ATOM 620 CE MET A 420 -3.156 -7.832 -5.105 1.00 0.00 C ATOM 0 H MET A 420 2.272 -4.951 -6.050 1.00 0.00 H new ATOM 0 HA MET A 420 0.160 -5.589 -7.951 1.00 0.00 H new ATOM 0 HB2 MET A 420 0.154 -6.741 -5.828 1.00 0.00 H new ATOM 0 HB3 MET A 420 0.311 -5.240 -4.938 1.00 0.00 H new ATOM 0 HG2 MET A 420 -1.937 -5.555 -4.675 1.00 0.00 H new ATOM 0 HG3 MET A 420 -1.978 -4.656 -6.178 1.00 0.00 H new ATOM 0 HE1 MET A 420 -3.090 -8.908 -5.268 1.00 0.00 H new ATOM 0 HE2 MET A 420 -2.585 -7.563 -4.216 1.00 0.00 H new ATOM 0 HE3 MET A 420 -4.200 -7.550 -4.965 1.00 0.00 H new ATOM 630 N PHE A 421 0.557 -2.629 -6.631 1.00 0.00 N ATOM 631 CA PHE A 421 0.113 -1.241 -6.690 1.00 0.00 C ATOM 632 C PHE A 421 0.795 -0.501 -7.838 1.00 0.00 C ATOM 633 O PHE A 421 0.255 0.467 -8.373 1.00 0.00 O ATOM 634 CB PHE A 421 0.408 -0.533 -5.366 1.00 0.00 C ATOM 635 CG PHE A 421 -0.603 -0.824 -4.294 1.00 0.00 C ATOM 636 CD1 PHE A 421 -0.940 -2.131 -3.977 1.00 0.00 C ATOM 637 CD2 PHE A 421 -1.217 0.209 -3.603 1.00 0.00 C ATOM 638 CE1 PHE A 421 -1.869 -2.402 -2.990 1.00 0.00 C ATOM 639 CE2 PHE A 421 -2.146 -0.057 -2.615 1.00 0.00 C ATOM 640 CZ PHE A 421 -2.474 -1.363 -2.309 1.00 0.00 C ATOM 0 H PHE A 421 1.426 -2.773 -6.116 1.00 0.00 H new ATOM 0 HA PHE A 421 -0.963 -1.236 -6.865 1.00 0.00 H new ATOM 0 HB2 PHE A 421 1.395 -0.833 -5.015 1.00 0.00 H new ATOM 0 HB3 PHE A 421 0.444 0.543 -5.538 1.00 0.00 H new ATOM 0 HD1 PHE A 421 -0.471 -2.947 -4.507 1.00 0.00 H new ATOM 0 HD2 PHE A 421 -0.967 1.233 -3.839 1.00 0.00 H new ATOM 0 HE1 PHE A 421 -2.122 -3.425 -2.751 1.00 0.00 H new ATOM 0 HE2 PHE A 421 -2.616 0.757 -2.082 1.00 0.00 H new ATOM 0 HZ PHE A 421 -3.202 -1.572 -1.539 1.00 0.00 H new ATOM 650 N MET A 422 1.984 -0.964 -8.210 1.00 0.00 N ATOM 651 CA MET A 422 2.739 -0.347 -9.294 1.00 0.00 C ATOM 652 C MET A 422 1.842 -0.084 -10.499 1.00 0.00 C ATOM 653 O MET A 422 1.843 1.004 -11.078 1.00 0.00 O ATOM 654 CB MET A 422 3.912 -1.241 -9.701 1.00 0.00 C ATOM 655 CG MET A 422 5.219 -0.879 -9.016 1.00 0.00 C ATOM 656 SD MET A 422 6.178 0.333 -9.946 1.00 0.00 S ATOM 657 CE MET A 422 7.816 -0.383 -9.845 1.00 0.00 C ATOM 0 H MET A 422 2.445 -1.764 -7.777 1.00 0.00 H new ATOM 0 HA MET A 422 3.127 0.607 -8.937 1.00 0.00 H new ATOM 0 HB2 MET A 422 3.665 -2.277 -9.470 1.00 0.00 H new ATOM 0 HB3 MET A 422 4.048 -1.179 -10.781 1.00 0.00 H new ATOM 0 HG2 MET A 422 5.007 -0.484 -8.023 1.00 0.00 H new ATOM 0 HG3 MET A 422 5.815 -1.781 -8.880 1.00 0.00 H new ATOM 0 HE1 MET A 422 8.525 0.253 -10.375 1.00 0.00 H new ATOM 0 HE2 MET A 422 8.113 -0.465 -8.800 1.00 0.00 H new ATOM 0 HE3 MET A 422 7.809 -1.374 -10.299 1.00 0.00 H new ATOM 667 N PRO A 423 1.059 -1.100 -10.889 1.00 0.00 N ATOM 668 CA PRO A 423 0.143 -1.002 -12.030 1.00 0.00 C ATOM 669 C PRO A 423 -0.700 0.267 -11.988 1.00 0.00 C ATOM 670 O PRO A 423 -0.889 0.933 -13.006 1.00 0.00 O ATOM 671 CB PRO A 423 -0.745 -2.239 -11.879 1.00 0.00 C ATOM 672 CG PRO A 423 0.091 -3.217 -11.127 1.00 0.00 C ATOM 673 CD PRO A 423 1.006 -2.424 -10.246 1.00 0.00 C ATOM 0 HA PRO A 423 0.677 -0.957 -12.979 1.00 0.00 H new ATOM 0 HB2 PRO A 423 -1.662 -2.004 -11.339 1.00 0.00 H new ATOM 0 HB3 PRO A 423 -1.040 -2.635 -12.851 1.00 0.00 H new ATOM 0 HG2 PRO A 423 -0.535 -3.883 -10.533 1.00 0.00 H new ATOM 0 HG3 PRO A 423 0.662 -3.843 -11.812 1.00 0.00 H new ATOM 0 HD2 PRO A 423 0.622 -2.358 -9.228 1.00 0.00 H new ATOM 0 HD3 PRO A 423 1.995 -2.878 -10.185 1.00 0.00 H new ATOM 681 N PHE A 424 -1.205 0.598 -10.804 1.00 0.00 N ATOM 682 CA PHE A 424 -2.030 1.788 -10.630 1.00 0.00 C ATOM 683 C PHE A 424 -1.206 3.055 -10.833 1.00 0.00 C ATOM 684 O PHE A 424 -1.700 4.054 -11.353 1.00 0.00 O ATOM 685 CB PHE A 424 -2.664 1.796 -9.237 1.00 0.00 C ATOM 686 CG PHE A 424 -3.732 0.755 -9.058 1.00 0.00 C ATOM 687 CD1 PHE A 424 -3.396 -0.566 -8.810 1.00 0.00 C ATOM 688 CD2 PHE A 424 -5.072 1.098 -9.138 1.00 0.00 C ATOM 689 CE1 PHE A 424 -4.376 -1.525 -8.647 1.00 0.00 C ATOM 690 CE2 PHE A 424 -6.057 0.143 -8.974 1.00 0.00 C ATOM 691 CZ PHE A 424 -5.709 -1.171 -8.728 1.00 0.00 C ATOM 0 H PHE A 424 -1.057 0.059 -9.951 1.00 0.00 H new ATOM 0 HA PHE A 424 -2.820 1.765 -11.381 1.00 0.00 H new ATOM 0 HB2 PHE A 424 -1.885 1.638 -8.491 1.00 0.00 H new ATOM 0 HB3 PHE A 424 -3.092 2.780 -9.047 1.00 0.00 H new ATOM 0 HD1 PHE A 424 -2.356 -0.849 -8.743 1.00 0.00 H new ATOM 0 HD2 PHE A 424 -5.350 2.124 -9.331 1.00 0.00 H new ATOM 0 HE1 PHE A 424 -4.101 -2.552 -8.456 1.00 0.00 H new ATOM 0 HE2 PHE A 424 -7.098 0.424 -9.038 1.00 0.00 H new ATOM 0 HZ PHE A 424 -6.477 -1.920 -8.599 1.00 0.00 H new ATOM 701 N GLY A 425 0.057 3.007 -10.417 1.00 0.00 N ATOM 702 CA GLY A 425 0.930 4.156 -10.561 1.00 0.00 C ATOM 703 C GLY A 425 2.259 3.966 -9.858 1.00 0.00 C ATOM 704 O GLY A 425 2.584 2.865 -9.418 1.00 0.00 O ATOM 0 H GLY A 425 0.490 2.192 -9.983 1.00 0.00 H new ATOM 0 HA2 GLY A 425 1.106 4.344 -11.620 1.00 0.00 H new ATOM 0 HA3 GLY A 425 0.433 5.039 -10.159 1.00 0.00 H new ATOM 708 N ASN A 426 3.030 5.043 -9.751 1.00 0.00 N ATOM 709 CA ASN A 426 4.332 4.990 -9.097 1.00 0.00 C ATOM 710 C ASN A 426 4.178 4.940 -7.580 1.00 0.00 C ATOM 711 O ASN A 426 3.574 5.828 -6.978 1.00 0.00 O ATOM 712 CB ASN A 426 5.177 6.203 -9.495 1.00 0.00 C ATOM 713 CG ASN A 426 5.187 6.432 -10.994 1.00 0.00 C ATOM 714 OD1 ASN A 426 4.836 7.512 -11.470 1.00 0.00 O ATOM 715 ND2 ASN A 426 5.589 5.415 -11.746 1.00 0.00 N