USER MOD reduce.3.24.130724 H: found=0, std=0, add=688, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 689 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 534 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 538 ASN : amide:sc= -2.36! K(o=-2.4!,f=-1.3) USER MOD Set 2.1: A 529 LYS NZ :NH3+ -117:sc= -1.75! (180deg=-3.26!) USER MOD Set 2.2: A 536 TYR OH : rot 180:sc= 0 USER MOD Single : A 459 SER OG : rot -61:sc= 0.772 USER MOD Single : A 463 LYS NZ :NH3+ -109:sc= -0.492 (180deg=-1.19) USER MOD Single : A 464 ASN : amide:sc= -4.69! C(o=-4.7!,f=-3.4!) USER MOD Single : A 466 MET CE :methyl 140:sc= -0.18 (180deg=-1.19) USER MOD Single : A 470 GLN : amide:sc= -0.0036 K(o=-0.0036,f=-1.3!) USER MOD Single : A 471 GLN : amide:sc= -0.88 K(o=-0.88,f=-0.25) USER MOD Single : A 473 THR OG1 : rot 180:sc= -0.0447 USER MOD Single : A 474 CYS SG : rot 51:sc= -0.0143! USER MOD Single : A 481 ASN : amide:sc= -0.0139 K(o=-0.014,f=-1) USER MOD Single : A 484 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 486 ASN : amide:sc= -9.41! C(o=-9.4!,f=-9!) USER MOD Single : A 489 ASN : amide:sc= -10.6! C(o=-11!,f=-0.1!) USER MOD Single : A 490 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 491 GLN : amide:sc= -0.207 X(o=-0.21,f=-0.17) USER MOD Single : A 493 HIS : no HE2:sc= -8.17! C(o=-8.2!,f=-14!) USER MOD Single : A 501 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 505 GLN : amide:sc= -1 X(o=-1,f=-0.9) USER MOD Single : A 512 THR OG1 : rot 10:sc= -0.316 USER MOD Single : A 516 LYS NZ :NH3+ 180:sc= -1.04 (180deg=-1.04) USER MOD Single : A 518 ASN : amide:sc= -1.5 K(o=-1.5,f=-6.9!) USER MOD Single : A 522 ASN : amide:sc= -2.21! C(o=-2.2!,f=-12!) USER MOD Single : A 525 LYS NZ :NH3+ 132:sc= 0.2 (180deg=-0.0428) USER MOD Single : A 526 ASN : amide:sc= -3.11! C(o=-3.1!,f=-4.1!) USER MOD Single : A 527 CYS SG : rot 71:sc= -0.429 USER MOD Single : A 533 SER OG : rot 180:sc= 0 USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 385 N ASP A 456 4.974 14.286 12.066 1.00 0.00 N ATOM 386 CA ASP A 456 3.735 14.848 11.543 1.00 0.00 C ATOM 387 C ASP A 456 3.158 13.957 10.451 1.00 0.00 C ATOM 388 O ASP A 456 1.948 13.814 10.337 1.00 0.00 O ATOM 389 CB ASP A 456 3.995 16.248 10.982 1.00 0.00 C ATOM 390 CG ASP A 456 5.097 16.190 9.929 1.00 0.00 C ATOM 391 OD1 ASP A 456 5.666 15.126 9.752 1.00 0.00 O ATOM 392 OD2 ASP A 456 5.360 17.212 9.318 1.00 0.00 O ATOM 0 HA ASP A 456 3.014 14.911 12.358 1.00 0.00 H new ATOM 0 HB2 ASP A 456 3.081 16.649 10.543 1.00 0.00 H new ATOM 0 HB3 ASP A 456 4.285 16.924 11.787 1.00 0.00 H new ATOM 397 N ASP A 457 4.031 13.356 9.656 1.00 0.00 N ATOM 398 CA ASP A 457 3.586 12.482 8.576 1.00 0.00 C ATOM 399 C ASP A 457 2.793 11.309 9.137 1.00 0.00 C ATOM 400 O ASP A 457 1.844 10.840 8.512 1.00 0.00 O ATOM 401 CB ASP A 457 4.799 11.958 7.804 1.00 0.00 C ATOM 402 CG ASP A 457 5.413 13.078 6.971 1.00 0.00 C ATOM 403 OD1 ASP A 457 4.734 14.066 6.749 1.00 0.00 O ATOM 404 OD2 ASP A 457 6.554 12.929 6.565 1.00 0.00 O ATOM 0 H ASP A 457 5.043 13.455 9.735 1.00 0.00 H new ATOM 0 HA ASP A 457 2.945 13.053 7.904 1.00 0.00 H new ATOM 0 HB2 ASP A 457 5.540 11.563 8.499 1.00 0.00 H new ATOM 0 HB3 ASP A 457 4.499 11.134 7.156 1.00 0.00 H new ATOM 409 N LEU A 458 3.190 10.834 10.313 1.00 0.00 N ATOM 410 CA LEU A 458 2.508 9.709 10.935 1.00 0.00 C ATOM 411 C LEU A 458 1.042 10.074 11.187 1.00 0.00 C ATOM 412 O LEU A 458 0.144 9.264 10.954 1.00 0.00 O ATOM 413 CB LEU A 458 3.216 9.356 12.259 1.00 0.00 C ATOM 414 CG LEU A 458 3.047 7.863 12.600 1.00 0.00 C ATOM 415 CD1 LEU A 458 1.563 7.473 12.564 1.00 0.00 C ATOM 416 CD2 LEU A 458 3.858 6.989 11.607 1.00 0.00 C ATOM 0 H LEU A 458 3.973 11.208 10.849 1.00 0.00 H new ATOM 0 HA LEU A 458 2.541 8.842 10.275 1.00 0.00 H new ATOM 0 HB2 LEU A 458 4.276 9.597 12.183 1.00 0.00 H new ATOM 0 HB3 LEU A 458 2.808 9.965 13.066 1.00 0.00 H new ATOM 0 HG LEU A 458 3.428 7.690 13.607 1.00 0.00 H new ATOM 0 HD11 LEU A 458 1.459 6.416 12.807 1.00 0.00 H new ATOM 0 HD12 LEU A 458 1.013 8.069 13.292 1.00 0.00 H new ATOM 0 HD13 LEU A 458 1.162 7.658 11.567 1.00 0.00 H new ATOM 0 HD21 LEU A 458 3.729 5.937 11.860 1.00 0.00 H new ATOM 0 HD22 LEU A 458 3.501 7.165 10.592 1.00 0.00 H new ATOM 0 HD23 LEU A 458 4.914 7.251 11.670 1.00 0.00 H new ATOM 428 N SER A 459 0.804 11.296 11.656 1.00 0.00 N ATOM 429 CA SER A 459 -0.561 11.741 11.925 1.00 0.00 C ATOM 430 C SER A 459 -1.387 11.733 10.643 1.00 0.00 C ATOM 431 O SER A 459 -2.550 11.334 10.648 1.00 0.00 O ATOM 432 CB SER A 459 -0.553 13.150 12.521 1.00 0.00 C ATOM 433 OG SER A 459 -0.036 14.064 11.563 1.00 0.00 O ATOM 0 H SER A 459 1.527 11.987 11.855 1.00 0.00 H new ATOM 0 HA SER A 459 -1.010 11.052 12.641 1.00 0.00 H new ATOM 0 HB2 SER A 459 -1.563 13.441 12.809 1.00 0.00 H new ATOM 0 HB3 SER A 459 0.055 13.171 13.425 1.00 0.00 H new ATOM 0 HG SER A 459 0.882 13.810 11.331 1.00 0.00 H new ATOM 439 N LEU A 460 -0.779 12.172 9.544 1.00 0.00 N ATOM 440 CA LEU A 460 -1.483 12.203 8.260 1.00 0.00 C ATOM 441 C LEU A 460 -1.892 10.787 7.843 1.00 0.00 C ATOM 442 O LEU A 460 -3.014 10.572 7.385 1.00 0.00 O ATOM 443 CB LEU A 460 -0.581 12.841 7.182 1.00 0.00 C ATOM 444 CG LEU A 460 -0.753 14.378 7.158 1.00 0.00 C ATOM 445 CD1 LEU A 460 -2.116 14.763 6.543 1.00 0.00 C ATOM 446 CD2 LEU A 460 -0.659 14.937 8.588 1.00 0.00 C ATOM 0 H LEU A 460 0.184 12.507 9.513 1.00 0.00 H new ATOM 0 HA LEU A 460 -2.385 12.805 8.366 1.00 0.00 H new ATOM 0 HB2 LEU A 460 0.461 12.591 7.379 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -0.828 12.428 6.204 1.00 0.00 H new ATOM 0 HG LEU A 460 0.042 14.804 6.546 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -2.218 15.848 6.535 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -2.174 14.386 5.522 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -2.919 14.327 7.137 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -0.781 16.020 8.564 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -1.444 14.497 9.203 1.00 0.00 H new ATOM 0 HD23 LEU A 460 0.315 14.691 9.012 1.00 0.00 H new ATOM 458 N ILE A 461 -0.985 9.830 8.012 1.00 0.00 N ATOM 459 CA ILE A 461 -1.279 8.443 7.659 1.00 0.00 C ATOM 460 C ILE A 461 -2.359 7.882 8.582 1.00 0.00 C ATOM 461 O ILE A 461 -3.278 7.198 8.132 1.00 0.00 O ATOM 462 CB ILE A 461 -0.011 7.595 7.761 1.00 0.00 C ATOM 463 CG1 ILE A 461 1.065 8.179 6.843 1.00 0.00 C ATOM 464 CG2 ILE A 461 -0.320 6.162 7.325 1.00 0.00 C ATOM 465 CD1 ILE A 461 2.421 7.556 7.181 1.00 0.00 C ATOM 0 H ILE A 461 -0.049 9.985 8.387 1.00 0.00 H new ATOM 0 HA ILE A 461 -1.643 8.412 6.632 1.00 0.00 H new ATOM 0 HB ILE A 461 0.344 7.596 8.791 1.00 0.00 H new ATOM 0 HG12 ILE A 461 0.813 7.984 5.801 1.00 0.00 H new ATOM 0 HG13 ILE A 461 1.111 9.261 6.962 1.00 0.00 H new ATOM 0 HG21 ILE A 461 0.584 5.557 7.397 1.00 0.00 H new ATOM 0 HG22 ILE A 461 -1.090 5.743 7.972 1.00 0.00 H new ATOM 0 HG23 ILE A 461 -0.674 6.164 6.294 1.00 0.00 H new ATOM 0 HD11 ILE A 461 3.186 7.973 6.526 1.00 0.00 H new ATOM 0 HD12 ILE A 461 2.673 7.774 8.219 1.00 0.00 H new ATOM 0 HD13 ILE A 461 2.371 6.476 7.039 1.00 0.00 H new ATOM 477 N ARG A 462 -2.241 8.175 9.875 1.00 0.00 N ATOM 478 CA ARG A 462 -3.219 7.690 10.844 1.00 0.00 C ATOM 479 C ARG A 462 -4.608 8.230 10.513 1.00 0.00 C ATOM 480 O ARG A 462 -5.593 7.490 10.537 1.00 0.00 O ATOM 481 CB ARG A 462 -2.817 8.127 12.255 1.00 0.00 C ATOM 482 CG ARG A 462 -3.795 7.532 13.273 1.00 0.00 C ATOM 483 CD ARG A 462 -3.343 7.896 14.688 1.00 0.00 C ATOM 484 NE ARG A 462 -3.427 9.336 14.893 1.00 0.00 N ATOM 485 CZ ARG A 462 -2.977 9.897 16.012 1.00 0.00 C ATOM 486 NH1 ARG A 462 -2.466 9.151 16.953 1.00 0.00 N ATOM 487 NH2 ARG A 462 -3.048 11.189 16.170 1.00 0.00 N ATOM 0 H ARG A 462 -1.489 8.738 10.272 1.00 0.00 H new ATOM 0 HA ARG A 462 -3.244 6.601 10.798 1.00 0.00 H new ATOM 0 HB2 ARG A 462 -1.802 7.796 12.474 1.00 0.00 H new ATOM 0 HB3 ARG A 462 -2.820 9.215 12.325 1.00 0.00 H new ATOM 0 HG2 ARG A 462 -4.801 7.912 13.092 1.00 0.00 H new ATOM 0 HG3 ARG A 462 -3.839 6.449 13.161 1.00 0.00 H new ATOM 0 HD2 ARG A 462 -3.966 7.381 15.419 1.00 0.00 H new ATOM 0 HD3 ARG A 462 -2.319 7.559 14.848 1.00 0.00 H new ATOM 0 HE ARG A 462 -3.837 9.923 14.167 1.00 0.00 H new ATOM 0 HH11 ARG A 462 -2.412 8.140 16.830 1.00 0.00 H new ATOM 0 HH12 ARG A 462 -2.120 9.579 17.812 1.00 0.00 H new ATOM 0 HH21 ARG A 462 -3.449 11.771 15.435 1.00 0.00 H new ATOM 0 HH22 ARG A 462 -2.702 11.618 17.029 1.00 0.00 H new ATOM 501 N LYS A 463 -4.677 9.518 10.191 1.00 0.00 N ATOM 502 CA LYS A 463 -5.950 10.143 9.840 1.00 0.00 C ATOM 503 C LYS A 463 -6.519 9.519 8.573 1.00 0.00 C ATOM 504 O LYS A 463 -7.728 9.312 8.459 1.00 0.00 O ATOM 505 CB LYS A 463 -5.762 11.648 9.635 1.00 0.00 C ATOM 506 CG LYS A 463 -5.538 12.327 10.988 1.00 0.00 C ATOM 507 CD LYS A 463 -5.328 13.828 10.781 1.00 0.00 C ATOM 508 CE LYS A 463 -5.237 14.521 12.143 1.00 0.00 C ATOM 509 NZ LYS A 463 -4.047 14.013 12.880 1.00 0.00 N ATOM 0 H LYS A 463 -3.874 10.146 10.165 1.00 0.00 H new ATOM 0 HA LYS A 463 -6.650 9.979 10.659 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -4.911 11.832 8.979 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.639 12.071 9.145 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -6.396 12.156 11.638 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -4.670 11.893 11.485 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -4.416 14.004 10.210 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -6.152 14.245 10.203 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -5.162 15.600 12.010 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -6.143 14.333 12.720 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -4.358 13.416 13.