USER MOD reduce.3.24.130724 H: found=0, std=0, add=668, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 669 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 440 GLN : amide:sc= -0.287 X(o=0.85,f=0.59) USER MOD Set 1.2: A 476 SER OG : rot -18:sc= 1.14 USER MOD Single : A 421 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 LYS NZ :NH3+ -179:sc= 1.28 (180deg=1.25) USER MOD Single : A 429 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 436 THR OG1 : rot -89:sc= 0.594 USER MOD Single : A 443 THR OG1 : rot 180:sc=-0.00956 USER MOD Single : A 445 LYS NZ :NH3+ 152:sc= -0.0917 (180deg=-0.816!) USER MOD Single : A 454 THR OG1 : rot 180:sc= 0 USER MOD Single : A 455 THR OG1 : rot 180:sc= 0 USER MOD Single : A 456 TYR OH : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl 155:sc= -5.32! (180deg=-6.88!) USER MOD Single : A 464 ASN : amide:sc= -2.03! C(o=-2!,f=-14!) USER MOD Single : A 466 SER OG : rot 180:sc= 0 USER MOD Single : A 471 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 477 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 482 THR OG1 : rot 131:sc= 0.255 USER MOD Single : A 485 HIS : no HD1:sc=-0.00213 X(o=-0.0021,f=0) USER MOD Single : A 489 GLN :FLIP amide:sc= -0.0447 F(o=-1,f=-0.045) USER MOD Single : A 495 MET CE :methyl -166:sc= -0.0487 (180deg=-0.333) USER MOD Single : A 501 LYS NZ :NH3+ -149:sc= 1.22 (180deg=1.12) USER MOD Single : A 502 LYS NZ :NH3+ 164:sc= 0.746 (180deg=0.295) USER MOD Single : A 505 GLN : amide:sc= 0 X(o=0,f=-0.34) USER MOD ----------------------------------------------------------------- ATOM 470 N VAL A 419 -9.089 0.536 -0.760 1.00 0.00 N ATOM 471 CA VAL A 419 -7.973 -0.318 -1.101 1.00 0.00 C ATOM 472 C VAL A 419 -7.180 0.346 -2.198 1.00 0.00 C ATOM 473 O VAL A 419 -7.606 1.374 -2.736 1.00 0.00 O ATOM 474 CB VAL A 419 -8.406 -1.749 -1.582 1.00 0.00 C ATOM 475 CG1 VAL A 419 -9.115 -2.510 -0.486 1.00 0.00 C ATOM 476 CG2 VAL A 419 -9.273 -1.682 -2.829 1.00 0.00 C ATOM 0 HA VAL A 419 -7.381 -0.454 -0.196 1.00 0.00 H new ATOM 0 HB VAL A 419 -7.493 -2.289 -1.835 1.00 0.00 H new ATOM 0 HG11 VAL A 419 -9.400 -3.496 -0.853 1.00 0.00 H new ATOM 0 HG12 VAL A 419 -8.449 -2.621 0.370 1.00 0.00 H new ATOM 0 HG13 VAL A 419 -10.008 -1.963 -0.182 1.00 0.00 H new ATOM 0 HG21 VAL A 419 -9.553 -2.691 -3.132 1.00 0.00 H new ATOM 0 HG22 VAL A 419 -10.172 -1.104 -2.616 1.00 0.00 H new ATOM 0 HG23 VAL A 419 -8.716 -1.203 -3.634 1.00 0.00 H new ATOM 486 N GLY A 420 -6.060 -0.212 -2.512 1.00 0.00 N ATOM 487 CA GLY A 420 -5.238 0.291 -3.561 1.00 0.00 C ATOM 488 C GLY A 420 -4.609 -0.846 -4.300 1.00 0.00 C ATOM 489 O GLY A 420 -4.821 -2.015 -3.938 1.00 0.00 O ATOM 0 H GLY A 420 -5.686 -1.037 -2.044 1.00 0.00 H new ATOM 0 HA2 GLY A 420 -5.834 0.896 -4.244 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -4.466 0.942 -3.150 1.00 0.00 H new ATOM 493 N THR A 421 -3.814 -0.542 -5.276 1.00 0.00 N ATOM 494 CA THR A 421 -3.183 -1.554 -6.070 1.00 0.00 C ATOM 495 C THR A 421 -1.682 -1.345 -6.103 1.00 0.00 C ATOM 496 O THR A 421 -1.186 -0.202 -6.069 1.00 0.00 O ATOM 497 CB THR A 421 -3.751 -1.541 -7.495 1.00 0.00 C ATOM 498 OG1 THR A 421 -5.164 -1.703 -7.425 1.00 0.00 O ATOM 499 CG2 THR A 421 -3.174 -2.659 -8.362 1.00 0.00 C ATOM 0 H THR A 421 -3.582 0.414 -5.547 1.00 0.00 H new ATOM 0 HA THR A 421 -3.387 -2.525 -5.619 1.00 0.00 H new ATOM 0 HB THR A 421 -3.479 -0.590 -7.952 1.00 0.00 H new ATOM 0 HG1 THR A 421 -5.539 -1.695 -8.330 1.00 0.00 H new ATOM 0 HG21 THR A 421 -3.608 -2.606 -9.360 1.00 0.00 H new ATOM 0 HG22 THR A 421 -2.092 -2.545 -8.430 1.00 0.00 H new ATOM 0 HG23 THR A 421 -3.410 -3.625 -7.915 1.00 0.00 H new ATOM 507 N VAL A 422 -0.978 -2.431 -6.116 1.00 0.00 N ATOM 508 CA VAL A 422 0.449 -2.428 -6.197 1.00 0.00 C ATOM 509 C VAL A 422 0.825 -2.214 -7.654 1.00 0.00 C ATOM 510 O VAL A 422 0.266 -2.867 -8.537 1.00 0.00 O ATOM 511 CB VAL A 422 1.031 -3.780 -5.721 1.00 0.00 C ATOM 512 CG1 VAL A 422 2.536 -3.741 -5.711 1.00 0.00 C ATOM 513 CG2 VAL A 422 0.502 -4.160 -4.352 1.00 0.00 C ATOM 0 H VAL A 422 -1.386 -3.364 -6.070 1.00 0.00 H new ATOM 0 HA VAL A 422 0.851 -1.640 -5.560 1.00 0.00 H new ATOM 0 HB VAL A 422 0.708 -4.543 -6.429 1.00 0.00 H new ATOM 0 HG11 VAL A 422 2.923 -4.702 -5.373 1.00 0.00 H new ATOM 0 HG12 VAL A 422 2.901 -3.537 -6.717 1.00 0.00 H new ATOM 0 HG13 VAL A 422 2.875 -2.956 -5.035 1.00 0.00 H new ATOM 0 HG21 VAL A 422 0.931 -5.115 -4.048 1.00 0.00 H new ATOM 0 HG22 VAL A 422 0.778 -3.392 -3.629 1.00 0.00 H new ATOM 0 HG23 VAL A 422 -0.584 -4.247 -4.393 1.00 0.00 H new ATOM 523 N ILE A 423 1.740 -1.326 -7.918 1.00 0.00 N ATOM 524 CA ILE A 423 2.131 -1.062 -9.279 1.00 0.00 C ATOM 525 C ILE A 423 3.221 -2.021 -9.718 1.00 0.00 C ATOM 526 O ILE A 423 3.188 -2.539 -10.828 1.00 0.00 O ATOM 527 CB ILE A 423 2.505 0.423 -9.529 1.00 0.00 C ATOM 528 CG1 ILE A 423 3.585 0.911 -8.555 1.00 0.00 C ATOM 529 CG2 ILE A 423 1.256 1.292 -9.434 1.00 0.00 C ATOM 530 CD1 ILE A 423 3.934 2.381 -8.691 1.00 0.00 C ATOM 0 H ILE A 423 2.229 -0.773 -7.214 1.00 0.00 H new ATOM 0 HA ILE A 423 1.258 -1.242 -9.906 1.00 0.00 H new ATOM 0 HB ILE A 423 2.922 0.504 -10.533 1.00 0.00 H new ATOM 0 HG12 ILE A 423 3.249 0.723 -7.535 1.00 0.00 H new ATOM 0 HG13 ILE A 423 4.488 0.320 -8.707 1.00 0.00 H new ATOM 0 HG21 ILE A 423 1.523 2.334 -9.610 1.00 0.00 H new ATOM 0 HG22 ILE A 423 0.532 0.972 -10.183 1.00 0.00 H new ATOM 0 HG23 ILE A 423 0.818 1.193 -8.441 1.00 0.00 H new ATOM 0 HD11 ILE A 423 4.705 2.641 -7.965 1.00 0.00 H new ATOM 0 HD12 ILE A 423 4.303 2.576 -9.698 1.00 0.00 H new ATOM 0 HD13 ILE A 423 3.045 2.984 -8.508 1.00 0.00 H new ATOM 542 N GLU A 424 4.138 -2.296 -8.823 1.00 0.00 N ATOM 543 CA GLU A 424 5.174 -3.269 -9.053 1.00 0.00 C ATOM 544 C GLU A 424 5.661 -3.787 -7.715 1.00 0.00 C ATOM 545 O GLU A 424 5.662 -3.065 -6.739 1.00 0.00 O ATOM 546 CB GLU A 424 6.339 -2.705 -9.874 1.00 0.00 C ATOM 547 CG GLU A 424 7.040 -1.532 -9.239 1.00 0.00 C ATOM 548 CD GLU A 424 8.299 -1.158 -9.956 1.00 0.00 C ATOM 549 OE1 GLU A 424 9.232 -1.998 -10.016 1.00 0.00 O ATOM 550 OE2 GLU A 424 8.387 -0.039 -10.482 1.00 0.00 O ATOM 0 H GLU A 424 4.185 -1.847 -7.908 1.00 0.00 H new ATOM 0 HA GLU A 424 4.754 -4.084 -9.642 1.00 0.00 H new ATOM 0 HB2 GLU A 424 7.066 -3.499 -10.042 1.00 0.00 H new ATOM 0 HB3 GLU A 424 5.965 -2.403 -10.852 1.00 0.00 H new ATOM 0 HG2 GLU A 424 6.366 -0.675 -9.224 1.00 0.00 H new ATOM 0 HG3 GLU A 424 7.274 -1.771 -8.202 1.00 0.00 H new ATOM 557 N ALA A 425 6.037 -5.022 -7.660 1.00 0.00 N ATOM 558 CA ALA A 425 6.495 -5.621 -6.431 1.00 0.00 C ATOM 559 C ALA A 425 7.478 -6.669 -6.775 1.00 0.00 C ATOM 560 O ALA A 425 7.351 -7.287 -7.829 1.00 0.00 O ATOM 561 CB ALA A 425 5.342 -6.222 -5.663 1.00 0.00 C ATOM 0 H ALA A 425 6.039 -5.653 -8.462 1.00 0.00 H new ATOM 0 HA ALA A 425 6.952 -4.861 -5.797 1.00 0.00 H new ATOM 0 HB1 ALA A 425 5.713 -6.668 -4.740 1.00 0.00 H new ATOM 0 HB2 ALA A 425 4.618 -5.443 -5.425 1.00 0.00 H new ATOM 0 HB3 ALA A 425 4.862 -6.990 -6.269 1.00 0.00 H new ATOM 567 N LYS A 426 8.467 -6.860 -5.932 1.00 0.00 N ATOM 568 CA LYS A 426 9.514 -7.832 -6.195 1.00 0.00 C ATOM 569 C LYS A 426 10.417 -7.926 -4.976 1.00 0.00 C ATOM 570 O LYS A 426 10.214 -7.214 -3.989 1.00 0.00 O ATOM 571 CB LYS A 426 10.360 -7.464 -7.461 1.00 0.00 C ATOM 572 CG LYS A 426 11.481 -6.439 -7.243 1.00 0.00 C ATOM 573 CD LYS A 426 10.998 -5.074 -6.739 1.00 0.00 C ATOM 574 CE LYS A 426 10.096 -4.323 -7.723 1.00 0.00 C ATOM 575 NZ LYS A 426 10.799 -3.883 -8.955 1.00 0.00 N ATOM 0 H LYS A 426 8.572 -6.354 -5.053 1.00 0.00 H new ATOM 0 HA LYS A 426 9.042 -8.794 -6.395 1.00 0.00 H new ATOM 0 HB2 LYS A 426 10.802 -8.378 -7.857 1.00 0.00 H new ATOM 0 HB3 LYS A 426 9.685 -7.079 -8.226 1.00 0.00 H new ATOM 0 HG2 LYS A 426 12.195 -6.846 -6.527 1.00 0.00 H new ATOM 0 HG3 LYS A 426 12.016 -6.298 -8.182 1.00 0.00 H new ATOM 0 HD2 LYS A 426 10.457 -5.216 -5.803 1.00 0.00 H new ATOM 0 HD3 LYS A 426 11.866 -4.454 -6.514 1.00 0.00 H new ATOM 0 HE2 LYS A 426 9.261 -4.966 -8.001 1.00 0.00 H new ATOM 0 HE3 LYS A 426 9.674 -3.451 -7.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 426 10.136 -3.368 -9.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 426 11.590 -3.259 -8.