ATOM 0 H ASN A 426 2.775 5.964 -10.109 1.00 0.00 H new ATOM 0 HA ASN A 426 4.837 4.081 -9.423 1.00 0.00 H new ATOM 0 HB2 ASN A 426 4.790 7.092 -8.997 1.00 0.00 H new ATOM 0 HB3 ASN A 426 6.199 6.061 -9.145 1.00 0.00 H new ATOM 0 HD21 ASN A 426 5.616 5.511 -12.761 1.00 0.00 H new ATOM 0 HD22 ASN A 426 5.871 4.538 -11.309 1.00 0.00 H new ATOM 722 N VAL A 427 4.728 3.897 -6.968 1.00 0.00 N ATOM 723 CA VAL A 427 4.654 3.732 -5.522 1.00 0.00 C ATOM 724 C VAL A 427 5.901 4.283 -4.840 1.00 0.00 C ATOM 725 O VAL A 427 7.005 3.773 -5.035 1.00 0.00 O ATOM 726 CB VAL A 427 4.482 2.251 -5.134 1.00 0.00 C ATOM 727 CG1 VAL A 427 4.469 2.092 -3.621 1.00 0.00 C ATOM 728 CG2 VAL A 427 3.210 1.684 -5.747 1.00 0.00 C ATOM 0 H VAL A 427 5.230 3.153 -7.452 1.00 0.00 H new ATOM 0 HA VAL A 427 3.782 4.292 -5.185 1.00 0.00 H new ATOM 0 HB VAL A 427 5.330 1.691 -5.527 1.00 0.00 H new ATOM 0 HG11 VAL A 427 4.347 1.039 -3.367 1.00 0.00 H new ATOM 0 HG12 VAL A 427 5.409 2.458 -3.209 1.00 0.00 H new ATOM 0 HG13 VAL A 427 3.642 2.665 -3.202 1.00 0.00 H new ATOM 0 HG21 VAL A 427 3.104 0.637 -5.463 1.00 0.00 H new ATOM 0 HG22 VAL A 427 2.350 2.247 -5.385 1.00 0.00 H new ATOM 0 HG23 VAL A 427 3.264 1.761 -6.833 1.00 0.00 H new ATOM 738 N VAL A 428 5.719 5.327 -4.039 1.00 0.00 N ATOM 739 CA VAL A 428 6.830 5.947 -3.327 1.00 0.00 C ATOM 740 C VAL A 428 7.365 5.027 -2.235 1.00 0.00 C ATOM 741 O VAL A 428 8.576 4.885 -2.066 1.00 0.00 O ATOM 742 CB VAL A 428 6.413 7.287 -2.693 1.00 0.00 C ATOM 743 CG1 VAL A 428 7.499 7.799 -1.759 1.00 0.00 C ATOM 744 CG2 VAL A 428 6.102 8.312 -3.773 1.00 0.00 C ATOM 0 H VAL A 428 4.813 5.762 -3.867 1.00 0.00 H new ATOM 0 HA VAL A 428 7.614 6.129 -4.062 1.00 0.00 H new ATOM 0 HB VAL A 428 5.510 7.125 -2.105 1.00 0.00 H new ATOM 0 HG11 VAL A 428 7.185 8.747 -1.321 1.00 0.00 H new ATOM 0 HG12 VAL A 428 7.669 7.071 -0.966 1.00 0.00 H new ATOM 0 HG13 VAL A 428 8.422 7.946 -2.320 1.00 0.00 H new ATOM 0 HG21 VAL A 428 5.809 9.253 -3.308 1.00 0.00 H new ATOM 0 HG22 VAL A 428 6.987 8.472 -4.389 1.00 0.00 H new ATOM 0 HG23 VAL A 428 5.287 7.947 -4.397 1.00 0.00 H new ATOM 754 N SER A 429 6.453 4.403 -1.495 1.00 0.00 N ATOM 755 CA SER A 429 6.834 3.497 -0.417 1.00 0.00 C ATOM 756 C SER A 429 6.012 2.213 -0.471 1.00 0.00 C ATOM 757 O SER A 429 4.831 2.233 -0.815 1.00 0.00 O ATOM 758 CB SER A 429 6.645 4.180 0.939 1.00 0.00 C ATOM 759 OG SER A 429 6.368 3.230 1.954 1.00 0.00 O ATOM 0 H SER A 429 5.446 4.508 -1.622 1.00 0.00 H new ATOM 0 HA SER A 429 7.886 3.240 -0.544 1.00 0.00 H new ATOM 0 HB2 SER A 429 7.544 4.740 1.196 1.00 0.00 H new ATOM 0 HB3 SER A 429 5.828 4.899 0.877 1.00 0.00 H new ATOM 0 HG SER A 429 6.308 3.685 2.820 1.00 0.00 H new ATOM 765 N ALA A 430 6.648 1.097 -0.130 1.00 0.00 N ATOM 766 CA ALA A 430 5.977 -0.197 -0.137 1.00 0.00 C ATOM 767 C ALA A 430 6.735 -1.214 0.709 1.00 0.00 C ATOM 768 O ALA A 430 7.800 -1.692 0.317 1.00 0.00 O ATOM 769 CB ALA A 430 5.824 -0.703 -1.563 1.00 0.00 C ATOM 0 H ALA A 430 7.627 1.063 0.155 1.00 0.00 H new ATOM 0 HA ALA A 430 4.987 -0.068 0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 430 5.321 -1.670 -1.554 1.00 0.00 H new ATOM 0 HB2 ALA A 430 5.232 0.008 -2.140 1.00 0.00 H new ATOM 0 HB3 ALA A 430 6.808 -0.810 -2.019 1.00 0.00 H new ATOM 775 N LYS A 431 6.181 -1.540 1.872 1.00 0.00 N ATOM 776 CA LYS A 431 6.805 -2.501 2.774 1.00 0.00 C ATOM 777 C LYS A 431 5.759 -3.185 3.648 1.00 0.00 C ATOM 778 O LYS A 431 4.727 -2.598 3.972 1.00 0.00 O ATOM 779 CB LYS A 431 7.844 -1.804 3.655 1.00 0.00 C ATOM 780 CG LYS A 431 8.279 -2.631 4.852 1.00 0.00 C ATOM 781 CD LYS A 431 7.377 -2.392 6.052 1.00 0.00 C ATOM 782 CE LYS A 431 7.825 -1.178 6.853 1.00 0.00 C ATOM 783 NZ LYS A 431 7.289 0.089 6.285 1.00 0.00 N ATOM 0 H LYS A 431 5.301 -1.153 2.212 1.00 0.00 H new ATOM 0 HA LYS A 431 7.301 -3.260 2.169 1.00 0.00 H new ATOM 0 HB2 LYS A 431 8.719 -1.566 3.051 1.00 0.00 H new ATOM 0 HB3 LYS A 431 7.433 -0.858 4.008 1.00 0.00 H new ATOM 0 HG2 LYS A 431 8.264 -3.689 4.589 1.00 0.00 H new ATOM 0 HG3 LYS A 431 9.307 -2.382 5.113 1.00 0.00 H new ATOM 0 HD2 LYS A 431 6.351 -2.248 5.714 1.00 0.00 H new ATOM 0 HD3 LYS A 431 7.381 -3.274 6.693 1.00 0.00 H new ATOM 0 HE2 LYS A 431 7.493 -1.282 7.886 1.00 0.00 H new ATOM 0 HE3 LYS A 431 8.914 -1.136 6.871 1.00 0.00 H new ATOM 0 HZ1 LYS A 431 7.174 0.789 7.045 1.00 0.00 H new ATOM 0 HZ2 LYS A 431 7.951 0.457 5.572 1.00 0.00 H new ATOM 0 HZ3 LYS A 431 6.367 -0.093 5.840 1.00 0.00 H new ATOM 797 N VAL A 432 6.033 -4.430 4.027 1.00 0.00 N ATOM 798 CA VAL A 432 5.116 -5.192 4.865 1.00 0.00 C ATOM 799 C VAL A 432 5.615 -5.259 6.305 1.00 0.00 C ATOM 800 O VAL A 432 6.815 -5.380 6.552 1.00 0.00 O ATOM 801 CB VAL A 432 4.927 -6.625 4.331 1.00 0.00 C ATOM 802 CG1 VAL A 432 4.105 -7.454 5.306 1.00 0.00 C ATOM 803 CG2 VAL A 432 4.275 -6.599 2.957 1.00 0.00 C ATOM 0 H VAL A 432 6.882 -4.931 3.767 1.00 0.00 H new ATOM 0 HA VAL A 432 4.158 -4.673 4.839 1.00 0.00 H new ATOM 0 HB VAL A 432 5.908 -7.091 4.233 1.00 0.00 H new ATOM 0 HG11 VAL A 432 3.982 -8.463 4.912 1.00 0.00 H new ATOM 0 HG12 VAL A 432 4.618 -7.500 6.267 1.00 0.00 H new ATOM 0 HG13 VAL A 432 3.126 -6.994 5.439 1.00 0.00 H new ATOM 0 HG21 VAL A 432 4.149 -7.619 2.595 1.00 0.00 H new ATOM 0 HG22 VAL A 432 3.301 -6.115 3.026 1.00 0.00 H new ATOM 0 HG23 VAL A 432 4.908 -6.044 2.265 1.00 0.00 H new ATOM 813 N PHE A 433 4.685 -5.182 7.251 1.00 0.00 N ATOM 814 CA PHE A 433 5.030 -5.233 8.667 1.00 0.00 C ATOM 815 C PHE A 433 5.219 -6.675 9.129 1.00 0.00 C ATOM 816 O PHE A 433 4.638 -7.601 8.561 1.00 0.00 O ATOM 817 CB PHE A 433 3.941 -4.556 9.504 1.00 0.00 C ATOM 818 CG PHE A 433 4.042 -3.058 9.517 1.00 0.00 C ATOM 819 CD1 PHE A 433 4.390 -2.363 8.370 1.00 0.00 C ATOM 820 CD2 PHE A 433 3.788 -2.345 10.678 1.00 0.00 C ATOM 821 CE1 PHE A 433 4.482 -0.984 8.381 1.00 0.00 C ATOM 822 CE2 PHE A 433 3.878 -0.965 10.693 1.00 0.00 C ATOM 823 CZ PHE A 433 4.227 -0.284 9.544 1.00 0.00 C ATOM 0 H PHE A 433 3.687 -5.084 7.063 1.00 0.00 H new ATOM 0 HA PHE A 433 5.970 -4.699 8.806 1.00 0.00 H new ATOM 0 HB2 PHE A 433 2.964 -4.843 9.116 1.00 0.00 H new ATOM 0 HB3 PHE A 433 3.998 -4.925 10.528 1.00 0.00 H new ATOM 0 HD1 PHE A 433 4.592 -2.905 7.458 1.00 0.00 H new ATOM 0 HD2 PHE A 433 3.517 -2.873 11.581 1.00 0.00 H new ATOM 0 HE1 PHE A 433 4.753 -0.454 7.480 1.00 0.00 H new ATOM 0 HE2 PHE A 433 3.675 -0.420 11.603 1.00 0.00 H new ATOM 0 HZ PHE A 433 4.300 0.793 9.554 1.00 0.00 H new ATOM 983 N CYS A 443 -0.023 -9.680 8.131 1.00 0.00 N ATOM 984 CA CYS A 443 -1.003 -9.674 7.051 1.00 0.00 C ATOM 985 C CYS A 443 -1.432 -8.249 6.716 1.00 0.00 C ATOM 986 O CYS A 443 -2.600 -7.993 6.425 1.00 0.00 O ATOM 987 CB CYS A 443 -2.225 -10.509 7.436 1.00 0.00 C ATOM 988 SG CYS A 443 -1.865 -12.260 7.709 1.00 0.00 S ATOM 0 HA CYS A 443 -0.537 -10.113 6.169 1.00 0.00 H new ATOM 0 HB2 CYS A 443 -2.665 -10.094 8.343 1.00 0.00 H new ATOM 0 HB3 CYS A 443 -2.974 -10.421 6.649 1.00 0.00 H new ATOM 0 HG CYS A 443 -2.959 -12.883 8.032 1.00 0.00 H new ATOM 994 N PHE A 444 -0.478 -7.323 6.758 1.00 0.00 N ATOM 995 CA PHE A 444 -0.757 -5.923 6.461 1.00 0.00 C ATOM 996 C PHE A 444 0.531 -5.167 6.150 1.00 0.00 C ATOM 997 O PHE A 444 1.547 -5.346 6.820 1.00 0.00 O ATOM 998 CB PHE A 444 -1.478 -5.264 7.639 1.00 0.00 C ATOM 999 CG PHE A 444 -0.561 -4.881 8.765 1.00 0.00 C ATOM 1000 CD1 PHE A 444 0.235 -3.751 8.673 1.00 0.00 C ATOM 1001 CD2 PHE A 444 -0.493 -5.651 9.914 1.00 0.00 C ATOM 1002 CE1 PHE A 444 1.081 -3.396 9.707 1.00 0.00 C ATOM 1003 CE2 PHE A 444 0.350 -5.301 10.952 1.00 0.00 C ATOM 1004 CZ PHE A 444 1.138 -4.171 10.849 1.00 0.00 C ATOM 0 H PHE A 444 0.495 -7.518 6.995 1.00 0.00 H new ATOM 0 HA PHE A 444 -1.401 -5.884 5.583 1.00 0.00 H new ATOM 0 HB2 PHE A 444 -1.997 -4.373 7.285 1.00 0.00 H new ATOM 0 HB3 PHE A 444 -2.239 -5.947 8.017 1.00 0.00 H new ATOM 0 HD1 PHE A 444 0.194 -3.140 7.783 1.00 0.00 H new ATOM 0 HD2 PHE A 444 -1.106 -6.536 10.000 1.00 0.00 H new ATOM 0 HE1 PHE A 444 1.697 -2.513 9.622 1.00 0.00 H new ATOM 0 HE2 PHE A 444 0.393 -5.910 11.843 1.00 0.00 H new ATOM 0 HZ PHE A 444 1.797 -3.894 11.659 1.00 0.00 H new ATOM 1014 N GLY A 445 0.479 -4.319 5.127 1.00 0.00 N ATOM 1015 CA GLY A 445 1.647 -3.547 4.743 1.00 0.00 C ATOM 1016 C GLY A 445 1.333 -2.077 4.551 1.00 0.00 C ATOM 1017 O GLY A 445 0.167 -1.681 4.533 1.00 0.00 O ATOM 0 H GLY A 445 -0.351 -4.153 4.557 1.00 0.00 H new ATOM 0 HA2 GLY A 445 2.417 -3.654 5.507 1.00 0.00 H new ATOM 0 HA3 GLY A 445 2.058 -3.951 3.818 1.00 0.00 H new ATOM 1021 N PHE A 446 2.374 -1.264 4.408 1.00 0.00 N ATOM 1022 CA PHE A 446 2.204 0.171 4.218 1.00 0.00 C ATOM 1023 C PHE A 446 2.619 0.587 2.810 1.00 0.00 C ATOM 1024 O PHE A 446 3.494 -0.030 2.201 1.00 0.00 O ATOM 1025 CB PHE A 446 3.024 0.945 5.252 1.00 0.00 C ATOM 1026 CG PHE A 446 2.978 2.434 5.062 1.00 0.00 C ATOM 1027 CD1 PHE A 446 1.768 3.087 4.895 1.00 0.00 C ATOM 1028 CD2 PHE A 446 4.145 3.182 5.053 1.00 0.00 C ATOM 1029 CE1 PHE A 446 1.722 4.457 4.719 1.00 0.00 C ATOM 1030 CE2 PHE A 446 4.105 4.551 4.878 1.00 0.00 C ATOM 1031 CZ PHE A 446 2.892 5.191 4.712 1.00 0.00 C ATOM 0 H PHE A 446 3.345 -1.575 4.420 1.00 0.00 H new ATOM 0 HA PHE A 446 1.148 0.406 4.351 1.00 0.00 H new ATOM 0 HB2 PHE A 446 2.657 0.703 6.250 1.00 0.00 H new ATOM 0 HB3 PHE A 446 4.061 0.613 5.204 1.00 0.00 H new ATOM 0 HD1 PHE A 446 0.850 2.519 4.902 1.00 0.00 H new ATOM 0 HD2 PHE A 446 5.097 2.688 5.184 1.00 0.00 H new ATOM 0 HE1 PHE A 446 0.772 4.953 4.587 1.00 0.00 H new ATOM 0 HE2 PHE A 446 5.022 5.122 4.871 1.00 0.00 H new ATOM 0 HZ PHE A 446 2.859 6.262 4.577 1.00 0.00 H new ATOM 1041 N VAL A 447 1.985 1.637 2.297 1.00 0.00 N ATOM 1042 CA VAL A 447 2.287 2.136 0.962 1.00 0.00 C ATOM 1043 C VAL A 447 1.928 3.613 0.833 1.00 0.00 C ATOM 1044 O VAL A 447 0.953 4.078 1.421 1.00 0.00 O ATOM 1045 CB VAL A 447 1.533 1.340 -0.119 1.00 0.00 C ATOM 1046 CG1 VAL A 447 1.815 1.913 -1.500 1.00 0.00 C ATOM 1047 CG2 VAL A 447 1.910 -0.133 -0.057 1.00 0.00 C ATOM 0 H VAL A 447 1.258 2.158 2.787 1.00 0.00 H new ATOM 0 HA VAL A 447 3.359 2.011 0.813 1.00 0.00 H new ATOM 0 HB VAL A 447 0.463 1.426 0.072 1.00 0.00 H new ATOM 0 HG11 VAL A 447 1.273 1.337 -2.250 1.00 0.00 H new ATOM 0 HG12 VAL A 447 1.490 2.953 -1.536 1.00 0.00 H new ATOM 0 HG13 VAL A 447 2.884 1.860 -1.704 1.00 0.00 H new ATOM 0 HG21 VAL A 447 1.368 -0.680 -0.828 1.00 0.00 H new ATOM 0 HG22 VAL A 447 2.982 -0.241 -0.221 1.00 0.00 H new ATOM 0 HG23 VAL A 447 1.651 -0.534 0.923 1.00 0.00 H new ATOM 1057 N SER A 448 2.724 4.343 0.058 1.00 0.00 N ATOM 1058 CA SER A 448 2.493 5.768 -0.147 1.00 0.00 C ATOM 1059 C SER A 448 2.855 6.179 -1.571 1.00 0.00 C ATOM 1060 O SER A 448 3.841 5.704 -2.134 1.00 0.00 O ATOM 1061 CB SER A 448 3.310 6.587 0.856 1.00 0.00 C ATOM 1062 OG