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -3.454 13.452 12.236 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -3.497 14.816 13.246 1.00 0.00 H new ATOM 523 N ASN A 464 -5.639 9.225 7.621 1.00 0.00 N ATOM 524 CA ASN A 464 -6.058 8.629 6.358 1.00 0.00 C ATOM 525 C ASN A 464 -6.171 7.116 6.495 1.00 0.00 C ATOM 526 O ASN A 464 -6.406 6.409 5.515 1.00 0.00 O ATOM 527 CB ASN A 464 -5.039 8.963 5.268 1.00 0.00 C ATOM 528 CG ASN A 464 -5.043 10.463 4.994 1.00 0.00 C ATOM 529 OD1 ASN A 464 -6.099 11.048 4.753 1.00 0.00 O ATOM 530 ND2 ASN A 464 -3.919 11.125 5.017 1.00 0.00 N ATOM 0 H ASN A 464 -4.635 9.389 7.700 1.00 0.00 H new ATOM 0 HA ASN A 464 -7.033 9.035 6.088 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -4.044 8.644 5.579 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -5.278 8.417 4.355 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -3.914 12.129 4.835 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -3.045 10.639 5.217 1.00 0.00 H new ATOM 537 N ARG A 465 -5.998 6.624 7.718 1.00 0.00 N ATOM 538 CA ARG A 465 -6.077 5.191 7.970 1.00 0.00 C ATOM 539 C ARG A 465 -7.453 4.650 7.597 1.00 0.00 C ATOM 540 O ARG A 465 -7.561 3.612 6.945 1.00 0.00 O ATOM 541 CB ARG A 465 -5.800 4.914 9.451 1.00 0.00 C ATOM 542 CG ARG A 465 -5.791 3.406 9.715 1.00 0.00 C ATOM 543 CD ARG A 465 -5.572 3.157 11.208 1.00 0.00 C ATOM 544 NE ARG A 465 -4.236 3.580 11.602 1.00 0.00 N ATOM 545 CZ ARG A 465 -3.825 3.469 12.860 1.00 0.00 C ATOM 546 NH1 ARG A 465 -4.620 2.967 13.764 1.00 0.00 N ATOM 547 NH2 ARG A 465 -2.626 3.862 13.190 1.00 0.00 N ATOM 0 H ARG A 465 -5.804 7.192 8.543 1.00 0.00 H new ATOM 0 HA ARG A 465 -5.330 4.690 7.355 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -4.841 5.346 9.736 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -6.561 5.394 10.067 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -6.734 2.963 9.395 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -5.002 2.928 9.135 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -6.318 3.701 11.787 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -5.706 2.098 11.430 1.00 0.00 H new ATOM 0 HE ARG A 465 -3.605 3.968 10.901 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -5.557 2.660 13.505 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -4.304 2.882 14.730 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -2.005 4.254 12.482 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -2.309 3.777 14.156 1.00 0.00 H new ATOM 561 N MET A 466 -8.504 5.352 8.008 1.00 0.00 N ATOM 562 CA MET A 466 -9.859 4.913 7.696 1.00 0.00 C ATOM 563 C MET A 466 -10.123 5.045 6.203 1.00 0.00 C ATOM 564 O MET A 466 -10.745 4.175 5.594 1.00 0.00 O ATOM 565 CB MET A 466 -10.879 5.741 8.475 1.00 0.00 C ATOM 566 CG MET A 466 -10.760 5.432 9.968 1.00 0.00 C ATOM 567 SD MET A 466 -11.921 6.469 10.892 1.00 0.00 S ATOM 568 CE MET A 466 -13.455 5.741 10.262 1.00 0.00 C ATOM 0 H MET A 466 -8.446 6.214 8.550 1.00 0.00 H new ATOM 0 HA MET A 466 -9.958 3.867 7.985 1.00 0.00 H new ATOM 0 HB2 MET A 466 -10.710 6.803 8.299 1.00 0.00 H new ATOM 0 HB3 MET A 466 -11.887 5.516 8.126 1.00 0.00 H new ATOM 0 HG2 MET A 466 -10.972 4.378 10.150 1.00 0.00 H new ATOM 0 HG3 MET A 466 -9.741 5.616 10.308 1.00 0.00 H new ATOM 0 HE1 MET A 466 -14.178 5.656 11.074 1.00 0.00 H new ATOM 0 HE2 MET A 466 -13.864 6.377 9.477 1.00 0.00 H new ATOM 0 HE3 MET A 466 -13.248 4.751 9.856 1.00 0.00 H new ATOM 578 N ALA A 467 -9.639 6.136 5.618 1.00 0.00 N ATOM 579 CA ALA A 467 -9.827 6.364 4.197 1.00 0.00 C ATOM 580 C ALA A 467 -9.177 5.245 3.396 1.00 0.00 C ATOM 581 O ALA A 467 -9.753 4.751 2.430 1.00 0.00 O ATOM 582 CB ALA A 467 -9.208 7.704 3.795 1.00 0.00 C ATOM 0 H ALA A 467 -9.119 6.867 6.103 1.00 0.00 H new ATOM 0 HA ALA A 467 -10.896 6.382 3.986 1.00 0.00 H new ATOM 0 HB1 ALA A 467 -9.354 7.866 2.727 1.00 0.00 H new ATOM 0 HB2 ALA A 467 -9.687 8.508 4.353 1.00 0.00 H new ATOM 0 HB3 ALA A 467 -8.141 7.693 4.018 1.00 0.00 H new ATOM 588 N LEU A 468 -7.974 4.853 3.804 1.00 0.00 N ATOM 589 CA LEU A 468 -7.257 3.792 3.109 1.00 0.00 C ATOM 590 C LEU A 468 -8.046 2.487 3.190 1.00 0.00 C ATOM 591 O LEU A 468 -8.228 1.797 2.187 1.00 0.00 O ATOM 592 CB LEU A 468 -5.874 3.600 3.746 1.00 0.00 C ATOM 593 CG LEU A 468 -5.018 2.644 2.894 1.00 0.00 C ATOM 594 CD1 LEU A 468 -4.477 3.371 1.652 1.00 0.00 C ATOM 595 CD2 LEU A 468 -3.843 2.131 3.735 1.00 0.00 C ATOM 0 H LEU A 468 -7.480 5.250 4.604 1.00 0.00 H new ATOM 0 HA LEU A 468 -7.138 4.071 2.062 1.00 0.00 H new ATOM 0 HB2 LEU A 468 -5.372 4.563 3.838 1.00 0.00 H new ATOM 0 HB3 LEU A 468 -5.983 3.200 4.754 1.00 0.00 H new ATOM 0 HG LEU A 468 -5.638 1.808 2.570 1.00 0.00 H new ATOM 0 HD11 LEU A 468 -3.874 2.682 1.061 1.00 0.00 H new ATOM 0 HD12 LEU A 468 -5.311 3.732 1.050 1.00 0.00 H new ATOM 0 HD13 LEU A 468 -3.862 4.215 1.964 1.00 0.00 H new ATOM 0 HD21 LEU A 468 -3.235 1.454 3.135 1.00 0.00 H new ATOM 0 HD22 LEU A 468 -3.234 2.974 4.061 1.00 0.00 H new ATOM 0 HD23 LEU A 468 -4.224 1.600 4.607 1.00 0.00 H new ATOM 607 N PHE A 469 -8.522 2.163 4.390 1.00 0.00 N ATOM 608 CA PHE A 469 -9.305 0.951 4.594 1.00 0.00 C ATOM 609 C PHE A 469 -10.616 1.030 3.815 1.00 0.00 C ATOM 610 O PHE A 469 -11.013 0.080 3.140 1.00 0.00 O ATOM 611 CB PHE A 469 -9.584 0.763 6.090 1.00 0.00 C ATOM 612 CG PHE A 469 -10.577 -0.358 6.300 1.00 0.00 C ATOM 613 CD1 PHE A 469 -10.187 -1.689 6.111 1.00 0.00 C ATOM 614 CD2 PHE A 469 -11.894 -0.062 6.683 1.00 0.00 C ATOM 615 CE1 PHE A 469 -11.111 -2.722 6.304 1.00 0.00 C ATOM 616 CE2 PHE A 469 -12.814 -1.094 6.878 1.00 0.00 C ATOM 617 CZ PHE A 469 -12.426 -2.426 6.688 1.00 0.00 C ATOM 0 H PHE A 469 -8.379 2.721 5.231 1.00 0.00 H new ATOM 0 HA PHE A 469 -8.739 0.095 4.228 1.00 0.00 H new ATOM 0 HB2 PHE A 469 -8.655 0.539 6.615 1.00 0.00 H new ATOM 0 HB3 PHE A 469 -9.974 1.688 6.514 1.00 0.00 H new ATOM 0 HD1 PHE A 469 -9.174 -1.919 5.816 1.00 0.00 H new ATOM 0 HD2 PHE A 469 -12.196 0.965 6.827 1.00 0.00 H new ATOM 0 HE1 PHE A 469 -10.810 -3.749 6.157 1.00 0.00 H new ATOM 0 HE2 PHE A 469 -13.826 -0.865 7.176 1.00 0.00 H new ATOM 0 HZ PHE A 469 -13.139 -3.224 6.837 1.00 0.00 H new ATOM 627 N GLN A 470 -11.278 2.176 3.924 1.00 0.00 N ATOM 628 CA GLN A 470 -12.545 2.401 3.241 1.00 0.00 C ATOM 629 C GLN A 470 -12.340 2.420 1.729 1.00 0.00 C ATOM 630 O GLN A 470 -13.160 1.897 0.974 1.00 0.00 O ATOM 631 CB GLN A 470 -13.129 3.736 3.711 1.00 0.00 C ATOM 632 CG GLN A 470 -14.441 4.040 2.983 1.00 0.00 C ATOM 633 CD GLN A 470 -15.043 5.325 3.541 1.00 0.00 C ATOM 634 OE1 GLN A 470 -14.864 5.630 4.720 1.00 0.00 O ATOM 635 NE2 GLN A 470 -15.734 6.107 2.759 1.00 0.00 N ATOM 0 H GLN A 470 -10.956 2.967 4.482 1.00 0.00 H new ATOM 0 HA GLN A 470 -13.235 1.592 3.479 1.00 0.00 H new ATOM 0 HB2 GLN A 470 -13.303 3.704 4.786 1.00 0.00 H new ATOM 0 HB3 GLN A 470 -12.412 4.537 3.528 1.00 0.00 H new ATOM 0 HG2 GLN A 470 -14.260 4.144 1.913 1.00 0.00 H new ATOM 0 HG3 GLN A 470 -15.140 3.213 3.109 1.00 0.00 H new ATOM 0 HE21 GLN A 470 -15.881 5.851 1.782 1.00 0.00 H new ATOM 0 HE22 GLN A 470 -16.128 6.974 3.124 1.00 0.00 H new ATOM 644 N GLN A 471 -11.235 3.025 1.300 1.00 0.00 N ATOM 645 CA GLN A 471 -10.906 3.117 -0.123 1.00 0.00 C ATOM 646 C GLN A 471 -9.833 2.088 -0.466 1.00 0.00 C ATOM 647 O GLN A 471 -8.740 2.439 -0.911 1.00 0.00 O ATOM 648 CB GLN A 471 -10.385 4.523 -0.431 1.00 0.00 C ATOM 649 CG GLN A 471 -11.447 5.555 -0.045 1.00 0.00 C ATOM 650 CD GLN A 471 -10.827 6.946 0.015 1.00 0.00 C ATOM 651 OE1 GLN A 471 -10.099 7.346 -0.895 1.00 0.00 O ATOM 652 NE2 GLN A 471 -11.071 7.709 1.048 1.00 0.00 N ATOM 0 H GLN A 471 -10.550 3.460 1.918 1.00 0.00 H new ATOM 0 HA GLN A 471 -11.798 2.920 -0.718 1.00 0.00 H new ATOM 0 HB2 GLN A 471 -9.463 4.710 0.120 1.00 0.00 H new ATOM 0 HB3 GLN A 471 -10.146 4.610 -1.491 1.00 0.00 H new ATOM 0 HG2 GLN A 471 -12.260 5.541 -0.771 1.00 0.00 H new ATOM 0 HG3 GLN A 471 -11.880 5.299 0.922 1.00 0.00 H new ATOM 0 HE21 GLN A 471 -11.674 7.373 1.799 1.00 0.00 H new ATOM 0 HE22 GLN A 471 -10.658 8.640 1.103 1.00 0.00 H new ATOM 661 N LEU A 472 -10.154 0.818 -0.239 1.00 0.00 N ATOM 662 CA LEU A 472 -9.215 -0.266 -0.507 1.00 0.00 C ATOM 663 C LEU A 472 -9.235 -0.650 -1.983 1.00 0.00 C ATOM 664 O LEU A 472 -10.290 -0.954 -2.543 1.00 0.00 O ATOM 665 CB LEU A 472 -9.583 -1.481 0.360 1.00 0.00 C ATOM 666 CG LEU A 472 -10.977 -2.037 -0.050 1.00 0.00 C ATOM 667 CD1 LEU A 472 -10.819 -3.260 -0.972 1.00 0.00 C ATOM 668 CD2 LEU A 472 -11.770 -2.450 1.204 1.00 0.00 C ATOM 0 H LEU A 472 -11.056 0.515 0.129 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.208 0.070 -0.260 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.827 -2.258 0.248 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -9.593 -1.196 1.412 1.00 0.00 H new ATOM 0 HG LEU A 472 -11.515 -1.253 -0.583 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -11.804 -3.636 -1.249 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -10.275 -2.970 -1.871 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -10.266 -4.041 -0.449 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -12.744 -2.838 0.907 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -11.221 -3.222 1.744 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -11.906 -1.583 1.850 1.00 0.00 H new ATOM 680 N THR A 473 -8.063 -0.630 -2.611 1.00 0.00 N ATOM 681 CA THR A 473 -7.950 -0.976 -4.026 1.00 0.00 C ATOM 682 C THR A 473 -6.555 -1.513 -4.331 1.00 0.00 C ATOM 683 O THR A 473 -6.343 -2.724 -4.400 1.00 0.00 O ATOM 684 CB THR A 473 -8.227 0.257 -4.887 1.00 0.00 C ATOM 685 OG1 THR A 473 -9.570 0.676 -4.690 1.00 0.00 O ATOM 686 CG2 THR A 473 -8.010 -0.085 -6.362 1.00 0.00 C ATOM 0 H THR A 473 -7.181 -0.379 -2.165 1.00 0.00 H new ATOM 0 HA THR A 473 -8.683 -1.749 -4.256 1.00 0.00 H new ATOM 0 HB THR A 473 -7.547 1.060 -4.600 1.00 0.00 H new ATOM 0 HG1 