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 426 11.164 -4.714 -9.462 1.00 0.00 H new ATOM 589 N LEU A 427 11.371 -8.797 -5.033 1.00 0.00 N ATOM 590 CA LEU A 427 12.320 -8.938 -3.966 1.00 0.00 C ATOM 591 C LEU A 427 13.439 -7.937 -4.163 1.00 0.00 C ATOM 592 O LEU A 427 13.772 -7.568 -5.308 1.00 0.00 O ATOM 593 CB LEU A 427 12.911 -10.351 -3.944 1.00 0.00 C ATOM 594 CG LEU A 427 14.041 -10.683 -4.962 1.00 0.00 C ATOM 595 CD1 LEU A 427 14.641 -12.045 -4.656 1.00 0.00 C ATOM 596 CD2 LEU A 427 13.512 -10.672 -6.385 1.00 0.00 C ATOM 0 H LEU A 427 11.518 -9.432 -5.817 1.00 0.00 H new ATOM 0 HA LEU A 427 11.810 -8.758 -3.020 1.00 0.00 H new ATOM 0 HB2 LEU A 427 13.298 -10.536 -2.942 1.00 0.00 H new ATOM 0 HB3 LEU A 427 12.096 -11.057 -4.106 1.00 0.00 H new ATOM 0 HG LEU A 427 14.811 -9.917 -4.869 1.00 0.00 H new ATOM 0 HD11 LEU A 427 15.430 -12.265 -5.375 1.00 0.00 H new ATOM 0 HD12 LEU A 427 15.059 -12.041 -3.649 1.00 0.00 H new ATOM 0 HD13 LEU A 427 13.865 -12.808 -4.724 1.00 0.00 H new ATOM 0 HD21 LEU A 427 14.322 -10.907 -7.076 1.00 0.00 H new ATOM 0 HD22 LEU A 427 12.722 -11.416 -6.485 1.00 0.00 H new ATOM 0 HD23 LEU A 427 13.112 -9.685 -6.617 1.00 0.00 H new ATOM 608 N ASP A 428 13.992 -7.488 -3.096 1.00 0.00 N ATOM 609 CA ASP A 428 15.119 -6.608 -3.150 1.00 0.00 C ATOM 610 C ASP A 428 16.239 -7.154 -2.305 1.00 0.00 C ATOM 611 O ASP A 428 16.045 -7.520 -1.143 1.00 0.00 O ATOM 612 CB ASP A 428 14.772 -5.190 -2.713 1.00 0.00 C ATOM 613 CG ASP A 428 15.965 -4.288 -2.772 1.00 0.00 C ATOM 614 OD1 ASP A 428 16.642 -4.244 -3.808 1.00 0.00 O ATOM 615 OD2 ASP A 428 16.286 -3.658 -1.765 1.00 0.00 O ATOM 0 H ASP A 428 13.680 -7.717 -2.152 1.00 0.00 H new ATOM 0 HA ASP A 428 15.438 -6.553 -4.191 1.00 0.00 H new ATOM 0 HB2 ASP A 428 13.984 -4.794 -3.353 1.00 0.00 H new ATOM 0 HB3 ASP A 428 14.378 -5.208 -1.697 1.00 0.00 H new ATOM 620 N LYS A 429 17.399 -7.190 -2.883 1.00 0.00 N ATOM 621 CA LYS A 429 18.604 -7.697 -2.237 1.00 0.00 C ATOM 622 C LYS A 429 19.141 -6.715 -1.197 1.00 0.00 C ATOM 623 O LYS A 429 19.963 -7.080 -0.348 1.00 0.00 O ATOM 624 CB LYS A 429 19.712 -8.041 -3.273 1.00 0.00 C ATOM 625 CG LYS A 429 19.918 -6.983 -4.357 1.00 0.00 C ATOM 626 CD LYS A 429 18.975 -7.216 -5.534 1.00 0.00 C ATOM 627 CE LYS A 429 18.526 -5.914 -6.154 1.00 0.00 C ATOM 628 NZ LYS A 429 17.700 -6.116 -7.366 1.00 0.00 N ATOM 0 H LYS A 429 17.555 -6.865 -3.837 1.00 0.00 H new ATOM 0 HA LYS A 429 18.320 -8.616 -1.725 1.00 0.00 H new ATOM 0 HB2 LYS A 429 20.653 -8.188 -2.744 1.00 0.00 H new ATOM 0 HB3 LYS A 429 19.463 -8.989 -3.751 1.00 0.00 H new ATOM 0 HG2 LYS A 429 19.746 -5.991 -3.939 1.00 0.00 H new ATOM 0 HG3 LYS A 429 20.951 -7.008 -4.703 1.00 0.00 H new ATOM 0 HD2 LYS A 429 19.476 -7.824 -6.287 1.00 0.00 H new ATOM 0 HD3 LYS A 429 18.104 -7.779 -5.197 1.00 0.00 H new ATOM 0 HE2 LYS A 429 17.955 -5.344 -5.421 1.00 0.00 H new ATOM 0 HE3 LYS A 429 19.401 -5.317 -6.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 17.418 -5.192 -7.752 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 18.251 -6.636 -8.079 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 16.850 -6.662 -7.120 1.00 0.00 H new ATOM 642 N GLY A 430 18.670 -5.485 -1.263 1.00 0.00 N ATOM 643 CA GLY A 430 19.118 -4.472 -0.356 1.00 0.00 C ATOM 644 C GLY A 430 18.260 -4.376 0.896 1.00 0.00 C ATOM 645 O GLY A 430 18.758 -4.553 2.004 1.00 0.00 O ATOM 0 H GLY A 430 17.975 -5.172 -1.941 1.00 0.00 H new ATOM 0 HA2 GLY A 430 20.149 -4.679 -0.069 1.00 0.00 H new ATOM 0 HA3 GLY A 430 19.117 -3.509 -0.866 1.00 0.00 H new ATOM 649 N ARG A 431 16.977 -4.124 0.728 1.00 0.00 N ATOM 650 CA ARG A 431 16.092 -3.905 1.877 1.00 0.00 C ATOM 651 C ARG A 431 15.359 -5.178 2.286 1.00 0.00 C ATOM 652 O ARG A 431 15.212 -5.469 3.481 1.00 0.00 O ATOM 653 CB ARG A 431 15.049 -2.849 1.547 1.00 0.00 C ATOM 654 CG ARG A 431 15.603 -1.588 0.932 1.00 0.00 C ATOM 655 CD ARG A 431 14.480 -0.658 0.573 1.00 0.00 C ATOM 656 NE ARG A 431 14.895 0.367 -0.380 1.00 0.00 N ATOM 657 CZ ARG A 431 14.136 0.779 -1.400 1.00 0.00 C ATOM 658 NH1 ARG A 431 12.925 0.277 -1.556 1.00 0.00 N ATOM 659 NH2 ARG A 431 14.591 1.672 -2.267 1.00 0.00 N ATOM 0 H ARG A 431 16.518 -4.064 -0.181 1.00 0.00 H new ATOM 0 HA ARG A 431 16.726 -3.579 2.701 1.00 0.00 H new ATOM 0 HB2 ARG A 431 14.318 -3.280 0.863 1.00 0.00 H new ATOM 0 HB3 ARG A 431 14.515 -2.587 2.460 1.00 0.00 H new ATOM 0 HG2 ARG A 431 16.282 -1.100 1.631 1.00 0.00 H new ATOM 0 HG3 ARG A 431 16.183 -1.832 0.042 1.00 0.00 H new ATOM 0 HD2 ARG A 431 13.656 -1.233 0.150 1.00 0.00 H new ATOM 0 HD3 ARG A 431 14.104 -0.180 1.477 1.00 0.00 H new ATOM 0 HE ARG A 431 15.815 0.792 -0.261 1.00 0.00 H new ATOM 0 HH11 ARG A 431 12.574 -0.421 -0.900 1.00 0.00 H new ATOM 0 HH12 ARG A 431 12.341 0.587 -2.332 1.00 0.00 H new ATOM 0 HH21 ARG A 431 15.531 2.053 -2.160 1.00 0.00 H new ATOM 0 HH22 ARG A 431 14.001 1.978 -3.041 1.00 0.00 H new ATOM 673 N GLY A 432 14.882 -5.910 1.308 1.00 0.00 N ATOM 674 CA GLY A 432 14.100 -7.089 1.575 1.00 0.00 C ATOM 675 C GLY A 432 12.888 -7.122 0.672 1.00 0.00 C ATOM 676 O GLY A 432 13.015 -6.844 -0.514 1.00 0.00 O ATOM 0 H GLY A 432 15.023 -5.708 0.318 1.00 0.00 H new ATOM 0 HA2 GLY A 432 14.706 -7.981 1.416 1.00 0.00 H new ATOM 0 HA3 GLY A 432 13.786 -7.098 2.619 1.00 0.00 H new ATOM 680 N PRO A 433 11.699 -7.450 1.183 1.00 0.00 N ATOM 681 CA PRO A 433 10.482 -7.451 0.373 1.00 0.00 C ATOM 682 C PRO A 433 9.998 -6.020 0.121 1.00 0.00 C ATOM 683 O PRO A 433 9.624 -5.311 1.067 1.00 0.00 O ATOM 684 CB PRO A 433 9.458 -8.201 1.257 1.00 0.00 C ATOM 685 CG PRO A 433 10.242 -8.754 2.406 1.00 0.00 C ATOM 686 CD PRO A 433 11.434 -7.861 2.563 1.00 0.00 C ATOM 0 HA PRO A 433 10.630 -7.909 -0.605 1.00 0.00 H new ATOM 0 HB2 PRO A 433 8.675 -7.528 1.606 1.00 0.00 H new ATOM 0 HB3 PRO A 433 8.968 -8.998 0.698 1.00 0.00 H new ATOM 0 HG2 PRO A 433 9.643 -8.768 3.316 1.00 0.00 H new ATOM 0 HG3 PRO A 433 10.548 -9.782 2.210 1.00 0.00 H new ATOM 0 HD2 PRO A 433 11.221 -7.008 3.208 1.00 0.00 H new ATOM 0 HD3 PRO A 433 12.282 -8.388 3.001 1.00 0.00 H new ATOM 694 N VAL A 434 9.996 -5.601 -1.131 1.00 0.00 N ATOM 695 CA VAL A 434 9.575 -4.259 -1.484 1.00 0.00 C ATOM 696 C VAL A 434 8.373 -4.295 -2.426 1.00 0.00 C ATOM 697 O VAL A 434 8.263 -5.174 -3.307 1.00 0.00 O ATOM 698 CB VAL A 434 10.725 -3.400 -2.122 1.00 0.00 C ATOM 699 CG1 VAL A 434 11.881 -3.216 -1.161 1.00 0.00 C ATOM 700 CG2 VAL A 434 11.225 -4.002 -3.422 1.00 0.00 C ATOM 0 H VAL A 434 10.283 -6.175 -1.924 1.00 0.00 H new ATOM 0 HA VAL A 434 9.292 -3.776 -0.549 1.00 0.00 H new ATOM 0 HB VAL A 434 10.296 -2.422 -2.341 1.00 0.00 H new ATOM 0 HG11 VAL A 434 12.658 -2.617 -1.637 1.00 0.00 H new ATOM 0 HG12 VAL A 434 11.530 -2.708 -0.263 1.00 0.00 H new ATOM 0 HG13 VAL A 434 12.288 -4.190 -0.891 1.00 0.00 H new ATOM 0 HG21 VAL A 434 12.020 -3.377 -3.830 1.00 0.00 H new ATOM 0 HG22 VAL A 434 11.611 -5.004 -3.234 1.00 0.00 H new ATOM 0 HG23 VAL A 434 10.404 -4.058 -4.137 1.00 0.00 H new ATOM 710 N ALA A 435 7.483 -3.369 -2.237 1.00 0.00 N ATOM 711 CA ALA A 435 6.303 -3.262 -3.055 1.00 0.00 C ATOM 712 C ALA A 435 6.012 -1.813 -3.347 1.00 0.00 C ATOM 713 O ALA A 435 5.710 -1.042 -2.429 1.00 0.00 O ATOM 714 CB ALA A 435 5.109 -3.898 -2.360 1.00 0.00 C ATOM 0 H ALA A 435 7.551 -2.659 -1.507 1.00 0.00 H new ATOM 0 HA ALA A 435 6.482 -3.791 -3.991 1.00 0.00 H new ATOM 0 HB1 ALA A 435 4.227 -3.807 -2.995 1.00 0.00 H new ATOM 0 HB2 ALA A 435 5.315 -4.952 -2.175 1.00 0.00 H new ATOM 0 HB3 ALA A 435 4.928 -3.392 -1.412 1.00 0.00 H new ATOM 720 N THR A 436 6.134 -1.435 -4.589 1.00 0.00 N ATOM 721 CA THR A 436 5.822 -0.110 -5.003 1.00 0.00 C ATOM 722 C THR A 436 4.333 -0.093 -5.279 1.00 0.00 C ATOM 723 O THR A 436 3.834 -0.860 -6.109 1.00 0.00 O ATOM 724 CB THR A 436 6.569 0.243 -6.294 1.00 0.00 C ATOM 725 OG1 THR A 436 7.805 -0.503 -6.352 1.00 0.00 O ATOM 726 CG2 THR A 436 6.891 1.734 -6.308 1.00 0.00 C ATOM 0 H THR A 436 6.455 -2.046 -5.340 1.00 0.00 H new ATOM 0 HA THR A 436 6.111 0.610 -4.237 1.00 0.00 H new ATOM 0 HB THR A 436 5.943 -0.006 -7.151 1.00 0.00 H new ATOM 0 HG1 THR A 436 8.517 0.009 -5.915 1.00 0.00 H new ATOM 0 HG21 THR A 436 7.422 1.983 -7.227 1.00 0.00 H new ATOM 0 HG22 THR A 436 5.965 2.307 -6.258 1.00 0.00 H new ATOM 0 HG23 THR A 436 7.516 1.979 -5.450 1.00 0.00 H new ATOM 734 N LEU A 437 3.630 0.725 -4.603 1.00 0.00 N ATOM 735 CA LEU A 437 2.216 0.734 -4.695 1.00 0.00 C ATOM 736 C LEU A 437 1.668 2.145 -4.795 1.00 0.00 C ATOM 737 O LEU A 437 2.416 3.123 -4.678 1.00 0.00 O ATOM 738 CB LEU A 437 1.634 -0.050 -3.498 1.00 0.00 C ATOM 739 CG LEU A 437 2.143 0.323 -2.081 1.00 0.00 C ATOM 740 CD1 LEU A 437 1.738 1.716 -1.681 1.00 0.00 C ATOM 741 CD2 LEU A 437 1.651 -0.669 -1.052 1.00 0.00 C ATOM 0 H LEU A 437 4.017 1.417 -3.962 1.00 0.00 H new ATOM 0 HA LEU A 437 1.907 0.239 -5.616 1.00 0.00 H new ATOM 0 HB2 LEU A 437 0.551 0.074 -3.510 1.00 0.00 H new ATOM 0 HB3 LEU A 437 1.836 -1.109 -3.660 1.00 0.00 H new ATOM 0 HG LEU A 437 3.232 0.289 -2.120 1.00 0.00 H new ATOM 0 HD11 LEU A 437 2.117 1.932 -0.682 1.00 0.00 H new ATOM 0 HD12 LEU A 437 2.153 2.433 -2.389 1.00 0.00 H new ATOM 0 HD13 LEU A 437 0.651 1.793 -1.681 1.00 0.00 H new ATOM 0 HD21 LEU A 437 2.021 -0.385 -0.067 1.00 0.00 H new ATOM 0 HD22 LEU A 437 0.561 -0.673 -1.042 1.00 0.00 H new ATOM 0 HD23 LEU A 437 2.015 -1.665 -1.304 1.00 0.00 H new ATOM 753 N LEU A 438 0.386 2.242 -5.017 1.00 0.00 N ATOM 754 CA LEU A 438 -0.286 3.511 -5.070 1.00 0.00 C ATOM 755 C LEU A 438 -1.381 3.485 -3.985 1.00 0.00 C ATOM 756 O LEU A 438 -2.389 2.777 -4.121 1.00 0.00 O ATOM 757 CB LEU A 438 -0.871 3.709 -6.497 1.00 0.00 C ATOM 758 CG LEU A 438 -1.297 5.132 -6.954 1.00 0.00 C ATOM 759 CD1 LEU A 438 -2.428 5.704 -6.129 1.00 0.00 C ATOM 760 CD2 LEU A 438 -0.107 6.083 -6.981 1.00 0.00 C ATOM 0 H LEU A 438 -0.225 1.439 -5.167 1.00 0.00 H new ATOM 0 HA LEU A 438 0.385 4.348 -4.878 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -0.130 3.345 -7.208 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -1.743 3.062 -6.586 1.00 0.00 H new ATOM 0 HG LEU A 438 -1.677 5.025 -7.970 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -2.680 6.699 -6.497 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -3.301 5.056 -6.209 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -2.120 5.770 -5.086 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -0.437 7.070 -7.305 1.00 0.00 H new ATOM 0 HD22 LEU A 438 0.325 6.154 -5.983 1.00 0.00 H new ATOM 0 HD23 LEU A 438 0.644 5.706 -7.675 1.00 0.00 H new ATOM 772 N VAL A 439 -1.154 4.207 -2.896 1.00 0.00 N ATOM 773 CA VAL A 439 -2.080 4.204 -1.760 1.00 0.00 C ATOM 774 C VAL A 439 -3.353 4.996 -2.031 1.00 