SER A 448 2.576 6.815 2.046 1.00 0.00 O ATOM 0 H SER A 448 3.534 3.971 -0.438 1.00 0.00 H new ATOM 0 HA SER A 448 1.433 5.965 0.010 1.00 0.00 H new ATOM 0 HB2 SER A 448 4.236 6.062 1.091 1.00 0.00 H new ATOM 0 HB3 SER A 448 3.590 7.541 0.409 1.00 0.00 H new ATOM 0 HG SER A 448 2.859 6.175 2.732 1.00 0.00 H new ATOM 1068 N TYR A 449 2.048 7.063 -2.147 1.00 0.00 N ATOM 1069 CA TYR A 449 2.280 7.536 -3.506 1.00 0.00 C ATOM 1070 C TYR A 449 2.890 8.934 -3.500 1.00 0.00 C ATOM 1071 O TYR A 449 3.121 9.518 -2.441 1.00 0.00 O ATOM 1072 CB TYR A 449 0.971 7.543 -4.297 1.00 0.00 C ATOM 1073 CG TYR A 449 0.576 6.182 -4.825 1.00 0.00 C ATOM 1074 CD1 TYR A 449 0.638 5.055 -4.015 1.00 0.00 C ATOM 1075 CD2 TYR A 449 0.141 6.023 -6.135 1.00 0.00 C ATOM 1076 CE1 TYR A 449 0.278 3.810 -4.493 1.00 0.00 C ATOM 1077 CE2 TYR A 449 -0.223 4.783 -6.622 1.00 0.00 C ATOM 1078 CZ TYR A 449 -0.151 3.679 -5.798 1.00 0.00 C ATOM 1079 OH TYR A 449 -0.510 2.441 -6.278 1.00 0.00 O ATOM 0 H TYR A 449 1.228 7.466 -1.694 1.00 0.00 H new ATOM 0 HA TYR A 449 2.983 6.854 -3.985 1.00 0.00 H new ATOM 0 HB2 TYR A 449 0.173 7.922 -3.659 1.00 0.00 H new ATOM 0 HB3 TYR A 449 1.066 8.235 -5.134 1.00 0.00 H new ATOM 0 HD1 TYR A 449 0.974 5.154 -2.993 1.00 0.00 H new ATOM 0 HD2 TYR A 449 0.087 6.885 -6.784 1.00 0.00 H new ATOM 0 HE1 TYR A 449 0.332 2.944 -3.849 1.00 0.00 H new ATOM 0 HE2 TYR A 449 -0.562 4.678 -7.642 1.00 0.00 H new ATOM 0 HH TYR A 449 0.075 2.198 -7.026 1.00 0.00 H new ATOM 1089 N ASP A 450 3.149 9.465 -4.690 1.00 0.00 N ATOM 1090 CA ASP A 450 3.730 10.796 -4.824 1.00 0.00 C ATOM 1091 C ASP A 450 2.686 11.876 -4.557 1.00 0.00 C ATOM 1092 O ASP A 450 3.019 12.990 -4.157 1.00 0.00 O ATOM 1093 CB ASP A 450 4.325 10.977 -6.221 1.00 0.00 C ATOM 1094 CG ASP A 450 5.128 9.773 -6.670 1.00 0.00 C ATOM 1095 OD1 ASP A 450 6.345 9.734 -6.391 1.00 0.00 O ATOM 1096 OD2 ASP A 450 4.541 8.870 -7.301 1.00 0.00 O ATOM 0 H ASP A 450 2.966 8.994 -5.576 1.00 0.00 H new ATOM 0 HA ASP A 450 4.524 10.895 -4.084 1.00 0.00 H new ATOM 0 HB2 ASP A 450 3.521 11.160 -6.934 1.00 0.00 H new ATOM 0 HB3 ASP A 450 4.965 11.860 -6.228 1.00 0.00 H new ATOM 1101 N ASN A 451 1.421 11.535 -4.783 1.00 0.00 N ATOM 1102 CA ASN A 451 0.328 12.476 -4.568 1.00 0.00 C ATOM 1103 C ASN A 451 -0.931 11.751 -4.101 1.00 0.00 C ATOM 1104 O ASN A 451 -1.097 10.548 -4.309 1.00 0.00 O ATOM 1105 CB ASN A 451 0.035 13.252 -5.854 1.00 0.00 C ATOM 1106 CG ASN A 451 0.134 12.380 -7.091 1.00 0.00 C ATOM 1107 OD1 ASN A 451 0.160 11.152 -6.998 1.00 0.00 O ATOM 1108 ND2 ASN A 451 0.191 13.012 -8.257 1.00 0.00 N ATOM 0 H ASN A 451 1.128 10.616 -5.114 1.00 0.00 H new ATOM 0 HA ASN A 451 0.633 13.176 -3.790 1.00 0.00 H new ATOM 0 HB2 ASN A 451 -0.965 13.683 -5.795 1.00 0.00 H new ATOM 0 HB3 ASN A 451 0.735 14.083 -5.941 1.00 0.00 H new ATOM 0 HD21 ASN A 451 0.259 12.478 -9.124 1.00 0.00 H new ATOM 0 HD22 ASN A 451 0.166 14.031 -8.286 1.00 0.00 H new ATOM 1115 N PRO A 452 -1.839 12.496 -3.456 1.00 0.00 N ATOM 1116 CA PRO A 452 -3.099 11.945 -2.947 1.00 0.00 C ATOM 1117 C PRO A 452 -4.115 11.702 -4.058 1.00 0.00 C ATOM 1118 O PRO A 452 -5.128 11.033 -3.850 1.00 0.00 O ATOM 1119 CB PRO A 452 -3.601 13.032 -1.992 1.00 0.00 C ATOM 1120 CG PRO A 452 -3.023 14.299 -2.522 1.00 0.00 C ATOM 1121 CD PRO A 452 -1.707 13.935 -3.173 1.00 0.00 C ATOM 0 HA PRO A 452 -2.958 10.974 -2.473 1.00 0.00 H new ATOM 0 HB2 PRO A 452 -4.690 13.071 -1.974 1.00 0.00 H new ATOM 0 HB3 PRO A 452 -3.272 12.844 -0.970 1.00 0.00 H new ATOM 0 HG2 PRO A 452 -3.697 14.761 -3.243 1.00 0.00 H new ATOM 0 HG3 PRO A 452 -2.872 15.021 -1.720 1.00 0.00 H new ATOM 0 HD2 PRO A 452 -1.540 14.508 -4.085 1.00 0.00 H new ATOM 0 HD3 PRO A 452 -0.865 14.137 -2.511 1.00 0.00 H new ATOM 1129 N VAL A 453 -3.838 12.247 -5.238 1.00 0.00 N ATOM 1130 CA VAL A 453 -4.727 12.087 -6.382 1.00 0.00 C ATOM 1131 C VAL A 453 -4.572 10.707 -7.010 1.00 0.00 C ATOM 1132 O VAL A 453 -5.550 10.093 -7.435 1.00 0.00 O ATOM 1133 CB VAL A 453 -4.462 13.160 -7.454 1.00 0.00 C ATOM 1134 CG1 VAL A 453 -5.347 12.931 -8.670 1.00 0.00 C ATOM 1135 CG2 VAL A 453 -4.678 14.552 -6.880 1.00 0.00 C ATOM 0 H VAL A 453 -3.004 12.804 -5.427 1.00 0.00 H new ATOM 0 HA VAL A 453 -5.745 12.201 -6.009 1.00 0.00 H new ATOM 0 HB VAL A 453 -3.422 13.081 -7.772 1.00 0.00 H new ATOM 0 HG11 VAL A 453 -5.145 13.699 -9.417 1.00 0.00 H new ATOM 0 HG12 VAL A 453 -5.136 11.949 -9.094 1.00 0.00 H new ATOM 0 HG13 VAL A 453 -6.394 12.981 -8.372 1.00 0.00 H new ATOM 0 HG21 VAL A 453 -4.486 15.298 -7.652 1.00 0.00 H new ATOM 0 HG22 VAL A 453 -5.707 14.646 -6.532 1.00 0.00 H new ATOM 0 HG23 VAL A 453 -3.996 14.711 -6.045 1.00 0.00 H new ATOM 1145 N SER A 454 -3.335 10.224 -7.064 1.00 0.00 N ATOM 1146 CA SER A 454 -3.050 8.916 -7.643 1.00 0.00 C ATOM 1147 C SER A 454 -3.283 7.807 -6.622 1.00 0.00 C ATOM 1148 O SER A 454 -3.802 6.741 -6.954 1.00 0.00 O ATOM 1149 CB SER A 454 -1.608 8.862 -8.150 1.00 0.00 C ATOM 1150 OG SER A 454 -1.477 7.941 -9.219 1.00 0.00 O ATOM 0 H SER A 454 -2.514 10.718 -6.714 1.00 0.00 H new ATOM 0 HA SER A 454 -3.729 8.763 -8.482 1.00 0.00 H new ATOM 0 HB2 SER A 454 -1.298 9.853 -8.480 1.00 0.00 H new ATOM 0 HB3 SER A 454 -0.943 8.575 -7.335 1.00 0.00 H new ATOM 0 HG SER A 454 -0.546 7.927 -9.526 1.00 0.00 H new ATOM 1156 N ALA A 455 -2.895 8.065 -5.378 1.00 0.00 N ATOM 1157 CA ALA A 455 -3.062 7.091 -4.306 1.00 0.00 