THR A 473 -9.750 1.467 -5.240 1.00 0.00 H new ATOM 0 HG21 THR A 473 -8.208 0.796 -6.973 1.00 0.00 H new ATOM 0 HG22 THR A 473 -6.980 -0.407 -6.513 1.00 0.00 H new ATOM 0 HG23 THR A 473 -8.687 -0.888 -6.653 1.00 0.00 H new ATOM 694 N CYS A 474 -5.608 -0.600 -4.512 1.00 0.00 N ATOM 695 CA CYS A 474 -4.232 -0.979 -4.806 1.00 0.00 C ATOM 696 C CYS A 474 -3.535 -1.479 -3.546 1.00 0.00 C ATOM 697 O CYS A 474 -2.681 -0.793 -2.983 1.00 0.00 O ATOM 698 CB CYS A 474 -3.473 0.221 -5.369 1.00 0.00 C ATOM 699 SG CYS A 474 -3.493 1.567 -4.157 1.00 0.00 S ATOM 0 H CYS A 474 -5.768 0.406 -4.460 1.00 0.00 H new ATOM 0 HA CYS A 474 -4.243 -1.781 -5.544 1.00 0.00 H new ATOM 0 HB2 CYS A 474 -2.446 -0.060 -5.600 1.00 0.00 H new ATOM 0 HB3 CYS A 474 -3.931 0.550 -6.302 1.00 0.00 H new ATOM 0 HG CYS A 474 -3.099 1.117 -3.003 1.00 0.00 H new ATOM 705 N VAL A 475 -3.898 -2.686 -3.116 1.00 0.00 N ATOM 706 CA VAL A 475 -3.299 -3.290 -1.925 1.00 0.00 C ATOM 707 C VAL A 475 -2.188 -4.267 -2.316 1.00 0.00 C ATOM 708 O VAL A 475 -1.313 -4.575 -1.509 1.00 0.00 O ATOM 709 CB VAL A 475 -4.373 -4.039 -1.132 1.00 0.00 C ATOM 710 CG1 VAL A 475 -5.282 -3.032 -0.424 1.00 0.00 C ATOM 711 CG2 VAL A 475 -5.208 -4.893 -2.095 1.00 0.00 C ATOM 0 H VAL A 475 -4.603 -3.265 -3.573 1.00 0.00 H new ATOM 0 HA VAL A 475 -2.872 -2.496 -1.313 1.00 0.00 H new ATOM 0 HB VAL A 475 -3.898 -4.681 -0.390 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -6.046 -3.566 0.140 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -4.688 -2.422 0.257 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -5.760 -2.390 -1.164 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -5.975 -5.429 -1.535 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -5.683 -4.248 -2.835 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -4.561 -5.610 -2.600 1.00 0.00 H new ATOM 721 N LEU A 476 -2.231 -4.757 -3.555 1.00 0.00 N ATOM 722 CA LEU A 476 -1.217 -5.708 -4.017 1.00 0.00 C ATOM 723 C LEU A 476 0.086 -4.992 -4.377 1.00 0.00 C ATOM 724 O LEU A 476 1.164 -5.465 -4.017 1.00 0.00 O ATOM 725 CB LEU A 476 -1.718 -6.543 -5.225 1.00 0.00 C ATOM 726 CG LEU A 476 -3.234 -6.771 -5.127 1.00 0.00 C ATOM 727 CD1 LEU A 476 -3.740 -7.447 -6.402 1.00 0.00 C ATOM 728 CD2 LEU A 476 -3.550 -7.665 -3.923 1.00 0.00 C ATOM 0 H LEU A 476 -2.942 -4.518 -4.246 1.00 0.00 H new ATOM 0 HA LEU A 476 -1.024 -6.393 -3.191 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -1.481 -6.027 -6.155 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -1.201 -7.502 -5.252 1.00 0.00 H new ATOM 0 HG LEU A 476 -3.728 -5.807 -5.004 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -4.816 -7.606 -6.327 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -3.526 -6.810 -7.261 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -3.239 -8.407 -6.528 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -4.627 -7.823 -3.859 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -3.049 -8.626 -4.042 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -3.199 -7.183 -3.010 1.00 0.00 H new ATOM 740 N PRO A 477 0.033 -3.881 -5.077 1.00 0.00 N ATOM 741 CA PRO A 477 1.268 -3.138 -5.471 1.00 0.00 C ATOM 742 C PRO A 477 2.038 -2.614 -4.260 1.00 0.00 C ATOM 743 O PRO A 477 3.265 -2.700 -4.204 1.00 0.00 O ATOM 744 CB PRO A 477 0.737 -1.980 -6.340 1.00 0.00 C ATOM 745 CG PRO A 477 -0.624 -2.422 -6.765 1.00 0.00 C ATOM 746 CD PRO A 477 -1.173 -3.197 -5.570 1.00 0.00 C ATOM 0 HA PRO A 477 1.980 -3.775 -5.997 1.00 0.00 H new ATOM 0 HB2 PRO A 477 0.693 -1.049 -5.776 1.00 0.00 H new ATOM 0 HB3 PRO A 477 1.382 -1.801 -7.200 1.00 0.00 H new ATOM 0 HG2 PRO A 477 -1.258 -1.570 -7.009 1.00 0.00 H new ATOM 0 HG3 PRO A 477 -0.576 -3.049 -7.655 1.00 0.00 H new ATOM 0 HD2 PRO A 477 -1.605 -2.537 -4.818 1.00 0.00 H new ATOM 0 HD3 PRO A 477 -1.952 -3.901 -5.862 1.00 0.00 H new ATOM 754 N ILE A 478 1.308 -2.059 -3.295 1.00 0.00 N ATOM 755 CA ILE A 478 1.944 -1.518 -2.102 1.00 0.00 C ATOM 756 C ILE A 478 2.510 -2.656 -1.250 1.00 0.00 C ATOM 757 O ILE A 478 3.607 -2.557 -0.703 1.00 0.00 O ATOM 758 CB ILE A 478 0.927 -0.669 -1.285 1.00 0.00 C ATOM 759 CG1 ILE A 478 1.666 0.473 -0.564 1.00 0.00 C ATOM 760 CG2 ILE A 478 0.197 -1.537 -0.247 1.00 0.00 C ATOM 761 CD1 ILE A 478 2.814 -0.090 0.283 1.00 0.00 C ATOM 0 H ILE A 478 0.292 -1.974 -3.316 1.00 0.00 H new ATOM 0 HA ILE A 478 2.766 -0.868 -2.402 1.00 0.00 H new ATOM 0 HB ILE A 478 0.191 -0.258 -1.976 1.00 0.00 H new ATOM 0 HG12 ILE A 478 2.057 1.181 -1.295 1.00 0.00 H new ATOM 0 HG13 ILE A 478 0.971 1.022 0.071 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -0.508 -0.921 0.311 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -0.343 -2.336 -0.756 1.00 0.00 H new ATOM 0 HG23 ILE A 478 0.923 -1.970 0.440 1.00 0.00 H new ATOM 0 HD11 ILE A 478 3.329 0.728 0.788 1.00 0.00 H new ATOM 0 HD12 ILE A 478 2.414 -0.780 1.026 1.00 0.00 H new ATOM 0 HD13 ILE A 478 3.517 -0.618 -0.362 1.00 0.00 H new ATOM 773 N LEU A 479 1.744 -3.737 -1.146 1.00 0.00 N ATOM 774 CA LEU A 479 2.166 -4.887 -0.363 1.00 0.00 C ATOM 775 C LEU A 479 3.451 -5.459 -0.934 1.00 0.00 C ATOM 776 O LEU A 479 4.362 -5.829 -0.195 1.00 0.00 O ATOM 777 CB LEU A 479 1.063 -5.953 -0.374 1.00 0.00 C ATOM 778 CG LEU A 479 1.488 -7.183 0.442 1.00 0.00 C ATOM 779 CD1 LEU A 479 1.818 -6.778 1.889 1.00 0.00 C ATOM 780 CD2 LEU A 479 0.339 -8.198 0.437 1.00 0.00 C ATOM 0 H LEU A 479 0.833 -3.838 -1.593 1.00 0.00 H new ATOM 0 HA LEU A 479 2.348 -4.574 0.665 1.00 0.00 H new ATOM 0 HB2 LEU A 479 0.144 -5.537 0.039 1.00 0.00 H new ATOM 0 HB3 LEU A 479 0.846 -6.249 -1.401 1.00 0.00 H new ATOM 0 HG LEU A 479 2.379 -7.624 -0.004 1.00 0.00 H new ATOM 0 HD11 LEU A 479 2.117 -7.660 2.455 1.00 0.00 H new ATOM 0 HD12 LEU A 479 2.633 -6.054 1.887 1.00 0.00 H new ATOM 0 HD13 LEU A 479 0.938 -6.332 2.352 1.00 0.00 H new ATOM 0 HD21 LEU A 479 0.628 -9.077 1.013 1.00 0.00 H new ATOM 0 HD22 LEU A 479 -0.547 -7.747 0.883 1.00 0.00 H new ATOM 0 HD23 LEU A 479 0.119 -8.493 -0.589 1.00 0.00 H new ATOM 792 N ASP A 480 3.520 -5.526 -2.257 1.00 0.00 N ATOM 793 CA ASP A 480 4.703 -6.049 -2.917 1.00 0.00 C ATOM 794 C ASP A 480 5.915 -5.192 -2.573 1.00 0.00 C ATOM 795 O ASP A 480 6.994 -5.715 -2.288 1.00 0.00 O ATOM 796 CB ASP A 480 4.496 -6.062 -4.433 1.00 0.00 C ATOM 797 CG ASP A 480 5.738 -6.619 -5.123 1.00 0.00 C ATOM 798 OD1 ASP A 480 6.712 -6.867 -4.431 1.00 0.00 O ATOM 799 OD2 ASP A 480 5.697 -6.788 -6.330 1.00 0.00 O ATOM 0 H ASP A 480 2.776 -5.227 -2.888 1.00 0.00 H new ATOM 0 HA ASP A 480 4.875 -7.068 -2.571 1.00 0.00 H new ATOM 0 HB2 ASP A 480 3.627 -6.669 -4.685 1.00 0.00 H new ATOM 0 HB3 ASP A 480 4.293 -5.052 -4.790 1.00 0.00 H new ATOM 804 N ASN A 481 5.734 -3.874 -2.598 1.00 0.00 N ATOM 805 CA ASN A 481 6.822 -2.956 -2.285 1.00 0.00 C ATOM 806 C ASN A 481 7.265 -3.123 -0.833 1.00 0.00 C ATOM 807 O ASN A 481 8.456 -3.112 -0.533 1.00 0.00 O ATOM 808 CB ASN A 481 6.369 -1.513 -2.513 1.00 0.00 C ATOM 809 CG ASN A 481 6.193 -1.252 -4.006 1.00 0.00 C ATOM 810 OD1 ASN A 481 6.970 -1.750 -4.820 1.00 0.00 O ATOM 811 ND2 ASN A 481 5.209 -0.499 -4.415 1.00 0.00 N ATOM 0 H ASN A 481 4.850 -3.421 -2.830 1.00 0.00 H new ATOM 0 HA ASN A 481 7.662 -3.184 -2.940 1.00 0.00 H new ATOM 0 HB2 ASN A 481 5.430 -1.331 -1.990 1.00 0.00 H new ATOM 0 HB3 ASN A 481 7.104 -0.823 -2.099 1.00 0.00 H new ATOM 0 HD21 ASN A 481 5.082 -0.322 -5.412 1.00 0.00 H new ATOM 0 HD22 ASN A 481 4.566 -0.087 -3.738 1.00 0.00 H new ATOM 818 N LEU A 482 6.294 -3.279 0.061 1.00 0.00 N ATOM 819 CA LEU A 482 6.587 -3.451 1.481 1.00 0.00 C ATOM 820 C LEU A 482 7.297 -4.784 1.722 1.00 0.00 C ATOM 821 O LEU A 482 8.179 -4.888 2.575 1.00 0.00 O ATOM 822 CB LEU A 482 5.287 -3.390 2.300 1.00 0.00 C ATOM 823 CG LEU A 482 5.592 -3.485 3.804 1.00 0.00 C ATOM 824 CD1 LEU A 482 6.410 -2.268 4.264 1.00 0.00 C ATOM 825 CD2 LEU A 482 4.275 -3.540 4.587 1.00 0.00 C ATOM 0 H LEU A 482 5.301 -3.290 -0.171 1.00 0.00 H new ATOM 0 HA LEU A 482 7.245 -2.643 1.800 1.00 0.00 H new ATOM 0 HB2 LEU A 482 4.760 -2.460 2.088 1.00 0.00 H new ATOM 0 HB3 LEU A 482 4.626 -4.205 2.005 1.00 0.00 H new ATOM 0 HG LEU A 482 6.172 -4.389 3.990 1.00 0.00 H new ATOM 0 HD11 LEU A 482 6.617 -2.351 5.331 1.00 0.00 H new ATOM 0 HD12 LEU A 482 7.350 -2.232 3.713 1.00 0.00 H new ATOM 0 HD13 LEU A 482 5.844 -1.356 4.074 1.00 0.00 H new ATOM 0 HD21 LEU A 482 4.488 -3.607 5.654 1.00 0.00 H new ATOM 0 HD22 LEU A 482 3.696 -2.638 4.389 1.00 0.00 H new ATOM 0 HD23 LEU A 482 3.703 -4.414 4.276 1.00 0.00 H new ATOM 837 N LEU A 483 6.889 -5.801 0.973 1.00 0.00 N ATOM 838 CA LEU A 483 7.469 -7.134 1.111 1.00 0.00 C ATOM 839 C LEU A 483 8.982 -7.094 0.894 1.00 0.00 C ATOM 840 O LEU A 483 9.702 -7.991 1.334 1.00 0.00 O ATOM 841 CB LEU A 483 6.813 -8.090 0.103 1.00 0.00 C ATOM 842 CG LEU A 483 7.444 -9.489 0.198 1.00 0.00 C ATOM 843 CD1 LEU A 483 7.326 -10.028 1.635 1.00 0.00 C ATOM 844 CD2 LEU A 483 6.724 -10.438 -0.767 1.00 0.00 C ATOM 0 H LEU A 483 6.159 -5.730 0.264 1.00 0.00 H new ATOM 0 HA LEU A 483 7.282 -7.493 2.123 1.00 0.00 H new ATOM 0 HB2 LEU A 483 5.742 -8.154 0.297 1.00 0.00 H new ATOM 0 HB3 LEU A 483 6.931 -7.699 -0.908 1.00 0.00 H new ATOM 0 HG LEU A 483 8.499 -9.424 -0.069 1.00 0.00 H new ATOM 0 HD11 LEU A 483 7.776 -11.019 1.690 1.00 0.00 H new ATOM 0 HD12 LEU A 483 7.844 -9.356 2.319 1.00 0.00 H new ATOM 0 HD13 LEU A 483 6.274 -10.091 1.915 1.00 0.00 H new ATOM 0 HD21 LEU A 483 7.170 -11.431 -0.701 1.00 0.00 H new ATOM 0 HD22 LEU A 483 5.669 -10.496 -0.501 1.00 0.00 H new ATOM 0 HD23 LEU A 483 6.821 -10.063 -1.786 1.00 0.00 H new ATOM 856 N LYS A 484 9.456 -6.055 0.217 1.00 0.00 N ATOM 857 CA LYS A 484 10.885 -5.922 -0.050 1.00 0.00 C ATOM 858 C LYS A 484 11.678 -5.841 1.254 1.00 0.00 C ATOM 859 O LYS A 484 12.741 -6.449 1.378 1.00 0.00 O ATOM 860 