0.00 C ATOM 775 O VAL A 439 -3.317 6.177 -2.389 1.00 0.00 O ATOM 776 CB VAL A 439 -1.405 4.646 -0.417 1.00 0.00 C ATOM 777 CG1 VAL A 439 -0.748 6.011 -0.531 1.00 0.00 C ATOM 778 CG2 VAL A 439 -2.405 4.623 0.740 1.00 0.00 C ATOM 0 H VAL A 439 -0.337 4.805 -2.770 1.00 0.00 H new ATOM 0 HA VAL A 439 -2.374 3.162 -1.636 1.00 0.00 H new ATOM 0 HB VAL A 439 -0.619 3.921 -0.205 1.00 0.00 H new ATOM 0 HG11 VAL A 439 -0.293 6.277 0.423 1.00 0.00 H new ATOM 0 HG12 VAL A 439 0.020 5.982 -1.304 1.00 0.00 H new ATOM 0 HG13 VAL A 439 -1.499 6.756 -0.795 1.00 0.00 H new ATOM 0 HG21 VAL A 439 -1.907 4.935 1.658 1.00 0.00 H new ATOM 0 HG22 VAL A 439 -3.227 5.305 0.524 1.00 0.00 H new ATOM 0 HG23 VAL A 439 -2.795 3.613 0.864 1.00 0.00 H new ATOM 788 N GLN A 440 -4.475 4.308 -1.916 1.00 0.00 N ATOM 789 CA GLN A 440 -5.781 4.917 -2.094 1.00 0.00 C ATOM 790 C GLN A 440 -6.675 4.683 -0.901 1.00 0.00 C ATOM 791 O GLN A 440 -7.662 5.378 -0.711 1.00 0.00 O ATOM 792 CB GLN A 440 -6.445 4.480 -3.402 1.00 0.00 C ATOM 793 CG GLN A 440 -5.841 5.147 -4.631 1.00 0.00 C ATOM 794 CD GLN A 440 -6.053 6.664 -4.642 1.00 0.00 C ATOM 795 OE1 GLN A 440 -5.226 7.422 -5.151 1.00 0.00 O ATOM 796 NE2 GLN A 440 -7.165 7.114 -4.112 1.00 0.00 N ATOM 0 H GLN A 440 -4.506 3.312 -1.697 1.00 0.00 H new ATOM 0 HA GLN A 440 -5.622 5.993 -2.167 1.00 0.00 H new ATOM 0 HB2 GLN A 440 -6.357 3.398 -3.503 1.00 0.00 H new ATOM 0 HB3 GLN A 440 -7.509 4.711 -3.357 1.00 0.00 H new ATOM 0 HG2 GLN A 440 -4.773 4.933 -4.668 1.00 0.00 H new ATOM 0 HG3 GLN A 440 -6.284 4.715 -5.529 1.00 0.00 H new ATOM 0 HE21 GLN A 440 -7.832 6.463 -3.697 1.00 0.00 H new ATOM 0 HE22 GLN A 440 -7.363 8.115 -4.115 1.00 0.00 H new ATOM 805 N ALA A 441 -6.282 3.721 -0.066 1.00 0.00 N ATOM 806 CA ALA A 441 -7.072 3.296 1.075 1.00 0.00 C ATOM 807 C ALA A 441 -7.057 4.320 2.207 1.00 0.00 C ATOM 808 O ALA A 441 -7.799 4.190 3.171 1.00 0.00 O ATOM 809 CB ALA A 441 -6.560 1.957 1.563 1.00 0.00 C ATOM 0 H ALA A 441 -5.402 3.216 -0.168 1.00 0.00 H new ATOM 0 HA ALA A 441 -8.109 3.204 0.752 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -7.150 1.632 2.420 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -6.646 1.221 0.764 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -5.515 2.052 1.857 1.00 0.00 H new ATOM 815 N GLY A 442 -6.213 5.317 2.097 1.00 0.00 N ATOM 816 CA GLY A 442 -6.173 6.331 3.105 1.00 0.00 C ATOM 817 C GLY A 442 -4.862 7.039 3.129 1.00 0.00 C ATOM 818 O GLY A 442 -4.616 7.935 2.346 1.00 0.00 O ATOM 0 H GLY A 442 -5.555 5.442 1.328 1.00 0.00 H new ATOM 0 HA2 GLY A 442 -6.971 7.051 2.927 1.00 0.00 H new ATOM 0 HA3 GLY A 442 -6.361 5.881 4.080 1.00 0.00 H new ATOM 822 N THR A 443 -4.015 6.622 3.997 1.00 0.00 N ATOM 823 CA THR A 443 -2.724 7.221 4.183 1.00 0.00 C ATOM 824 C THR A 443 -1.771 6.106 4.521 1.00 0.00 C ATOM 825 O THR A 443 -2.148 5.187 5.231 1.00 0.00 O ATOM 826 CB THR A 443 -2.791 8.233 5.351 1.00 0.00 C ATOM 827 OG1 THR A 443 -3.854 9.166 5.089 1.00 0.00 O ATOM 828 CG2 THR A 443 -1.481 8.999 5.517 1.00 0.00 C ATOM 0 H THR A 443 -4.195 5.834 4.619 1.00 0.00 H new ATOM 0 HA THR A 443 -2.398 7.751 3.288 1.00 0.00 H new ATOM 0 HB THR A 443 -2.972 7.681 6.273 1.00 0.00 H new ATOM 0 HG1 THR A 443 -3.909 9.813 5.823 1.00 0.00 H new ATOM 0 HG21 THR A 443 -1.571 9.699 6.348 1.00 0.00 H new ATOM 0 HG22 THR A 443 -0.672 8.297 5.720 1.00 0.00 H new ATOM 0 HG23 THR A 443 -1.263 9.549 4.602 1.00 0.00 H new ATOM 836 N LEU A 444 -0.585 6.140 3.994 1.00 0.00 N ATOM 837 CA LEU A 444 0.341 5.094 4.268 1.00 0.00 C ATOM 838 C LEU A 444 1.443 5.672 5.122 1.00 0.00 C ATOM 839 O LEU A 444 2.160 6.584 4.705 1.00 0.00 O ATOM 840 CB LEU A 444 0.882 4.488 2.962 1.00 0.00 C ATOM 841 CG LEU A 444 0.966 2.943 2.893 1.00 0.00 C ATOM 842 CD1 LEU A 444 1.414 2.520 1.543 1.00 0.00 C ATOM 843 CD2 LEU A 444 1.905 2.367 3.926 1.00 0.00 C ATOM 0 H LEU A 444 -0.241 6.876 3.377 1.00 0.00 H new ATOM 0 HA LEU A 444 -0.145 4.279 4.804 1.00 0.00 H new ATOM 0 HB2 LEU A 444 0.252 4.831 2.141 1.00 0.00 H new ATOM 0 HB3 LEU A 444 1.880 4.891 2.788 1.00 0.00 H new ATOM 0 HG LEU A 444 -0.034 2.562 3.101 1.00 0.00 H new ATOM 0 HD11 LEU A 444 1.471 1.432 1.503 1.00 0.00 H new ATOM 0 HD12 LEU A 444 0.703 2.874 0.796 1.00 0.00 H new ATOM 0 HD13 LEU A 444 2.398 2.942 1.337 1.00 0.00 H new ATOM 0 HD21 LEU A 444 1.926 1.281 3.833 1.00 0.00 H new ATOM 0 HD22 LEU A 444 2.908 2.764 3.768 1.00 0.00 H new ATOM 0 HD23 LEU A 444 1.560 2.639 4.923 1.00 0.00 H new ATOM 855 N LYS A 445 1.540 5.189 6.317 1.00 0.00 N ATOM 856 CA LYS A 445 2.517 5.656 7.253 1.00 0.00 C ATOM 857 C LYS A 445 3.209 4.448 7.863 1.00 0.00 C ATOM 858 O LYS A 445 2.634 3.357 7.904 1.00 0.00 O ATOM 859 CB LYS A 445 1.831 6.458 8.353 1.00 0.00 C ATOM 860 CG LYS A 445 2.780 7.004 9.408 1.00 0.00 C ATOM 861 CD LYS A 445 2.107 7.156 10.754 1.00 0.00 C ATOM 862 CE LYS A 445 1.523 5.824 11.212 1.00 0.00 C ATOM 863 NZ LYS A 445 0.063 5.744 10.957 1.00 0.00 N ATOM 0 H LYS A 445 0.937 4.450 6.678 1.00 0.00 H new ATOM 0 HA LYS A 445 3.244 6.294 6.750 1.00 0.00 H new ATOM 0 HB2 LYS A 445 1.292 7.290 7.899 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.089 5.825 8.840 1.00 0.00 H new ATOM 0 HG2 LYS A 445 3.637 6.337 9.505 1.00 0.00 H new ATOM 0 HG3 LYS A 445 3.164 7.971 9.084 1.00 0.00 H new ATOM 0 HD2 LYS A 445 2.827 7.516 11.489 1.00 0.00 H new ATOM 0 HD3 LYS A 445 1.316 7.904 10.690 1.00 0.00 H new ATOM 0 HE2 LYS A 445 2.027 5.009 10.693 1.00 0.00 H new ATOM 0 HE3 LYS A 445 1.714 5.691 12.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 -0.212 4.750 10.821 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 -0.453 6.138 11.769 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -0.170 6.288 10.102 1.00 0.00 H new ATOM 877 N VAL A 446 4.423 4.632 8.314 1.00 0.00 N ATOM 878 CA VAL A 446 5.170 3.563 8.912 1.00 0.00 C ATOM 879 C VAL A 446 4.625 3.153 10.277 1.00 0.00 C ATOM 880 O VAL A 446 4.087 3.973 11.040 1.00 0.00 O ATOM 881 CB VAL A 446 6.692 3.855 8.988 1.00 0.00 C ATOM 882 CG1 VAL A 446 7.274 4.062 7.600 1.00 0.00 C ATOM 883 CG2 VAL A 446 6.985 5.061 9.875 1.00 0.00 C ATOM 0 H VAL A 446 4.917 5.524 8.276 1.00 0.00 H new ATOM 0 HA VAL A 446 5.038 2.715 8.240 1.00 0.00 H new ATOM 0 HB VAL A 446 7.170 2.985 9.437 1.00 0.00 H new ATOM 0 HG11 VAL A 446 8.342 4.265 7.680 1.00 0.00 H new ATOM 0 HG12 VAL A 446 7.119 3.163 7.003 1.00 0.00 H new ATOM 0 HG13 VAL A 446 6.779 4.906 7.120 1.00 0.00 H new ATOM 0 HG21 VAL A 446 8.060 5.237 9.906 1.00 0.00 H new ATOM 0 HG22 VAL A 446 6.485 5.941 9.470 1.00 0.00 H new ATOM 0 HG23 VAL A 446 6.620 4.868 10.884 1.00 0.00 H new ATOM 893 N GLY A 447 4.734 1.879 10.556 1.00 0.00 N ATOM 894 CA GLY A 447 4.311 1.351 11.815 1.00 0.00 C ATOM 895 C GLY A 447 2.930 0.750 11.783 1.00 0.00 C ATOM 896 O GLY A 447 2.532 0.082 12.724 1.00 0.00 O ATOM 0 H GLY A 447 5.118 1.185 9.915 1.00 0.00 H new ATOM 0 HA2 GLY A 447 5.022 0.590 12.138 1.00 0.00 H new ATOM 0 HA3 GLY A 447 4.335 2.146 12.560 1.00 0.00 H new ATOM 900 N ASP A 448 2.205 0.960 10.715 1.00 0.00 N ATOM 901 CA ASP A 448 0.854 0.425 10.626 1.00 0.00 C ATOM 902 C ASP A 448 0.786 -0.883 9.883 1.00 0.00 C ATOM 903 O ASP A 448 1.666 -1.175 9.059 1.00 0.00 O ATOM 904 CB ASP A 448 -0.151 1.435 10.082 1.00 0.00 C ATOM 905 CG ASP A 448 -0.839 2.152 11.204 1.00 0.00 C ATOM 906 OD1 ASP A 448 -1.685 1.538 11.873 1.00 0.00 O ATOM 907 OD2 ASP A 448 -0.519 3.308 11.470 1.00 0.00 O ATOM 0 H ASP A 448 2.514 1.489 9.900 1.00 0.00 H new ATOM 0 HA ASP A 448 0.562 0.215 11.655 1.00 0.00 H new ATOM 0 HB2 ASP A 448 0.359 2.155 9.442 1.00 0.00 H new ATOM 0 HB3 ASP A 448 -0.889 0.925 9.463 1.00 0.00 H new ATOM 912 N PRO A 449 -0.226 -1.726 10.185 1.00 0.00 N ATOM 913 CA PRO A 449 -0.394 -2.988 9.531 1.00 0.00 C ATOM 914 C PRO A 449 -1.143 -2.865 8.210 1.00 0.00 C ATOM 915 O PRO A 449 -2.179 -2.203 8.105 1.00 0.00 O ATOM 916 CB PRO A 449 -1.189 -3.823 10.527 1.00 0.00 C ATOM 917 CG PRO A 449 -1.788 -2.871 11.512 1.00 0.00 C ATOM 918 CD PRO A 449 -1.287 -1.498 11.181 1.00 0.00 C ATOM 0 HA PRO A 449 0.567 -3.432 9.270 1.00 0.00 H new ATOM 0 HB2 PRO A 449 -1.967 -4.393 10.019 1.00 0.00 H new ATOM 0 HB3 PRO A 449 -0.543 -4.543 11.030 1.00 0.00 H new ATOM 0 HG2 PRO A 449 -2.876 -2.903 11.462 1.00 0.00 H new ATOM 0 HG3 PRO A 449 -1.507 -3.146 12.529 1.00 0.00 H new ATOM 0 HD2 PRO A 449 -2.082 -0.871 10.778 1.00 0.00 H new ATOM 0 HD3 PRO A 449 -0.900 -0.992 12.066 1.00 0.00 H new ATOM 926 N ILE A 450 -0.626 -3.522 7.228 1.00 0.00 N ATOM 927 CA ILE A 450 -1.167 -3.495 5.902 1.00 0.00 C ATOM 928 C ILE A 450 -1.396 -4.901 5.411 1.00 0.00 C ATOM 929 O ILE A 450 -0.716 -5.829 5.854 1.00 0.00 O ATOM 930 CB ILE A 450 -0.229 -2.700 4.927 1.00 0.00 C ATOM 931 CG1 ILE A 450 1.265 -3.121 5.067 1.00 0.00 C ATOM 932 CG2 ILE A 450 -0.384 -1.200 5.124 1.00 0.00 C ATOM 933 CD1 ILE A 450 1.665 -4.396 4.345 1.00 0.00 C ATOM 0 H ILE A 450 0.204 -4.108 7.322 1.00 0.00 H new ATOM 0 HA ILE A 450 -2.126 -2.977 5.927 1.00 0.00 H new ATOM 0 HB ILE A 450 -0.541 -2.953 3.914 1.00 0.00 H new ATOM 0 HG12 ILE A 450 1.888 -2.306 4.698 1.00 0.00 H new ATOM 0 HG13 ILE A 450 1.491 -3.240 6.127 1.00 0.00 H new ATOM 0 HG21 ILE A 450 0.277 -0.672 4.436 1.00 0.00 H new ATOM 0 HG22 ILE A 450 -1.417 -0.912 4.927 1.00 0.00 H new ATOM 0 HG23 ILE A 450 -0.123 -0.939 6.150 1.00 0.00 H new ATOM 0 HD11 ILE A 450 2.724 -4.591 4.512 1.00 0.00 H new ATOM 0 HD12 ILE A 450 1.077 -5.231 4.728 1.00 0.00 H new ATOM 0 HD13 ILE A 450 