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 464 ASN : amide:sc= -1.01! C(o=-0.91!,f=-5.8!) USER MOD Set 1.2: A 466 SER OG : rot 82:sc= 0.106 USER MOD Single : A 421 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 LYS NZ :NH3+ 164:sc= -0.0274 (180deg=-0.262) USER MOD Single : A 429 LYS NZ :NH3+ 129:sc= 1.21 (180deg=0.577) USER MOD Single : A 436 THR OG1 : rot -91:sc= 1.05 USER MOD Single : A 440 GLN : amide:sc= -0.703 X(o=-0.7,f=-0.52) USER MOD Single : A 443 THR OG1 : rot 180:sc= 0 USER MOD Single : A 445 LYS NZ :NH3+ -128:sc= 2.25 (180deg=0.972) 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 160:sc= -6.63! (180deg=-6.94!) USER MOD Single : A 471 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 SER OG : rot -46:sc= 0.447 USER MOD Single : A 477 MET CE :methyl 154:sc= -0.116 (180deg=-0.286) USER MOD Single : A 482 THR OG1 : rot -110:sc= 0.808 USER MOD Single : A 485 HIS : no HD1:sc= -0.0862 X(o=-0.086,f=-0.086) USER MOD Single : A 489 GLN : amide:sc= 0 K(o=0,f=-0.74) USER MOD Single : A 495 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 501 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.039) USER MOD Single : A 502 LYS NZ :NH3+ 136:sc= -0.94 (180deg=-2.98!) USER MOD Single : A 505 GLN : amide:sc= -0.17 X(o=-0.17,f=-0.095) USER MOD ----------------------------------------------------------------- ATOM 470 N VAL A 419 -9.199 0.899 -1.095 1.00 0.00 N ATOM 471 CA VAL A 419 -8.087 0.001 -1.217 1.00 0.00 C ATOM 472 C VAL A 419 -7.191 0.555 -2.295 1.00 0.00 C ATOM 473 O VAL A 419 -7.494 1.600 -2.852 1.00 0.00 O ATOM 474 CB VAL A 419 -8.539 -1.435 -1.632 1.00 0.00 C ATOM 475 CG1 VAL A 419 -9.287 -2.129 -0.511 1.00 0.00 C ATOM 476 CG2 VAL A 419 -9.403 -1.378 -2.879 1.00 0.00 C ATOM 0 HA VAL A 419 -7.582 -0.078 -0.254 1.00 0.00 H new ATOM 0 HB VAL A 419 -7.641 -2.015 -1.846 1.00 0.00 H new ATOM 0 HG11 VAL A 419 -9.586 -3.126 -0.836 1.00 0.00 H new ATOM 0 HG12 VAL A 419 -8.640 -2.211 0.362 1.00 0.00 H new ATOM 0 HG13 VAL A 419 -10.174 -1.550 -0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 419 -9.710 -2.387 -3.155 1.00 0.00 H new ATOM 0 HG22 VAL A 419 -10.287 -0.771 -2.682 1.00 0.00 H new ATOM 0 HG23 VAL A 419 -8.834 -0.935 -3.696 1.00 0.00 H new ATOM 486 N GLY A 420 -6.125 -0.113 -2.592 1.00 0.00 N ATOM 487 CA GLY A 420 -5.256 0.341 -3.632 1.00 0.00 C ATOM 488 C GLY A 420 -4.796 -0.805 -4.475 1.00 0.00 C ATOM 489 O GLY A 420 -5.105 -1.963 -4.169 1.00 0.00 O ATOM 0 H GLY A 420 -5.833 -0.975 -2.131 1.00 0.00 H new ATOM 0 HA2 GLY A 420 -5.775 1.071 -4.254 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -4.394 0.848 -3.197 1.00 0.00 H new ATOM 493 N THR A 421 -4.053 -0.512 -5.509 1.00 0.00 N ATOM 494 CA THR A 421 -3.508 -1.530 -6.362 1.00 0.00 C ATOM 495 C THR A 421 -1.968 -1.409 -6.356 1.00 0.00 C ATOM 496 O THR A 421 -1.416 -0.292 -6.281 1.00 0.00 O ATOM 497 CB THR A 421 -4.054 -1.393 -7.804 1.00 0.00 C ATOM 498 OG1 THR A 421 -5.494 -1.269 -7.763 1.00 0.00 O ATOM 499 CG2 THR A 421 -3.716 -2.626 -8.623 1.00 0.00 C ATOM 0 H THR A 421 -3.809 0.440 -5.782 1.00 0.00 H new ATOM 0 HA THR A 421 -3.804 -2.510 -5.989 1.00 0.00 H new ATOM 0 HB THR A 421 -3.600 -0.513 -8.258 1.00 0.00 H new ATOM 0 HG1 THR A 421 -5.841 -1.180 -8.675 1.00 0.00 H new ATOM 0 HG21 THR A 421 -4.108 -2.510 -9.633 1.00 0.00 H new ATOM 0 HG22 THR A 421 -2.634 -2.749 -8.666 1.00 0.00 H new ATOM 0 HG23 THR A 421 -4.163 -3.505 -8.159 1.00 0.00 H new ATOM 507 N VAL A 422 -1.302 -2.535 -6.373 1.00 0.00 N ATOM 508 CA VAL A 422 0.149 -2.591 -6.362 1.00 0.00 C ATOM 509 C VAL A 422 0.647 -2.445 -7.792 1.00 0.00 C ATOM 510 O VAL A 422 0.070 -3.038 -8.701 1.00 0.00 O ATOM 511 CB VAL A 422 0.646 -3.950 -5.790 1.00 0.00 C ATOM 512 CG1 VAL A 422 2.159 -3.984 -5.681 1.00 0.00 C ATOM 513 CG2 VAL A 422 0.010 -4.241 -4.441 1.00 0.00 C ATOM 0 H VAL A 422 -1.750 -3.451 -6.395 1.00 0.00 H new ATOM 0 HA VAL A 422 0.532 -1.788 -5.732 1.00 0.00 H new ATOM 0 HB VAL A 422 0.340 -4.729 -6.489 1.00 0.00 H new ATOM 0 HG11 VAL A 422 2.473 -4.947 -5.278 1.00 0.00 H new ATOM 0 HG12 VAL A 422 2.598 -3.843 -6.669 1.00 0.00 H new ATOM 0 HG13 VAL A 422 2.494 -3.186 -5.018 1.00 0.00 H new ATOM 0 HG21 VAL A 422 0.375 -5.197 -4.065 1.00 0.00 H new ATOM 0 HG22 VAL A 422 0.271 -3.450 -3.737 1.00 0.00 H new ATOM 