CB LYS A 484 11.148 -4.664 -0.881 1.00 0.00 C ATOM 861 CG LYS A 484 10.570 -4.849 -2.285 1.00 0.00 C ATOM 862 CD LYS A 484 10.828 -3.590 -3.114 1.00 0.00 C ATOM 863 CE LYS A 484 10.273 -3.784 -4.526 1.00 0.00 C ATOM 864 NZ LYS A 484 10.490 -2.545 -5.321 1.00 0.00 N ATOM 0 H LYS A 484 8.880 -5.299 -0.154 1.00 0.00 H new ATOM 0 HA LYS A 484 11.209 -6.803 -0.604 1.00 0.00 H new ATOM 0 HB2 LYS A 484 10.694 -3.797 -0.401 1.00 0.00 H new ATOM 0 HB3 LYS A 484 12.219 -4.472 -0.940 1.00 0.00 H new ATOM 0 HG2 LYS A 484 11.026 -5.714 -2.766 1.00 0.00 H new ATOM 0 HG3 LYS A 484 9.499 -5.045 -2.226 1.00 0.00 H new ATOM 0 HD2 LYS A 484 10.356 -2.728 -2.642 1.00 0.00 H new ATOM 0 HD3 LYS A 484 11.897 -3.384 -3.158 1.00 0.00 H new ATOM 0 HE2 LYS A 484 10.765 -4.629 -5.008 1.00 0.00 H new ATOM 0 HE3 LYS A 484 9.209 -4.018 -4.481 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 10.112 -2.678 -6.281 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 10.001 -1.749 -4.864 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 11.508 -2.341 -5.375 1.00 0.00 H new ATOM 878 N ALA A 485 11.160 -5.088 2.225 1.00 0.00 N ATOM 879 CA ALA A 485 11.839 -4.943 3.514 1.00 0.00 C ATOM 880 C ALA A 485 10.834 -4.690 4.636 1.00 0.00 C ATOM 881 O ALA A 485 10.386 -3.562 4.838 1.00 0.00 O ATOM 882 CB ALA A 485 12.831 -3.780 3.448 1.00 0.00 C ATOM 0 H ALA A 485 10.282 -4.574 2.146 1.00 0.00 H new ATOM 0 HA ALA A 485 12.370 -5.871 3.726 1.00 0.00 H new ATOM 0 HB1 ALA A 485 13.334 -3.676 4.409 1.00 0.00 H new ATOM 0 HB2 ALA A 485 13.570 -3.976 2.671 1.00 0.00 H new ATOM 0 HB3 ALA A 485 12.297 -2.859 3.216 1.00 0.00 H new ATOM 888 N ASN A 486 10.490 -5.748 5.364 1.00 0.00 N ATOM 889 CA ASN A 486 9.542 -5.632 6.467 1.00 0.00 C ATOM 890 C ASN A 486 9.665 -6.825 7.417 1.00 0.00 C ATOM 891 O ASN A 486 10.552 -7.663 7.263 1.00 0.00 O ATOM 892 CB ASN A 486 8.114 -5.537 5.927 1.00 0.00 C ATOM 893 CG ASN A 486 7.859 -6.649 4.918 1.00 0.00 C ATOM 894 OD1 ASN A 486 8.732 -7.482 4.675 1.00 0.00 O ATOM 895 ND2 ASN A 486 6.704 -6.713 4.315 1.00 0.00 N ATOM 0 H ASN A 486 10.851 -6.690 5.212 1.00 0.00 H new ATOM 0 HA ASN A 486 9.774 -4.724 7.023 1.00 0.00 H new ATOM 0 HB2 ASN A 486 7.401 -5.610 6.748 1.00 0.00 H new ATOM 0 HB3 ASN A 486 7.959 -4.566 5.456 1.00 0.00 H new ATOM 0 HD21 ASN A 486 6.522 -7.455 3.639 1.00 0.00 H new ATOM 0 HD22 ASN A 486 5.983 -6.021 4.519 1.00 0.00 H new ATOM 902 N VAL A 487 8.771 -6.888 8.403 1.00 0.00 N ATOM 903 CA VAL A 487 8.795 -7.978 9.377 1.00 0.00 C ATOM 904 C VAL A 487 8.214 -9.257 8.778 1.00 0.00 C ATOM 905 O VAL A 487 8.630 -10.361 9.127 1.00 0.00 O ATOM 906 CB VAL A 487 7.991 -7.587 10.619 1.00 0.00 C ATOM 907 CG1 VAL A 487 8.548 -6.286 11.201 1.00 0.00 C ATOM 908 CG2 VAL A 487 6.524 -7.386 10.235 1.00 0.00 C ATOM 0 H VAL A 487 8.028 -6.204 8.548 1.00 0.00 H new ATOM 0 HA VAL A 487 9.833 -8.162 9.655 1.00 0.00 H new ATOM 0 HB VAL A 487 8.067 -8.379 11.364 1.00 0.00 H new ATOM 0 HG11 VAL A 487 7.975 -6.008 12.086 1.00 0.00 H new ATOM 0 HG12 VAL A 487 9.593 -6.428 11.476 1.00 0.00 H new ATOM 0 HG13 VAL A 487 8.473 -5.493 10.457 1.00 0.00 H new ATOM 0 HG21 VAL A 487 5.951 -7.108 11.120 1.00 0.00 H new ATOM 0 HG22 VAL A 487 6.448 -6.594 9.490 1.00 0.00 H new ATOM 0 HG23 VAL A 487 6.126 -8.313 9.822 1.00 0.00 H new ATOM 918 N ILE A 488 7.258 -9.102 7.868 1.00 0.00 N ATOM 919 CA ILE A 488 6.635 -10.253 7.222 1.00 0.00 C ATOM 920 C ILE A 488 7.545 -10.791 6.123 1.00 0.00 C ATOM 921 O ILE A 488 8.541 -10.162 5.766 1.00 0.00 O ATOM 922 CB ILE A 488 5.278 -9.856 6.628 1.00 0.00 C ATOM 923 CG1 ILE A 488 5.464 -8.708 5.637 1.00 0.00 C ATOM 924 CG2 ILE A 488 4.342 -9.397 7.746 1.00 0.00 C ATOM 925 CD1 ILE A 488 4.144 -8.434 4.917 1.00 0.00 C ATOM 0 H ILE A 488 6.899 -8.197 7.562 1.00 0.00 H new ATOM 0 HA ILE A 488 6.479 -11.032 7.968 1.00 0.00 H new ATOM 0 HB ILE A 488 4.849 -10.718 6.117 1.00 0.00 H new ATOM 0 HG12 ILE A 488 5.797 -7.812 6.161 1.00 0.00 H new ATOM 0 HG13 ILE A 488 6.239 -8.961 4.913 1.00 0.00 H new ATOM 0 HG21 ILE A 488 3.378 -9.115 7.321 1.00 0.00 H new ATOM 0 HG22 ILE A 488 4.201 -10.209 8.459 1.00 0.00 H new ATOM 0 HG23 ILE A 488 4.778 -8.538 8.256 1.00 0.00 H new ATOM 0 HD11 ILE A 488 4.278 -7.615 4.210 1.00 0.00 H new ATOM 0 HD12 ILE A 488 3.830 -9.329 4.380 1.00 0.00 H new ATOM 0 HD13 ILE A 488 3.381 -8.162 5.647 1.00 0.00 H new ATOM 937 N ASN A 489 7.199 -11.958 5.593 1.00 0.00 N ATOM 938 CA ASN A 489 7.991 -12.579 4.534 1.00 0.00 C ATOM 939 C ASN A 489 7.098 -13.414 3.627 1.00 0.00 C ATOM 940 O ASN A 489 5.896 -13.534 3.863 1.00 0.00 O ATOM 941 CB ASN A 489 9.077 -13.467 5.145 1.00 0.00 C ATOM 942 CG ASN A 489 8.472 -14.360 6.223 1.00 0.00 C ATOM 943 OD1 ASN A 489 9.195 -15.087 6.905 1.00 0.00 O ATOM 944 ND2 ASN A 489 7.183 -14.350 6.418 1.00 0.00 N ATOM 0 H ASN A 489 6.378 -12.493 5.877 1.00 0.00 H new ATOM 0 HA ASN A 489 8.460 -11.792 3.943 1.00 0.00 H new ATOM 0 HB2 ASN A 489 9.537 -14.079 4.369 1.00 0.00 H new ATOM 0 HB3 ASN A 489 9.866 -12.849 5.573 1.00 0.00 H new ATOM 0 HD21 ASN A 489 6.771 -14.945 7.137 1.00 0.00 H new ATOM 0 HD22 ASN A 489 6.586 -13.747 5.852 1.00 0.00 H new ATOM 951 N LYS A 490 7.692 -13.988 2.588 1.00 0.00 N ATOM 952 CA LYS A 490 6.939 -14.809 1.651 1.00 0.00 C ATOM 953 C LYS A 490 6.035 -15.783 2.401 1.00 0.00 C ATOM 954 O LYS A 490 5.042 -16.263 1.858 1.00 0.00 O ATOM 955 CB LYS A 490 7.896 -15.587 0.747 1.00 0.00 C ATOM 956 CG LYS A 490 8.632 -14.613 -0.174 1.00 0.00 C ATOM 957 CD LYS A 490 9.589 -15.389 -1.080 1.00 0.00 C ATOM 958 CE LYS A 490 10.343 -14.410 -1.982 1.00 0.00 C ATOM 959 NZ LYS A 490 11.305 -15.163 -2.837 1.00 0.00 N ATOM 0 H LYS A 490 8.686 -13.901 2.375 1.00 0.00 H new ATOM 0 HA LYS A 490 6.320 -14.153 1.039 1.00 0.00 H new ATOM 0 HB2 LYS A 490 8.612 -16.144 1.351 1.00 0.00 H new ATOM 0 HB3 LYS A 490 7.342 -16.316 0.155 1.00 0.00 H new ATOM 0 HG2 LYS A 490 7.916 -14.055 -0.777 1.00 0.00 H new ATOM 0 HG3 LYS A 490 9.186 -13.884 0.418 1.00 0.00 H new ATOM 0 HD2 LYS A 490 10.294 -15.961 -0.477 1.00 0.00 H new ATOM 0 HD3 LYS A 490 9.033 -16.105 -1.686 1.00 0.00 H new ATOM 0 HE2 LYS A 490 9.640 -13.858 -2.606 1.00 0.00 H new ATOM 0 HE3 LYS A 490 10.875 -13.677 -1.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 11.818 -14.498 -3.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 11.983 -15.670 -2.233 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 10.786 -15.846 -3.425 1.00 0.00 H new ATOM 973 N GLN A 491 6.384 -16.069 3.652 1.00 0.00 N ATOM 974 CA GLN A 491 5.591 -16.987 4.465 1.00 0.00 C ATOM 975 C GLN A 491 4.354 -16.289 5.023 1.00 0.00 C ATOM 976 O GLN A 491 3.231 -16.612 4.644 1.00 0.00 O ATOM 977 CB GLN A 491 6.442 -17.533 5.620 1.00 0.00 C ATOM 978 CG GLN A 491 7.414 -18.593 5.093 1.00 0.00 C ATOM 979 CD GLN A 491 6.645 -19.845 4.680 1.00 0.00 C ATOM 980 OE1 GLN A 491 6.171 -20.594 5.534 1.00 0.00 O ATOM 981 NE2 GLN A 491 6.485 -20.111 3.414 1.00 0.00 N ATOM 0 H GLN A 491 7.203 -15.683 4.122 1.00 0.00 H new ATOM 0 HA GLN A 491 5.267 -17.812 3.831 1.00 0.00 H new ATOM 0 HB2 GLN A 491 6.996 -16.721 6.091 1.00 0.00 H new ATOM 0 HB3 GLN A 491 5.798 -17.966 6.385 1.00 0.00 H new ATOM 0 HG2 GLN A 491 7.968 -18.199 4.241 1.00 0.00 H new ATOM 0 HG3 GLN A 491 8.145 -18.842 5.862 1.00 0.00 H new ATOM 0 HE21 GLN A 491 6.879 -19.489 2.708 1.00 0.00 H new ATOM 0 HE22 GLN A 491 5.966 -20.942 3.129 1.00 0.00 H new ATOM 990 N GLU A 492 4.568 -15.331 5.918 1.00 0.00 N ATOM 991 CA GLU A 492 3.457 -14.603 6.520 1.00 0.00 C ATOM 992 C GLU A 492 2.643 -13.890 5.447 1.00 0.00 C ATOM 993 O GLU A 492 1.418 -13.812 5.538 1.00 0.00 O ATOM 994 CB GLU A 492 3.989 -13.588 7.533 1.00 0.00 C ATOM 995 CG GLU A 492 4.589 -14.331 8.730 1.00 0.00 C ATOM 996 CD GLU A 492 5.192 -13.334 9.713 1.00 0.00 C ATOM 997 OE1 GLU A 492 5.067 -12.147 9.472 1.00 0.00 O ATOM 998 OE2 GLU A 492 5.766 -13.773 10.696 1.00 0.00 O ATOM 0 H GLU A 492 5.492 -15.042 6.240 1.00 0.00 H new ATOM 0 HA GLU A 492 2.809 -15.315 7.032 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.745 -12.955 7.068 1.00 0.00 H new ATOM 0 HB3 GLU A 492 3.184 -12.932 7.864 1.00 0.00 H new ATOM 0 HG2 GLU A 492 3.819 -14.922 9.225 1.00 0.00 H new ATOM 0 HG3 GLU A 492 5.355 -15.027 8.389 1.00 0.00 H new ATOM 1005 N HIS A 493 3.324 -13.387 4.426 1.00 0.00 N ATOM 1006 CA HIS A 493 2.650 -12.694 3.331 1.00 0.00 C ATOM 1007 C HIS A 493 1.670 -13.632 2.631 1.00 0.00 C ATOM 1008 O HIS A 493 0.574 -13.228 2.243 1.00 0.00 O ATOM 1009 CB HIS A 493 3.683 -12.185 2.322 1.00 0.00 C ATOM 1010 CG HIS A 493 2.982 -11.472 1.201 1.00 0.00 C ATOM 1011 ND1 HIS A 493 2.103 -12.125 0.352 1.00 0.00 N ATOM 1012 CD2 HIS A 493 3.023 -10.170 0.770 1.00 0.00 C ATOM 1013 CE1 HIS A 493 1.653 -11.225 -0.538 1.00 0.00 C ATOM 1014 NE2 HIS A 493 2.181 -10.018 -0.330 1.00 0.00 N ATOM 0 H HIS A 493 4.338 -13.444 4.331 1.00 0.00 H new ATOM 0 HA HIS A 493 2.098 -11.849 3.742 1.00 0.00 H new ATOM 0 HB2 HIS A 493 4.385 -11.511 2.813 1.00 0.00 H new ATOM 0 HB3 HIS A 493 4.264 -13.019 1.929 1.00 0.00 H new ATOM 0 HD1 HIS A 493 1.844 -13.111 0.395 1.00 0.00 H new ATOM 0 HD2 HIS A 493 3.616 -9.384 1.214 1.00 0.00 H new ATOM 0 HE1 HIS A 493 0.950 -11.451 -1.326 1.00 0.00 H new ATOM 1022 N ASP A 494 2.077 -14.884 2.465 1.00 0.00 N ATOM 1023 CA ASP A 494 1.235 -15.877 1.813 1.00 0.00 C ATOM 1024 C ASP A 494 0.083 -16.301 2.719 1.00 0.00 C ATOM 1025 O ASP A 494 -1.003 -16.631 2.240 1.00 0.00 O ATOM 1026 CB ASP A 494 2.064 -17.107 1.434 1.00 0.00 C ATOM 1027 CG ASP A 494 1.259 -18.011 0.507 1.00 0.00 C ATOM 1028 OD1 ASP A 494 0.245 -17.558 0.002 1.00 0.00 O ATOM 1029 OD2 ASP A 494 1.668 -19.145 0.316 1.00 0.00 O ATOM 0 H ASP A 494 2.984 -15.235 2.773 1.00 0.00 H new ATOM 0 HA ASP A 494 0.821 -15.424 0.912 1.00 0.00 H new ATOM 0 HB2 ASP A 494 2.986 -16.797 0.943 