1.481 -4.282 3.277 1.00 0.00 H new ATOM 945 N VAL A 451 -2.356 -5.075 4.555 1.00 0.00 N ATOM 946 CA VAL A 451 -2.606 -6.364 3.968 1.00 0.00 C ATOM 947 C VAL A 451 -2.491 -6.261 2.458 1.00 0.00 C ATOM 948 O VAL A 451 -3.141 -5.424 1.833 1.00 0.00 O ATOM 949 CB VAL A 451 -3.981 -6.991 4.412 1.00 0.00 C ATOM 950 CG1 VAL A 451 -5.167 -6.113 4.042 1.00 0.00 C ATOM 951 CG2 VAL A 451 -4.154 -8.401 3.844 1.00 0.00 C ATOM 0 H VAL A 451 -2.986 -4.336 4.243 1.00 0.00 H new ATOM 0 HA VAL A 451 -1.847 -7.053 4.339 1.00 0.00 H new ATOM 0 HB VAL A 451 -3.957 -7.056 5.500 1.00 0.00 H new ATOM 0 HG11 VAL A 451 -6.090 -6.591 4.370 1.00 0.00 H new ATOM 0 HG12 VAL A 451 -5.068 -5.143 4.529 1.00 0.00 H new ATOM 0 HG13 VAL A 451 -5.194 -5.975 2.961 1.00 0.00 H new ATOM 0 HG21 VAL A 451 -5.112 -8.808 4.167 1.00 0.00 H new ATOM 0 HG22 VAL A 451 -4.126 -8.361 2.755 1.00 0.00 H new ATOM 0 HG23 VAL A 451 -3.348 -9.040 4.205 1.00 0.00 H new ATOM 961 N VAL A 452 -1.618 -7.048 1.896 1.00 0.00 N ATOM 962 CA VAL A 452 -1.401 -7.067 0.478 1.00 0.00 C ATOM 963 C VAL A 452 -1.854 -8.407 -0.047 1.00 0.00 C ATOM 964 O VAL A 452 -1.226 -9.446 0.229 1.00 0.00 O ATOM 965 CB VAL A 452 0.089 -6.835 0.098 1.00 0.00 C ATOM 966 CG1 VAL A 452 0.258 -6.783 -1.417 1.00 0.00 C ATOM 967 CG2 VAL A 452 0.627 -5.560 0.737 1.00 0.00 C ATOM 0 H VAL A 452 -1.031 -7.701 2.415 1.00 0.00 H new ATOM 0 HA VAL A 452 -1.971 -6.251 0.033 1.00 0.00 H new ATOM 0 HB VAL A 452 0.666 -7.676 0.482 1.00 0.00 H new ATOM 0 HG11 VAL A 452 1.308 -6.620 -1.661 1.00 0.00 H new ATOM 0 HG12 VAL A 452 -0.073 -7.726 -1.853 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -0.340 -5.966 -1.822 1.00 0.00 H new ATOM 0 HG21 VAL A 452 1.671 -5.424 0.454 1.00 0.00 H new ATOM 0 HG22 VAL A 452 0.043 -4.706 0.393 1.00 0.00 H new ATOM 0 HG23 VAL A 452 0.552 -5.637 1.822 1.00 0.00 H new ATOM 977 N GLY A 453 -2.951 -8.385 -0.755 1.00 0.00 N ATOM 978 CA GLY A 453 -3.542 -9.565 -1.295 1.00 0.00 C ATOM 979 C GLY A 453 -4.091 -10.466 -0.226 1.00 0.00 C ATOM 980 O GLY A 453 -5.235 -10.328 0.200 1.00 0.00 O ATOM 0 H GLY A 453 -3.462 -7.530 -0.972 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -4.343 -9.287 -1.980 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -2.798 -10.108 -1.878 1.00 0.00 H new ATOM 984 N THR A 454 -3.265 -11.355 0.218 1.00 0.00 N ATOM 985 CA THR A 454 -3.617 -12.309 1.216 1.00 0.00 C ATOM 986 C THR A 454 -2.748 -12.136 2.469 1.00 0.00 C ATOM 987 O THR A 454 -3.142 -12.536 3.566 1.00 0.00 O ATOM 988 CB THR A 454 -3.487 -13.769 0.648 1.00 0.00 C ATOM 989 OG1 THR A 454 -3.693 -14.761 1.673 1.00 0.00 O ATOM 990 CG2 THR A 454 -2.127 -13.998 -0.011 1.00 0.00 C ATOM 0 H THR A 454 -2.303 -11.440 -0.111 1.00 0.00 H new ATOM 0 HA THR A 454 -4.655 -12.139 1.500 1.00 0.00 H new ATOM 0 HB THR A 454 -4.267 -13.875 -0.106 1.00 0.00 H new ATOM 0 HG1 THR A 454 -3.606 -15.656 1.284 1.00 0.00 H new ATOM 0 HG21 THR A 454 -2.074 -15.018 -0.392 1.00 0.00 H new ATOM 0 HG22 THR A 454 -1.999 -13.296 -0.835 1.00 0.00 H new ATOM 0 HG23 THR A 454 -1.336 -13.843 0.723 1.00 0.00 H new ATOM 998 N THR A 455 -1.620 -11.490 2.333 1.00 0.00 N ATOM 999 CA THR A 455 -0.669 -11.447 3.414 1.00 0.00 C ATOM 1000 C THR A 455 -0.660 -10.089 4.088 1.00 0.00 C ATOM 1001 O THR A 455 -0.722 -9.062 3.429 1.00 0.00 O ATOM 1002 CB THR A 455 0.733 -11.794 2.892 1.00 0.00 C ATOM 1003 OG1 THR A 455 0.666 -13.044 2.174 1.00 0.00 O ATOM 1004 CG2 THR A 455 1.726 -11.924 4.041 1.00 0.00 C ATOM 0 H THR A 455 -1.338 -10.989 1.490 1.00 0.00 H new ATOM 0 HA THR A 455 -0.967 -12.185 4.159 1.00 0.00 H new ATOM 0 HB THR A 455 1.073 -10.994 2.234 1.00 0.00 H new ATOM 0 HG1 THR A 455 1.556 -13.274 1.835 1.00 0.00 H new ATOM 0 HG21 THR A 455 2.711 -12.170 3.644 1.00 0.00 H new ATOM 0 HG22 THR A 455 1.779 -10.981 4.585 1.00 0.00 H new ATOM 0 HG23 THR A 455 1.399 -12.714 4.717 1.00 0.00 H new ATOM 1012 N TYR A 456 -0.598 -10.087 5.389 1.00 0.00 N ATOM 1013 CA TYR A 456 -0.548 -8.865 6.123 1.00 0.00 C ATOM 1014 C TYR A 456 0.776 -8.725 6.849 1.00 0.00 C ATOM 1015 O TYR A 456 1.395 -9.721 7.247 1.00 0.00 O ATOM 1016 CB TYR A 456 -1.751 -8.704 7.074 1.00 0.00 C ATOM 1017 CG TYR A 456 -1.922 -9.808 8.103 1.00 0.00 C ATOM 1018 CD1 TYR A 456 -1.317 -9.719 9.342 1.00 0.00 C ATOM 1019 CD2 TYR A 456 -2.704 -10.923 7.838 1.00 0.00 C ATOM 1020 CE1 TYR A 456 -1.477 -10.700 10.290 1.00 0.00 C ATOM 1021 CE2 TYR A 456 -2.866 -11.915 8.783 1.00 0.00 C ATOM 1022 CZ TYR A 456 -2.250 -11.792 10.007 1.00 0.00 C ATOM 1023 OH TYR A 456 -2.409 -12.773 10.958 1.00 0.00 O ATOM 0 H TYR A 456 -0.581 -10.930 5.964 1.00 0.00 H new ATOM 0 HA TYR A 456 -0.620 -8.049 5.404 1.00 0.00 H new ATOM 0 HB2 TYR A 456 -1.653 -7.754 7.599 1.00 0.00 H new ATOM 0 HB3 TYR A 456 -2.660 -8.645 6.475 1.00 0.00 H new ATOM 0 HD1 TYR A 456 -0.705 -8.859 9.570 1.00 0.00 H new ATOM 0 HD2 TYR A 456 -3.192 -11.016 6.879 1.00 0.00 H new ATOM 0 HE1 TYR A 456 -0.996 -10.610 11.252 1.00 0.00 H new ATOM 0 HE2 TYR A 456 -3.472 -12.782 8.564 1.00 0.00 H new ATOM 0 HH TYR A 456 -2.987 -13.481 10.604 1.00 0.00 H new ATOM 1033 N GLY A 457 1.203 -7.517 6.995 1.00 0.00 N ATOM 1034 CA GLY A 457 2.435 -7.212 7.653 1.00 0.00 C ATOM 1035 C GLY A 457 2.377 -5.818 8.180 1.00 0.00 C ATOM 1036 O GLY A 457 1.294 -5.231 8.238 1.00 0.00 O ATOM 0 H GLY A 457 0.700 -6.697 6.656 1.00 0.00 H new ATOM 0 HA2 GLY A 457 2.610 -7.915 8.468 1.00 0.00 H new ATOM 0 HA3 GLY A 457 3.268 -7.316 6.958 1.00 0.00 H new ATOM 1040 N ARG A 458 3.491 -5.272 8.536 1.00 0.00 N ATOM 1041 CA ARG A 458 3.528 -3.930 9.056 1.00 0.00 C ATOM 1042 C ARG A 458 4.523 -3.113 8.266 1.00 0.00 C ATOM 1043 O ARG A 458 5.560 -3.631 7.849 1.00 0.00 O ATOM 1044 CB ARG A 458 3.850 -3.950 10.555 1.00 0.00 C ATOM 1045 CG ARG A 458 3.946 -2.583 11.208 1.00 0.00 C ATOM 1046 CD ARG A 458 4.170 -2.701 12.702 1.00 0.00 C ATOM 1047 NE ARG A 458 5.389 -3.444 13.022 1.00 0.00 N ATOM 1048 CZ ARG A 458 5.585 -4.140 14.148 1.00 0.00 C ATOM 1049 NH1 ARG A 458 4.650 -4.154 15.094 1.00 0.00 N ATOM 1050 NH2 ARG A 458 6.725 -4.808 14.332 1.00 0.00 N ATOM 0 H ARG A 458 4.400 -5.732 8.479 1.00 0.00 H new ATOM 0 HA ARG A 458 2.550 -3.461 8.948 1.00 0.00 H new ATOM 0 HB2 ARG A 458 3.082 -4.528 11.069 1.00 0.00 H new ATOM 0 HB3 ARG A 458 4.795 -4.473 10.702 1.00 0.00 H new ATOM 0 HG2 ARG A 458 4.764 -2.020 10.759 1.00 0.00 H new ATOM 0 HG3 ARG A 458 3.031 -2.022 11.019 1.00 0.00 H new ATOM 0 HD2 ARG A 458 4.229 -1.704 13.138 1.00 0.00 H new ATOM 0 HD3 ARG A 458 3.314 -3.198 13.158 1.00 0.00 H new ATOM 0 HE ARG A 458 6.145 -3.431 12.337 1.00 0.00 H new ATOM 0 HH11 ARG A 458 3.783 -3.634 14.961 1.00 0.00 H new ATOM 0 HH12 ARG A 458 4.800 -4.685 15.952 1.00 0.00 H new ATOM 0 HH21 ARG A 458 7.449 -4.789 13.614 1.00 0.00 H new ATOM 0 HH22 ARG A 458 6.873 -5.338 15.191 1.00 0.00 H new ATOM 1064 N VAL A 459 4.201 -1.859 8.047 1.00 0.00 N ATOM 1065 CA VAL A 459 5.032 -0.982 7.257 1.00 0.00 C ATOM 1066 C VAL A 459 6.264 -0.613 8.042 1.00 0.00 C ATOM 1067 O VAL A 459 6.175 0.071 9.063 1.00 0.00 O ATOM 1068 CB VAL A 459 4.288 0.308 6.867 1.00 0.00 C ATOM 1069 CG1 VAL A 459 5.130 1.144 5.917 1.00 0.00 C ATOM 1070 CG2 VAL A 459 2.950 -0.017 6.248 1.00 0.00 C ATOM 0 H VAL A 459 3.356 -1.419 8.411 1.00 0.00 H new ATOM 0 HA VAL A 459 5.302 -1.514 6.345 1.00 0.00 H new ATOM 0 HB VAL A 459 4.113 0.890 7.772 1.00 0.00 H new ATOM 0 HG11 VAL A 459 4.587 2.052 5.653 1.00 0.00 H new ATOM 0 HG12 VAL A 459 6.069 1.411 6.402 1.00 0.00 H new ATOM 0 HG13 VAL A 459 5.338 0.570 5.014 1.00 0.00 H new ATOM 0 HG21 VAL A 459 2.439 0.908 5.979 1.00 0.00 H new ATOM 0 HG22 VAL A 459 3.100 -0.622 5.354 1.00 0.00 H new ATOM 0 HG23 VAL A 459 2.343 -0.572 6.964 1.00 0.00 H new ATOM 1080 N ARG A 460 7.394 -1.067 7.588 1.00 0.00 N ATOM 1081 CA ARG A 460 8.619 -0.798 8.273 1.00 0.00 C ATOM 1082 C ARG A 460 9.222 0.522 7.768 1.00 0.00 C ATOM 1083 O ARG A 460 9.424 1.466 8.547 1.00 0.00 O ATOM 1084 CB ARG A 460 9.587 -2.014 8.141 1.00 0.00 C ATOM 1085 CG ARG A 460 10.866 -1.916 8.974 1.00 0.00 C ATOM 1086 CD ARG A 460 11.896 -1.012 8.338 1.00 0.00 C ATOM 1087 NE ARG A 460 12.886 -0.550 9.293 1.00 0.00 N ATOM 1088 CZ ARG A 460 14.093 -0.105 8.974 1.00 0.00 C ATOM 1089 NH1 ARG A 460 14.598 -0.351 7.763 1.00 0.00 N ATOM 1090 NH2 ARG A 460 14.823 0.534 9.892 1.00 0.00 N ATOM 0 H ARG A 460 7.491 -1.628 6.742 1.00 0.00 H new ATOM 0 HA ARG A 460 8.433 -0.668 9.339 1.00 0.00 H new ATOM 0 HB2 ARG A 460 9.052 -2.918 8.430 1.00 0.00 H new ATOM 0 HB3 ARG A 460 9.862 -2.128 7.092 1.00 0.00 H new ATOM 0 HG2 ARG A 460 10.622 -1.542 9.968 1.00 0.00 H new ATOM 0 HG3 ARG A 460 11.290 -2.912 9.103 1.00 0.00 H new ATOM 0 HD2 ARG A 460 12.395 -1.546 7.529 1.00 0.00 H new ATOM 0 HD3 ARG A 460 11.396 -0.153 7.891 1.00 0.00 H new ATOM 0 HE ARG A 460 12.635 -0.569 10.281 1.00 0.00 H new ATOM 0 HH11 ARG A 460 14.055 -0.882 7.082 1.00 0.00 H new ATOM 0 HH12 ARG A 460 15.527 -0.008 7.519 1.00 0.00 H new ATOM 0 HH21 ARG A 460 14.451 0.677 10.831 1.00 0.00 H new ATOM 0 HH22 ARG A 460 15.753 0.879 9.654 1.00 0.00 H new ATOM 1104 N ALA A 461 9.499 0.589 6.489 1.00 0.00 N ATOM 1105 CA ALA A 461 10.071 1.767 5.891 1.00 0.00 C ATOM 1106 C ALA A 461 9.235 2.177 4.736 1.00 0.00 C ATOM 1107 O ALA A 461 8.617 1.332 4.069 1.00 0.00 O ATOM 1108 CB ALA A 461 11.512 1.517 5.453 1.00 0.00 C ATOM 0 H ALA A 461 9.333 -0.174 5.833 1.00 0.00 H new ATOM 0 HA ALA A 461 10.090 2.569 6.629 1.00 0.00 H new ATOM 0 HB1 ALA A 461 11.919 2.424 5.005 1.00 