0 HG23 VAL A 422 -1.073 -4.285 -4.551 1.00 0.00 H new ATOM 523 N ILE A 423 1.701 -1.684 -7.996 1.00 0.00 N ATOM 524 CA ILE A 423 2.209 -1.473 -9.333 1.00 0.00 C ATOM 525 C ILE A 423 3.322 -2.450 -9.670 1.00 0.00 C ATOM 526 O ILE A 423 3.390 -2.956 -10.783 1.00 0.00 O ATOM 527 CB ILE A 423 2.632 -0.008 -9.608 1.00 0.00 C ATOM 528 CG1 ILE A 423 3.662 0.496 -8.596 1.00 0.00 C ATOM 529 CG2 ILE A 423 1.410 0.895 -9.620 1.00 0.00 C ATOM 530 CD1 ILE A 423 4.099 1.937 -8.819 1.00 0.00 C ATOM 0 H ILE A 423 2.219 -1.205 -7.259 1.00 0.00 H new ATOM 0 HA ILE A 423 1.373 -1.673 -10.004 1.00 0.00 H new ATOM 0 HB ILE A 423 3.108 0.018 -10.588 1.00 0.00 H new ATOM 0 HG12 ILE A 423 3.245 0.405 -7.593 1.00 0.00 H new ATOM 0 HG13 ILE A 423 4.540 -0.149 -8.635 1.00 0.00 H new ATOM 0 HG21 ILE A 423 1.719 1.922 -9.814 1.00 0.00 H new ATOM 0 HG22 ILE A 423 0.724 0.568 -10.401 1.00 0.00 H new ATOM 0 HG23 ILE A 423 0.910 0.843 -8.653 1.00 0.00 H new ATOM 0 HD11 ILE A 423 4.830 2.217 -8.060 1.00 0.00 H new ATOM 0 HD12 ILE A 423 4.548 2.032 -9.808 1.00 0.00 H new ATOM 0 HD13 ILE A 423 3.233 2.595 -8.749 1.00 0.00 H new ATOM 542 N GLU A 424 4.170 -2.727 -8.712 1.00 0.00 N ATOM 543 CA GLU A 424 5.227 -3.704 -8.873 1.00 0.00 C ATOM 544 C GLU A 424 5.594 -4.272 -7.514 1.00 0.00 C ATOM 545 O GLU A 424 5.479 -3.577 -6.506 1.00 0.00 O ATOM 546 CB GLU A 424 6.460 -3.119 -9.580 1.00 0.00 C ATOM 547 CG GLU A 424 7.077 -1.939 -8.884 1.00 0.00 C ATOM 548 CD GLU A 424 8.350 -1.494 -9.524 1.00 0.00 C ATOM 549 OE1 GLU A 424 9.406 -2.124 -9.286 1.00 0.00 O ATOM 550 OE2 GLU A 424 8.337 -0.517 -10.281 1.00 0.00 O ATOM 0 H GLU A 424 4.150 -2.282 -7.794 1.00 0.00 H new ATOM 0 HA GLU A 424 4.858 -4.504 -9.515 1.00 0.00 H new ATOM 0 HB2 GLU A 424 7.213 -3.902 -9.677 1.00 0.00 H new ATOM 0 HB3 GLU A 424 6.177 -2.822 -10.590 1.00 0.00 H new ATOM 0 HG2 GLU A 424 6.367 -1.112 -8.882 1.00 0.00 H new ATOM 0 HG3 GLU A 424 7.269 -2.196 -7.842 1.00 0.00 H new ATOM 557 N ALA A 425 6.012 -5.508 -7.478 1.00 0.00 N ATOM 558 CA ALA A 425 6.341 -6.162 -6.233 1.00 0.00 C ATOM 559 C ALA A 425 7.370 -7.245 -6.463 1.00 0.00 C ATOM 560 O ALA A 425 7.217 -8.077 -7.372 1.00 0.00 O ATOM 561 CB ALA A 425 5.096 -6.734 -5.601 1.00 0.00 C ATOM 0 H ALA A 425 6.135 -6.092 -8.306 1.00 0.00 H new ATOM 0 HA ALA A 425 6.767 -5.426 -5.551 1.00 0.00 H new ATOM 0 HB1 ALA A 425 5.357 -7.225 -4.663 1.00 0.00 H new ATOM 0 HB2 ALA A 425 4.385 -5.931 -5.405 1.00 0.00 H new ATOM 0 HB3 ALA A 425 4.645 -7.460 -6.277 1.00 0.00 H new ATOM 567 N LYS A 426 8.409 -7.242 -5.649 1.00 0.00 N ATOM 568 CA LYS A 426 9.524 -8.174 -5.779 1.00 0.00 C ATOM 569 C LYS A 426 10.459 -7.969 -4.600 1.00 0.00 C ATOM 570 O LYS A 426 10.203 -7.133 -3.739 1.00 0.00 O ATOM 571 CB LYS A 426 10.317 -8.010 -7.110 1.00 0.00 C ATOM 572 CG LYS A 426 11.286 -6.837 -7.158 1.00 0.00 C ATOM 573 CD LYS A 426 10.572 -5.509 -7.015 1.00 0.00 C ATOM 574 CE LYS A 426 11.515 -4.341 -7.151 1.00 0.00 C ATOM 575 NZ LYS A 426 12.119 -4.267 -8.493 1.00 0.00 N ATOM 0 H LYS A 426 8.508 -6.589 -4.871 1.00 0.00 H new ATOM 0 HA LYS A 426 9.110 -9.182 -5.792 1.00 0.00 H new ATOM 0 HB2 LYS A 426 10.876 -8.927 -7.295 1.00 0.00 H new ATOM 0 HB3 LYS A 426 9.603 -7.902 -7.926 1.00 0.00 H new ATOM 0 HG2 LYS A 426 12.022 -6.941 -6.361 1.00 0.00 H new ATOM 0 HG3 LYS A 426 11.832 -6.856 -8.101 1.00 0.00 H new ATOM 0 HD2 LYS A 426 9.791 -5.434 -7.772 1.00 0.00 H new ATOM 0 HD3 LYS A 426 10.079 -5.465 -6.044 1.00 0.00 H new ATOM 0 HE2 LYS A 426 10.977 -3.416 -6.945 1.00 0.00 H new ATOM 0 HE3 LYS A 426 12.304 -4.424 -6.403 1.00 0.00 H new ATOM 0 HZ1 LYS A 426 12.536 -3.325 -8.635 1.00 0.00 H new ATOM 0 HZ2 LYS A 426 12.861 -4.991 -8.580 1.00 0.00 H new ATOM 0 HZ3 LYS A 426 11.387 -4.433 -9.213 1.00 0.00 H new ATOM 589 N LEU A 427 11.490 -8.739 -4.541 1.00 0.00 N ATOM 590 CA LEU A 427 12.466 -8.602 -3.490 1.00 0.00 C ATOM 591 C LEU A 427 13.433 -7.466 -3.815 1.00 0.00 C ATOM 592 O LEU A 427 13.694 -7.159 -4.989 1.00 0.00 O ATOM 593 CB LEU A 427 13.271 -9.898 -3.322 1.00 0.00 C ATOM 594 CG LEU A 427 14.499 -10.125 -4.258 1.00 0.00 C ATOM 595 CD1 LEU A 427 15.273 -11.351 -3.821 1.00 0.00 C ATOM 596 CD2 LEU A 427 14.073 -10.290 -5.705 1.00 0.00 C ATOM 0 H LEU A 427 11.689 -9.481 -5.212 1.00 0.00 H new ATOM 0 HA LEU A 427 11.932 -8.385 -2.565 1.00 0.00 H new ATOM 0 HB2 LEU A 427 13.624 -9.940 -2.292 1.00 0.00 H new ATOM 0 HB3 LEU A 427 12.587 -10.736 -3.459 1.00 0.00 H new ATOM 0 HG LEU A 427 15.134 -9.242 -4.183 1.00 0.00 H new ATOM 0 HD11 LEU A 427 16.127 -11.497 -4.483 1.00 0.00 H new ATOM 0 HD12 LEU A 427 15.626 -11.213 -2.799 1.00 0.00 H new ATOM 0 HD13 LEU A 427 14.625 -12.226 -3.867 1.00 0.00 H new ATOM 0 HD21 LEU A 427 14.954 -10.446 -6.328 1.00 0.00 H new ATOM 0 HD22 LEU A 427 13.409 -11.150 -5.793 1.00 0.00 H new ATOM 0 HD23 LEU A 427 13.550 -9.392 -6.035 1.00 0.00 H new ATOM 608 N ASP A 428 13.926 -6.830 -2.815 1.00 0.00 N ATOM 609 CA ASP A 428 14.981 -5.881 -2.994 1.00 0.00 C ATOM 610 C ASP A 428 16.100 -6.249 -2.067 1.00 0.00 C ATOM 611 O ASP A 428 15.895 -6.370 -0.863 1.00 0.00 O ATOM 612 CB ASP A 428 14.550 -4.443 -2.749 1.00 0.00 C ATOM 613 CG ASP A 428 15.657 -3.488 -3.097 1.00 0.00 C ATOM 614 OD1 ASP A 428 16.481 -3.169 -2.217 1.00 0.00 O ATOM 615 OD2 ASP A 428 15.767 -3.086 -4.271 1.00 0.00 O ATOM 0 H ASP A 428 13.616 -6.947 -1.850 1.00 0.00 H new ATOM 0 HA ASP A 428 15.297 -5.923 -4.036 1.00 0.00 H new ATOM 0 HB2 ASP A 428 13.667 -4.216 -3.346 1.00 0.00 H new ATOM 0 HB3 ASP A 428 14.269 -4.316 -1.704 1.00 0.00 H new ATOM 620 N LYS A 429 17.257 -6.470 -2.624 1.00 0.00 N ATOM 621 CA LYS A 429 18.440 -6.874 -1.867 1.00 0.00 C ATOM 622 C LYS A 429 18.912 -5.853 -0.801 1.00 0.00 C ATOM 623 O LYS A 429 19.682 -6.210 0.091 1.00 0.00 O ATOM 624 CB LYS A 429 19.615 -7.286 -2.794 1.00 0.00 C ATOM 625 CG LYS A 429 20.302 -6.202 -3.681 1.00 0.00 C ATOM 626 CD LYS A 429 19.475 -5.710 -4.884 1.00 0.00 C ATOM 627 CE LYS A 429 18.623 -4.505 -4.547 1.00 0.00 C ATOM 628 NZ LYS A 429 17.828 -4.035 -5.694 1.00 0.00 N ATOM 0 H LYS A 429 17.422 -6.378 -3.626 1.00 0.00 H new ATOM 0 HA LYS A 429 18.110 -7.750 -1.308 1.00 0.00 H new ATOM 0 HB2 LYS A 429 20.386 -7.733 -2.167 1.00 0.00 H new ATOM 0 HB3 LYS A 429 19.250 -8.070 -3.458 1.00 0.00 H new ATOM 0 HG2 LYS A 429 20.545 -5.344 -3.054 1.00 0.00 H new ATOM 0 HG3 LYS A 429 21.245 -6.604 -4.050 1.00 0.00 H new ATOM 0 HD2 LYS A 429 20.147 -5.458 -5.704 1.00 0.00 H new ATOM 0 HD3 LYS A 429 18.833 -6.518 -5.235 1.00 0.00 H new ATOM 0 HE2 LYS A 429 17.954 -4.757 -3.724 1.00 0.00 H new ATOM 0 HE3 LYS A 429 19.266 -3.696 -4.199 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 16.833 -3.935 -5.409 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 18.191 -3.114 -6.014 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 17.898 -4.723 -6.470 1.00 0.00 H new ATOM 642 N GLY A 430 18.463 -4.612 -0.890 1.00 0.00 N ATOM 643 CA GLY A 430 18.887 -3.625 0.079 1.00 0.00 C ATOM 644 C GLY A 430 17.767 -3.207 1.012 1.00 0.00 C ATOM 645 O GLY A 430 17.965 -3.084 2.229 1.00 0.00 O ATOM 0 H GLY A 430 17.821 -4.273 -1.606 1.00 0.00 H new ATOM 0 HA2 GLY A 430 19.713 -4.028 0.666 1.00 0.00 H new ATOM 0 HA3 GLY A 430 19.266 -2.747 -0.444 1.00 0.00 H new ATOM 649 N ARG A 431 16.592 -2.999 0.457 1.00 0.00 N ATOM 650 CA ARG A 431 15.440 -2.538 1.228 1.00 0.00 C ATOM 651 C ARG A 431 14.703 -3.704 1.906 1.00 0.00 C ATOM 652 O ARG A 431 14.174 -3.557 3.009 1.00 0.00 O ATOM 653 CB ARG A 431 14.483 -1.734 0.324 1.00 0.00 C ATOM 654 CG ARG A 431 15.119 -0.491 -0.299 1.00 0.00 C ATOM 655 CD ARG A 431 14.196 0.193 -1.315 1.00 0.00 C ATOM 656 NE ARG A 431 14.860 1.350 -1.962 1.00 0.00 N ATOM 657 CZ ARG A 431 14.578 1.832 -3.188 1.00 0.00 C ATOM 658 NH1 ARG A 431 13.506 1.412 -3.853 1.00 0.00 N ATOM 659 NH2 ARG A 431 15.351 2.784 -3.721 1.00 0.00 N ATOM 0 H ARG A 431 16.401 -3.141 -0.535 1.00 0.00 H new ATOM 0 HA ARG A 431 15.807 -1.886 2.021 1.00 0.00 H new ATOM 0 HB2 ARG A 431 14.120 -2.383 -0.473 1.00 0.00 H new ATOM 0 HB3 ARG A 431 13.614 -1.432 0.909 1.00 0.00 H new ATOM 0 HG2 ARG A 431 15.374 0.217 0.490 1.00 0.00 H new ATOM 0 HG3 ARG A 431 16.051 -0.771 -0.790 1.00 0.00 H new ATOM 0 HD2 ARG A 431 13.895 -0.527 -2.076 1.00 0.00 H new ATOM 0 HD3 ARG A 431 13.287 0.527 -0.815 1.00 0.00 H new ATOM 0 HE ARG A 431 15.594 1.822 -1.433 1.00 0.00 H new ATOM 0 HH11 ARG A 431 12.887 0.717 -3.436 1.00 0.00 H new ATOM 0 HH12 ARG A 431 13.303 1.784 -4.781 1.00 0.00 H new ATOM 0 HH21 ARG A 431 16.151 3.143 -3.200 1.00 0.00 H new ATOM 0 HH22 ARG A 431 15.141 3.151 -4.649 1.00 0.00 H new ATOM 673 N