C ATOM 1158 C ALA A 455 -4.506 6.608 -4.224 1.00 0.00 C ATOM 1159 O ALA A 455 -4.762 5.415 -4.062 1.00 0.00 O ATOM 1160 CB ALA A 455 -2.627 7.689 -2.976 1.00 0.00 C ATOM 0 H ALA A 455 -2.462 8.942 -5.087 1.00 0.00 H new ATOM 0 HA ALA A 455 -2.430 6.231 -4.528 1.00 0.00 H new ATOM 0 HB1 ALA A 455 -2.757 6.950 -2.185 1.00 0.00 H new ATOM 0 HB2 ALA A 455 -1.578 7.978 -3.033 1.00 0.00 H new ATOM 0 HB3 ALA A 455 -3.234 8.567 -2.756 1.00 0.00 H new ATOM 1166 N GLN A 456 -5.444 7.542 -4.337 1.00 0.00 N ATOM 1167 CA GLN A 456 -6.863 7.210 -4.275 1.00 0.00 C ATOM 1168 C GLN A 456 -7.239 6.218 -5.371 1.00 0.00 C ATOM 1169 O GLN A 456 -7.986 5.269 -5.133 1.00 0.00 O ATOM 1170 CB GLN A 456 -7.711 8.477 -4.405 1.00 0.00 C ATOM 1171 CG GLN A 456 -7.948 9.189 -3.082 1.00 0.00 C ATOM 1172 CD GLN A 456 -8.965 8.477 -2.211 1.00 0.00 C ATOM 1173 OE1 GLN A 456 -9.337 7.334 -2.477 1.00 0.00 O ATOM 1174 NE2 GLN A 456 -9.421 9.152 -1.162 1.00 0.00 N ATOM 0 H GLN A 456 -5.248 8.534 -4.472 1.00 0.00 H new ATOM 0 HA GLN A 456 -7.060 6.747 -3.308 1.00 0.00 H new ATOM 0 HB2 GLN A 456 -7.220 9.164 -5.095 1.00 0.00 H new ATOM 0 HB3 GLN A 456 -8.673 8.217 -4.845 1.00 0.00 H new ATOM 0 HG2 GLN A 456 -7.004 9.268 -2.542 1.00 0.00 H new ATOM 0 HG3 GLN A 456 -8.290 10.205 -3.277 1.00 0.00 H new ATOM 0 HE21 GLN A 456 -9.085 10.098 -0.979 1.00 0.00 H new ATOM 0 HE22 GLN A 456 -10.107 8.725 -0.540 1.00 0.00 H new ATOM 1183 N ALA A 457 -6.716 6.443 -6.571 1.00 0.00 N ATOM 1184 CA ALA A 457 -6.996 5.568 -7.702 1.00 0.00 C ATOM 1185 C ALA A 457 -6.936 4.101 -7.290 1.00 0.00 C ATOM 1186 O ALA A 457 -7.739 3.286 -7.743 1.00 0.00 O ATOM 1187 CB ALA A 457 -6.016 5.840 -8.834 1.00 0.00 C ATOM 0 H ALA A 457 -6.096 7.224 -6.785 1.00 0.00 H new ATOM 0 HA ALA A 457 -8.007 5.779 -8.051 1.00 0.00 H new ATOM 0 HB1 ALA A 457 -6.236 5.180 -9.673 1.00 0.00 H new ATOM 0 HB2 ALA A 457 -6.110 6.877 -9.155 1.00 0.00 H new ATOM 0 HB3 ALA A 457 -4.999 5.658 -8.486 1.00 0.00 H new ATOM 1193 N ALA A 458 -5.979 3.772 -6.429 1.00 0.00 N ATOM 1194 CA ALA A 458 -5.816 2.404 -5.955 1.00 0.00 C ATOM 1195 C ALA A 458 -7.001 1.975 -5.097 1.00 0.00 C ATOM 1196 O ALA A 458 -7.717 1.032 -5.438 1.00 0.00 O ATOM 1197 CB ALA A 458 -4.519 2.267 -5.171 1.00 0.00 C ATOM 0 H ALA A 458 -5.305 4.435 -6.046 1.00 0.00 H new ATOM 0 HA ALA A 458 -5.773 1.748 -6.825 1.00 0.00 H new ATOM 0 HB1 ALA A 458 -4.411 1.240 -4.823 1.00 0.00 H new ATOM 0 HB2 ALA A 458 -3.677 2.523 -5.814 1.00 0.00 H new ATOM 0 HB3 ALA A 458 -4.539 2.940 -4.314 1.00 0.00 H new ATOM 1203 N ILE A 459 -7.203 2.671 -3.985 1.00 0.00 N ATOM 1204 CA ILE A 459 -8.303 2.362 -3.079 1.00 0.00 C ATOM 1205 C ILE A 459 -9.613 2.191 -3.843 1.00 0.00 C ATOM 1206 O ILE A 459 -10.365 1.248 -3.599 1.00 0.00 O ATOM 1207 CB ILE A 459 -8.482 3.461 -2.014 1.00 0.00 C ATOM 1208 CG1 ILE A 459 -7.196 3.631 -1.204 1.00 0.00 C ATOM 1209 CG2 ILE A 459 -9.651 3.127 -1.100 1.00 0.00 C ATOM 1210 CD1 ILE A 459 -7.156 4.908 -0.394 1.00 0.00 C ATOM 0 H ILE A 459 -6.620 3.453 -3.689 1.00 0.00 H new ATOM 0 HA ILE A 459 -8.049 1.425 -2.583 1.00 0.00 H new ATOM 0 HB ILE A 459 -8.698 4.403 -2.518 1.00 0.00 H new ATOM 0 HG12 ILE A 459 -7.085 2.780 -0.532 1.00 0.00 H new ATOM 0 HG13 ILE A 459 -6.344 3.614 -1.883 1.00 0.00 H new ATOM 0 HG21 ILE A 459 -9.765 3.913 -0.353 1.00 0.00 H new ATOM 0 HG22 ILE A 459 -10.564 3.052 -1.690 1.00 0.00 H new ATOM 0 HG23 ILE A 459 -9.463 2.176 -0.601 1.00 0.00 H new ATOM 0 HD11 ILE A 459 -6.216 4.962 0.155 1.00 0.00 H new ATOM 0 HD12 ILE A 459 -7.236 5.765 -1.062 1.00 0.00 H new ATOM 0 HD13 ILE A 459 -7.988 4.918 0.310 1.00 0.00 H new ATOM 1222 N GLN A 460 -9.876 3.109 -4.766 1.00 0.00 N ATOM 1223 CA GLN A 460 -11.094 3.059 -5.567 1.00 0.00 C ATOM 1224 C GLN A 460 -11.452 1.619 -5.923 1.00 0.00 C ATOM 1225 O GLN A 460 -12.600 1.200 -5.772 1.00 0.00 O ATOM 1226 CB GLN A 460 -10.926 3.886 -6.843 1.00 0.00 C ATOM 1227 CG GLN A 460 -11.029 5.385 -6.613 1.00 0.00 C ATOM 1228 CD GLN A 460 -10.993 6.177 -7.905 1.00 0.00 C ATOM 1229 OE1 GLN A 460 -10.808 5.614 -8.986 1.00 0.00 O ATOM 1230 NE2 GLN A 460 -11.170 7.488 -7.802 1.00 0.00 N ATOM 0 H GLN A 460 -9.263 3.896 -4.978 1.00 0.00 H new ATOM 0 HA GLN A 460 -11.906 3.481 -4.975 1.00 0.00 H new ATOM 0 HB2 GLN A 460 -9.957 3.661 -7.287 1.00 0.00 H new ATOM 0 HB3 GLN A 460 -11.685 3.584 -7.564 1.00 0.00 H new ATOM 0 HG2 GLN A 460 -11.955 5.605 -6.082 1.00 0.00 H new ATOM 0 HG3 GLN A 460 -10.210 5.707 -5.971 1.00 0.00 H new ATOM 0 HE21 GLN A 460 -11.320 7.912 -6.887 1.00 0.00 H new ATOM 0 HE22 GLN A 460 -11.156 8.072 -8.638 1.00 0.00 H new ATOM 1239 N SER A 461 -10.463 0.869 -6.397 1.00 0.00 N ATOM 1240 CA SER A 461 -10.675 -0.522 -6.778 1.00 0.00 C ATOM 1241 C SER A 461 -10.130 -1.468 -5.711 1.00 0.00 C ATOM 1242 O SER A 461 -10.859 -2.303 -5.176 1.00 0.00 O ATOM 1243 CB SER A 461 -10.004 -0.812 -8.122 1.00 0.00 C ATOM 1244 OG SER A 461 -10.871 -0.506 -9.201 1.00 0.00 O ATOM 0 H SER A 461 -9.507 1.201 -6.526 1.00 0.00 H new ATOM 0 HA SER A 461 -11.748 -0.687 -6.871 1.00 0.00 H new ATOM 0 HB2 SER A 461 -9.089 -0.226 -8.209 1.00 0.00 H new ATOM 0 HB3 SER A 461 -9.716 -1.862 -8.169 1.00 0.00 H new ATOM 0 HG SER A 461 -10.419 -0.698 -10.049 1.00 0.00 H new ATOM 1250 N MET A 462 -8.843 -1.329 -5.408 1.00 0.00 N ATOM 1251 CA MET A 462 -8.200 -2.169 -4.405 1.00 0.00 C ATOM 1252 C MET A 462 -9.127 -2.400 -3.215 1.00 0.00 