0.00 H new ATOM 0 HB2 ALA A 461 12.113 1.240 6.319 1.00 0.00 H new ATOM 0 HB3 ALA A 461 11.535 0.709 4.722 1.00 0.00 H new ATOM 1114 N MET A 462 9.202 3.447 4.511 1.00 0.00 N ATOM 1115 CA MET A 462 8.444 4.014 3.455 1.00 0.00 C ATOM 1116 C MET A 462 9.426 4.612 2.511 1.00 0.00 C ATOM 1117 O MET A 462 10.198 5.474 2.891 1.00 0.00 O ATOM 1118 CB MET A 462 7.573 5.135 3.997 1.00 0.00 C ATOM 1119 CG MET A 462 6.502 5.624 3.040 1.00 0.00 C ATOM 1120 SD MET A 462 5.170 4.452 2.880 1.00 0.00 S ATOM 1121 CE MET A 462 4.633 4.446 4.579 1.00 0.00 C ATOM 0 H MET A 462 9.713 4.131 5.069 1.00 0.00 H new ATOM 0 HA MET A 462 7.813 3.262 2.981 1.00 0.00 H new ATOM 0 HB2 MET A 462 7.093 4.793 4.914 1.00 0.00 H new ATOM 0 HB3 MET A 462 8.212 5.976 4.266 1.00 0.00 H new ATOM 0 HG2 MET A 462 6.107 6.577 3.393 1.00 0.00 H new ATOM 0 HG3 MET A 462 6.945 5.806 2.061 1.00 0.00 H new ATOM 0 HE1 MET A 462 3.585 4.151 4.628 1.00 0.00 H new ATOM 0 HE2 MET A 462 5.236 3.739 5.149 1.00 0.00 H new ATOM 0 HE3 MET A 462 4.749 5.444 5.001 1.00 0.00 H new ATOM 1131 N VAL A 463 9.458 4.138 1.343 1.00 0.00 N ATOM 1132 CA VAL A 463 10.322 4.665 0.351 1.00 0.00 C ATOM 1133 C VAL A 463 9.401 5.123 -0.734 1.00 0.00 C ATOM 1134 O VAL A 463 8.266 4.702 -0.761 1.00 0.00 O ATOM 1135 CB VAL A 463 11.311 3.580 -0.193 1.00 0.00 C ATOM 1136 CG1 VAL A 463 12.391 4.205 -1.062 1.00 0.00 C ATOM 1137 CG2 VAL A 463 11.945 2.781 0.945 1.00 0.00 C ATOM 0 H VAL A 463 8.880 3.359 1.028 1.00 0.00 H new ATOM 0 HA VAL A 463 10.949 5.465 0.745 1.00 0.00 H new ATOM 0 HB VAL A 463 10.728 2.894 -0.808 1.00 0.00 H new ATOM 0 HG11 VAL A 463 13.062 3.426 -1.425 1.00 0.00 H new ATOM 0 HG12 VAL A 463 11.929 4.710 -1.910 1.00 0.00 H new ATOM 0 HG13 VAL A 463 12.958 4.928 -0.475 1.00 0.00 H new ATOM 0 HG21 VAL A 463 12.626 2.037 0.532 1.00 0.00 H new ATOM 0 HG22 VAL A 463 12.498 3.455 1.599 1.00 0.00 H new ATOM 0 HG23 VAL A 463 11.164 2.280 1.517 1.00 0.00 H new ATOM 1147 N ASN A 464 9.802 6.006 -1.553 1.00 0.00 N ATOM 1148 CA ASN A 464 8.946 6.390 -2.628 1.00 0.00 C ATOM 1149 C ASN A 464 9.493 5.846 -3.930 1.00 0.00 C ATOM 1150 O ASN A 464 10.527 5.159 -3.933 1.00 0.00 O ATOM 1151 CB ASN A 464 8.713 7.916 -2.682 1.00 0.00 C ATOM 1152 CG ASN A 464 9.970 8.731 -2.927 1.00 0.00 C ATOM 1153 OD1 ASN A 464 10.920 8.267 -3.474 1.00 0.00 O ATOM 1154 ND2 ASN A 464 9.967 9.947 -2.578 1.00 0.00 N ATOM 0 H ASN A 464 10.704 6.481 -1.514 1.00 0.00 H new ATOM 0 HA ASN A 464 7.962 5.954 -2.456 1.00 0.00 H new ATOM 0 HB2 ASN A 464 7.993 8.134 -3.471 1.00 0.00 H new ATOM 0 HB3 ASN A 464 8.263 8.237 -1.742 1.00 0.00 H new ATOM 0 HD21 ASN A 464 10.780 10.533 -2.765 1.00 0.00 H new ATOM 0 HD22 ASN A 464 9.151 10.341 -2.110 1.00 0.00 H new ATOM 1161 N ASP A 465 8.848 6.174 -5.022 1.00 0.00 N ATOM 1162 CA ASP A 465 9.269 5.686 -6.341 1.00 0.00 C ATOM 1163 C ASP A 465 10.561 6.384 -6.777 1.00 0.00 C ATOM 1164 O ASP A 465 11.372 5.827 -7.513 1.00 0.00 O ATOM 1165 CB ASP A 465 8.152 5.918 -7.374 1.00 0.00 C ATOM 1166 CG ASP A 465 8.465 5.334 -8.746 1.00 0.00 C ATOM 1167 OD1 ASP A 465 8.137 4.160 -8.997 1.00 0.00 O ATOM 1168 OD2 ASP A 465 9.025 6.043 -9.608 1.00 0.00 O ATOM 0 H ASP A 465 8.026 6.778 -5.038 1.00 0.00 H new ATOM 0 HA ASP A 465 9.462 4.615 -6.276 1.00 0.00 H new ATOM 0 HB2 ASP A 465 7.227 5.478 -7.002 1.00 0.00 H new ATOM 0 HB3 ASP A 465 7.977 6.989 -7.475 1.00 0.00 H new ATOM 1173 N SER A 466 10.775 7.577 -6.242 1.00 0.00 N ATOM 1174 CA SER A 466 11.921 8.396 -6.579 1.00 0.00 C ATOM 1175 C SER A 466 13.175 7.958 -5.778 1.00 0.00 C ATOM 1176 O SER A 466 14.290 8.394 -6.053 1.00 0.00 O ATOM 1177 CB SER A 466 11.564 9.837 -6.266 1.00 0.00 C ATOM 1178 OG SER A 466 10.259 10.132 -6.761 1.00 0.00 O ATOM 0 H SER A 466 10.151 8.004 -5.557 1.00 0.00 H new ATOM 0 HA SER A 466 12.162 8.283 -7.636 1.00 0.00 H new ATOM 0 HB2 SER A 466 11.601 10.004 -5.190 1.00 0.00 H new ATOM 0 HB3 SER A 466 12.294 10.508 -6.718 1.00 0.00 H new ATOM 0 HG SER A 466 10.034 11.063 -6.554 1.00 0.00 H new ATOM 1184 N GLY A 467 12.968 7.145 -4.763 1.00 0.00 N ATOM 1185 CA GLY A 467 14.056 6.597 -4.003 1.00 0.00 C ATOM 1186 C GLY A 467 14.311 7.271 -2.682 1.00 0.00 C ATOM 1187 O GLY A 467 15.269 6.943 -1.992 1.00 0.00 O ATOM 0 H GLY A 467 12.044 6.851 -4.448 1.00 0.00 H new ATOM 0 HA2 GLY A 467 13.858 5.540 -3.823 1.00 0.00 H new ATOM 0 HA3 GLY A 467 14.964 6.653 -4.604 1.00 0.00 H new ATOM 1191 N ARG A 468 13.457 8.171 -2.311 1.00 0.00 N ATOM 1192 CA ARG A 468 13.590 8.867 -1.047 1.00 0.00 C ATOM 1193 C ARG A 468 12.866 8.073 0.024 1.00 0.00 C ATOM 1194 O ARG A 468 11.794 7.515 -0.240 1.00 0.00 O ATOM 1195 CB ARG A 468 13.027 10.294 -1.136 1.00 0.00 C ATOM 1196 CG ARG A 468 13.921 11.344 -1.834 1.00 0.00 C ATOM 1197 CD ARG A 468 14.269 10.982 -3.276 1.00 0.00 C ATOM 1198 NE ARG A 468 14.943 12.083 -3.977 1.00 0.00 N ATOM 1199 CZ ARG A 468 15.284 12.079 -5.279 1.00 0.00 C ATOM 1200 NH1 ARG A 468 15.192 10.966 -6.006 1.00 0.00 N ATOM 1201 NH2 ARG A 468 15.749 13.185 -5.839 1.00 0.00 N ATOM 0 H ARG A 468 12.647 8.452 -2.864 1.00 0.00 H new ATOM 0 HA ARG A 468 14.647 8.952 -0.794 1.00 0.00 H new ATOM 0 HB2 ARG A 468 12.074 10.253 -1.663 1.00 0.00 H new ATOM 0 HB3 ARG A 468 12.817 10.642 -0.125 1.00 0.00 H new ATOM 0 HG2 ARG A 468 13.413 12.308 -1.822 1.00 0.00 H new ATOM 0 HG3 ARG A 468 14.843 11.462 -1.264 1.00 0.00 H new ATOM 0 HD2 ARG A 468 14.912 10.102 -3.283 1.00 0.00 H new ATOM 0 HD3 ARG A 468 13.358 10.716 -3.812 1.00 0.00 H new ATOM 0 HE ARG A 468 15.170 12.916 -3.434 1.00 0.00 H new ATOM 0 HH11 ARG A 468 14.860 10.102 -5.577 1.00 0.00 H new ATOM 0 HH12 ARG A 468 15.454 10.978 -6.992 1.00 0.00 H new ATOM 0 HH21 ARG A 468 15.847 14.035 -5.284 1.00 0.00 H new ATOM 0 HH22 ARG A 468 16.009 13.187 -6.825 1.00 0.00 H new ATOM 1215 N ARG A 469 13.437 8.008 1.197 1.00 0.00 N ATOM 1216 CA ARG A 469 12.878 7.236 2.276 1.00 0.00 C ATOM 1217 C ARG A 469 12.178 8.213 3.212 1.00 0.00 C ATOM 1218 O ARG A 469 12.779 9.177 3.671 1.00 0.00 O ATOM 1219 CB ARG A 469 14.007 6.441 2.989 1.00 0.00 C ATOM 1220 CG ARG A 469 13.563 5.217 3.824 1.00 0.00 C ATOM 1221 CD ARG A 469 12.770 5.579 5.071 1.00 0.00 C ATOM 1222 NE ARG A 469 13.568 6.351 6.020 1.00 0.00 N ATOM 1223 CZ ARG A 469 13.105 6.909 7.148 1.00 0.00 C ATOM 1224 NH1 ARG A 469 11.825 6.800 7.474 1.00 0.00 N ATOM 1225 NH2 ARG A 469 13.930 7.586 7.943 1.00 0.00 N ATOM 0 H ARG A 469 14.305 8.490 1.432 1.00 0.00 H new ATOM 0 HA ARG A 469 12.156 6.502 1.919 1.00 0.00 H new ATOM 0 HB2 ARG A 469 14.715 6.101 2.233 1.00 0.00 H new ATOM 0 HB3 ARG A 469 14.545 7.125 3.645 1.00 0.00 H new ATOM 0 HG2 ARG A 469 12.958 4.562 3.197 1.00 0.00 H new ATOM 0 HG3 ARG A 469 14.446 4.650 4.118 1.00 0.00 H new ATOM 0 HD2 ARG A 469 11.889 6.154 4.786 1.00 0.00 H new ATOM 0 HD3 ARG A 469 12.415 4.668 5.552 1.00 0.00 H new ATOM 0 HE ARG A 469 14.558 6.476 5.807 1.00 0.00 H new ATOM 0 HH11 ARG A 469 11.185 6.289 6.865 1.00 0.00 H new ATOM 0 HH12 ARG A 469 11.479 7.227 8.334 1.00 0.00 H new ATOM 0 HH21 ARG A 469 14.915 7.681 7.694 1.00 0.00 H new ATOM 0 HH22 ARG A 469 13.578 8.010 8.801 1.00 0.00 H new ATOM 1239 N VAL A 470 10.937 7.954 3.495 1.00 0.00 N ATOM 1240 CA VAL A 470 10.115 8.850 4.272 1.00 0.00 C ATOM 1241 C VAL A 470 9.404 8.066 5.363 1.00 0.00 C ATOM 1242 O VAL A 470 9.680 6.867 5.552 1.00 0.00 O ATOM 1243 CB VAL A 470 9.075 9.626 3.381 1.00 0.00 C ATOM 1244 CG1 VAL A 470 9.776 10.570 2.411 1.00 0.00 C ATOM 1245 CG2 VAL A 470 8.185 8.668 2.605 1.00 0.00 C ATOM 0 H VAL A 470 10.456 7.107 3.193 1.00 0.00 H new ATOM 0 HA VAL A 470 10.766 9.600 4.722 1.00 0.00 H new ATOM 0 HB VAL A 470 8.452 10.212 4.057 1.00 0.00 H new ATOM 0 HG11 VAL A 470 9.032 11.092 1.809 1.00 0.00 H new ATOM 0 HG12 VAL A 470 10.364 11.297 2.971 1.00 0.00 H new ATOM 0 HG13 VAL A 470 10.434 9.997 1.758 1.00 0.00 H new ATOM 0 HG21 VAL A 470 7.479 9.237 2.000 1.00 0.00 H new ATOM 0 HG22 VAL A 470 8.800 8.045 1.955 1.00 0.00 H new ATOM 0 HG23 VAL A 470 7.637 8.034 3.303 1.00 0.00 H new ATOM 1255 N LYS A 471 8.540 8.715 6.098 1.00 0.00 N ATOM 1256 CA LYS A 471 7.815 8.039 7.157 1.00 0.00 C ATOM 1257 C LYS A 471 6.310 7.991 6.893 1.00 0.00 C ATOM 1258 O LYS A 471 5.615 7.108 7.410 1.00 0.00 O ATOM 1259 CB LYS A 471 8.074 8.728 8.505 1.00 0.00 C ATOM 1260 CG LYS A 471 7.584 10.174 8.572 1.00 0.00 C ATOM 1261 CD LYS A 471 7.851 10.791 9.925 1.00 0.00 C ATOM 1262 CE LYS A 471 7.349 12.221 9.995 1.00 0.00 C ATOM 1263 NZ LYS A 471 7.617 12.824 11.312 1.00 0.00 N ATOM 0 H LYS A 471 8.318 9.704 5.989 1.00 0.00 H new ATOM 0 HA LYS A 471 8.182 7.013 7.186 1.00 0.00 H new ATOM 0 HB2 LYS A 471 7.587 8.154 9.293 1.00 0.00 H new ATOM 0 HB3 LYS A 471 9.144 8.709 8.711 1.00 0.00 H new ATOM 0 HG2 LYS A 471 8.079 10.762 7.799 1.00 0.00 H new ATOM 0 HG3 LYS A 471 6.515 10.206 8.362 1.00 0.00 H new ATOM 0 HD2 LYS A 471 7.366 10.196 10.699 1.00 0.00 H new ATOM 0 HD3 LYS A 471 8.921 10.770 10.130 1.00 0.00 H new ATOM 0 HE2 LYS A 471 7.830 12.815 9.217 1.00 0.00 H new ATOM 0 HE3 LYS A 471 6.278 12.242 9.796 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 7.261 13.801 11.325 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 7.138 12.271 12.051 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 8.642 12.826 11.491 1.00 0.00 H new ATOM 1277 N GLU A 472 5.813 8.904 6.081 1.00 0.00 N ATOM 1278 CA GLU A 472 4.380 9.063 5.920 1.00 0.00 C ATOM 1279 C GLU A 472 4.075 9.666 4.549 1.00 0.00 C ATOM 1280 O GLU A 472 4.802 10.551 4.085 