GLY A 432 14.721 -4.857 1.275 1.00 0.00 N ATOM 674 CA GLY A 432 14.011 -6.019 1.791 1.00 0.00 C ATOM 675 C GLY A 432 12.892 -6.402 0.840 1.00 0.00 C ATOM 676 O GLY A 432 12.976 -6.074 -0.335 1.00 0.00 O ATOM 0 H GLY A 432 15.220 -5.021 0.400 1.00 0.00 H new ATOM 0 HA2 GLY A 432 14.701 -6.854 1.911 1.00 0.00 H new ATOM 0 HA3 GLY A 432 13.603 -5.799 2.777 1.00 0.00 H new ATOM 680 N PRO A 433 11.856 -7.124 1.281 1.00 0.00 N ATOM 681 CA PRO A 433 10.697 -7.409 0.428 1.00 0.00 C ATOM 682 C PRO A 433 9.948 -6.111 0.162 1.00 0.00 C ATOM 683 O PRO A 433 9.424 -5.487 1.102 1.00 0.00 O ATOM 684 CB PRO A 433 9.833 -8.352 1.288 1.00 0.00 C ATOM 685 CG PRO A 433 10.748 -8.845 2.355 1.00 0.00 C ATOM 686 CD PRO A 433 11.720 -7.729 2.609 1.00 0.00 C ATOM 0 HA PRO A 433 10.960 -7.844 -0.536 1.00 0.00 H new ATOM 0 HB2 PRO A 433 8.978 -7.826 1.713 1.00 0.00 H new ATOM 0 HB3 PRO A 433 9.438 -9.176 0.695 1.00 0.00 H new ATOM 0 HG2 PRO A 433 10.194 -9.095 3.260 1.00 0.00 H new ATOM 0 HG3 PRO A 433 11.266 -9.750 2.038 1.00 0.00 H new ATOM 0 HD2 PRO A 433 11.340 -7.018 3.343 1.00 0.00 H new ATOM 0 HD3 PRO A 433 12.673 -8.098 2.987 1.00 0.00 H new ATOM 694 N VAL A 434 9.899 -5.698 -1.084 1.00 0.00 N ATOM 695 CA VAL A 434 9.328 -4.421 -1.417 1.00 0.00 C ATOM 696 C VAL A 434 8.102 -4.549 -2.283 1.00 0.00 C ATOM 697 O VAL A 434 7.939 -5.513 -3.058 1.00 0.00 O ATOM 698 CB VAL A 434 10.348 -3.456 -2.102 1.00 0.00 C ATOM 699 CG1 VAL A 434 11.498 -3.120 -1.180 1.00 0.00 C ATOM 700 CG2 VAL A 434 10.869 -4.020 -3.417 1.00 0.00 C ATOM 0 H VAL A 434 10.249 -6.230 -1.881 1.00 0.00 H new ATOM 0 HA VAL A 434 9.039 -3.986 -0.460 1.00 0.00 H new ATOM 0 HB VAL A 434 9.807 -2.536 -2.324 1.00 0.00 H new ATOM 0 HG11 VAL A 434 12.188 -2.447 -1.689 1.00 0.00 H new ATOM 0 HG12 VAL A 434 11.115 -2.635 -0.282 1.00 0.00 H new ATOM 0 HG13 VAL A 434 12.022 -4.035 -0.903 1.00 0.00 H new ATOM 0 HG21 VAL A 434 11.575 -3.318 -3.860 1.00 0.00 H new ATOM 0 HG22 VAL A 434 11.370 -4.970 -3.232 1.00 0.00 H new ATOM 0 HG23 VAL A 434 10.035 -4.176 -4.102 1.00 0.00 H new ATOM 710 N ALA A 435 7.245 -3.598 -2.137 1.00 0.00 N ATOM 711 CA ALA A 435 6.062 -3.503 -2.926 1.00 0.00 C ATOM 712 C ALA A 435 5.815 -2.058 -3.242 1.00 0.00 C ATOM 713 O ALA A 435 5.535 -1.259 -2.338 1.00 0.00 O ATOM 714 CB ALA A 435 4.871 -4.092 -2.182 1.00 0.00 C ATOM 0 H ALA A 435 7.348 -2.849 -1.452 1.00 0.00 H new ATOM 0 HA ALA A 435 6.192 -4.069 -3.849 1.00 0.00 H new ATOM 0 HB1 ALA A 435 3.978 -4.010 -2.802 1.00 0.00 H new ATOM 0 HB2 ALA A 435 5.063 -5.142 -1.960 1.00 0.00 H new ATOM 0 HB3 ALA A 435 4.718 -3.547 -1.251 1.00 0.00 H new ATOM 720 N THR A 436 5.963 -1.706 -4.483 1.00 0.00 N ATOM 721 CA THR A 436 5.703 -0.383 -4.915 1.00 0.00 C ATOM 722 C THR A 436 4.235 -0.348 -5.264 1.00 0.00 C ATOM 723 O THR A 436 3.754 -1.149 -6.081 1.00 0.00 O ATOM 724 CB THR A 436 6.537 -0.043 -6.152 1.00 0.00 C ATOM 725 OG1 THR A 436 7.829 -0.689 -6.036 1.00 0.00 O ATOM 726 CG2 THR A 436 6.753 1.466 -6.245 1.00 0.00 C ATOM 0 H THR A 436 6.270 -2.339 -5.222 1.00 0.00 H new ATOM 0 HA THR A 436 5.960 0.342 -4.142 1.00 0.00 H new ATOM 0 HB THR A 436 6.012 -0.388 -7.043 1.00 0.00 H new ATOM 0 HG1 THR A 436 8.461 -0.080 -5.601 1.00 0.00 H new ATOM 0 HG21 THR A 436 7.348 1.695 -7.129 1.00 0.00 H new ATOM 0 HG22 THR A 436 5.788 1.968 -6.317 1.00 0.00 H new ATOM 0 HG23 THR A 436 7.278 1.814 -5.355 1.00 0.00 H new ATOM 734 N LEU A 437 3.525 0.513 -4.653 1.00 0.00 N ATOM 735 CA LEU A 437 2.118 0.544 -4.800 1.00 0.00 C ATOM 736 C LEU A 437 1.605 1.961 -4.902 1.00 0.00 C ATOM 737 O LEU A 437 2.369 2.922 -4.734 1.00 0.00 O ATOM 738 CB LEU A 437 1.488 -0.225 -3.615 1.00 0.00 C ATOM 739 CG LEU A 437 1.984 0.138 -2.188 1.00 0.00 C ATOM 740 CD1 LEU A 437 1.605 1.541 -1.791 1.00 0.00 C ATOM 741 CD2 LEU A 437 1.459 -0.844 -1.168 1.00 0.00 C ATOM 0 H LEU A 437 3.902 1.226 -4.029 1.00 0.00 H new ATOM 0 HA LEU A 437 1.831 0.057 -5.732 1.00 0.00 H new ATOM 0 HB2 LEU A 437 0.410 -0.070 -3.647 1.00 0.00 H new ATOM 0 HB3 LEU A 437 1.662 -1.289 -3.772 1.00 0.00 H new ATOM 0 HG LEU A 437 3.072 0.082 -2.212 1.00 0.00 H new ATOM 0 HD11 LEU A 437 1.974 1.747 -0.786 1.00 0.00 H new ATOM 0 HD12 LEU A 437 2.047 2.249 -2.492 1.00 0.00 H new ATOM 0 HD13 LEU A 437 0.520 1.643 -1.807 1.00 0.00 H new ATOM 0 HD21 LEU