C ATOM 1253 O MET A 462 -9.253 -3.521 -2.724 1.00 0.00 O ATOM 1254 CB MET A 462 -6.894 -1.528 -3.932 1.00 0.00 C ATOM 1255 CG MET A 462 -5.858 -1.377 -5.035 1.00 0.00 C ATOM 1256 SD MET A 462 -5.630 -2.892 -5.985 1.00 0.00 S ATOM 1257 CE MET A 462 -4.926 -3.970 -4.740 1.00 0.00 C ATOM 0 H MET A 462 -8.226 -0.643 -5.843 1.00 0.00 H new ATOM 0 HA MET A 462 -7.977 -3.133 -4.863 1.00 0.00 H new ATOM 0 HB2 MET A 462 -7.112 -0.546 -3.512 1.00 0.00 H new ATOM 0 HB3 MET A 462 -6.472 -2.132 -3.129 1.00 0.00 H new ATOM 0 HG2 MET A 462 -6.162 -0.574 -5.706 1.00 0.00 H new ATOM 0 HG3 MET A 462 -4.905 -1.081 -4.595 1.00 0.00 H new ATOM 0 HE1 MET A 462 -4.292 -4.715 -5.220 1.00 0.00 H new ATOM 0 HE2 MET A 462 -4.330 -3.381 -4.044 1.00 0.00 H new ATOM 0 HE3 MET A 462 -5.728 -4.471 -4.197 1.00 0.00 H new ATOM 1267 N ASN A 463 -9.772 -1.333 -2.757 1.00 0.00 N ATOM 1268 CA ASN A 463 -10.685 -1.419 -1.624 1.00 0.00 C ATOM 1269 C ASN A 463 -11.623 -2.614 -1.771 1.00 0.00 C ATOM 1270 O ASN A 463 -12.503 -2.624 -2.631 1.00 0.00 O ATOM 1271 CB ASN A 463 -11.499 -0.130 -1.498 1.00 0.00 C ATOM 1272 CG ASN A 463 -12.658 -0.270 -0.530 1.00 0.00 C ATOM 1273 OD1 ASN A 463 -12.474 -0.658 0.625 1.00 0.00 O ATOM 1274 ND2 ASN A 463 -13.861 0.047 -0.996 1.00 0.00 N ATOM 0 H ASN A 463 -9.679 -0.398 -3.153 1.00 0.00 H new ATOM 0 HA ASN A 463 -10.091 -1.555 -0.720 1.00 0.00 H new ATOM 0 HB2 ASN A 463 -10.847 0.677 -1.165 1.00 0.00 H new ATOM 0 HB3 ASN A 463 -11.881 0.153 -2.479 1.00 0.00 H new ATOM 0 HD21 ASN A 463 -14.678 -0.027 -0.390 1.00 0.00 H new ATOM 0 HD22 ASN A 463 -13.967 0.364 -1.960 1.00 0.00 H new ATOM 1281 N GLY A 464 -11.428 -3.620 -0.924 1.00 0.00 N ATOM 1282 CA GLY A 464 -12.264 -4.807 -0.977 1.00 0.00 C ATOM 1283 C GLY A 464 -11.936 -5.695 -2.159 1.00 0.00 C ATOM 1284 O GLY A 464 -12.824 -6.315 -2.746 1.00 0.00 O ATOM 0 H GLY A 464 -10.707 -3.635 -0.203 1.00 0.00 H new ATOM 0 HA2 GLY A 464 -12.142 -5.375 -0.055 1.00 0.00 H new ATOM 0 HA3 GLY A 464 -13.311 -4.508 -1.031 1.00 0.00 H new ATOM 1288 N PHE A 465 -10.657 -5.758 -2.513 1.00 0.00 N ATOM 1289 CA PHE A 465 -10.213 -6.576 -3.636 1.00 0.00 C ATOM 1290 C PHE A 465 -10.359 -8.061 -3.319 1.00 0.00 C ATOM 1291 O PHE A 465 -9.729 -8.573 -2.395 1.00 0.00 O ATOM 1292 CB PHE A 465 -8.756 -6.259 -3.982 1.00 0.00 C ATOM 1293 CG PHE A 465 -8.190 -7.140 -5.058 1.00 0.00 C ATOM 1294 CD1 PHE A 465 -7.860 -8.459 -4.790 1.00 0.00 C ATOM 1295 CD2 PHE A 465 -7.987 -6.650 -6.338 1.00 0.00 C ATOM 1296 CE1 PHE A 465 -7.338 -9.273 -5.778 1.00 0.00 C ATOM 1297 CE2 PHE A 465 -7.467 -7.460 -7.331 1.00 0.00 C ATOM 1298 CZ PHE A 465 -7.141 -8.772 -7.049 1.00 0.00 C ATOM 0 H PHE A 465 -9.909 -5.252 -2.038 1.00 0.00 H new ATOM 0 HA PHE A 465 -10.843 -6.341 -4.494 1.00 0.00 H new ATOM 0 HB2 PHE A 465 -8.685 -5.219 -4.300 1.00 0.00 H new ATOM 0 HB3 PHE A 465 -8.147 -6.360 -3.083 1.00 0.00 H new ATOM 0 HD1 PHE A 465 -8.012 -8.856 -3.797 1.00 0.00 H new ATOM 0 HD2 PHE A 465 -8.238 -5.624 -6.563 1.00 0.00 H new ATOM 0 HE1 PHE A 465 -7.085 -10.299 -5.556 1.00 0.00 H new ATOM 0 HE2 PHE A 465 -7.316 -7.067 -8.326 1.00 0.00 H new ATOM 0 HZ PHE A 465 -6.732 -9.406 -7.822 1.00 0.00 H new ATOM 1308 N GLN A 466 -11.198 -8.745 -4.090 1.00 0.00 N ATOM 1309 CA GLN A 466 -11.429 -10.171 -3.891 1.00 0.00 C ATOM 1310 C GLN A 466 -10.153 -10.969 -4.139 1.00 0.00 C ATOM 1311 O GLN A 466 -9.641 -11.009 -5.258 1.00 0.00 O ATOM 1312 CB GLN A 466 -12.541 -10.663 -4.819 1.00 0.00 C ATOM 1313 CG GLN A 466 -13.149 -11.989 -4.390 1.00 0.00 C ATOM 1314 CD GLN A 466 -12.247 -13.170 -4.691 1.00 0.00 C ATOM 1315 OE1 GLN A 466 -11.727 -13.301 -5.800 1.00 0.00 O ATOM 1316 NE2 GLN A 466 -12.056 -14.038 -3.704 1.00 0.00 N ATOM 0 H GLN A 466 -11.729 -8.335 -4.858 1.00 0.00 H new ATOM 0 HA GLN A 466 -11.735 -10.323 -2.856 1.00 0.00 H new ATOM 0 HB2 GLN A 466 -13.327 -9.909 -4.862 1.00 0.00 H new ATOM 0 HB3 GLN A 466 -12.142 -10.765 -5.828 1.00 0.00 H new ATOM 0 HG2 GLN A 466 -13.358 -11.959 -3.321 1.00 0.00 H new ATOM 0 HG3 GLN A 466 -14.104 -12.127 -4.897 1.00 0.00 H new ATOM 0 HE21 GLN A 466 -12.507 -13.891 -2.801 1.00 0.00 H new ATOM 0 HE22 GLN A 466 -11.459 -14.852 -3.849 1.00 0.00 H new ATOM 1325 N ILE A 467 -9.644 -11.604 -3.088 1.00 0.00 N ATOM 1326 CA ILE A 467 -8.429 -12.400 -3.192 1.00 0.00 C ATOM 1327 C ILE A 467 -8.559 -13.705 -2.412 1.00 0.00 C ATOM 1328 O ILE A 467 -8.995 -13.712 -1.262 1.00 0.00 O ATOM 1329 CB ILE A 467 -7.202 -11.627 -2.676 1.00 0.00 C ATOM 1330 CG1 ILE A 467 -5.912 -12.283 -3.170 1.00 0.00 C ATOM 1331 CG2 ILE A 467 -7.219 -11.560 -1.156 1.00 0.00 C ATOM 1332 CD1 ILE A 467 -4.701 -11.379 -3.085 1.00 0.00 C ATOM 0 H ILE A 467 -10.055 -11.582 -2.155 1.00 0.00 H new ATOM 0 HA ILE A 467 -8.288 -12.623 -4.250 1.00 0.00 H new ATOM 0 HB ILE A 467 -7.242 -10.610 -3.067 1.00 0.00 H new ATOM 0 HG12 ILE A 467 -5.725 -13.183 -2.584 1.00 0.00 H new ATOM 0 HG13 ILE A 467 -6.048 -12.598 -4.205 1.00 0.00 H new ATOM 0 HG21 ILE A 467 -6.345 -11.010 -0.806 1.00 0.00 H new ATOM 0 HG22 ILE A 467 -8.124 -11.051 -0.824 1.00 0.00 H new ATOM 0 HG23 ILE A 467 -7.200 -12.570 -0.747 1.00 0.00 H new ATOM 0 HD11 ILE A 467 -3.823 -11.911 -3.452 1.00 0.00 H new ATOM 0 HD12 ILE A 467 -4.867 -10.490 -3.693 1.00 0.00 H new ATOM 0 HD13 ILE A 467 -4.539 -11.084 -2.048 1.00 0.00 H new ATOM 1344 N GLY A 468 -8.174 -14.808 -3.047 1.00 0.00 N ATOM 1345 CA GLY A 468 -8.253 -16.104 -2.397 1.00 0.00 C ATOM 1346 C GLY A 468 -9.622 -16.372 -1.803 1.00 0.00 C ATOM 1347 O GLY A 468 -10.588 -16.599 -2.531 1.00 0.00 O ATOM 0 H GLY A 468 -7.809 -14.828 -3.999 1.00 0.00 H new ATOM 0 HA2 GLY A 468 -8.015 -16.885 -3.119 1.00 0.00 H new ATOM 0 HA3 GLY A 468 -7.502 -16.158 -1.609 1.00 0.00 H new ATOM 1351 N MET A 469 -9.705 -16.346 -0.477 1.00 0.00 N ATOM 1352 CA MET A 469 -10.966 -16.589 0.215 1.00 0.00 C ATOM 1353 C MET A 469 -11.273 -15.462 1.195 1.00 0.00 C ATOM 1354 O MET A 469 -11.998 -15.655 2.172 1.00 0.00 O ATOM 1355 CB MET A 469 -10.916 -17.927 0.955 1.00 0.00 C ATOM 1356 CG MET A 469 -11.153 -19.128 0.056 1.00 0.00 C ATOM 1357 SD MET A 469 -11.686 -20.588 0.971 1.00 0.00 S ATOM 1358 CE MET A 469 -11.711 -21.815 -0.332 1.00 0.00 C ATOM 0 H MET A 469 -8.914 -16.159 0.140 1.00 0.00 H new ATOM 0 HA MET A 469 -11.761 -16.625 -0.530 1.00 0.00 H new ATOM 0 HB2 MET A 469 -9.944 -18.030 1.436 1.00 0.00 H new ATOM 0 HB3 MET A 469 -11.665 -17.923 1.747 1.00 0.00 H new ATOM 0 HG2 MET A 469 -11.908 -18.876 -0.689 1.00 0.00 H new ATOM 0 HG3 MET A 469 -10.235 -19.358 -0.485 1.00 0.00 H new ATOM 0 HE1 MET A 469 -12.023 -22.775 0.079 1.00 0.00 H new ATOM 0 HE2 MET A 469 -12.412 -21.507 -1.108 1.00 0.00 H new ATOM 0 HE3 MET A 469 -10.714 -21.910 -0.761 1.00 0.00 H new ATOM 1368 N LYS A 470 -10.719 -14.284 0.929 1.00 0.00 N ATOM 1369 CA LYS A 470 -10.935 -13.125 1.787 1.00 0.00 C ATOM 1370 C LYS A 470 -11.054 -11.850 0.959 1.00 0.00 C ATOM 1371 O LYS A 470 -10.995 -11.889 -0.270 1.00 0.00 O ATOM 1372 CB LYS A 470 -9.788 -12.988 2.791 1.00 0.00 C ATOM 1373 CG LYS A 470 -8.440 -12.723 2.144 1.00 0.00 C ATOM 1374 CD LYS A 470 -7.294 -13.066 3.081 1.00 0.00 C ATOM 1375 CE LYS A 470 -6.060 -13.512 2.311 1.00 0.00 C ATOM 1376 NZ LYS A 470 -5.227 -14.460 3.100 1.00 0.00 N ATOM 0 H LYS A 470 -10.117 -14.107 0.125 1.00 0.00 H new ATOM 0 HA LYS A 470 -11.869 -13.274 2.329 1.00 0.00 H new ATOM 0 HB2 LYS A 470 -10.016 -12.176 3.481 1.00 0.00 H new ATOM 0 HB3 LYS A 470 -9.724 -13.901 3.383 1.00 0.00 H new ATOM 0 HG2 LYS A 470 -8.352 -13.311 1.230 1.00 0.00 H new ATOM 0 HG3 LYS A 470 -8.374 -11.674 1.856 1.00 0.00 H new ATOM 0 HD2 LYS A 470 -7.049 -12.197 3.692 1.00 0.00 H new ATOM 0 HD3 LYS A 470 -7.605 -13.857 3.763 1.00 0.00 H new ATOM 0 HE2 LYS A 470 -6.366 -13.986 1.378 1.00 0.00 H new ATOM 0 HE3 LYS A 470 -5.463 -12.640 2.044 1.00 0.00 H new ATOM 0 HZ1 LYS A 470 -4.548 -14.933 2.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 470 -4.710 -13.938 3.836 1.00 0.00 H new ATOM 0 HZ3 LYS A 470 -5.840 -15.172 3.546 1.00 0.00 H new ATOM 1390 N ARG A 471 -11.221 -10.721 1.639 1.00 0.00 N ATOM 1391 CA ARG A 471 -11.348 -9.434 0.966 1.00 0.00 C ATOM 1392 C ARG A 471 -10.316 -8.440 1.492 1.00 0.00 C ATOM 1393 O ARG A 471 -10.273 -8.149 2.688 1.00 0.00 O ATOM 1394 CB ARG A 471 -12.757 -8.871 1.158 1.00 0.00 C ATOM 1395 CG ARG A 471 -13.831 -9.650 0.416 1.00 0.00 C ATOM 1396 CD ARG A 471 -15.225 -9.235 0.858 1.00 0.00 C ATOM 1397 NE ARG A 471 -15.701 -10.026 1.988 1.00 0.00 N ATOM 1398 CZ ARG A 471 -16.219 -11.243 1.868 1.00 0.00 C ATOM 1399 NH1 ARG A 471 -16.329 -11.805 0.671 1.00 0.00 N ATOM 1400 NH2 ARG A 471 -16.630 -11.901 2.945 1.00 0.00 N ATOM 0 H ARG A 471 -11.272 -10.671 2.657 1.00 0.00 H new ATOM 0 HA ARG A 471 -11.168 -9.590 -0.098 1.00 0.00 H new ATOM 0 HB2 ARG A 471 -12.995 -8.864 2.222 1.00 0.00 H new ATOM 0 HB3 ARG A 471 -12.774 -7.834 0.821 1.00 0.00 H new ATOM 0 HG2 ARG A 471 -13.725 -9.487 -0.657 1.00 0.00 H new ATOM 0 HG3 ARG A 471 -13.695 -10.717 0.592 1.00 0.00 H new ATOM 0 HD2 ARG A 471 -15.219 -8.180 1.132 1.00 0.00 H new ATOM 0 HD3 ARG A 471 -15.917 -9.344 0.023 1.00 0.00 H new ATOM 0 HE ARG A 471 -15.632 -9.622 2.922 1.00 0.00 H new ATOM 0 HH11 ARG A 471 -16.015 -11.302 -0.159 1.00 0.00 H new ATOM 0 HH12 ARG A 471 -16.727 -12.740 0.581 1.00 0.00 H new ATOM 0 HH21 ARG A 471 -16.548 -11.472 3.867 1.00 0.00 H new ATOM 0 HH22 ARG A 471 -17.028 -12.836 2.851 1.00 0.00 H new ATOM 1414 N LEU A 472 -9.486 -7.925 0.592 1.00 0.00 N ATOM 1415 CA LEU A 472 -8.454 -6.964 0.964 1.00 0.00 C ATOM 1416 C LEU A 472 -9.074 -5.660 1.452 1.00 0.00 C ATOM 1417 O LEU A 472 -10.179 -5.296 1.048 1.00 0.00 O ATOM 1418 CB LEU A 472 -7.531 -6.691 -0.225 1.00 0.00 C ATOM 1419 CG LEU A 472 -6.493 -7.771 -0.531 1.00 0.00 C ATOM 1420 CD1 LEU A 472 -5.774 -7.466 -1.836 1.00 0.00 C ATOM 1421 CD2 LEU A 472 -5.497 -7.894 0.613 1.00 0.00 C ATOM 0 H LEU A 472 -9.508 -8.157 -0.401 1.00 0.00 H new ATOM 0 HA LEU A 472 -7.870 -7.393 1.778 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.148 -6.546 -1.112 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -7.007 -5.752 -0.044 1.00 0.00 H new ATOM 0 HG LEU A 472 -7.010 -8.724 -0.639 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -5.039 -8.245 -2.037 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -6.498 -7.430 -2.650 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -5.269 -6.503 -1.757 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -4.766 -8.667 0.377 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -4.985 -6.942 0.754 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -6.025 -8.161 1.528 1.00 0.00 H new ATOM 1433 N LYS A 473 -8.355 -4.957 2.321 1.00 0.00 N ATOM 1434 CA LYS A 473 -8.832 -3.689 2.861 1.00 0.00 C ATOM 1435 C LYS A 473 -7.743 -2.624 2.790 1.00 0.00 C ATOM 