1.00 0.00 O ATOM 1281 CB GLU A 472 3.887 9.949 7.092 1.00 0.00 C ATOM 1282 CG GLU A 472 2.398 10.217 7.188 1.00 0.00 C ATOM 1283 CD GLU A 472 2.021 10.712 8.580 1.00 0.00 C ATOM 1284 OE1 GLU A 472 2.459 11.813 9.002 1.00 0.00 O ATOM 1285 OE2 GLU A 472 1.305 9.983 9.304 1.00 0.00 O ATOM 0 H GLU A 472 6.378 9.545 5.524 1.00 0.00 H new ATOM 0 HA GLU A 472 3.856 8.108 5.953 1.00 0.00 H new ATOM 0 HB2 GLU A 472 4.206 9.482 8.024 1.00 0.00 H new ATOM 0 HB3 GLU A 472 4.398 10.909 7.026 1.00 0.00 H new ATOM 0 HG2 GLU A 472 2.110 10.959 6.444 1.00 0.00 H new ATOM 0 HG3 GLU A 472 1.845 9.306 6.960 1.00 0.00 H new ATOM 1292 N ALA A 473 3.057 9.137 3.883 1.00 0.00 N ATOM 1293 CA ALA A 473 2.655 9.602 2.566 1.00 0.00 C ATOM 1294 C ALA A 473 1.139 9.519 2.404 1.00 0.00 C ATOM 1295 O ALA A 473 0.490 8.615 2.954 1.00 0.00 O ATOM 1296 CB ALA A 473 3.340 8.783 1.487 1.00 0.00 C ATOM 0 H ALA A 473 2.487 8.372 4.243 1.00 0.00 H new ATOM 0 HA ALA A 473 2.957 10.644 2.464 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.030 9.142 0.506 1.00 0.00 H new ATOM 0 HB2 ALA A 473 4.421 8.883 1.585 1.00 0.00 H new ATOM 0 HB3 ALA A 473 3.062 7.735 1.594 1.00 0.00 H new ATOM 1302 N GLY A 474 0.590 10.441 1.638 1.00 0.00 N ATOM 1303 CA GLY A 474 -0.844 10.513 1.434 1.00 0.00 C ATOM 1304 C GLY A 474 -1.288 9.793 0.167 1.00 0.00 C ATOM 1305 O GLY A 474 -0.450 9.257 -0.565 1.00 0.00 O ATOM 0 H GLY A 474 1.121 11.157 1.142 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -1.353 10.077 2.294 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -1.148 11.558 1.380 1.00 0.00 H new ATOM 1309 N PRO A 475 -2.601 9.786 -0.131 1.00 0.00 N ATOM 1310 CA PRO A 475 -3.151 9.074 -1.286 1.00 0.00 C ATOM 1311 C PRO A 475 -2.747 9.688 -2.630 1.00 0.00 C ATOM 1312 O PRO A 475 -2.330 10.858 -2.701 1.00 0.00 O ATOM 1313 CB PRO A 475 -4.662 9.163 -1.083 1.00 0.00 C ATOM 1314 CG PRO A 475 -4.864 10.385 -0.259 1.00 0.00 C ATOM 1315 CD PRO A 475 -3.656 10.492 0.630 1.00 0.00 C ATOM 0 HA PRO A 475 -2.773 8.053 -1.334 1.00 0.00 H new ATOM 0 HB2 PRO A 475 -5.185 9.238 -2.036 1.00 0.00 H new ATOM 0 HB3 PRO A 475 -5.046 8.277 -0.577 1.00 0.00 H new ATOM 0 HG2 PRO A 475 -4.963 11.268 -0.890 1.00 0.00 H new ATOM 0 HG3 PRO A 475 -5.777 10.311 0.331 1.00 0.00 H new ATOM 0 HD2 PRO A 475 -3.387 11.531 0.818 1.00 0.00 H new ATOM 0 HD3 PRO A 475 -3.830 10.027 1.600 1.00 0.00 H new ATOM 1323 N SER A 476 -2.867 8.876 -3.691 1.00 0.00 N ATOM 1324 CA SER A 476 -2.516 9.262 -5.061 1.00 0.00 C ATOM 1325 C SER A 476 -1.010 9.517 -5.183 1.00 0.00 C ATOM 1326 O SER A 476 -0.538 10.298 -6.020 1.00 0.00 O ATOM 1327 CB SER A 476 -3.355 10.467 -5.513 1.00 0.00 C ATOM 1328 OG SER A 476 -4.749 10.158 -5.393 1.00 0.00 O ATOM 0 H SER A 476 -3.216 7.920 -3.618 1.00 0.00 H new ATOM 0 HA SER A 476 -2.753 8.437 -5.733 1.00 0.00 H new ATOM 0 HB2 SER A 476 -3.113 11.339 -4.906 1.00 0.00 H new ATOM 0 HB3 SER A 476 -3.117 10.721 -6.546 1.00 0.00 H new ATOM 0 HG SER A 476 -4.864 9.187 -5.329 1.00 0.00 H new ATOM 1334 N MET A 477 -0.266 8.820 -4.366 1.00 0.00 N ATOM 1335 CA MET A 477 1.157 8.901 -4.376 1.00 0.00 C ATOM 1336 C MET A 477 1.764 7.522 -4.388 1.00 0.00 C ATOM 1337 O MET A 477 1.324 6.640 -3.633 1.00 0.00 O ATOM 1338 CB MET A 477 1.675 9.715 -3.198 1.00 0.00 C ATOM 1339 CG MET A 477 3.178 9.650 -3.039 1.00 0.00 C ATOM 1340 SD MET A 477 3.819 10.942 -1.960 1.00 0.00 S ATOM 1341 CE MET A 477 5.574 10.586 -2.018 1.00 0.00 C ATOM 0 H MET A 477 -0.642 8.176 -3.670 1.00 0.00 H new ATOM 0 HA MET A 477 1.458 9.417 -5.288 1.00 0.00 H new ATOM 0 HB2 MET A 477 1.375 10.755 -3.324 1.00 0.00 H new ATOM 0 HB3 MET A 477 1.204 9.356 -2.283 1.00 0.00 H new ATOM 0 HG2 MET A 477 3.455 8.676 -2.637 1.00 0.00 H new ATOM 0 HG3 MET A 477 3.647 9.735 -4.019 1.00 0.00 H new ATOM 0 HE1 MET A 477 6.111 11.303 -1.397 1.00 0.00 H new ATOM 0 HE2 MET A 477 5.753 9.577 -1.646 1.00 0.00 H new ATOM 0 HE3 MET A 477 5.927 10.661 -3.047 1.00 0.00 H new ATOM 1351 N PRO A 478 2.718 7.282 -5.294 1.00 0.00 N ATOM 1352 CA PRO A 478 3.418 6.025 -5.339 1.00 0.00 C ATOM 1353 C PRO A 478 4.489 5.932 -4.258 1.00 0.00 C ATOM 1354 O PRO A 478 5.401 6.781 -4.166 1.00 0.00 O ATOM 1355 CB PRO A 478 4.076 6.035 -6.715 1.00 0.00 C ATOM 1356 CG PRO A 478 4.256 7.471 -7.054 1.00 0.00 C ATOM 1357 CD PRO A 478 3.139 8.201 -6.381 1.00 0.00 C ATOM 0 HA PRO A 478 2.750 5.180 -5.172 1.00 0.00 H new ATOM 0 HB2 PRO A 478 5.032 5.512 -6.697 1.00 0.00 H new ATOM 0 HB3 PRO A 478 3.451 5.532 -7.453 1.00 0.00 H new ATOM 0 HG2 PRO A 478 5.223 7.835 -6.707 1.00 0.00 H new ATOM 0 HG3 PRO A 478 4.226 7.623 -8.133 1.00 0.00 H new ATOM 0 HD2 PRO A 478 3.470 9.162 -5.987 1.00 0.00 H new ATOM 0 HD3 PRO A 478 2.321 8.405 -7.072 1.00 0.00 H new ATOM 1365 N VAL A 479 4.402 4.901 -3.476 1.00 0.00 N ATOM 1366 CA VAL A 479 5.358 4.632 -2.438 1.00 0.00 C ATOM 1367 C VAL A 479 5.685 3.170 -2.423 1.00 0.00 C ATOM 1368 O VAL A 479 4.934 2.360 -2.940 1.00 0.00 O ATOM 1369 CB VAL A 479 4.927 5.120 -1.015 1.00 0.00 C ATOM 1370 CG1 VAL A 479 4.978 6.633 -0.915 1.00 0.00 C ATOM 1371 CG2 VAL A 479 3.539 4.625 -0.660 1.00 0.00 C ATOM 0 H VAL A 479 3.655 4.210 -3.539 1.00 0.00 H new ATOM 0 HA VAL A 479 6.245 5.217 -2.680 1.00 0.00 H new ATOM 0 HB VAL A 479 5.637 4.700 -0.302 1.00 0.00 H new ATOM 0 HG11 VAL A 479 4.673 6.942 0.085 1.00 0.00 H new ATOM 0 HG12 VAL A 479 5.995 6.976 -1.107 1.00 0.00 H new ATOM 0 HG13 VAL A 479 4.303 7.069 -1.651 1.00 0.00 H new ATOM 0 HG21 VAL A 479 3.269 4.981 0.334 1.00 0.00 H new ATOM 0 HG22 VAL A 479 2.821 5.002 -1.388 1.00 0.00 H new ATOM 0 HG23 VAL A 479 3.528 3.535 -0.671 1.00 0.00 H new ATOM 1381 N GLU A 480 6.788 2.857 -1.876 1.00 0.00 N ATOM 1382 CA GLU A 480 7.290 1.540 -1.823 1.00 0.00 C ATOM 1383 C GLU A 480 7.485 1.165 -0.369 1.00 0.00 C ATOM 1384 O GLU A 480 8.290 1.772 0.348 1.00 0.00 O ATOM 1385 CB GLU A 480 8.586 1.507 -2.623 1.00 0.00 C ATOM 1386 CG GLU A 480 9.218 0.155 -2.813 1.00 0.00 C ATOM 1387 CD GLU A 480 10.276 0.221 -3.876 1.00 0.00 C ATOM 1388 OE1 GLU A 480 11.408 0.635 -3.599 1.00 0.00 O ATOM 1389 OE2 GLU A 480 9.980 -0.089 -5.026 1.00 0.00 O ATOM 0 H GLU A 480 7.399 3.542 -1.430 1.00 0.00 H new ATOM 0 HA GLU A 480 6.606 0.812 -2.259 1.00 0.00 H new ATOM 0 HB2 GLU A 480 8.392 1.935 -3.606 1.00 0.00 H new ATOM 0 HB3 GLU A 480 9.309 2.156 -2.130 1.00 0.00 H new ATOM 0 HG2 GLU A 480 9.656 -0.185 -1.874 1.00 0.00 H new ATOM 0 HG3 GLU A 480 8.457 -0.574 -3.092 1.00 0.00 H new ATOM 1396 N ILE A 481 6.723 0.203 0.068 1.00 0.00 N ATOM 1397 CA ILE A 481 6.733 -0.216 1.451 1.00 0.00 C ATOM 1398 C ILE A 481 7.608 -1.425 1.630 1.00 0.00 C ATOM 1399 O ILE A 481 8.049 -2.050 0.649 1.00 0.00 O ATOM 1400 CB ILE A 481 5.317 -0.575 1.958 1.00 0.00 C ATOM 1401 CG1 ILE A 481 4.722 -1.747 1.157 1.00 0.00 C ATOM 1402 CG2 ILE A 481 4.417 0.645 1.892 1.00 0.00 C ATOM 1403 CD1 ILE A 481 3.444 -2.296 1.742 1.00 0.00 C ATOM 0 H ILE A 481 6.074 -0.318 -0.522 1.00 0.00 H new ATOM 0 HA ILE A 481 7.117 0.626 2.026 1.00 0.00 H new ATOM 0 HB ILE A 481 5.391 -0.895 2.997 1.00 0.00 H new ATOM 0 HG12 ILE A 481 4.531 -1.417 0.136 1.00 0.00 H new ATOM 0 HG13 ILE A 481 5.459 -2.548 1.101 1.00 0.00 H new ATOM 0 HG21 ILE A 481 3.422 0.383 2.251 1.00 0.00 H new ATOM 0 HG22 ILE A 481 4.831 1.437 2.516 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.351 0.993 0.861 1.00 0.00 H new ATOM 0 HD11 ILE A 481 3.085 -3.119 1.124 1.00 0.00 H new ATOM 0 HD12 ILE A 481 3.632 -2.657 2.753 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.690 -1.509 1.773 1.00 0.00 H new ATOM 1415 N THR A 482 7.827 -1.759 2.870 1.00 0.00 N ATOM 1416 CA THR A 482 8.629 -2.875 3.283 1.00 0.00 C ATOM 1417 C THR A 482 8.044 -3.409 4.578 1.00 0.00 C ATOM 1418 O THR A 482 7.292 -2.686 5.253 1.00 0.00 O ATOM 1419 CB THR A 482 10.083 -2.421 3.541 1.00 0.00 C ATOM 1420 OG1 THR A 482 10.062 -1.163 4.236 1.00 0.00 O ATOM 1421 CG2 THR A 482 10.883 -2.296 2.249 1.00 0.00 C ATOM 0 H THR A 482 7.434 -1.238 3.654 1.00 0.00 H new ATOM 0 HA THR A 482 8.632 -3.639 2.506 1.00 0.00 H new ATOM 0 HB THR A 482 10.576 -3.180 4.148 1.00 0.00 H new ATOM 0 HG1 THR A 482 10.659 -1.208 5.012 1.00 0.00 H new ATOM 0 HG21 THR A 482 11.899 -1.974 2.480 1.00 0.00 H new ATOM 0 HG22 THR A 482 10.914 -3.262 1.745 1.00 0.00 H new ATOM 0 HG23 THR A 482 10.409 -1.562 1.597 1.00 0.00 H new ATOM 1429 N GLY A 483 8.359 -4.640 4.928 1.00 0.00 N ATOM 1430 CA GLY A 483 7.885 -5.182 6.187 1.00 0.00 C ATOM 1431 C GLY A 483 6.749 -6.174 6.051 1.00 0.00 C ATOM 1432 O GLY A 483 6.170 -6.599 7.057 1.00 0.00 O ATOM 0 H GLY A 483 8.931 -5.275 4.371 1.00 0.00 H new ATOM 0 HA2 GLY A 483 8.717 -5.668 6.696 1.00 0.00 H new ATOM 0 HA3 GLY A 483 7.559 -4.359 6.823 1.00 0.00 H new ATOM 1436 N LEU A 484 6.419 -6.553 4.823 1.00 0.00 N ATOM 1437 CA LEU A 484 5.360 -7.540 4.604 1.00 0.00 C ATOM 1438 C LEU A 484 5.850 -8.933 5.017 1.00 0.00 C ATOM 1439 O LEU A 484 5.071 -9.774 5.447 1.00 0.00 O ATOM 1440 CB LEU A 484 4.915 -7.551 3.135 1.00 0.00 C ATOM 1441 CG LEU A 484 3.738 -8.478 2.804 1.00 0.00 C ATOM 1442 CD1 LEU A 484 2.479 -8.033 3.526 1.00 0.00 C ATOM 1443 CD2 LEU A 484 3.504 -8.543 1.313 1.00 0.00 C ATOM 0 H LEU A 484 6.859 -6.201 3.973 1.00 0.00 H new ATOM 0 HA LEU A 484 4.502 -7.265 5.217 1.00 0.00 H new ATOM 0 HB2 LEU A 484 4.645 -6.535 2.849 1.00 0.00 H new ATOM 0 HB3 LEU A 484 5.766 -7.840 2.519 1.00 0.00 H new ATOM 0 HG LEU A 484 3.993 -9.480 3.151 1.00 0.00 H new ATOM 0 HD11 LEU A 484 1.659 -8.706 3.275 1.00 