1.00 0.00 H new ATOM 0 HB3 ASP A 494 2.349 -17.655 2.332 1.00 0.00 H new ATOM 1034 N ILE A 495 0.328 -16.311 4.028 1.00 0.00 N ATOM 1035 CA ILE A 495 -0.704 -16.721 4.976 1.00 0.00 C ATOM 1036 C ILE A 495 -1.893 -15.761 4.929 1.00 0.00 C ATOM 1037 O ILE A 495 -3.044 -16.197 4.903 1.00 0.00 O ATOM 1038 CB ILE A 495 -0.127 -16.753 6.398 1.00 0.00 C ATOM 1039 CG1 ILE A 495 0.906 -17.889 6.517 1.00 0.00 C ATOM 1040 CG2 ILE A 495 -1.254 -16.992 7.410 1.00 0.00 C ATOM 1041 CD1 ILE A 495 1.738 -17.741 7.806 1.00 0.00 C ATOM 0 H ILE A 495 1.217 -16.044 4.451 1.00 0.00 H new ATOM 0 HA ILE A 495 -1.047 -17.718 4.699 1.00 0.00 H new ATOM 0 HB ILE A 495 0.355 -15.798 6.605 1.00 0.00 H new ATOM 0 HG12 ILE A 495 0.395 -18.852 6.517 1.00 0.00 H new ATOM 0 HG13 ILE A 495 1.566 -17.878 5.650 1.00 0.00 H new ATOM 0 HG21 ILE A 495 -0.839 -17.014 8.418 1.00 0.00 H new ATOM 0 HG22 ILE A 495 -1.986 -16.188 7.336 1.00 0.00 H new ATOM 0 HG23 ILE A 495 -1.739 -17.945 7.196 1.00 0.00 H new ATOM 0 HD11 ILE A 495 2.461 -18.555 7.868 1.00 0.00 H new ATOM 0 HD12 ILE A 495 2.266 -16.787 7.791 1.00 0.00 H new ATOM 0 HD13 ILE A 495 1.077 -17.776 8.672 1.00 0.00 H new ATOM 1147 N GLN A 501 -8.566 -11.874 2.754 1.00 0.00 N ATOM 1148 CA GLN A 501 -8.839 -11.484 1.369 1.00 0.00 C ATOM 1149 C GLN A 501 -8.458 -10.026 1.142 1.00 0.00 C ATOM 1150 O GLN A 501 -7.913 -9.383 2.033 1.00 0.00 O ATOM 1151 CB GLN A 501 -10.327 -11.684 1.078 1.00 0.00 C ATOM 1152 CG GLN A 501 -10.686 -13.148 1.323 1.00 0.00 C ATOM 1153 CD GLN A 501 -12.165 -13.379 1.027 1.00 0.00 C ATOM 1154 OE1 GLN A 501 -13.029 -12.854 1.729 1.00 0.00 O ATOM 1155 NE2 GLN A 501 -12.508 -14.135 0.020 1.00 0.00 N ATOM 0 HA GLN A 501 -8.245 -12.104 0.697 1.00 0.00 H new ATOM 0 HB2 GLN A 501 -10.927 -11.037 1.718 1.00 0.00 H new ATOM 0 HB3 GLN A 501 -10.550 -11.409 0.047 1.00 0.00 H new ATOM 0 HG2 GLN A 501 -10.075 -13.792 0.690 1.00 0.00 H new ATOM 0 HG3 GLN A 501 -10.467 -13.417 2.356 1.00 0.00 H new ATOM 0 HE21 GLN A 501 -11.790 -14.569 -0.560 1.00 0.00 H new ATOM 0 HE22 GLN A 501 -13.494 -14.292 -0.187 1.00 0.00 H new ATOM 1164 N ILE A 502 -8.743 -9.505 -0.052 1.00 0.00 N ATOM 1165 CA ILE A 502 -8.413 -8.117 -0.358 1.00 0.00 C ATOM 1166 C ILE A 502 -8.850 -7.174 0.777 1.00 0.00 C ATOM 1167 O ILE A 502 -8.029 -6.399 1.269 1.00 0.00 O ATOM 1168 CB ILE A 502 -9.057 -7.673 -1.684 1.00 0.00 C ATOM 1169 CG1 ILE A 502 -9.042 -8.840 -2.683 1.00 0.00 C ATOM 1170 CG2 ILE A 502 -8.279 -6.483 -2.261 1.00 0.00 C ATOM 1171 CD1 ILE A 502 -9.397 -8.334 -4.085 1.00 0.00 C ATOM 0 H ILE A 502 -9.195 -10.015 -0.811 1.00 0.00 H new ATOM 0 HA ILE A 502 -7.329 -8.059 -0.458 1.00 0.00 H new ATOM 0 HB ILE A 502 -10.089 -7.372 -1.502 1.00 0.00 H new ATOM 0 HG12 ILE A 502 -8.057 -9.307 -2.695 1.00 0.00 H new ATOM 0 HG13 ILE A 502 -9.754 -9.605 -2.372 1.00 0.00 H new ATOM 0 HG21 ILE A 502 -8.736 -6.170 -3.200 1.00 0.00 H new ATOM 0 HG22 ILE A 502 -8.302 -5.655 -1.552 1.00 0.00 H new ATOM 0 HG23 ILE A 502 -7.245 -6.777 -2.441 1.00 0.00 H new ATOM 0 HD11 ILE A 502 -9.384 -9.168 -4.787 1.00 0.00 H new ATOM 0 HD12 ILE A 502 -10.391 -7.888 -4.070 1.00 0.00 H new ATOM 0 HD13 ILE A 502 -8.668 -7.586 -4.397 1.00 0.00 H new ATOM 1183 N PRO A 503 -10.103 -7.205 1.214 1.00 0.00 N ATOM 1184 CA PRO A 503 -10.580 -6.310 2.319 1.00 0.00 C ATOM 1185 C PRO A 503 -9.656 -6.366 3.540 1.00 0.00 C ATOM 1186 O PRO A 503 -9.117 -5.346 3.968 1.00 0.00 O ATOM 1187 CB PRO A 503 -12.001 -6.847 2.648 1.00 0.00 C ATOM 1188 CG PRO A 503 -12.083 -8.185 1.981 1.00 0.00 C ATOM 1189 CD PRO A 503 -11.215 -8.068 0.745 1.00 0.00 C ATOM 0 HA PRO A 503 -10.587 -5.260 2.027 1.00 0.00 H new ATOM 0 HB2 PRO A 503 -12.149 -6.935 3.724 1.00 0.00 H new ATOM 0 HB3 PRO A 503 -12.772 -6.173 2.274 1.00 0.00 H new ATOM 0 HG2 PRO A 503 -11.725 -8.976 2.640 1.00 0.00 H new ATOM 0 HG3 PRO A 503 -13.112 -8.431 1.718 1.00 0.00 H new ATOM 0 HD2 PRO A 503 -10.859 -9.041 0.406 1.00 0.00 H new ATOM 0 HD3 PRO A 503 -11.754 -7.618 -0.088 1.00 0.00 H new ATOM 1197 N LEU A 504 -9.479 -7.562 4.093 1.00 0.00 N ATOM 1198 CA LEU A 504 -8.618 -7.735 5.260 1.00 0.00 C ATOM 1199 C LEU A 504 -7.168 -7.408 4.913 1.00 0.00 C ATOM 1200 O LEU A 504 -6.460 -6.793 5.707 1.00 0.00 O ATOM 1201 CB LEU A 504 -8.719 -9.176 5.784 1.00 0.00 C ATOM 1202 CG LEU A 504 -9.989 -9.358 6.640 1.00 0.00 C ATOM 1203 CD1 LEU A 504 -9.848 -8.637 7.993 1.00 0.00 C ATOM 1204 CD2 LEU A 504 -11.198 -8.800 5.884 1.00 0.00 C ATOM 0 H LEU A 504 -9.916 -8.420 3.756 1.00 0.00 H new ATOM 0 HA LEU A 504 -8.952 -7.048 6.038 1.00 0.00 H new ATOM 0 HB2 LEU A 504 -8.737 -9.872 4.946 1.00 0.00 H new ATOM 0 HB3 LEU A 504 -7.837 -9.415 6.378 1.00 0.00 H new ATOM 0 HG LEU A 504 -10.129 -10.422 6.830 1.00 0.00 H new ATOM 0 HD11 LEU A 504 -10.756 -8.780 8.578 1.00 0.00 H new ATOM 0 HD12 LEU A 504 -8.997 -9.047 8.537 1.00 0.00 H new ATOM 0 HD13 LEU A 504 -9.690 -7.572 7.823 1.00 0.00 H new ATOM 0 HD21 LEU A 504 -12.096 -8.928 6.488 1.00 0.00 H new ATOM 0 HD22 LEU A 504 -11.044 -7.740 5.683 1.00 0.00 H new ATOM 0 HD23 LEU A 504 -11.316 -9.334 4.941 1.00 0.00 H new ATOM 1216 N GLN A 505 -6.734 -7.827 3.725 1.00 0.00 N ATOM 1217 CA GLN A 505 -5.362 -7.575 3.285 1.00 0.00 C ATOM 1218 C GLN A 505 -4.939 -6.164 3.678 1.00 0.00 C ATOM 1219 O GLN A 505 -3.820 -5.948 4.144 1.00 0.00 O ATOM 1220 CB GLN A 505 -5.267 -7.741 1.766 1.00 0.00 C ATOM 1221 CG GLN A 505 -3.802 -7.836 1.338 1.00 0.00 C ATOM 1222 CD GLN A 505 -3.230 -9.192 1.736 1.00 0.00 C ATOM 1223 OE1 GLN A 505 -2.095 -9.274 2.204 1.00 0.00 O ATOM 1224 NE2 GLN A 505 -3.952 -10.267 1.575 1.00 0.00 N ATOM 0 H GLN A 505 -7.307 -8.339 3.054 1.00 0.00 H new ATOM 0 HA GLN A 505 -4.697 -8.292 3.767 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -5.803 -8.638 1.456 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -5.745 -6.896 1.270 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -3.720 -7.700 0.260 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -3.225 -7.037 1.805 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -4.893 -10.196 1.187 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -3.576 -11.178 1.837 1.00 0.00 H new ATOM 1233 N ALA A 506 -5.849 -5.213 3.498 1.00 0.00 N ATOM 1234 CA ALA A 506 -5.564 -3.833 3.854 1.00 0.00 C ATOM 1235 C ALA A 506 -5.442 -3.701 5.368 1.00 0.00 C ATOM 1236 O ALA A 506 -4.584 -2.977 5.868 1.00 0.00 O ATOM 1237 CB ALA A 506 -6.675 -2.914 3.343 1.00 0.00 C ATOM 0 H ALA A 506 -6.780 -5.372 3.112 1.00 0.00 H new ATOM 0 HA ALA A 506 -4.622 -3.540 3.391 1.00 0.00 H new ATOM 0 HB1 ALA A 506 -6.449 -1.883 3.616 1.00 0.00 H new ATOM 0 HB2 ALA A 506 -6.744 -2.995 2.258 1.00 0.00 H new ATOM 0 HB3 ALA A 506 -7.625 -3.208 3.790 1.00 0.00 H new ATOM 1243 N ARG A 507 -6.306 -4.408 6.095 1.00 0.00 N ATOM 1244 CA ARG A 507 -6.279 -4.357 7.554 1.00 0.00 C ATOM 1245 C ARG A 507 -4.942 -4.858 8.077 1.00 0.00 C ATOM 1246 O ARG A 507 -4.345 -4.247 8.963 1.00 0.00 O ATOM 1247 CB ARG A 507 -7.413 -5.208 8.133 1.00 0.00 C ATOM 1248 CG ARG A 507 -7.431 -5.084 9.659 1.00 0.00 C ATOM 1249 CD ARG A 507 -8.597 -5.899 10.219 1.00 0.00 C ATOM 1250 NE ARG A 507 -9.867 -5.312 9.809 1.00 0.00 N ATOM 1251 CZ ARG A 507 -11.024 -5.866 10.153 1.00 0.00 C ATOM 1252 NH1 ARG A 507 -11.038 -6.950 10.879 1.00 0.00 N ATOM 1253 NH2 ARG A 507 -12.147 -5.324 9.767 1.00 0.00 N ATOM 0 H ARG A 507 -7.025 -5.016 5.703 1.00 0.00 H new ATOM 0 HA ARG A 507 -6.414 -3.321 7.866 1.00 0.00 H new ATOM 0 HB2 ARG A 507 -8.369 -4.884 7.722 1.00 0.00 H new ATOM 0 HB3 ARG A 507 -7.280 -6.251 7.846 1.00 0.00 H new ATOM 0 HG2 ARG A 507 -6.489 -5.442 10.075 1.00 0.00 H new ATOM 0 HG3 ARG A 507 -7.531 -4.038 9.949 1.00 0.00 H new ATOM 0 HD2 ARG A 507 -8.533 -6.928 9.866 1.00 0.00 H new ATOM 0 HD3 ARG A 507 -8.538 -5.931 11.307 1.00 0.00 H new ATOM 0 HE ARG A 507 -9.867 -4.460 9.248 1.00 0.00 H new ATOM 0 HH11 ARG A 507 -10.160 -7.372 11.182 1.00 0.00 H new ATOM 0 HH12 ARG A 507 -11.927 -7.375 11.143 1.00 0.00 H new ATOM 0 HH21 ARG A 507 -12.136 -4.475 9.201 1.00 0.00 H new ATOM 0 HH22 ARG A 507 -13.036 -5.749 10.031 1.00 0.00 H new ATOM 1267 N GLU A 508 -4.475 -5.967 7.522 1.00 0.00 N ATOM 1268 CA GLU A 508 -3.197 -6.530 7.946 1.00 0.00 C ATOM 1269 C GLU A 508 -2.065 -5.554 7.640 1.00 0.00 C ATOM 1270 O GLU A 508 -1.150 -5.378 8.444 1.00 0.00 O ATOM 1271 CB GLU A 508 -2.946 -7.862 7.231 1.00 0.00 C ATOM 1272 CG GLU A 508 -3.971 -8.900 7.701 1.00 0.00 C ATOM 1273 CD GLU A 508 -3.736 -9.243 9.169 1.00 0.00 C ATOM 1274 OE1 GLU A 508 -2.617 -9.599 9.502 1.00 0.00 O ATOM 1275 OE2 GLU A 508 -4.678 -9.146 9.937 1.00 0.00 O ATOM 0 H GLU A 508 -4.952 -6.490 6.788 1.00 0.00 H new ATOM 0 HA GLU A 508 -3.231 -6.705 9.021 1.00 0.00 H new ATOM 0 HB2 GLU A 508 -3.020 -7.726 6.152 1.00 0.00 H new ATOM 0 HB3 GLU A 508 -1.936 -8.214 7.440 1.00 0.00 H new ATOM 0 HG2 GLU A 508 -4.981 -8.512 7.568 1.00 0.00 H new ATOM 0 HG3 GLU A 508 -3.893 -9.801 7.092 1.00 0.00 H new ATOM 1282 N LEU A 509 -2.145 -4.917 6.479 1.00 0.00 N ATOM 1283 CA LEU A 509 -1.133 -3.947 6.070 1.00 0.00 C ATOM 1284 C LEU A 509 -1.108 -2.756 7.024 1.00 0.00 C ATOM 1285 O LEU A 509 -0.044 -2.269 7.389 1.00 0.00 O ATOM 1286 CB LEU A 509 -1.428 -3.466 4.645 1.00 0.00 C ATOM 1287 CG LEU A 509 -0.443 -2.365 4.229 1.00 0.00 C ATOM 1288 CD1 LEU A 509 1.002 -2.867 4.361 1.00 0.00 C ATOM 1289 CD2 LEU A 509 -0.721 -1.978 2.777 1.00 0.00 C ATOM 0 H LEU A 509 -2.898 -5.053 5.804 1.00 0.00 H new ATOM 0 HA LEU A 509 -0.156 -4.430 6.098 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -1.359 -4.304 3.951 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -2.449 -3.088 4.587 1.00 0.00 H new ATOM 0 HG LEU A 509 -0.572 -1.499 4.878 1.00 0.00 H new ATOM 0 HD11 LEU A 509 1.691 -2.076 4.063 1.00 0.00 H new ATOM 0 HD12 LEU A 509 1.197 -3.147 5.396 1.00 0.00 H