A 437 1.820 -0.568 -0.177 1.00 0.00 H new ATOM 0 HD22 LEU A 437 0.369 -0.827 -1.174 1.00 0.00 H new ATOM 0 HD23 LEU A 437 1.808 -1.847 -1.415 1.00 0.00 H new ATOM 753 N LEU A 438 0.340 2.091 -5.177 1.00 0.00 N ATOM 754 CA LEU A 438 -0.291 3.378 -5.221 1.00 0.00 C ATOM 755 C LEU A 438 -1.359 3.385 -4.116 1.00 0.00 C ATOM 756 O LEU A 438 -2.400 2.718 -4.242 1.00 0.00 O ATOM 757 CB LEU A 438 -0.905 3.589 -6.631 1.00 0.00 C ATOM 758 CG LEU A 438 -1.288 5.022 -7.081 1.00 0.00 C ATOM 759 CD1 LEU A 438 -2.377 5.640 -6.234 1.00 0.00 C ATOM 760 CD2 LEU A 438 -0.068 5.921 -7.115 1.00 0.00 C ATOM 0 H LEU A 438 -0.283 1.309 -5.377 1.00 0.00 H new ATOM 0 HA LEU A 438 0.411 4.194 -5.050 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -0.197 3.194 -7.360 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -1.803 2.974 -6.693 1.00 0.00 H new ATOM 0 HG LEU A 438 -1.692 4.928 -8.089 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -2.599 6.642 -6.601 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -3.275 5.026 -6.292 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -2.043 5.698 -5.198 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -0.362 6.921 -7.434 1.00 0.00 H new ATOM 0 HD22 LEU A 438 0.374 5.972 -6.120 1.00 0.00 H new ATOM 0 HD23 LEU A 438 0.662 5.517 -7.816 1.00 0.00 H new ATOM 772 N VAL A 439 -1.085 4.097 -3.028 1.00 0.00 N ATOM 773 CA VAL A 439 -1.991 4.116 -1.882 1.00 0.00 C ATOM 774 C VAL A 439 -3.244 4.935 -2.155 1.00 0.00 C ATOM 775 O VAL A 439 -3.181 6.112 -2.492 1.00 0.00 O ATOM 776 CB VAL A 439 -1.293 4.554 -0.548 1.00 0.00 C ATOM 777 CG1 VAL A 439 -0.681 5.940 -0.643 1.00 0.00 C ATOM 778 CG2 VAL A 439 -2.257 4.465 0.635 1.00 0.00 C ATOM 0 H VAL A 439 -0.247 4.667 -2.914 1.00 0.00 H new ATOM 0 HA VAL A 439 -2.302 3.081 -1.737 1.00 0.00 H new ATOM 0 HB VAL A 439 -0.475 3.854 -0.378 1.00 0.00 H new ATOM 0 HG11 VAL A 439 -0.210 6.196 0.306 1.00 0.00 H new ATOM 0 HG12 VAL A 439 0.068 5.953 -1.435 1.00 0.00 H new ATOM 0 HG13 VAL A 439 -1.461 6.667 -0.869 1.00 0.00 H new ATOM 0 HG21 VAL A 439 -1.745 4.775 1.546 1.00 0.00 H new ATOM 0 HG22 VAL A 439 -3.111 5.119 0.459 1.00 0.00 H new ATOM 0 HG23 VAL A 439 -2.604 3.438 0.745 1.00 0.00 H new ATOM 788 N GLN A 440 -4.373 4.271 -2.075 1.00 0.00 N ATOM 789 CA GLN A 440 -5.664 4.905 -2.311 1.00 0.00 C ATOM 790 C GLN A 440 -6.569 4.698 -1.107 1.00 0.00 C ATOM 791 O GLN A 440 -7.592 5.352 -0.949 1.00 0.00 O ATOM 792 CB GLN A 440 -6.325 4.340 -3.569 1.00 0.00 C ATOM 793 CG GLN A 440 -5.543 4.561 -4.853 1.00 0.00 C ATOM 794 CD GLN A 440 -6.192 3.905 -6.050 1.00 0.00 C ATOM 795 OE1 GLN A 440 -7.409 3.742 -6.102 1.00 0.00 O ATOM 796 NE2 GLN A 440 -5.396 3.529 -7.021 1.00 0.00 N ATOM 0 H GLN A 440 -4.431 3.279 -1.846 1.00 0.00 H new ATOM 0 HA GLN A 440 -5.503 5.973 -2.460 1.00 0.00 H new ATOM 0 HB2 GLN A 440 -6.478 3.269 -3.433 1.00 0.00 H new ATOM 0 HB3 GLN A 440 -7.311 4.791 -3.678 1.00 0.00 H new ATOM 0 HG2 GLN A 440 -5.449 5.631 -5.037 1.00 0.00 H new ATOM 0 HG3 GLN A 440 -4.534 4.168 -4.731 1.00 0.00 H new ATOM 0 HE21 GLN A 440 -4.390 3.680 -6.944 1.00 0.00 H new ATOM 0 HE22 GLN A 440 -5.782 3.085 -7.854 1.00 0.00 H new ATOM 805 N ALA A 441 -6.174 3.771 -0.259 1.00 0.00 N ATOM 806 CA ALA A 441 -6.977 3.338 0.850 1.00 0.00 C ATOM 807 C ALA A 441 -6.986 4.333 2.012 1.00 0.00 C ATOM 808 O ALA A 441 -7.832 4.252 2.902 1.00 0.00 O ATOM 809 CB ALA A 441 -6.472 2.001 1.301 1.00 0.00 C ATOM 0 H ALA A 441 -5.274 3.295 -0.327 1.00 0.00 H new ATOM 0 HA ALA A 441 -8.012 3.268 0.515 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -7.068 1.652 2.144 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -6.550 1.287 0.481 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -5.429 2.090 1.606 1.00 0.00 H new ATOM 815 N GLY A 442 -6.060 5.253 2.004 1.00 0.00 N ATOM 816 CA GLY A 442 -5.981 6.213 3.057 1.00 0.00 C ATOM 817 C GLY A 442 -4.687 6.948 3.004 1.00 0.00 C ATOM 818 O GLY A 442 -4.513 7.822 2.173 1.00 0.00 O ATOM 0 H GLY A 442 -5.352 5.353 1.277 1.00 0.00 H new ATOM 0 HA2 GLY A 442 -6.809 6.918 2.976 1.00 0.00 H new ATOM 0 HA3 GLY A 442 -6.081 5.713 4.020 1.00 0.00 H new ATOM 822 N THR A 443 -3.784 6.560 3.839 1.00 0.00 N ATOM 823 CA THR A 443 -2.483 7.167 3.948 1.00 0.00 C ATOM 824 C THR A 443 -1.554 6.016 4.276 1.00 0.00 C