0.00 H new ATOM 0 HD12 LEU A 484 2.650 -8.055 4.602 1.00 0.00 H new ATOM 0 HD13 LEU A 484 2.223 -7.019 3.220 1.00 0.00 H new ATOM 0 HD21 LEU A 484 2.665 -9.207 1.105 1.00 0.00 H new ATOM 0 HD22 LEU A 484 3.280 -7.545 0.936 1.00 0.00 H new ATOM 0 HD23 LEU A 484 4.399 -8.924 0.821 1.00 0.00 H new ATOM 1455 N HIS A 485 7.166 -9.139 4.857 1.00 0.00 N ATOM 1456 CA HIS A 485 7.875 -10.378 5.214 1.00 0.00 C ATOM 1457 C HIS A 485 7.379 -11.564 4.346 1.00 0.00 C ATOM 1458 O HIS A 485 7.556 -12.739 4.672 1.00 0.00 O ATOM 1459 CB HIS A 485 7.724 -10.635 6.726 1.00 0.00 C ATOM 1460 CG HIS A 485 8.694 -11.619 7.323 1.00 0.00 C ATOM 1461 ND1 HIS A 485 9.947 -11.266 7.769 1.00 0.00 N ATOM 1462 CD2 HIS A 485 8.568 -12.945 7.584 1.00 0.00 C ATOM 1463 CE1 HIS A 485 10.534 -12.346 8.274 1.00 0.00 C ATOM 1464 NE2 HIS A 485 9.740 -13.401 8.191 1.00 0.00 N ATOM 0 H HIS A 485 7.784 -8.429 4.465 1.00 0.00 H new ATOM 0 HA HIS A 485 8.939 -10.272 5.002 1.00 0.00 H new ATOM 0 HB2 HIS A 485 7.831 -9.685 7.249 1.00 0.00 H new ATOM 0 HB3 HIS A 485 6.711 -10.991 6.916 1.00 0.00 H new ATOM 0 HD2 HIS A 485 7.702 -13.549 7.359 1.00 0.00 H new ATOM 0 HE1 HIS A 485 11.528 -12.361 8.696 1.00 0.00 H new ATOM 0 HE2 HIS A 485 9.942 -14.350 8.505 1.00 0.00 H new ATOM 1472 N ASP A 486 6.806 -11.230 3.224 1.00 0.00 N ATOM 1473 CA ASP A 486 6.316 -12.187 2.258 1.00 0.00 C ATOM 1474 C ASP A 486 6.501 -11.530 0.912 1.00 0.00 C ATOM 1475 O ASP A 486 6.967 -10.383 0.865 1.00 0.00 O ATOM 1476 CB ASP A 486 4.836 -12.520 2.512 1.00 0.00 C ATOM 1477 CG ASP A 486 4.340 -13.726 1.729 1.00 0.00 C ATOM 1478 OD1 ASP A 486 3.875 -13.567 0.595 1.00 0.00 O ATOM 1479 OD2 ASP A 486 4.421 -14.859 2.235 1.00 0.00 O ATOM 0 H ASP A 486 6.660 -10.260 2.944 1.00 0.00 H new ATOM 0 HA ASP A 486 6.854 -13.133 2.321 1.00 0.00 H new ATOM 0 HB2 ASP A 486 4.691 -12.704 3.577 1.00 0.00 H new ATOM 0 HB3 ASP A 486 4.228 -11.654 2.253 1.00 0.00 H new ATOM 1484 N VAL A 487 6.144 -12.186 -0.147 1.00 0.00 N ATOM 1485 CA VAL A 487 6.377 -11.660 -1.454 1.00 0.00 C ATOM 1486 C VAL A 487 5.063 -11.167 -2.102 1.00 0.00 C ATOM 1487 O VAL A 487 4.146 -11.951 -2.392 1.00 0.00 O ATOM 1488 CB VAL A 487 7.142 -12.684 -2.355 1.00 0.00 C ATOM 1489 CG1 VAL A 487 6.408 -14.015 -2.468 1.00 0.00 C ATOM 1490 CG2 VAL A 487 7.438 -12.098 -3.728 1.00 0.00 C ATOM 0 H VAL A 487 5.685 -13.097 -0.130 1.00 0.00 H new ATOM 0 HA VAL A 487 7.025 -10.789 -1.355 1.00 0.00 H new ATOM 0 HB VAL A 487 8.094 -12.888 -1.864 1.00 0.00 H new ATOM 0 HG11 VAL A 487 6.979 -14.692 -3.103 1.00 0.00 H new ATOM 0 HG12 VAL A 487 6.297 -14.455 -1.477 1.00 0.00 H new ATOM 0 HG13 VAL A 487 5.423 -13.851 -2.905 1.00 0.00 H new ATOM 0 HG21 VAL A 487 7.970 -12.834 -4.331 1.00 0.00 H new ATOM 0 HG22 VAL A 487 6.502 -11.834 -4.221 1.00 0.00 H new ATOM 0 HG23 VAL A 487 8.054 -11.205 -3.618 1.00 0.00 H new ATOM 1500 N PRO A 488 4.930 -9.852 -2.272 1.00 0.00 N ATOM 1501 CA PRO A 488 3.763 -9.269 -2.903 1.00 0.00 C ATOM 1502 C PRO A 488 3.873 -9.324 -4.425 1.00 0.00 C ATOM 1503 O PRO A 488 4.976 -9.501 -4.978 1.00 0.00 O ATOM 1504 CB PRO A 488 3.768 -7.823 -2.407 1.00 0.00 C ATOM 1505 CG PRO A 488 5.187 -7.521 -2.024 1.00 0.00 C ATOM 1506 CD PRO A 488 5.912 -8.831 -1.863 1.00 0.00 C ATOM 0 HA PRO A 488 2.843 -9.799 -2.656 1.00 0.00 H new ATOM 0 HB2 PRO A 488 3.421 -7.143 -3.185 1.00 0.00 H new ATOM 0 HB3 PRO A 488 3.100 -7.701 -1.555 1.00 0.00 H new ATOM 0 HG2 PRO A 488 5.667 -6.911 -2.789 1.00 0.00 H new ATOM 0 HG3 PRO A 488 5.218 -6.951 -1.095 1.00 0.00 H new ATOM 0 HD2 PRO A 488 6.806 -8.869 -2.486 1.00 0.00 H new ATOM 0 HD3 PRO A 488 6.235 -8.982 -0.833 1.00 0.00 H new ATOM 1514 N GLN A 489 2.763 -9.185 -5.105 1.00 0.00 N ATOM 1515 CA GLN A 489 2.752 -9.249 -6.505 1.00 0.00 C ATOM 1516 C GLN A 489 2.351 -7.905 -7.068 1.00 0.00 C ATOM 1517 O GLN A 489 1.591 -7.150 -6.449 1.00 0.00 O ATOM 1518 CB GLN A 489 1.749 -10.287 -6.930 1.00 0.00 C ATOM 1519 CG GLN A 489 1.746 -10.571 -8.394 1.00 0.00 C ATOM 1520 CD GLN A 489 3.040 -11.202 -8.887 1.00 0.00 C ATOM 1521 OE1 GLN A 489 3.683 -11.997 -8.049 1.00 0.00 O flip ATOM 1522 NE2 GLN A 489 3.450 -10.989 -10.030 1.00 0.00 N flip ATOM 0 H GLN A 489 1.849 -9.024 -4.681 1.00 0.00 H new ATOM 0 HA GLN A 489 3.743 -9.512 -6.874 1.00 0.00 H new ATOM 0 HB2 GLN A 489 1.951 -11.213 -6.392 1.00 0.00 H new ATOM 0 HB3 GLN A 489 0.753 -9.957 -6.633 1.00 0.00 H new ATOM 0 HG2 GLN A 489 0.914 -11.236 -8.626 1.00 0.00 H new ATOM 0 HG3 GLN A 489 1.573 -9.642 -8.937 1.00 0.00 H new ATOM 0 HE21 GLN A 489 2.929 -10.370 -10.651 1.00 0.00 H new ATOM 0 HE22 GLN A 489 4.310 -11.432 -10.354 1.00 0.00 H new ATOM 1531 N ALA A 490 2.884 -7.605 -8.204 1.00 0.00 N ATOM 1532 CA ALA A 490 2.534 -6.408 -8.930 1.00 0.00 C ATOM 1533 C ALA A 490 1.126 -6.568 -9.480 1.00 0.00 C ATOM 1534 O ALA A 490 0.823 -7.577 -10.108 1.00 0.00 O ATOM 1535 CB ALA A 490 3.511 -6.182 -10.065 1.00 0.00 C ATOM 0 H ALA A 490 3.584 -8.183 -8.669 1.00 0.00 H new ATOM 0 HA ALA A 490 2.576 -5.547 -8.263 1.00 0.00 H new ATOM 0 HB1 ALA A 490 3.237 -5.276 -10.606 1.00 0.00 H new ATOM 0 HB2 ALA A 490 4.518 -6.074 -9.662 1.00 0.00 H new ATOM 0 HB3 ALA A 490 3.482 -7.033 -10.745 1.00 0.00 H new ATOM 1541 N GLY A 491 0.275 -5.607 -9.230 1.00 0.00 N ATOM 1542 CA GLY A 491 -1.089 -5.701 -9.699 1.00 0.00 C ATOM 1543 C GLY A 491 -2.014 -6.259 -8.642 1.00 0.00 C ATOM 1544 O GLY A 491 -3.225 -6.402 -8.872 1.00 0.00 O ATOM 0 H GLY A 491 0.496 -4.758 -8.710 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -1.437 -4.713 -10.001 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -1.125 -6.336 -10.584 1.00 0.00 H new ATOM 1548 N ASP A 492 -1.453 -6.578 -7.479 1.00 0.00 N ATOM 1549 CA ASP A 492 -2.231 -7.099 -6.375 1.00 0.00 C ATOM 1550 C ASP A 492 -2.959 -5.972 -5.709 1.00 0.00 C ATOM 1551 O ASP A 492 -2.760 -4.795 -6.043 1.00 0.00 O ATOM 1552 CB ASP A 492 -1.367 -7.762 -5.323 1.00 0.00 C ATOM 1553 CG ASP A 492 -1.858 -9.135 -4.948 1.00 0.00 C ATOM 1554 OD1 ASP A 492 -2.987 -9.251 -4.428 1.00 0.00 O ATOM 1555 OD2 ASP A 492 -1.109 -10.127 -5.139 1.00 0.00 O ATOM 0 H ASP A 492 -0.457 -6.482 -7.283 1.00 0.00 H new ATOM 0 HA ASP A 492 -2.915 -7.840 -6.789 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -0.344 -7.835 -5.692 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -1.341 -7.134 -4.432 1.00 0.00 H new ATOM 1560 N ARG A 493 -3.711 -6.299 -4.727 1.00 0.00 N ATOM 1561 CA ARG A 493 -4.529 -5.339 -4.070 1.00 0.00 C ATOM 1562 C ARG A 493 -4.223 -5.281 -2.610 1.00 0.00 C ATOM 1563 O ARG A 493 -4.162 -6.301 -1.940 1.00 0.00 O ATOM 1564 CB ARG A 493 -6.014 -5.604 -4.325 1.00 0.00 C ATOM 1565 CG ARG A 493 -6.624 -6.928 -3.789 1.00 0.00 C ATOM 1566 CD ARG A 493 -6.065 -8.176 -4.476 1.00 0.00 C ATOM 1567 NE ARG A 493 -6.798 -9.393 -4.095 1.00 0.00 N ATOM 1568 CZ ARG A 493 -6.354 -10.654 -4.258 1.00 0.00 C ATOM 1569 NH1 ARG A 493 -5.078 -10.891 -4.570 1.00 0.00 N ATOM 1570 NH2 ARG A 493 -7.175 -11.669 -4.036 1.00 0.00 N ATOM 0 H ARG A 493 -3.781 -7.244 -4.350 1.00 0.00 H new ATOM 0 HA ARG A 493 -4.299 -4.361 -4.492 1.00 0.00 H new ATOM 0 HB2 ARG A 493 -6.579 -4.778 -3.893 1.00 0.00 H new ATOM 0 HB3 ARG A 493 -6.178 -5.574 -5.402 1.00 0.00 H new ATOM 0 HG2 ARG A 493 -6.437 -6.998 -2.717 1.00 0.00 H new ATOM 0 HG3 ARG A 493 -7.705 -6.902 -3.923 1.00 0.00 H new ATOM 0 HD2 ARG A 493 -6.115 -8.047 -5.557 1.00 0.00 H new ATOM 0 HD3 ARG A 493 -5.013 -8.291 -4.217 1.00 0.00 H new ATOM 0 HE ARG A 493 -7.718 -9.272 -3.673 1.00 0.00 H new ATOM 0 HH11 ARG A 493 -4.429 -10.113 -4.687 1.00 0.00 H new ATOM 0 HH12 ARG A 493 -4.752 -11.850 -4.691 1.00 0.00 H new ATOM 0 HH21 ARG A 493 -8.136 -11.493 -3.744 1.00 0.00 H new ATOM 0 HH22 ARG A 493 -6.846 -12.627 -4.157 1.00 0.00 H new ATOM 1584 N PHE A 494 -4.024 -4.110 -2.116 1.00 0.00 N ATOM 1585 CA PHE A 494 -3.690 -3.956 -0.740 1.00 0.00 C ATOM 1586 C PHE A 494 -4.679 -3.062 -0.065 1.00 0.00 C ATOM 1587 O PHE A 494 -5.274 -2.178 -0.689 1.00 0.00 O ATOM 1588 CB PHE A 494 -2.261 -3.416 -0.549 1.00 0.00 C ATOM 1589 CG PHE A 494 -2.050 -2.023 -1.057 1.00 0.00 C ATOM 1590 CD1 PHE A 494 -1.781 -1.793 -2.381 1.00 0.00 C ATOM 1591 CD2 PHE A 494 -2.136 -0.942 -0.200 1.00 0.00 C ATOM 1592 CE1 PHE A 494 -1.607 -0.517 -2.843 1.00 0.00 C ATOM 1593 CE2 PHE A 494 -1.959 0.339 -0.665 1.00 0.00 C ATOM 1594 CZ PHE A 494 -1.695 0.547 -1.988 1.00 0.00 C ATOM 0 H PHE A 494 -4.086 -3.240 -2.645 1.00 0.00 H new ATOM 0 HA PHE A 494 -3.727 -4.944 -0.281 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -2.015 -3.443 0.512 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -1.563 -4.083 -1.055 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -1.706 -2.625 -3.065 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -2.345 -1.106 0.847 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -1.399 -0.349 -3.889 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -2.028 1.177 0.013 1.00 0.00 H new ATOM 0 HZ PHE A 494 -1.556 1.551 -2.360 1.00 0.00 H new ATOM 1604 N MET A 495 -4.844 -3.278 1.182 1.00 0.00 N ATOM 1605 CA MET A 495 -5.712 -2.477 1.987 1.00 0.00 C ATOM 1606 C MET A 495 -4.904 -1.880 3.101 1.00 0.00 C ATOM 1607 O MET A 495 -4.304 -2.605 3.910 1.00 0.00 O ATOM 1608 CB MET A 495 -6.874 -3.300 2.564 1.00 0.00 C ATOM 1609 CG MET A 495 -7.837 -2.489 3.440 1.00 0.00 C ATOM 1610 SD MET A 495 -9.124 -3.500 4.221 1.00 0.00 S ATOM 1611 CE MET A 495 -9.999 -4.134 2.782 1.00 0.00 C ATOM 0 H MET A 495 -4.376 -4.027 1.692 1.00 0.00 H new ATOM 