1436 O LYS A 473 -6.841 -2.585 3.627 1.00 0.00 O ATOM 1437 CB LYS A 473 -9.289 -3.870 4.310 1.00 0.00 C ATOM 1438 CG LYS A 473 -9.967 -2.641 4.892 1.00 0.00 C ATOM 1439 CD LYS A 473 -10.338 -2.847 6.350 1.00 0.00 C ATOM 1440 CE LYS A 473 -11.572 -3.724 6.493 1.00 0.00 C ATOM 1441 NZ LYS A 473 -12.830 -2.937 6.372 1.00 0.00 N ATOM 0 H LYS A 473 -7.439 -5.244 2.666 1.00 0.00 H new ATOM 0 HA LYS A 473 -9.678 -3.360 2.257 1.00 0.00 H new ATOM 0 HB2 LYS A 473 -9.977 -4.713 4.362 1.00 0.00 H new ATOM 0 HB3 LYS A 473 -8.426 -4.124 4.925 1.00 0.00 H new ATOM 0 HG2 LYS A 473 -9.303 -1.781 4.803 1.00 0.00 H new ATOM 0 HG3 LYS A 473 -10.864 -2.412 4.316 1.00 0.00 H new ATOM 0 HD2 LYS A 473 -9.502 -3.305 6.878 1.00 0.00 H new ATOM 0 HD3 LYS A 473 -10.521 -1.881 6.820 1.00 0.00 H new ATOM 0 HE2 LYS A 473 -11.555 -4.501 5.729 1.00 0.00 H new ATOM 0 HE3 LYS A 473 -11.550 -4.227 7.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 473 -13.648 -3.571 6.475 1.00 0.00 H new ATOM 0 HZ2 LYS A 473 -12.859 -2.211 7.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 473 -12.864 -2.478 5.440 1.00 0.00 H new ATOM 1455 N VAL A 474 -7.835 -1.757 1.786 1.00 0.00 N ATOM 1456 CA VAL A 474 -6.860 -0.688 1.607 1.00 0.00 C ATOM 1457 C VAL A 474 -7.456 0.667 1.966 1.00 0.00 C ATOM 1458 O VAL A 474 -8.592 0.972 1.601 1.00 0.00 O ATOM 1459 CB VAL A 474 -6.339 -0.640 0.157 1.00 0.00 C ATOM 1460 CG1 VAL A 474 -5.179 0.335 0.039 1.00 0.00 C ATOM 1461 CG2 VAL A 474 -5.930 -2.029 -0.308 1.00 0.00 C ATOM 0 H VAL A 474 -8.575 -1.774 1.084 1.00 0.00 H new ATOM 0 HA VAL A 474 -6.028 -0.904 2.278 1.00 0.00 H new ATOM 0 HB VAL A 474 -7.144 -0.289 -0.489 1.00 0.00 H new ATOM 0 HG11 VAL A 474 -4.824 0.356 -0.991 1.00 0.00 H new ATOM 0 HG12 VAL A 474 -5.511 1.332 0.328 1.00 0.00 H new ATOM 0 HG13 VAL A 474 -4.369 0.018 0.695 1.00 0.00 H new ATOM 0 HG21 VAL A 474 -5.565 -1.976 -1.334 1.00 0.00 H new ATOM 0 HG22 VAL A 474 -5.141 -2.412 0.339 1.00 0.00 H new ATOM 0 HG23 VAL A 474 -6.791 -2.696 -0.263 1.00 0.00 H new ATOM 1471 N GLN A 475 -6.685 1.477 2.683 1.00 0.00 N ATOM 1472 CA GLN A 475 -7.139 2.801 3.093 1.00 0.00 C ATOM 1473 C GLN A 475 -5.954 3.720 3.370 1.00 0.00 C ATOM 1474 O GLN A 475 -4.909 3.278 3.849 1.00 0.00 O ATOM 1475 CB GLN A 475 -8.022 2.698 4.338 1.00 0.00 C ATOM 1476 CG GLN A 475 -8.734 3.995 4.686 1.00 0.00 C ATOM 1477 CD GLN A 475 -9.396 3.948 6.049 1.00 0.00 C ATOM 1478 OE1 GLN A 475 -10.614 3.811 6.157 1.00 0.00 O ATOM 1479 NE2 GLN A 475 -8.592 4.062 7.101 1.00 0.00 N ATOM 0 H GLN A 475 -5.742 1.240 2.992 1.00 0.00 H new ATOM 0 HA GLN A 475 -7.723 3.227 2.277 1.00 0.00 H new ATOM 0 HB2 GLN A 475 -8.765 1.915 4.183 1.00 0.00 H new ATOM 0 HB3 GLN A 475 -7.408 2.391 5.185 1.00 0.00 H new ATOM 0 HG2 GLN A 475 -8.018 4.816 4.662 1.00 0.00 H new ATOM 0 HG3 GLN A 475 -9.487 4.207 3.927 1.00 0.00 H new ATOM 0 HE21 GLN A 475 -7.587 4.174 6.965 1.00 0.00 H new ATOM 0 HE22 GLN A 475 -8.980 4.037 8.044 1.00 0.00 H new ATOM 1488 N LEU A 476 -6.123 5.003 3.066 1.00 0.00 N ATOM 1489 CA LEU A 476 -5.068 5.986 3.282 1.00 0.00 C ATOM 1490 C LEU A 476 -5.187 6.617 4.666 1.00 0.00 C ATOM 1491 O LEU A 476 -6.239 7.138 5.035 1.00 0.00 O ATOM 1492 CB LEU A 476 -5.128 7.073 2.207 1.00 0.00 C ATOM 1493 CG LEU A 476 -6.175 8.166 2.416 1.00 0.00 C ATOM 1494 CD1 LEU A 476 -5.706 9.161 3.466 1.00 0.00 C ATOM 1495 CD2 LEU A 476 -6.475 8.876 1.103 1.00 0.00 C ATOM 0 H LEU A 476 -6.981 5.386 2.669 1.00 0.00 H new ATOM 0 HA LEU A 476 -4.109 5.473 3.218 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -4.148 7.545 2.141 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -5.318 6.595 1.246 1.00 0.00 H new ATOM 0 HG LEU A 476 -7.093 7.699 2.772 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -6.465 9.932 3.601 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -5.543 8.643 4.411 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -4.774 9.622 3.139 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -7.223 9.651 1.271 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -5.562 9.330 0.718 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -6.855 8.156 0.379 1.00 0.00 H new ATOM 1507 N LYS A 477 -4.099 6.568 5.427 1.00 0.00 N ATOM 1508 CA LYS A 477 -4.078 7.138 6.770 1.00 0.00 C ATOM 1509 C LYS A 477 -4.946 8.391 6.843 1.00 0.00 C ATOM 1510 O LYS A 477 -4.656 9.396 6.194 1.00 0.00 O ATOM 1511 CB LYS A 477 -2.644 7.474 7.181 1.00 0.00 C ATOM 1512 CG LYS A 477 -2.436 7.517 8.686 1.00 0.00 C ATOM 1513 CD LYS A 477 -1.002 7.181 9.061 1.00 0.00 C ATOM 1514 CE LYS A 477 -0.067 8.349 8.786 1.00 0.00 C ATOM 1515 NZ LYS A 477 -0.330 9.497 9.698 1.00 0.00 N ATOM 0 H LYS A 477 -3.220 6.140 5.137 1.00 0.00 H new ATOM 0 HA LYS A 477 -4.483 6.396 7.459 1.00 0.00 H new ATOM 0 HB2 LYS A 477 -1.969 6.734 6.750 1.00 0.00 H new ATOM 0 HB3 LYS A 477 -2.370 8.440 6.757 1.00 0.00 H new ATOM 0 HG2 LYS A 477 -2.688 8.509 9.061 1.00 0.00 H new ATOM 0 HG3 LYS A 477 -3.114 6.812 9.168 1.00 0.00 H new ATOM 0 HD2 LYS A 477 -0.953 6.915 10.117 1.00 0.00 H new ATOM 0 HD3 LYS A 477 -0.672 6.308 8.497 1.00 0.00 H new ATOM 0 HE2 LYS A 477 0.966 8.022 8.902 1.00 0.00 H new ATOM 0 HE3 LYS A 477 -0.184 8.673 7.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 477 0.491 10.135 9.699 1.00 0.00 H new ATOM 0 HZ2 LYS A 477 -1.171 10.015 9.371 1.00 0.00 H new ATOM 0 HZ3 LYS A 477 -0.495 9.144 10.662 1.00 0.00 H new