ATOM 825 O THR A 443 -1.976 5.090 4.962 1.00 0.00 O ATOM 826 CB THR A 443 -2.461 8.148 5.147 1.00 0.00 C ATOM 827 OG1 THR A 443 -3.689 8.896 5.216 1.00 0.00 O ATOM 828 CG2 THR A 443 -1.297 9.120 5.072 1.00 0.00 C ATOM 0 H THR A 443 -3.927 5.787 4.489 1.00 0.00 H new ATOM 0 HA THR A 443 -2.210 7.709 3.043 1.00 0.00 H new ATOM 0 HB THR A 443 -2.345 7.539 6.044 1.00 0.00 H new ATOM 0 HG1 THR A 443 -3.656 9.509 5.980 1.00 0.00 H new ATOM 0 HG21 THR A 443 -1.324 9.787 5.934 1.00 0.00 H new ATOM 0 HG22 THR A 443 -0.359 8.565 5.072 1.00 0.00 H new ATOM 0 HG23 THR A 443 -1.371 9.707 4.156 1.00 0.00 H new ATOM 836 N LEU A 444 -0.357 6.019 3.784 1.00 0.00 N ATOM 837 CA LEU A 444 0.534 4.948 4.114 1.00 0.00 C ATOM 838 C LEU A 444 1.589 5.487 5.038 1.00 0.00 C ATOM 839 O LEU A 444 2.200 6.523 4.768 1.00 0.00 O ATOM 840 CB LEU A 444 1.122 4.297 2.862 1.00 0.00 C ATOM 841 CG LEU A 444 0.998 2.758 2.793 1.00 0.00 C ATOM 842 CD1 LEU A 444 1.443 2.274 1.464 1.00 0.00 C ATOM 843 CD2 LEU A 444 1.806 2.066 3.873 1.00 0.00 C ATOM 0 H LEU A 444 0.023 6.734 3.164 1.00 0.00 H new ATOM 0 HA LEU A 444 -0.009 4.151 4.622 1.00 0.00 H new ATOM 0 HB2 LEU A 444 0.631 4.723 1.987 1.00 0.00 H new ATOM 0 HB3 LEU A 444 2.177 4.563 2.797 1.00 0.00 H new ATOM 0 HG LEU A 444 -0.052 2.513 2.953 1.00 0.00 H new ATOM 0 HD11 LEU A 444 1.353 1.189 1.423 1.00 0.00 H new ATOM 0 HD12 LEU A 444 0.821 2.719 0.688 1.00 0.00 H new ATOM 0 HD13 LEU A 444 2.483 2.558 1.303 1.00 0.00 H new ATOM 0 HD21 LEU A 444 1.686 0.986 3.782 1.00 0.00 H new ATOM 0 HD22 LEU A 444 2.859 2.325 3.762 1.00 0.00 H new ATOM 0 HD23 LEU A 444 1.455 2.389 4.853 1.00 0.00 H new ATOM 855 N LYS A 445 1.792 4.809 6.122 1.00 0.00 N ATOM 856 CA LYS A 445 2.649 5.281 7.170 1.00 0.00 C ATOM 857 C LYS A 445 3.480 4.119 7.702 1.00 0.00 C ATOM 858 O LYS A 445 3.020 2.974 7.685 1.00 0.00 O ATOM 859 CB LYS A 445 1.743 5.797 8.272 1.00 0.00 C ATOM 860 CG LYS A 445 2.433 6.371 9.486 1.00 0.00 C ATOM 861 CD LYS A 445 1.566 6.151 10.706 1.00 0.00 C ATOM 862 CE LYS A 445 1.574 4.667 11.093 1.00 0.00 C ATOM 863 NZ LYS A 445 0.562 4.329 12.115 1.00 0.00 N ATOM 0 H LYS A 445 1.364 3.902 6.310 1.00 0.00 H new ATOM 0 HA LYS A 445 3.323 6.060 6.813 1.00 0.00 H new ATOM 0 HB2 LYS A 445 1.094 6.565 7.851 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.099 4.980 8.598 1.00 0.00 H new ATOM 0 HG2 LYS A 445 3.404 5.895 9.625 1.00 0.00 H new ATOM 0 HG3 LYS A 445 2.617 7.436 9.344 1.00 0.00 H new ATOM 0 HD2 LYS A 445 1.933 6.754 11.537 1.00 0.00 H new ATOM 0 HD3 LYS A 445 0.546 6.477 10.501 1.00 0.00 H new ATOM 0 HE2 LYS A 445 1.397 4.064 10.202 1.00 0.00 H new ATOM 0 HE3 LYS A 445 2.563 4.401 11.467 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 1.018 3.822 12.900 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 0.126 5.202 12.474 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 -0.171 3.725 11.691 1.00 0.00 H new ATOM 877 N VAL A 446 4.687 4.402 8.149 1.00 0.00 N ATOM 878 CA VAL A 446 5.534 3.385 8.724 1.00 0.00 C ATOM 879 C VAL A 446 5.014 2.944 10.073 1.00 0.00 C ATOM 880 O VAL A 446 4.509 3.752 10.860 1.00 0.00 O ATOM 881 CB VAL A 446 7.028 3.805 8.841 1.00 0.00 C ATOM 882 CG1 VAL A 446 7.623 4.070 7.482 1.00 0.00 C ATOM 883 CG2 VAL A 446 7.207 5.025 9.746 1.00 0.00 C ATOM 0 H VAL A 446 5.102 5.333 8.123 1.00 0.00 H new ATOM 0 HA VAL A 446 5.498 2.548 8.026 1.00 0.00 H new ATOM 0 HB VAL A 446 7.560 2.970 9.298 1.00 0.00 H new ATOM 0 HG11 VAL A 446 8.667 4.362 7.593 1.00 0.00 H new ATOM 0 HG12 VAL A 446 7.561 3.167 6.875 1.00 0.00 H new ATOM 0 HG13 VAL A 446 7.072 4.874 6.994 1.00 0.00 H new ATOM 0 HG21 VAL A 446 8.264 5.285 9.801 1.00 0.00 H new ATOM 0 HG22 VAL A 446 6.647 5.866 9.338 1.00 0.00 H new ATOM 0 HG23 VAL A 446 6.838 4.794 10.745 1.00 0.00 H new ATOM 893 N GLY A 447 5.119 1.672 10.325 1.00 0.00 N ATOM 894 CA GLY A 447 4.654 1.130 11.560 1.00 0.00 C ATOM 895 C GLY A 447 3.190 0.766 11.519 1.00 0.00 C ATOM 896 O GLY A 447 2.630 0.318 12.521 1.00 0.00 O ATOM 0 H GLY A 447 5.526 0.990 9.685 1.00 0.00 H new ATOM 0 HA2 GLY A 447 5.238 0.243 11.806 1.00 0.00 H new ATOM 0 HA3 GLY A 447 4.822 1.854 12.357 1.00 0.00 H new ATOM 900 N ASP A 448 2.565 0.925 10.378 1.00 0.00 N ATOM 901 CA ASP A 448 1.157 0.605 10.277 1.00 0.00 C ATOM 902 C ASP A 448 1.017 -0.815 9.755 1.00 0.00 C ATOM 903 O ASP A 448 1.742 -1.201 8.814 1.00 0.00 O ATOM 904 CB ASP A 448 0.430 1.569 9.332 1.00 0.00 C ATOM 905 CG ASP A 448 -0.989 1.864 9.790 1.00 0.00 C ATOM 906 OD1 ASP A 448 -1.891 1.040 9.575 1.00 0.00 O ATOM 907 OD2 ASP A 448 -1.210 2.952 10.413 1.00 0.00 O ATOM 0 H ASP A 448 2.996 1.267 9.519 1.00 0.00 H new ATOM 0 HA ASP A 448 0.706 0.699 11.265 1.00 0.00 H new ATOM 0 HB2 ASP A 448 0.990 2.502 9.267 1.00 0.00 H new ATOM 0 HB3 ASP A 448 0.405 1.142 8.330 1.00 0.00 H new ATOM 912 N PRO A 449 0.198 -1.655 10.414 1.00 0.00 N ATOM 913 CA PRO A 449 -0.115 -2.989 9.915 1.00 0.00 C ATOM 914 C PRO A 449 -0.943 -2.881 8.641 1.00 0.00 C ATOM 915 O PRO A 449 -2.003 -2.263 8.635 1.00 0.00 O ATOM 916 CB PRO A 449 -0.950 -3.630 11.039 1.00 0.00 C ATOM 917 CG PRO A 449 -0.728 -2.767 12.231 1.00 0.00 C ATOM 918 CD PRO A 449 -0.458 -1.389 11.704 1.00 0.00 C ATOM 0 HA PRO A 449 0.775 -3.571 9.674 1.00 0.00 H new ATOM 0 HB2 PRO A 449 -2.006 -3.668 10.772 1.00 0.00 H new ATOM 0 HB3 PRO A 449 -0.632 -4.655 11.230 1.00 0.00 H new ATOM 0 HG2 PRO A 449 -1.602 -2.771 12.883 1.00 0.00 H new ATOM 0 HG3 PRO A 449 0.112 -3.129 12.823 1.00 0.00 H new ATOM 0 HD2 PRO A 449 -1.377 -0.816 11.580 1.00 0.00 H new ATOM 0 HD3 PRO A 449 0.185 -0.818 12.374 1.00 0.00 H new ATOM 926 N ILE A 450 -0.470 -3.464 7.588 1.00 0.00 N ATOM 927 CA ILE A 450 -1.102 -3.361 6.286 1.00 0.00 C ATOM 928 C ILE A 450 -1.336 -4.737 5.700 1.00 0.00 C ATOM 929 O ILE A 450 -0.728 -5.701 6.152 1.00 0.00 O ATOM 930 CB ILE A 450 -0.237 -2.472 5.318 1.00 0.00 C ATOM 931 CG1 ILE A 450 1.249 -2.929 5.266 1.00 0.00 C ATOM 932 CG2 ILE A 450 -0.322 -1.004 5.705 1.00 0.00 C ATOM 933 CD1 ILE A 450 1.535 -4.128 4.384 1.00 0.00 C ATOM 0 H ILE A 450 0.375 -4.035 7.594 1.00 0.00 H new ATOM 0 HA ILE A 450 -2.071 -2.877 6.408 1.00 0.00 H new ATOM 0 HB ILE A 450 -0.655 -2.599 4.319 1.00 0.00 H new ATOM 0 HG12 ILE A 450 1.856 -2.093 4.919 1.00 0.00 H new ATOM 0 HG13 ILE A 450 1.575 -3.160 6.280 1.00 0.00 H new ATOM 0 HG21 ILE A 450 0.285 -0.411 5.020 1.00 0.00 H new ATOM 0 HG22 ILE A 450 -1.359 -0.673 5.650 1.00 0.00 H new ATOM 0 HG23 ILE A 450 0.047 -0.874 6.722 1.00 0.00 H new ATOM 0 HD11 ILE A 450 2.599 -4.361 4.421 1.00 0.00 H new ATOM 0 HD12 ILE A 450 0.963 -4.985 4.739 1.00 0.00 H new ATOM 0 HD13 ILE A 450 1.249 -3.901 3.357 1.00 0.00 H new ATOM 945 N VAL A 451 -2.199 -4.831 4.707 1.00 0.00 N ATOM 946 CA VAL A 451 -2.468 -6.095 4.051 1.00 0.00 C ATOM 947 C VAL A 451 -2.344 -5.923 2.541 1.00 0.00 C ATOM 948 O VAL A 451 -2.984 -5.048 1.949 1.00 0.00 O ATOM 949 CB VAL A 451 -3.853 -6.722 4.471 1.00 0.00 C ATOM 950 CG1 VAL A 451 -5.026 -5.808 4.162 1.00 0.00 C ATOM 951 CG2 VAL A 451 -4.061 -8.095 3.838 1.00 0.00 C ATOM 0 H VAL A 451 -2.728 -4.042 4.336 1.00 0.00 H new ATOM 0 HA VAL A 451 -1.720 -6.814 4.383 1.00 0.00 H new ATOM 0 HB VAL A 451 -3.816 -6.844 5.554 1.00 0.00 H new ATOM 0 HG11 VAL A 451 -5.954 -6.289 4.472 1.00 0.00 H new ATOM 0 HG12 VAL A 451 -4.907 -4.868 4.702 1.00 0.00 H new ATOM 0 HG13 VAL A 451 -5.060 -5.609 3.091 1.00 0.00 H new ATOM 0 HG21 VAL A 451 -5.025 -8.497 4.149 1.00 0.00 H new ATOM 0 HG22 VAL A 451 -4.040 -8.002 2.752 1.00 0.00 H new ATOM 0 HG23 VAL A 451 -3.266 -8.768 4.160 1.00 0.00 H new ATOM 961 N VAL A 452 -1.469 -6.711 1.945 1.00 0.00 N ATOM 962 CA VAL A 452 -1.169 -6.653 0.524 1.00 0.00 C ATOM 963 C VAL A 452 -1.154 -8.071 -0.020 1.00 0.00 C ATOM 964 O VAL A 452 -0.452 -8.930 0.526 1.00 0.00 O ATOM 965 CB VAL A 452 0.244 -6.029 0.267 1.00 0.00 C ATOM 966 CG1 VAL A 452 0.523 -5.890 -1.218 1.00 0.00 C ATOM 967 CG2 VAL A 452 0.402 -4.688 0.952 1.00 0.00 C ATOM 0 H VAL A 452 -0.936 -7.424 2.443 1.00 0.00 H new ATOM 0 HA VAL A 452 -1.925 -6.037 0.036 1.00 0.00 H new ATOM 0 HB VAL A 452 0.973 -6.716 0.697 1.00 0.00 H new ATOM 0 HG11 VAL A 452 1.511 -5.454 -1.363 1.00 0.00 H new ATOM 0 HG12 VAL A 452 0.487 -6.873 -1.688 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -0.229 -5.243 -1.671 1.00 0.00 H new ATOM 0 HG21 VAL A 452 1.396 -4.290 0.748 1.00 0.00 H new ATOM 0 HG22 VAL A 452 -0.350 -3.996 0.574 1.00 0.00 H new ATOM 0 HG23 VAL A 452 0.274 -4.811 2.027 1.00 0.00 H new ATOM 977 N GLY A 453 -1.943 -8.327 -1.054 1.00 0.00 N ATOM 978 CA GLY A 453 -1.969 -9.643 -1.677 1.00 0.00 C ATOM 979 