new ATOM 0 HD13 LEU A 509 1.146 -3.735 3.718 1.00 0.00 H new ATOM 0 HD21 LEU A 509 -0.027 -1.196 2.470 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -0.591 -2.850 2.137 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -1.744 -1.611 2.688 1.00 0.00 H new ATOM 1301 N ILE A 510 -2.282 -2.287 7.425 1.00 0.00 N ATOM 1302 CA ILE A 510 -2.352 -1.146 8.330 1.00 0.00 C ATOM 1303 C ILE A 510 -1.652 -1.472 9.643 1.00 0.00 C ATOM 1304 O ILE A 510 -0.907 -0.650 10.176 1.00 0.00 O ATOM 1305 CB ILE A 510 -3.815 -0.767 8.588 1.00 0.00 C ATOM 1306 CG1 ILE A 510 -4.415 -0.162 7.316 1.00 0.00 C ATOM 1307 CG2 ILE A 510 -3.904 0.259 9.721 1.00 0.00 C ATOM 1308 CD1 ILE A 510 -5.935 -0.078 7.455 1.00 0.00 C ATOM 0 H ILE A 510 -3.185 -2.670 7.144 1.00 0.00 H new ATOM 0 HA ILE A 510 -1.847 -0.298 7.867 1.00 0.00 H new ATOM 0 HB ILE A 510 -4.367 -1.663 8.872 1.00 0.00 H new ATOM 0 HG12 ILE A 510 -4.000 0.831 7.143 1.00 0.00 H new ATOM 0 HG13 ILE A 510 -4.152 -0.772 6.452 1.00 0.00 H new ATOM 0 HG21 ILE A 510 -4.948 0.520 9.894 1.00 0.00 H new ATOM 0 HG22 ILE A 510 -3.480 -0.166 10.631 1.00 0.00 H new ATOM 0 HG23 ILE A 510 -3.347 1.155 9.445 1.00 0.00 H new ATOM 0 HD11 ILE A 510 -6.360 0.353 6.548 1.00 0.00 H new ATOM 0 HD12 ILE A 510 -6.342 -1.078 7.607 1.00 0.00 H new ATOM 0 HD13 ILE A 510 -6.188 0.551 8.309 1.00 0.00 H new ATOM 1320 N ASP A 511 -1.889 -2.670 10.157 1.00 0.00 N ATOM 1321 CA ASP A 511 -1.267 -3.079 11.407 1.00 0.00 C ATOM 1322 C ASP A 511 0.254 -3.046 11.274 1.00 0.00 C ATOM 1323 O ASP A 511 0.952 -2.610 12.191 1.00 0.00 O ATOM 1324 CB ASP A 511 -1.720 -4.491 11.775 1.00 0.00 C ATOM 1325 CG ASP A 511 -1.103 -4.913 13.103 1.00 0.00 C ATOM 1326 OD1 ASP A 511 -0.298 -4.160 13.627 1.00 0.00 O ATOM 1327 OD2 ASP A 511 -1.441 -5.985 13.577 1.00 0.00 O ATOM 0 H ASP A 511 -2.500 -3.368 9.734 1.00 0.00 H new ATOM 0 HA ASP A 511 -1.570 -2.387 12.193 1.00 0.00 H new ATOM 0 HB2 ASP A 511 -2.807 -4.525 11.844 1.00 0.00 H new ATOM 0 HB3 ASP A 511 -1.428 -5.190 10.992 1.00 0.00 H new ATOM 1332 N THR A 512 0.765 -3.503 10.130 1.00 0.00 N ATOM 1333 CA THR A 512 2.207 -3.511 9.903 1.00 0.00 C ATOM 1334 C THR A 512 2.748 -2.084 9.816 1.00 0.00 C ATOM 1335 O THR A 512 3.815 -1.783 10.352 1.00 0.00 O ATOM 1336 CB THR A 512 2.540 -4.275 8.616 1.00 0.00 C ATOM 1337 OG1 THR A 512 1.695 -3.835 7.564 1.00 0.00 O ATOM 1338 CG2 THR A 512 2.343 -5.775 8.842 1.00 0.00 C ATOM 0 H THR A 512 0.209 -3.868 9.357 1.00 0.00 H new ATOM 0 HA THR A 512 2.681 -4.013 10.746 1.00 0.00 H new ATOM 0 HB THR A 512 3.578 -4.085 8.345 1.00 0.00 H new ATOM 0 HG1 THR A 512 1.205 -3.036 7.850 1.00 0.00 H new ATOM 0 HG21 THR A 512 2.580 -6.315 7.926 1.00 0.00 H new ATOM 0 HG22 THR A 512 3.001 -6.112 9.643 1.00 0.00 H new ATOM 0 HG23 THR A 512 1.307 -5.968 9.119 1.00 0.00 H new ATOM 1346 N ILE A 513 2.000 -1.204 9.153 1.00 0.00 N ATOM 1347 CA ILE A 513 2.412 0.192 9.023 1.00 0.00 C ATOM 1348 C ILE A 513 2.451 0.850 10.399 1.00 0.00 C ATOM 1349 O ILE A 513 3.362 1.619 10.707 1.00 0.00 O ATOM 1350 CB ILE A 513 1.440 0.959 8.109 1.00 0.00 C ATOM 1351 CG1 ILE A 513 1.554 0.441 6.659 1.00 0.00 C ATOM 1352 CG2 ILE A 513 1.758 2.461 8.152 1.00 0.00 C ATOM 1353 CD1 ILE A 513 2.965 0.671 6.086 1.00 0.00 C ATOM 0 H ILE A 513 1.114 -1.430 8.701 1.00 0.00 H new ATOM 0 HA ILE A 513 3.407 0.221 8.578 1.00 0.00 H new ATOM 0 HB ILE A 513 0.422 0.798 8.463 1.00 0.00 H new ATOM 0 HG12 ILE A 513 1.318 -0.623 6.632 1.00 0.00 H new ATOM 0 HG13 ILE A 513 0.819 0.946 6.032 1.00 0.00 H new ATOM 0 HG21 ILE A 513 1.066 2.998 7.503 1.00 0.00 H new ATOM 0 HG22 ILE A 513 1.654 2.826 9.174 1.00 0.00 H new ATOM 0 HG23 ILE A 513 2.780 2.627 7.810 1.00 0.00 H new ATOM 0 HD11 ILE A 513 3.009 0.294 5.064 1.00 0.00 H new ATOM 0 HD12 ILE A 513 3.190 1.738 6.089 1.00 0.00 H new ATOM 0 HD13 ILE A 513 3.697 0.144 6.698 1.00 0.00 H new ATOM 1365 N LEU A 514 1.445 0.557 11.214 1.00 0.00 N ATOM 1366 CA LEU A 514 1.360 1.142 12.547 1.00 0.00 C ATOM 1367 C LEU A 514 2.564 0.748 13.399 1.00 0.00 C ATOM 1368 O LEU A 514 3.130 1.584 14.105 1.00 0.00 O ATOM 1369 CB LEU A 514 0.070 0.672 13.236 1.00 0.00 C ATOM 1370 CG LEU A 514 -0.021 1.251 14.659 1.00 0.00 C ATOM 1371 CD1 LEU A 514 0.090 2.784 14.624 1.00 0.00 C ATOM 1372 CD2 LEU A 514 -1.370 0.850 15.272 1.00 0.00 C ATOM 0 H LEU A 514 0.682 -0.077 10.978 1.00 0.00 H new ATOM 0 HA LEU A 514 1.352 2.227 12.443 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -0.796 0.986 12.653 1.00 0.00 H new ATOM 0 HB3 LEU A 514 0.049 -0.417 13.278 1.00 0.00 H new ATOM 0 HG LEU A 514 0.798 0.857 15.260 1.00 0.00 H new ATOM 0 HD11 LEU A 514 0.024 3.177 15.639 1.00 0.00 H new ATOM 0 HD12 LEU A 514 1.046 3.070 14.186 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -0.721 3.194 14.022 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -1.446 1.255 16.281 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -2.180 1.247 14.660 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -1.443 -0.237 15.311 1.00 0.00 H new ATOM 1384 N VAL A 515 2.951 -0.523 13.344 1.00 0.00 N ATOM 1385 CA VAL A 515 4.086 -0.988 14.137 1.00 0.00 C ATOM 1386 C VAL A 515 5.368 -0.273 13.712 1.00 0.00 C ATOM 1387 O VAL A 515 6.097 0.258 14.550 1.00 0.00 O ATOM 1388 CB VAL A 515 4.252 -2.503 13.967 1.00 0.00 C ATOM 1389 CG1 VAL A 515 5.553 -2.963 14.633 1.00 0.00 C ATOM 1390 CG2 VAL A 515 3.066 -3.219 14.617 1.00 0.00 C ATOM 0 H VAL A 515 2.505 -1.239 12.770 1.00 0.00 H new ATOM 0 HA VAL A 515 3.895 -0.761 15.186 1.00 0.00 H new ATOM 0 HB VAL A 515 4.289 -2.744 12.905 1.00 0.00 H new ATOM 0 HG11 VAL A 515 5.664 -4.040 14.508 1.00 0.00 H new ATOM 0 HG12 VAL A 515 6.399 -2.455 14.170 1.00 0.00 H new ATOM 0 HG13 VAL A 515 5.523 -2.722 15.696 1.00 0.00 H new ATOM 0 HG21 VAL A 515 3.181 -4.296 14.498 1.00 0.00 H new ATOM 0 HG22 VAL A 515 3.030 -2.973 15.678 1.00 0.00 H new ATOM 0 HG23 VAL A 515 2.141 -2.898 14.139 1.00 0.00 H new ATOM 1400 N LYS A 516 5.632 -0.253 12.409 1.00 0.00 N ATOM 1401 CA LYS A 516 6.823 0.412 11.895 1.00 0.00 C ATOM 1402 C LYS A 516 6.730 1.923 12.090 1.00 0.00 C ATOM 1403 O LYS A 516 7.694 2.570 12.500 1.00 0.00 O ATOM 1404 CB LYS A 516 6.997 0.093 10.411 1.00 0.00 C ATOM 1405 CG LYS A 516 7.392 -1.377 10.239 1.00 0.00 C ATOM 1406 CD LYS A 516 7.497 -1.704 8.748 1.00 0.00 C ATOM 1407 CE LYS A 516 7.872 -3.177 8.566 1.00 0.00 C ATOM 1408 NZ LYS A 516 9.260 -3.400 9.059 1.00 0.00 N ATOM 0 H LYS A 516 5.044 -0.685 11.697 1.00 0.00 H new ATOM 0 HA LYS A 516 7.686 0.045 12.450 1.00 0.00 H new ATOM 0 HB2 LYS A 516 6.070 0.295 9.875 1.00 0.00 H new ATOM 0 HB3 LYS A 516 7.762 0.738 9.978 1.00 0.00 H new ATOM 0 HG2 LYS A 516 8.345 -1.569 10.733 1.00 0.00 H new ATOM 0 HG3 LYS A 516 6.652 -2.022 10.713 1.00 0.00 H new ATOM 0 HD2 LYS A 516 6.548 -1.497 8.253 1.00 0.00 H new ATOM 0 HD3 LYS A 516 8.247 -1.067 8.279 1.00 0.00 H new ATOM 0 HE2 LYS A 516 7.174 -3.811 9.113 1.00 0.00 H new ATOM 0 HE3 LYS A 516 7.799 -3.455 7.515 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 9.516 -4.401 8.936 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 9.920 -2.805 8.519 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 9.315 -3.150 10.067 1.00 0.00 H new ATOM 1422 N GLY A 517 5.559 2.478 11.795 1.00 0.00 N ATOM 1423 CA GLY A 517 5.334 3.912 11.939 1.00 0.00 C ATOM 1424 C GLY A 517 6.097 4.720 10.891 1.00 0.00 C ATOM 1425 O GLY A 517 6.035 4.424 9.699 1.00 0.00 O ATOM 0 H GLY A 517 4.751 1.957 11.455 1.00 0.00 H new ATOM 0 HA2 GLY A 517 4.268 4.122 11.853 1.00 0.00 H new ATOM 0 HA3 GLY A 517 5.642 4.229 12.936 1.00 0.00 H new ATOM 1429 N ASN A 518 6.806 5.755 11.347 1.00 0.00 N ATOM 1430 CA ASN A 518 7.564 6.613 10.439 1.00 0.00 C ATOM 1431 C ASN A 518 8.518 5.787 9.578 1.00 0.00 C ATOM 1432 O ASN A 518 8.680 6.055 8.387 1.00 0.00 O ATOM 1433 CB ASN A 518 8.365 7.661 11.247 1.00 0.00 C ATOM 1434 CG ASN A 518 7.526 8.914 11.490 1.00 0.00 C ATOM 1435 OD1 ASN A 518 6.327 8.921 11.222 1.00 0.00 O ATOM 1436 ND2 ASN A 518 8.096 9.985 11.968 1.00 0.00 N ATOM 0 H ASN A 518 6.870 6.016 12.331 1.00 0.00 H new ATOM 0 HA ASN A 518 6.859 7.123 9.783 1.00 0.00 H new ATOM 0 HB2 ASN A 518 8.673 7.233 12.201 1.00 0.00 H new ATOM 0 HB3 ASN A 518 9.274 7.926 10.707 1.00 0.00 H new ATOM 0 HD21 ASN A 518 7.546 10.831 12.120 1.00 0.00 H new ATOM 0 HD22 ASN A 518 9.092 9.977 12.190 1.00 0.00 H new ATOM 1443 N ALA A 519 9.147 4.791 10.179 1.00 0.00 N ATOM 1444 CA ALA A 519 10.080 3.949 9.446 1.00 0.00 C ATOM 1445 C ALA A 519 9.434 3.405 8.176 1.00 0.00 C ATOM 1446 O ALA A 519 10.115 3.185 7.174 1.00 0.00 O ATOM 1447 CB ALA A 519 10.533 2.783 10.327 1.00 0.00 C ATOM 0 H ALA A 519 9.031 4.546 11.162 1.00 0.00 H new ATOM 0 HA ALA A 519 10.943 4.555 9.169 1.00 0.00 H new ATOM 0 HB1 ALA A 519 11.231 2.157 9.771 1.00 0.00 H new ATOM 0 HB2 ALA A 519 11.024 3.171 11.219 1.00 0.00 H new ATOM 0 HB3 ALA A 519 9.667 2.189 10.619 1.00 0.00 H new ATOM 1453 N ALA A 520 8.118 3.190 8.215 1.00 0.00 N ATOM 1454 CA ALA A 520 7.397 2.672 7.047 1.00 0.00 C ATOM 1455 C ALA A 520 6.685 3.794 6.299 1.00 0.00 C ATOM 1456 O ALA A 520 6.209 3.597 5.184 1.00 0.00 O ATOM 1457 CB ALA A 520 6.379 1.626 7.486 1.00 0.00 C ATOM 0 H ALA A 520 7.533 3.364 9.032 1.00 0.00 H new ATOM 0 HA ALA A 520 8.125 2.217 6.375 1.00 0.00 H new ATOM 0 HB1 ALA A 520 5.848 1.246 6.613 1.00 0.00 H new ATOM 0 HB2 ALA A 520 6.893 0.804 7.984 1.00 0.00 H new ATOM 0 HB3 ALA A 520 5.667 2.079 8.176 1.00 0.00 H new ATOM 1463 N ALA A 521 6.612 4.970 6.913 1.00 0.00 N ATOM 1464 CA ALA A 521 5.948 6.100 6.271 1.00 0.00 C ATOM 1465 C ALA A 521 6.643 6.440 4.963 1.00 0.00 C ATOM 1466 O ALA A 521 5.994 6.737 3.961 1.00 0.00 O ATOM 1467 CB ALA A 521 5.974 7.320 7.189 1.00 0.00 C ATOM 0 H ALA A 521 6.996 5.165 7.837 1.00 0.00 H new ATOM 0 HA ALA A 521 4.913 5.823 6.070 1.00 