0 HA MET A 495 -6.148 -1.695 1.365 1.00 0.00 H new ATOM 0 HB2 MET A 495 -7.434 -3.745 1.742 1.00 0.00 H new ATOM 0 HB3 MET A 495 -6.467 -4.121 3.154 1.00 0.00 H new ATOM 0 HG2 MET A 495 -7.267 -1.977 4.215 1.00 0.00 H new ATOM 0 HG3 MET A 495 -8.310 -1.719 2.831 1.00 0.00 H new ATOM 0 HE1 MET A 495 -10.952 -4.561 3.095 1.00 0.00 H new ATOM 0 HE2 MET A 495 -10.179 -3.321 2.079 1.00 0.00 H new ATOM 0 HE3 MET A 495 -9.397 -4.904 2.300 1.00 0.00 H new ATOM 1621 N VAL A 496 -4.821 -0.587 3.100 1.00 0.00 N ATOM 1622 CA VAL A 496 -4.189 0.119 4.163 1.00 0.00 C ATOM 1623 C VAL A 496 -5.240 0.396 5.207 1.00 0.00 C ATOM 1624 O VAL A 496 -6.191 1.162 4.970 1.00 0.00 O ATOM 1625 CB VAL A 496 -3.521 1.443 3.695 1.00 0.00 C ATOM 1626 CG1 VAL A 496 -2.964 2.196 4.887 1.00 0.00 C ATOM 1627 CG2 VAL A 496 -2.398 1.135 2.734 1.00 0.00 C ATOM 0 H VAL A 496 -5.191 0.008 2.359 1.00 0.00 H new ATOM 0 HA VAL A 496 -3.382 -0.493 4.565 1.00 0.00 H new ATOM 0 HB VAL A 496 -4.272 2.058 3.199 1.00 0.00 H new ATOM 0 HG11 VAL A 496 -2.499 3.121 4.548 1.00 0.00 H new ATOM 0 HG12 VAL A 496 -3.772 2.429 5.580 1.00 0.00 H new ATOM 0 HG13 VAL A 496 -2.220 1.580 5.392 1.00 0.00 H new ATOM 0 HG21 VAL A 496 -1.932 2.065 2.408 1.00 0.00 H new ATOM 0 HG22 VAL A 496 -1.655 0.512 3.231 1.00 0.00 H new ATOM 0 HG23 VAL A 496 -2.795 0.605 1.868 1.00 0.00 H new ATOM 1684 N GLU A 500 -5.040 5.801 11.355 1.00 0.00 N ATOM 1685 CA GLU A 500 -5.723 6.766 12.185 1.00 0.00 C ATOM 1686 C GLU A 500 -5.545 6.506 13.662 1.00 0.00 C ATOM 1687 O GLU A 500 -5.390 7.449 14.427 1.00 0.00 O ATOM 1688 CB GLU A 500 -7.210 6.781 11.884 1.00 0.00 C ATOM 1689 CG GLU A 500 -7.867 5.403 11.992 1.00 0.00 C ATOM 1690 CD GLU A 500 -9.355 5.458 12.037 1.00 0.00 C ATOM 1691 OE1 GLU A 500 -9.975 5.786 11.022 1.00 0.00 O ATOM 1692 OE2 GLU A 500 -9.930 5.182 13.096 1.00 0.00 O ATOM 0 HA GLU A 500 -5.271 7.729 11.947 1.00 0.00 H new ATOM 0 HB2 GLU A 500 -7.705 7.466 12.572 1.00 0.00 H new ATOM 0 HB3 GLU A 500 -7.365 7.171 10.878 1.00 0.00 H new ATOM 0 HG2 GLU A 500 -7.559 4.794 11.142 1.00 0.00 H new ATOM 0 HG3 GLU A 500 -7.502 4.904 12.890 1.00 0.00 H new ATOM 1699 N LYS A 501 -5.550 5.233 14.064 1.00 0.00 N ATOM 1700 CA LYS A 501 -5.483 4.916 15.480 1.00 0.00 C ATOM 1701 C LYS A 501 -4.172 5.377 16.058 1.00 0.00 C ATOM 1702 O LYS A 501 -4.142 6.097 17.043 1.00 0.00 O ATOM 1703 CB LYS A 501 -5.707 3.428 15.753 1.00 0.00 C ATOM 1704 CG LYS A 501 -7.104 2.899 15.407 1.00 0.00 C ATOM 1705 CD LYS A 501 -8.182 3.596 16.218 1.00 0.00 C ATOM 1706 CE LYS A 501 -9.560 2.973 16.020 1.00 0.00 C ATOM 1707 NZ LYS A 501 -10.029 3.011 14.616 1.00 0.00 N ATOM 0 H LYS A 501 -5.599 4.427 13.441 1.00 0.00 H new ATOM 0 HA LYS A 501 -6.294 5.452 15.973 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -4.971 2.857 15.187 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -5.516 3.237 16.809 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -7.296 3.045 14.344 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -7.144 1.826 15.594 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -7.918 3.557 17.275 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -8.219 4.649 15.937 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -9.534 1.937 16.358 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -10.280 3.496 16.650 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -11.066 3.085 14.598 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -9.615 3.834 14.134 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -9.736 2.140 14.128 1.00 0.00 H new ATOM 1721 N LYS A 502 -3.097 5.021 15.399 1.00 0.00 N ATOM 1722 CA LYS A 502 -1.790 5.438 15.840 1.00 0.00 C ATOM 1723 C LYS A 502 -1.630 6.933 15.661 1.00 0.00 C ATOM 1724 O LYS A 502 -1.036 7.599 16.500 1.00 0.00 O ATOM 1725 CB LYS A 502 -0.689 4.695 15.097 1.00 0.00 C ATOM 1726 CG LYS A 502 -0.721 3.199 15.301 1.00 0.00 C ATOM 1727 CD LYS A 502 0.426 2.529 14.582 1.00 0.00 C ATOM 1728 CE LYS A 502 0.378 1.019 14.733 1.00 0.00 C ATOM 1729 NZ LYS A 502 -0.850 0.435 14.155 1.00 0.00 N ATOM 0 H LYS A 502 -3.101 4.445 14.557 1.00 0.00 H new ATOM 0 HA LYS A 502 -1.700 5.195 16.899 1.00 0.00 H new ATOM 0 HB2 LYS A 502 -0.773 4.909 14.032 1.00 0.00 H new ATOM 0 HB3 LYS A 502 0.279 5.077 15.423 1.00 0.00 H new ATOM 0 HG2 LYS A 502 -0.669 2.973 16.366 1.00 0.00 H new ATOM 0 HG3 LYS A 502 -1.667 2.799 14.936 1.00 0.00 H new ATOM 0 HD2 LYS A 502 0.395 2.790 13.524 1.00 0.00 H new ATOM 0 HD3 LYS A 502 1.371 2.904 14.975 1.00 0.00 H new ATOM 0 HE2 LYS A 502 1.250 0.580 14.247 1.00 0.00 H new ATOM 0 HE3 LYS A 502 0.438 0.760 15.790 1.00 0.00 H new ATOM 0 HZ1 LYS A 502 -0.723 -0.590 14.034 1.00 0.00 H new ATOM 0 HZ2 LYS A 502 -1.652 0.612 14.793 1.00 0.00 H new ATOM 0 HZ3 LYS A 502 -1.040 0.872 13.230 1.00 0.00 H new ATOM 1743 N ALA A 503 -2.224 7.470 14.597 1.00 0.00 N ATOM 1744 CA ALA A 503 -2.114 8.879 14.300 1.00 0.00 C ATOM 1745 C ALA A 503 -2.737 9.715 15.409 1.00 0.00 C ATOM 1746 O ALA A 503 -2.054 10.525 16.026 1.00 0.00 O ATOM 1747 CB ALA A 503 -2.754 9.194 12.960 1.00 0.00 C ATOM 0 H ALA A 503 -2.786 6.941 13.930 1.00 0.00 H new ATOM 0 HA ALA A 503 -1.056 9.134 14.240 1.00 0.00 H new ATOM 0 HB1 ALA A 503 -2.661 10.260 12.754 1.00 0.00 H new ATOM 0 HB2 ALA A 503 -2.253 8.628 12.175 1.00 0.00 H new ATOM 0 HB3 ALA A 503 -3.809 8.920 12.987 1.00 0.00 H new ATOM 1753 N ARG A 504 -4.003 9.465 15.682 1.00 0.00 N ATOM 1754 CA ARG A 504 -4.783 10.191 16.686 1.00 0.00 C ATOM 1755 C ARG A 504 -4.162 10.088 18.067 1.00 0.00 C ATOM 1756 O ARG A 504 -4.112 11.082 18.805 1.00 0.00 O ATOM 1757 CB ARG A 504 -6.225 9.680 16.718 1.00 0.00 C ATOM 1758 CG ARG A 504 -7.136 10.435 17.674 1.00 0.00 C ATOM 1759 CD ARG A 504 -8.533 9.874 17.642 1.00 0.00 C ATOM 1760 NE ARG A 504 -9.465 10.620 18.492 1.00 0.00 N ATOM 1761 CZ ARG A 504 -10.801 10.579 18.369 1.00 0.00 C ATOM 1762 NH1 ARG A 504 -11.365 9.846 17.409 1.00 0.00 N ATOM 1763 NH2 ARG A 504 -11.560 11.284 19.190 1.00 0.00 N ATOM 0 H ARG A 504 -4.536 8.737 15.206 1.00 0.00 H new ATOM 0 HA ARG A 504 -4.783 11.243 16.399 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -6.642 9.741 15.713 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -6.219 8.626 16.997 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -6.738 10.373 18.687 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -7.158 11.491 17.404 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -8.899 9.882 16.615 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -8.509 8.833 17.964 1.00 0.00 H new ATOM 0 HE ARG A 504 -9.072 11.210 19.226 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -10.781 9.313 16.764 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -12.381 9.818 17.319 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -11.130 11.858 19.915 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -12.575 11.254 19.098 1.00 0.00 H new ATOM 1777 N GLN A 505 -3.661 8.908 18.406 1.00 0.00 N ATOM 1778 CA GLN A 505 -3.040 8.685 19.699 1.00 0.00 C ATOM 1779 C GLN A 505 -1.720 9.458 19.836 1.00 0.00 C ATOM 1780 O GLN A 505 -1.287 9.775 20.950 1.00 0.00 O ATOM 1781 CB GLN A 505 -2.885 7.197 19.970 1.00 0.00 C ATOM 1782 CG GLN A 505 -4.232 6.483 20.077 1.00 0.00 C ATOM 1783 CD GLN A 505 -4.116 4.981 20.223 1.00 0.00 C ATOM 1784 OE1 GLN A 505 -3.140 4.464 20.783 1.00 0.00 O ATOM 1785 NE2 GLN A 505 -5.101 4.265 19.731 1.00 0.00 N ATOM 0 H GLN A 505 -3.674 8.089 17.799 1.00 0.00 H new ATOM 0 HA GLN A 505 -3.700 9.083 20.470 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -2.299 6.744 19.171 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -2.327 7.055 20.895 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -4.777 6.881 20.933 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -4.824 6.708 19.190 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -5.889 4.726 19.276 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -5.078 3.248 19.804 1.00 0.00 H new ATOM 1794 N ILE A 506 -1.086 9.753 18.712 1.00 0.00 N ATOM 1795 CA ILE A 506 0.069 10.639 18.702 1.00 0.00 C ATOM 1796 C ILE A 506 -0.449 12.085 18.799 1.00 0.00 C ATOM 1797 O ILE A 506 -0.046 12.854 19.684 1.00 0.00 O ATOM 1798 CB ILE A 506 0.929 10.476 17.395 1.00 0.00 C ATOM 1799 CG1 ILE A 506 1.548 9.062 17.283 1.00 0.00 C ATOM 1800 CG2 ILE A 506 2.019 11.545 17.299 1.00 0.00 C ATOM 1801 CD1 ILE A 506 2.528 8.701 18.387 1.00 0.00 C ATOM 0 H ILE A 506 -1.351 9.393 17.795 1.00 0.00 H new ATOM 0 HA ILE A 506 0.714 10.388 19.544 1.00 0.00 H new ATOM 0 HB ILE A 506 0.247 10.610 16.556 1.00 0.00 H new ATOM 0 HG12 ILE A 506 0.742 8.328 17.279 1.00 0.00 H new ATOM 0 HG13 ILE A 506 2.059 8.980 16.323 1.00 0.00 H new ATOM 0 HG21 ILE A 506 2.592 11.399 16.383 1.00 0.00 H new ATOM 0 HG22 ILE A 506 1.559 12.533 17.286 1.00 0.00 H new ATOM 0 HG23 ILE A 506 2.684 11.465 18.159 1.00 0.00 H new ATOM 0 HD11 ILE A 506 2.907 7.693 18.221 1.00 0.00 H new ATOM 0 HD12 ILE A 506 3.359 9.407 18.381 1.00 0.00 H new ATOM 0 HD13 ILE A 506 2.022 8.744 19.351 1.00 0.00 H new ATOM 1813 N GLY A 507 -1.381 12.413 17.926 1.00 0.00 N ATOM 1814 CA GLY A 507 -1.950 13.733 17.886 1.00 0.00 C ATOM 1815 C GLY A 507 -2.574 14.033 16.536 1.00 0.00 C ATOM 1816 O GLY A 507 -3.271 15.030 16.386 1.00 0.00 O ATOM 0 H GLY A 507 -1.760 11.771 17.230 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -2.706 13.827 18.666 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -1.176 14.470 18.101 1.00 0.00 H new