0.00 H new ATOM 0 HB1 ALA A 521 5.475 8.156 6.698 1.00 0.00 H new ATOM 0 HB2 ALA A 521 5.458 7.086 8.120 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.007 7.591 7.405 1.00 0.00 H new ATOM 1473 N ASN A 522 7.969 6.386 4.974 1.00 0.00 N ATOM 1474 CA ASN A 522 8.735 6.687 3.773 1.00 0.00 C ATOM 1475 C ASN A 522 8.417 5.678 2.674 1.00 0.00 C ATOM 1476 O ASN A 522 8.228 6.050 1.518 1.00 0.00 O ATOM 1477 CB ASN A 522 10.231 6.654 4.098 1.00 0.00 C ATOM 1478 CG ASN A 522 10.598 5.314 4.727 1.00 0.00 C ATOM 1479 OD1 ASN A 522 9.718 4.510 5.030 1.00 0.00 O ATOM 1480 ND2 ASN A 522 11.850 5.024 4.948 1.00 0.00 N ATOM 0 H ASN A 522 8.530 6.140 5.790 1.00 0.00 H new ATOM 0 HA ASN A 522 8.464 7.682 3.419 1.00 0.00 H new ATOM 0 HB2 ASN A 522 10.813 6.810 3.189 1.00 0.00 H new ATOM 0 HB3 ASN A 522 10.481 7.466 4.780 1.00 0.00 H new ATOM 0 HD21 ASN A 522 12.099 4.130 5.372 1.00 0.00 H new ATOM 0 HD22 ASN A 522 12.580 5.691 4.697 1.00 0.00 H new ATOM 1487 N ILE A 523 8.346 4.401 3.039 1.00 0.00 N ATOM 1488 CA ILE A 523 8.032 3.361 2.067 1.00 0.00 C ATOM 1489 C ILE A 523 6.590 3.515 1.589 1.00 0.00 C ATOM 1490 O ILE A 523 6.303 3.419 0.396 1.00 0.00 O ATOM 1491 CB ILE A 523 8.233 1.977 2.692 1.00 0.00 C ATOM 1492 CG1 ILE A 523 9.723 1.762 2.969 1.00 0.00 C ATOM 1493 CG2 ILE A 523 7.737 0.891 1.730 1.00 0.00 C ATOM 1494 CD1 ILE A 523 9.911 0.502 3.816 1.00 0.00 C ATOM 0 H ILE A 523 8.500 4.065 3.990 1.00 0.00 H new ATOM 0 HA ILE A 523 8.702 3.461 1.213 1.00 0.00 H new ATOM 0 HB ILE A 523 7.668 1.917 3.622 1.00 0.00 H new ATOM 0 HG12 ILE A 523 10.268 1.666 2.030 1.00 0.00 H new ATOM 0 HG13 ILE A 523 10.135 2.627 3.489 1.00 0.00 H new ATOM 0 HG21 ILE A 523 7.884 -0.090 2.182 1.00 0.00 H new ATOM 0 HG22 ILE A 523 6.677 1.042 1.526 1.00 0.00 H new ATOM 0 HG23 ILE A 523 8.297 0.948 0.797 1.00 0.00 H new ATOM 0 HD11 ILE A 523 10.972 0.351 4.012 1.00 0.00 H new ATOM 0 HD12 ILE A 523 9.380 0.616 4.761 1.00 0.00 H new ATOM 0 HD13 ILE A 523 9.515 -0.360 3.279 1.00 0.00 H new ATOM 1506 N PHE A 524 5.687 3.754 2.537 1.00 0.00 N ATOM 1507 CA PHE A 524 4.277 3.919 2.212 1.00 0.00 C ATOM 1508 C PHE A 524 4.100 5.101 1.268 1.00 0.00 C ATOM 1509 O PHE A 524 3.422 5.000 0.245 1.00 0.00 O ATOM 1510 CB PHE A 524 3.475 4.159 3.497 1.00 0.00 C ATOM 1511 CG PHE A 524 1.993 4.087 3.198 1.00 0.00 C ATOM 1512 CD1 PHE A 524 1.423 2.874 2.789 1.00 0.00 C ATOM 1513 CD2 PHE A 524 1.186 5.227 3.333 1.00 0.00 C ATOM 1514 CE1 PHE A 524 0.054 2.800 2.516 1.00 0.00 C ATOM 1515 CE2 PHE A 524 -0.184 5.151 3.058 1.00 0.00 C ATOM 1516 CZ PHE A 524 -0.751 3.937 2.650 1.00 0.00 C ATOM 0 H PHE A 524 5.907 3.837 3.530 1.00 0.00 H new ATOM 0 HA PHE A 524 3.914 3.014 1.725 1.00 0.00 H new ATOM 0 HB2 PHE A 524 3.741 3.414 4.247 1.00 0.00 H new ATOM 0 HB3 PHE A 524 3.724 5.134 3.915 1.00 0.00 H new ATOM 0 HD1 PHE A 524 2.042 1.995 2.685 1.00 0.00 H new ATOM 0 HD2 PHE A 524 1.622 6.163 3.649 1.00 0.00 H new ATOM 0 HE1 PHE A 524 -0.383 1.864 2.201 1.00 0.00 H new ATOM 0 HE2 PHE A 524 -0.805 6.029 3.160 1.00 0.00 H new ATOM 0 HZ PHE A 524 -1.809 3.878 2.439 1.00 0.00 H new ATOM 1526 N LYS A 525 4.729 6.219 1.619 1.00 0.00 N ATOM 1527 CA LYS A 525 4.658 7.422 0.802 1.00 0.00 C ATOM 1528 C LYS A 525 5.319 7.203 -0.555 1.00 0.00 C ATOM 1529 O LYS A 525 4.806 7.637 -1.583 1.00 0.00 O ATOM 1530 CB LYS A 525 5.361 8.574 1.523 1.00 0.00 C ATOM 1531 CG LYS A 525 4.526 9.023 2.725 1.00 0.00 C ATOM 1532 CD LYS A 525 5.341 10.007 3.577 1.00 0.00 C ATOM 1533 CE LYS A 525 5.588 11.299 2.789 1.00 0.00 C ATOM 1534 NZ LYS A 525 5.960 12.397 3.726 1.00 0.00 N ATOM 0 H LYS A 525 5.293 6.315 2.464 1.00 0.00 H new ATOM 0 HA LYS A 525 3.607 7.664 0.643 1.00 0.00 H new ATOM 0 HB2 LYS A 525 6.350 8.258 1.854 1.00 0.00 H new ATOM 0 HB3 LYS A 525 5.506 9.409 0.838 1.00 0.00 H new ATOM 0 HG2 LYS A 525 3.605 9.497 2.385 1.00 0.00 H new ATOM 0 HG3 LYS A 525 4.238 8.159 3.324 1.00 0.00 H new ATOM 0 HD2 LYS A 525 4.807 10.231 4.501 1.00 0.00 H new ATOM 0 HD3 LYS A 525 6.292 9.556 3.860 1.00 0.00 H new ATOM 0 HE2 LYS A 525 6.384 11.145 2.060 1.00 0.00 H new ATOM 0 HE3 LYS A 525 4.693 11.572 2.231 1.00 0.00 H new ATOM 0 HZ1 LYS A 525 6.803 12.889 3.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 525 5.172 13.071 3.801 1.00 0.00 H new ATOM 0 HZ3 LYS A 525 6.165 11.998 4.664 1.00 0.00 H new ATOM 1548 N ASN A 526 6.469 6.538 -0.549 1.00 0.00 N ATOM 1549 CA ASN A 526 7.202 6.282 -1.780 1.00 0.00 C ATOM 1550 C ASN A 526 6.386 5.420 -2.738 1.00 0.00 C ATOM 1551 O ASN A 526 6.381 5.651 -3.947 1.00 0.00 O ATOM 1552 CB ASN A 526 8.519 5.577 -1.453 1.00 0.00 C ATOM 1553 CG ASN A 526 9.466 6.541 -0.744 1.00 0.00 C ATOM 1554 OD1 ASN A 526 9.392 7.752 -0.955 1.00 0.00 O ATOM 1555 ND2 ASN A 526 10.354 6.072 0.090 1.00 0.00 N ATOM 0 H ASN A 526 6.911 6.168 0.292 1.00 0.00 H new ATOM 0 HA ASN A 526 7.401 7.238 -2.265 1.00 0.00 H new ATOM 0 HB2 ASN A 526 8.329 4.710 -0.821 1.00 0.00 H new ATOM 0 HB3 ASN A 526 8.981 5.209 -2.369 1.00 0.00 H new ATOM 0 HD21 ASN A 526 10.990 6.709 0.570 1.00 0.00 H new ATOM 0 HD22 ASN A 526 10.412 5.068 0.262 1.00 0.00 H new ATOM 1562 N CYS A 527 5.701 4.423 -2.194 1.00 0.00 N ATOM 1563 CA CYS A 527 4.893 3.532 -3.014 1.00 0.00 C ATOM 1564 C CYS A 527 3.725 4.285 -3.643 1.00 0.00 C ATOM 1565 O CYS A 527 3.529 4.240 -4.852 1.00 0.00 O ATOM 1566 CB CYS A 527 4.359 2.389 -2.152 1.00 0.00 C ATOM 1567 SG CYS A 527 5.747 1.488 -1.418 1.00 0.00 S ATOM 0 H CYS A 527 5.689 4.212 -1.196 1.00 0.00 H new ATOM 0 HA CYS A 527 5.518 3.133 -3.812 1.00 0.00 H new ATOM 0 HB2 CYS A 527 3.711 2.782 -1.368 1.00 0.00 H new ATOM 0 HB3 CYS A 527 3.753 1.715 -2.758 1.00 0.00 H new ATOM 0 HG CYS A 527 6.303 2.221 -0.500 1.00 0.00 H new ATOM 1573 N LEU A 528 2.959 4.989 -2.818 1.00 0.00 N ATOM 1574 CA LEU A 528 1.813 5.740 -3.315 1.00 0.00 C ATOM 1575 C LEU A 528 2.232 6.662 -4.450 1.00 0.00 C ATOM 1576 O LEU A 528 1.499 6.824 -5.426 1.00 0.00 O ATOM 1577 CB LEU A 528 1.195 6.573 -2.189 1.00 0.00 C ATOM 1578 CG LEU A 528 0.561 5.654 -1.134 1.00 0.00 C ATOM 1579 CD1 LEU A 528 0.086 6.504 0.056 1.00 0.00 C ATOM 1580 CD2 LEU A 528 -0.632 4.880 -1.739 1.00 0.00 C ATOM 0 H LEU A 528 3.108 5.055 -1.811 1.00 0.00 H new ATOM 0 HA LEU A 528 1.075 5.028 -3.685 1.00 0.00 H new ATOM 0 HB2 LEU A 528 1.960 7.196 -1.726 1.00 0.00 H new ATOM 0 HB3 LEU A 528 0.440 7.245 -2.597 1.00 0.00 H new ATOM 0 HG LEU A 528 1.304 4.931 -0.796 1.00 0.00 H new ATOM 0 HD11 LEU A 528 -0.365 5.857 0.808 1.00 0.00 H new ATOM 0 HD12 LEU A 528 0.937 7.028 0.491 1.00 0.00 H new ATOM 0 HD13 LEU A 528 -0.651 7.230 -0.287 1.00 0.00 H new ATOM 0 HD21 LEU A 528 -1.070 4.234 -0.978 1.00 0.00 H new ATOM 0 HD22 LEU A 528 -1.384 5.587 -2.091 1.00 0.00 H new ATOM 0 HD23 LEU A 528 -0.285 4.273 -2.575 1.00 0.00 H new ATOM 1592 N LYS A 529 3.411 7.259 -4.328 1.00 0.00 N ATOM 1593 CA LYS A 529 3.899 8.148 -5.365 1.00 0.00 C ATOM 1594 C LYS A 529 4.038 7.393 -6.683 1.00 0.00 C ATOM 1595 O LYS A 529 3.690 7.909 -7.744 1.00 0.00 O ATOM 1596 CB LYS A 529 5.253 8.733 -4.960 1.00 0.00 C ATOM 1597 CG LYS A 529 5.060 9.800 -3.881 1.00 0.00 C ATOM 1598 CD LYS A 529 6.428 10.258 -3.374 1.00 0.00 C ATOM 1599 CE LYS A 529 6.249 11.369 -2.340 1.00 0.00 C ATOM 1600 NZ LYS A 529 5.728 12.589 -3.016 1.00 0.00 N ATOM 0 H LYS A 529 4.037 7.144 -3.531 1.00 0.00 H new ATOM 0 HA LYS A 529 3.183 8.960 -5.494 1.00 0.00 H new ATOM 0 HB2 LYS A 529 5.904 7.942 -4.588 1.00 0.00 H new ATOM 0 HB3 LYS A 529 5.745 9.168 -5.830 1.00 0.00 H new ATOM 0 HG2 LYS A 529 4.507 10.647 -4.286 1.00 0.00 H new ATOM 0 HG3 LYS A 529 4.470 9.398 -3.057 1.00 0.00 H new ATOM 0 HD2 LYS A 529 6.962 9.418 -2.930 1.00 0.00 H new ATOM 0 HD3 LYS A 529 7.034 10.617 -4.206 1.00 0.00 H new ATOM 0 HE2 LYS A 529 5.558 11.048 -1.560 1.00 0.00 H new ATOM 0 HE3 LYS A 529 7.200 11.586 -1.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 6.424 13.357 -2.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 5.560 12.384 -4.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 4.835 12.879 -2.568 1.00 0.00 H new ATOM 1614 N GLU A 530 4.554 6.167 -6.611 1.00 0.00 N ATOM 1615 CA GLU A 530 4.731 5.358 -7.816 1.00 0.00 C ATOM 1616 C GLU A 530 3.413 4.717 -8.246 1.00 0.00 C ATOM 1617 O GLU A 530 3.006 4.833 -9.402 1.00 0.00 O ATOM 1618 CB GLU A 530 5.772 4.264 -7.564 1.00 0.00 C ATOM 1619 CG GLU A 530 6.054 3.511 -8.867 1.00 0.00 C ATOM 1620 CD GLU A 530 7.121 2.447 -8.635 1.00 0.00 C ATOM 1621 OE1 GLU A 530 7.785 2.514 -7.615 1.00 0.00 O ATOM 1622 OE2 GLU A 530 7.256 1.579 -9.482 1.00 0.00 O ATOM 0 H GLU A 530 4.853 5.717 -5.746 1.00 0.00 H new ATOM 0 HA GLU A 530 5.075 6.015 -8.615 1.00 0.00 H new ATOM 0 HB2 GLU A 530 6.692 4.705 -7.181 1.00 0.00 H new ATOM 0 HB3 GLU A 530 5.410 3.572 -6.804 1.00 0.00 H new ATOM 0 HG2 GLU A 530 5.139 3.046 -9.233 1.00 0.00 H new ATOM 0 HG3 GLU A 530 6.386 4.209 -9.635 1.00 0.00 H new ATOM 1629 N ILE A 531 2.757 4.030 -7.315 1.00 0.00 N ATOM 1630 CA ILE A 531 1.491 3.367 -7.617 1.00 0.00 C ATOM 1631 C ILE A 531 0.431 4.386 -8.012 1.00 0.00 C ATOM 1632 O ILE A 531 -0.281 4.203 -8.999 1.00 0.00 O ATOM 1633 CB ILE A 531 1.012 2.576 -6.395 1.00 0.00 C ATOM 1634 CG1 ILE A 531 2.111 1.595 -5.937 1.00 0.00 C ATOM 1635 CG2 ILE A 531 -0.254 1.794 -6.754 1.00 0.00 C ATOM 1636 CD1 ILE A 531 2.521 0.667 -7.093 1.00 0.00 C ATOM 0 H ILE A 531 3.077 3.918 -6.353 1.00 0.00 H new ATOM 0 HA ILE A 531 1.650 2.686 -8.453 1.00 0.00 H new ATOM 0 HB ILE A 531 0.794 3.271 -5.584 1.00 0.00 H new ATOM 0 HG12 ILE A 531 2.979 2.151 -5.584 1.00 0.00 H new ATOM 0 HG13 ILE A 531 1.750 1.002 -5.097 1.00 0.00 H new ATOM 0 HG21 ILE A 531 -0.593 1.232 -5.884 1.00 0.00 H new ATOM 0 HG22 ILE A 531 -1.035 2.488 -7.065 1.00 0.00 H new ATOM 0 HG23 ILE A 531 -0.037 1.104 -7.569 1.00 0.00 H new ATOM 0 HD11 ILE A 531 3.297 -0.018 -6.752 1.00 0.00 H new ATOM 0 HD12 ILE A 531 1.654 0.096 -7.426 1.00 0.00 H new ATOM 0 HD13 ILE A 531 2.903 1.264 -7.921 1.00 0.00 H new ATOM 1648 N ASP A 532 0.329 5.465 -7.237 1.00 0.00 N ATOM 1649 CA ASP A 532 -0.656 6.515 -7.514 1.00 0.00 C ATOM 1650 C ASP A 532 -0.060 7.894 -7.253 1.00 0.00 C ATOM 1651 O ASP A 532 -0.255 8.479 -6.189 1.00 0.00 O ATOM 1652 CB ASP A 532 -1.892 6.315 -6.633 1.00 0.00 C ATOM 1653 CG ASP A 532 -2.633 5.049 -7.051 1.00 0.00 C ATOM 1654 OD1 ASP A 532 -2.439 4.614 -8.172 1.00 0.00 O ATOM 1655 OD2 ASP A 532 -3.389 4.535 -6.242 1.00 0.00 O ATOM 0 H ASP A 532 0.911 5.637 -6.417 1.00 0.00 H new ATOM 0 HA ASP A 532 -0.943 6.450 -8.564 1.00 0.00 H new ATOM 0 HB2 ASP A 532 -1.595 6.243 -5.587 1.00 0.00 H new ATOM 0 HB3 ASP A 532 -2.553 7.178 -6.718 1.00 0.00 H new ATOM 1660 N SER A 533 0.668 8.405 -8.243 1.00 0.00 N ATOM 1661 CA SER A 533 1.290 9.719 -8.126 1.00 0.00 C ATOM 1662 C SER A 533 0.229 10.798 -7.933 1.00 0.00 C ATOM 1663 O SER A 533 0.454 11.786 -7.235 1.00 0.00 O ATOM 1664 CB SER A 533 2.103 10.022 -9.386 1.00 0.00 C ATOM 1665 OG SER A 533 1.240 10.002 -10.515 1.00 0.00 O ATOM 0 H SER A 533 0.840 7.932 -9.130 1.00 0.00 H new ATOM 0 HA SER A 533 1.949 9.714 -7.258 1.00 0.00 H new ATOM 0 HB2 SER A 533 2.583 10.996 -9.298 1.00 0.00 H new ATOM 0 HB3 SER A 533 2.897 9.285 -9.507 1.00 0.00 H new ATOM 0 HG SER A 533 1.756 10.197 -11.325 1.00 0.00 H new ATOM 1671 N THR A 534 -0.926 10.599 -8.559 1.00 0.00 N ATOM 1672 CA THR A 534 -2.020 11.559 -8.455 1.00 0.00 C ATOM 1673 C THR A 534 -2.568 11.607 -7.030 1.00 0.00 C ATOM 1674 O THR A 534 -2.906 12.676 -6.523 1.00 0.00 O ATOM 1675 CB THR A 534 -3.143 11.178 -9.423 1.00 0.00 C ATOM 1676 OG1 THR A 534 -4.121 12.209 -9.440 1.00 0.00 O ATOM 1677 CG2 THR A 534 -3.791 9.868 -8.967 1.00 0.00 C ATOM 0 H THR A 534 -1.129 9.786 -9.141 1.00 0.00 H new ATOM 0 HA THR A 534 -1.634 12.545 -8.713 1.00 0.00 H new ATOM 0 HB THR A 534 -2.731 11.049 -10.424 1.00 0.00 H new ATOM 0 HG1 THR A 534 -4.840 11.967 -10.060 1.00 0.00 H new ATOM 0 HG21 THR A 534 -4.590 9.598 -9.657 1.00 0.00 H new ATOM 0 HG22 THR A 534 -3.041 9.077 -8.953 1.00 0.00 H new ATOM 0 HG23 THR A 534 -4.203 9.995 -7.966 1.00 0.00 H new ATOM 1685 N LEU A 535 -2.660 10.442 -6.393 1.00 0.00 N ATOM 1686 CA LEU A 535 -3.181 10.369 -5.032 1.00 0.00 C ATOM 1687 C LEU A 535 -2.302 11.176 -4.085 1.00 0.00 C ATOM 1688 O LEU A 535 -2.810 11.890 -3.222 1.00 0.00 O ATOM 1689 CB LEU A 535 -3.250 8.905 -4.569 1.00 0.00 C ATOM 1690 CG LEU A 535 -3.817 8.819 -3.141 1.00 0.00 C ATOM 1691 CD1 LEU A 535 -5.266 9.344 -3.115 1.00 0.00 C ATOM 1692 CD2 LEU A 535 -3.797 7.358 -2.673 1.00 0.00 C ATOM 0 H LEU A 535 -2.384 9.545 -6.793 1.00 0.00 H new ATOM 0 HA LEU A 535 -4.186 10.790 -5.021 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -3.877 8.331 -5.251 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -2.255 8.460 -4.599 1.00 0.00 H new ATOM 0 HG LEU A 535 -3.205 9.428 -2.476 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -5.658 9.279 -2.100 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -5.283 10.383 -3.445 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -5.883 8.742 -3.782 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -4.198 7.294 -1.662 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -4.407 6.753 -3.344 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -2.772 6.987 -2.681 1.00 0.00 H new ATOM 1704 N TYR A 536 -0.989 11.066 -4.247 1.00 0.00 N ATOM 1705 CA TYR A 536 -0.071 11.805 -3.389 1.00 0.00 C ATOM 1706 C TYR A 536 -0.313 13.303 -3.532 1.00 0.00 C ATOM 1707 O TYR A 536 -0.372 14.031 -2.541 1.00 0.00 O ATOM 1708 CB TYR A 536 1.377 11.482 -3.764 1.00 0.00 C ATOM 1709 CG TYR A 536 2.313 12.326 -2.931 1.00 0.00 C ATOM 1710 CD1 TYR A 536 2.663 11.920 -1.639 1.00 0.00 C ATOM 1711 CD2 TYR A 536 2.827 13.521 -3.452 1.00 0.00 C ATOM 1712 CE1 TYR A 536 3.528 12.705 -0.867 1.00 0.00 C ATOM 1713 CE2 TYR A 536 3.693 14.306 -2.681 1.00 0.00 C ATOM 1714 CZ TYR A 536 4.044 13.898 -1.389 1.00 0.00 C ATOM 1715 OH TYR A 536 4.899 14.672 -0.630 1.00 0.00 O ATOM 0 H TYR A 536 -0.541 10.482 -4.953 1.00 0.00 H new ATOM 0 HA TYR A 536 -0.247 11.510 -2.355 1.00 0.00 H new ATOM 0 HB2 TYR A 536 1.579 10.424 -3.598 1.00 0.00 H new ATOM 0 HB3 TYR A 536 1.541 11.676 -4.824 1.00 0.00 H new ATOM 0 HD1 TYR A 536 2.266 11.000 -1.236 1.00 0.00 H new ATOM 0 HD2 TYR A 536 2.555 13.837 -4.448 1.00 0.00 H new ATOM 0 HE1 TYR A 536 3.797 12.391 0.131 1.00 0.00 H new ATOM 0 HE2 TYR A 536 4.090 15.226 -3.083 1.00 0.00 H new ATOM 0 HH TYR A 536 5.165 15.464 -1.142 1.00 0.00 H new ATOM 1725 N LYS A 537 -0.451 13.755 -4.773 1.00 0.00 N ATOM 1726 CA LYS A 537 -0.683 15.166 -5.042 1.00 0.00 C ATOM 1727 C LYS A 537 -2.031 15.614 -4.478 1.00 0.00 C ATOM 1728 O LYS A 537 -2.333 16.806 -4.456 1.00 0.00 O ATOM 1729 CB LYS A 537 -0.642 15.422 -6.557 1.00 0.00 C ATOM 1730 CG LYS A 537 -0.342 16.910 -6.838 1.00 0.00 C ATOM 1731 CD LYS A 537 1.182 17.148 -6.860 1.00 0.00 C ATOM 1732 CE LYS A 537 1.729 16.882 -8.266 1.00 0.00 C ATOM 1733 NZ LYS A 537 3.201 17.124 -8.287 1.00 0.00 N ATOM 0 H LYS A 537 -0.406 13.166 -5.605 1.00 0.00 H new ATOM 0 HA LYS A 537 0.103 15.742 -4.554 1.00 0.00 H new ATOM 0 HB2 LYS A 537 0.122 14.796 -7.018 1.00 0.00 H new ATOM 0 HB3 LYS A 537 -1.596 15.145 -7.006 1.00 0.00 H new ATOM 0 HG2 LYS A 537 -0.778 17.203 -7.793 1.00 0.00 H new ATOM 0 HG3 LYS A 537 -0.804 17.533 -6.073 1.00 0.00 H new ATOM 0 HD2 LYS A 537 1.404 18.173 -6.562 1.00 0.00 H new ATOM 0 HD3 LYS A 537 1.672 16.493 -6.139 1.00 0.00 H new ATOM 0 HE2 LYS A 537 1.515 15.855 -8.561 1.00 0.00 H new ATOM 0 HE3 LYS A 537 1.234 17.531 -8.988 1.00 0.00 H new ATOM 0 HZ1 LYS A 537 3.569 16.943 -9.243 1.00 0.00 H new ATOM 0 HZ2 LYS A 537 3.394 18.111 -8.023 1.00 0.00 H new ATOM 0 HZ3 LYS A 537 3.667 16.487 -7.610 1.00 0.00 H new ATOM 1747 N ASN A 538 -2.844 14.656 -4.027 1.00 0.00 N ATOM 1748 CA ASN A 538 -4.163 14.973 -3.464 1.00 0.00 C ATOM 1749 C ASN A 538 -4.222 14.605 -1.983 1.00 0.00 C ATOM 1750 O ASN A 538 -5.193 14.920 -1.295 1.00 0.00 O ATOM 1751 CB ASN A 538 -5.247 14.203 -4.222 1.00 0.00 C ATOM 1752 CG ASN A 538 -5.246 14.614 -5.690 1.00 0.00 C ATOM 1753 OD1 ASN A 538 -5.356 15.798 -6.005 1.00 0.00 O ATOM 1754 ND2 ASN A 538 -5.123 13.698 -6.613 1.00 0.00 N ATOM 0 H ASN A 538 -2.617 13.662 -4.039 1.00 0.00 H new ATOM 0 HA ASN A 538 -4.332 16.045 -3.566 1.00 0.00 H new ATOM 0 HB2 ASN A 538 -5.071 13.131 -4.136 1.00 0.00 H new ATOM 0 HB3 ASN A 538 -6.223 14.403 -3.780 1.00 0.00 H new ATOM 0 HD21 ASN A 538 -5.118 13.964 -7.598 1.00 0.00 H new ATOM 0 HD22 ASN A 538 -5.032 12.717 -6.349 1.00 0.00 H new ATOM 1761 N LEU A 539 -3.187 13.918 -1.503 1.00 0.00 N ATOM 1762 CA LEU A 539 -3.131 13.490 -0.104 1.00 0.00 C ATOM 1763 C LEU A 539 -2.427 14.529 0.770 1.00 0.00 C ATOM 1764 O LEU A 539 -3.069 15.293 1.488 1.00 0.00 O ATOM 1765 CB LEU A 539 -2.392 12.146 -0.012 1.00 0.00 C ATOM 1766 CG LEU A 539 -2.409 11.614 1.432 1.00 0.00 C ATOM 1767 CD1 LEU A 539 -3.855 11.362 1.894 1.00 0.00 C ATOM 1768 CD2 LEU A 539 -1.611 10.304 1.488 1.00 0.00 C ATOM 0 H LEU A 539 -2.377 13.646 -2.060 1.00 0.00 H new ATOM 0 HA LEU A 539 -4.152 13.380 0.262 1.00 0.00 H new ATOM 0 HB2 LEU A 539 -2.861 11.421 -0.677 1.00 0.00 H new ATOM 0 HB3 LEU A 539 -1.362 12.268 -0.348 1.00 0.00 H new ATOM 0 HG LEU A 539 -1.959 12.353 2.094 1.00 0.00 H new ATOM 0 HD11 LEU A 539 -3.850 10.986 2.917 1.00 0.00 H new ATOM 0 HD12 LEU A 539 -4.418 12.295 1.853 1.00 0.00 H new ATOM 0 HD13 LEU A 539 -4.323 10.627 1.240 1.00 0.00 H new ATOM 0 HD21 LEU A 539 -1.616 9.918 2.507 1.00 0.00 H new ATOM 0 HD22 LEU A 539 -2.066 9.572 0.820 1.00 0.00 H new ATOM 0 HD23 LEU A 539 -0.583 10.490 1.176 1.00 0.00 H new ATOM 1780 N PHE A 540 -1.101 14.529 0.717 1.00 0.00 N ATOM 1781 CA PHE A 540 -0.302 15.453 1.520 1.00 0.00 C ATOM 1782 C PHE A 540 -0.458 16.903 1.062 1.00 0.00 C ATOM 1783 O PHE A 540 -0.457 17.823 1.878 1.00 0.00 O ATOM 1784 CB PHE A 540 1.173 15.056 1.443 1.00 0.00 C ATOM 1785 CG PHE A 540 1.388 13.760 2.189 1.00 0.00 C ATOM 1786 CD1 PHE A 540 1.606 13.779 3.572 1.00 0.00 C ATOM 1787 CD2 PHE A 540 1.364 12.543 1.499 1.00 0.00 C ATOM 1788 CE1 PHE A 540 1.804 12.579 4.264 1.00 0.00 C ATOM 1789 CE2 PHE A 540 1.562 11.342 2.193 1.00 0.00 C ATOM 1790 CZ PHE A 540 1.783 11.361 3.576 1.00 0.00 C ATOM 0 H PHE A 540 -0.554 13.901 0.128 1.00 0.00 H new ATOM 0 HA PHE A 540 -0.662 15.388 2.547 1.00 0.00 H new ATOM 0 HB2 PHE A 540 1.476 14.943 0.402 1.00 0.00 H new ATOM 0 HB3 PHE A 540 1.795 15.842 1.872 1.00 0.00 H new ATOM 0 HD1 PHE A 540 1.621 14.719 4.104 1.00 0.00 H new ATOM 0 HD2 PHE A 540 1.193 12.529 0.433 1.00 0.00 H new ATOM 0 HE1 PHE A 540 1.973 12.593 5.331 1.00 0.00 H new ATOM 0 HE2 PHE A 540 1.544 10.402 1.662 1.00 0.00 H new ATOM 0 HZ PHE A 540 1.937 10.436 4.111 1.00 0.00 H new ATOM 1800 N VAL A 541 -0.558 17.103 -0.246 1.00 0.00 N ATOM 1801 CA VAL A 541 -0.679 18.452 -0.796 1.00 0.00 C ATOM 1802 C VAL A 541 -2.074 19.042 -0.572 1.00 0.00 C ATOM 1803 O VAL A 541 -2.237 19.987 0.200 1.00 0.00 O ATOM 1804 CB VAL A 541 -0.366 18.421 -2.293 1.00 0.00 C ATOM 1805 CG1 VAL A 541 -0.596 19.806 -2.905 1.00 0.00 C ATOM 1806 CG2 VAL A 541 1.095 18.011 -2.498 1.00 0.00 C ATOM 0 H VAL A 541 -0.558 16.358 -0.942 1.00 0.00 H new ATOM 0 HA VAL A 541 0.034 19.090 -0.274 1.00 0.00 H new ATOM 0 HB VAL A 541 -1.023 17.701 -2.781 1.00 0.00 H new ATOM 0 HG11 VAL A 541 -0.371 19.775 -3.971 1.00 0.00 H new ATOM 0 HG12 VAL A 541 -1.636 20.099 -2.762 1.00 0.00 H new ATOM 0 HG13 VAL A 541 0.055 20.532 -2.418 1.00 0.00 H new ATOM 0 HG21 VAL A 541 1.320 17.988 -3.564 1.00 0.00 H new ATOM 0 HG22 VAL A 541 1.748 18.731 -2.004 1.00 0.00 H new ATOM 0 HG23 VAL A 541 1.258 17.021 -2.071 1.00 0.00 H new