C GLY A 453 -2.433 -10.714 -0.718 1.00 0.00 C ATOM 980 O GLY A 453 -1.878 -11.817 -0.680 1.00 0.00 O ATOM 0 H GLY A 453 -2.571 -7.644 -1.478 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -2.630 -9.621 -2.543 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -0.973 -9.891 -2.043 1.00 0.00 H new ATOM 984 N THR A 454 -3.427 -10.356 0.098 1.00 0.00 N ATOM 985 CA THR A 454 -4.019 -11.205 1.094 1.00 0.00 C ATOM 986 C THR A 454 -3.012 -11.593 2.240 1.00 0.00 C ATOM 987 O THR A 454 -3.313 -12.426 3.101 1.00 0.00 O ATOM 988 CB THR A 454 -4.659 -12.449 0.432 1.00 0.00 C ATOM 989 OG1 THR A 454 -5.270 -12.041 -0.812 1.00 0.00 O ATOM 990 CG2 THR A 454 -5.761 -12.963 1.314 1.00 0.00 C ATOM 0 H THR A 454 -3.847 -9.427 0.069 1.00 0.00 H new ATOM 0 HA THR A 454 -4.810 -10.636 1.581 1.00 0.00 H new ATOM 0 HB THR A 454 -3.897 -13.212 0.274 1.00 0.00 H new ATOM 0 HG1 THR A 454 -5.679 -12.819 -1.246 1.00 0.00 H new ATOM 0 HG21 THR A 454 -6.217 -13.840 0.854 1.00 0.00 H new ATOM 0 HG22 THR A 454 -5.351 -13.235 2.287 1.00 0.00 H new ATOM 0 HG23 THR A 454 -6.516 -12.187 1.443 1.00 0.00 H new ATOM 998 N THR A 455 -1.853 -10.964 2.264 1.00 0.00 N ATOM 999 CA THR A 455 -0.868 -11.182 3.315 1.00 0.00 C ATOM 1000 C THR A 455 -0.746 -9.886 4.127 1.00 0.00 C ATOM 1001 O THR A 455 -0.754 -8.807 3.542 1.00 0.00 O ATOM 1002 CB THR A 455 0.509 -11.558 2.690 1.00 0.00 C ATOM 1003 OG1 THR A 455 0.343 -12.715 1.837 1.00 0.00 O ATOM 1004 CG2 THR A 455 1.541 -11.867 3.775 1.00 0.00 C ATOM 0 H THR A 455 -1.564 -10.287 1.558 1.00 0.00 H new ATOM 0 HA THR A 455 -1.181 -12.002 3.961 1.00 0.00 H new ATOM 0 HB THR A 455 0.870 -10.710 2.108 1.00 0.00 H new ATOM 0 HG1 THR A 455 1.206 -12.955 1.440 1.00 0.00 H new ATOM 0 HG21 THR A 455 2.492 -12.126 3.309 1.00 0.00 H new ATOM 0 HG22 THR A 455 1.675 -10.991 4.410 1.00 0.00 H new ATOM 0 HG23 THR A 455 1.193 -12.704 4.380 1.00 0.00 H new ATOM 1012 N TYR A 456 -0.677 -9.962 5.449 1.00 0.00 N ATOM 1013 CA TYR A 456 -0.559 -8.741 6.214 1.00 0.00 C ATOM 1014 C TYR A 456 0.809 -8.637 6.872 1.00 0.00 C ATOM 1015 O TYR A 456 1.443 -9.649 7.184 1.00 0.00 O ATOM 1016 CB TYR A 456 -1.718 -8.529 7.237 1.00 0.00 C ATOM 1017 CG TYR A 456 -1.702 -9.381 8.501 1.00 0.00 C ATOM 1018 CD1 TYR A 456 -0.899 -9.026 9.580 1.00 0.00 C ATOM 1019 CD2 TYR A 456 -2.504 -10.506 8.630 1.00 0.00 C ATOM 1020 CE1 TYR A 456 -0.887 -9.764 10.736 1.00 0.00 C ATOM 1021 CE2 TYR A 456 -2.502 -11.250 9.798 1.00 0.00 C ATOM 1022 CZ TYR A 456 -1.686 -10.869 10.847 1.00 0.00 C ATOM 1023 OH TYR A 456 -1.676 -11.598 12.020 1.00 0.00 O ATOM 0 H TYR A 456 -0.700 -10.825 5.993 1.00 0.00 H new ATOM 0 HA TYR A 456 -0.654 -7.923 5.500 1.00 0.00 H new ATOM 0 HB2 TYR A 456 -1.715 -7.481 7.537 1.00 0.00 H new ATOM 0 HB3 TYR A 456 -2.661 -8.710 6.721 1.00 0.00 H new ATOM 0 HD1 TYR A 456 -0.271 -8.150 9.506 1.00 0.00 H new ATOM 0 HD2 TYR A 456 -3.138 -10.805 7.809 1.00 0.00 H new ATOM 0 HE1 TYR A 456 -0.248 -9.473 11.557 1.00 0.00 H new ATOM 0 HE2 TYR A 456 -3.133 -12.122 9.889 1.00 0.00 H new ATOM 0 HH TYR A 456 -2.298 -12.352 11.942 1.00 0.00 H new ATOM 1033 N GLY A 457 1.250 -7.432 7.064 1.00 0.00 N ATOM 1034 CA GLY A 457 2.531 -7.168 7.654 1.00 0.00 C ATOM 1035 C GLY A 457 2.542 -5.794 8.248 1.00 0.00 C ATOM 1036 O GLY A 457 1.482 -5.196 8.424 1.00 0.00 O ATOM 0 H GLY A 457 0.727 -6.593 6.813 1.00 0.00 H new ATOM 0 HA2 GLY A 457 2.747 -7.909 8.424 1.00 0.00 H new ATOM 0 HA3 GLY A 457 3.314 -7.255 6.900 1.00 0.00 H new ATOM 1040 N ARG A 458 3.696 -5.272 8.539 1.00 0.00 N ATOM 1041 CA ARG A 458 3.792 -3.959 9.127 1.00 0.00 C ATOM 1042 C ARG A 458 4.865 -3.185 8.398 1.00 0.00 C ATOM 1043 O ARG A 458 5.976 -3.680 8.239 1.00 0.00 O ATOM 1044 CB ARG A 458 4.118 -4.061 10.619 1.00 0.00 C ATOM 1045 CG ARG A 458 4.024 -2.742 11.361 1.00 0.00 C ATOM 1046 CD ARG A 458 4.424 -2.887 12.820 1.00 0.00 C ATOM 1047 NE ARG A 458 4.172 -1.647 13.569 1.00 0.00 N ATOM 1048 CZ ARG A 458 4.863 -1.216 14.629 1.00 0.00 C ATOM 1049 NH1 ARG A 458 5.946 -1.868 15.032 1.00 0.00 N ATOM 1050 NH2 ARG A 458 4.481 -0.103 15.259 1.00 0.00 N ATOM 0 H ARG A 458 4.591 -5.734 8.380 1.00 0.00 H new ATOM 0 HA ARG A 458 2.838 -3.441 9.033 1.00 0.00 H new ATOM 0 HB2 ARG A 458 3.437 -4.776 11.081 1.00 0.00 H new ATOM 0 HB3 ARG A 458 5.126 -4.460 10.734 1.00 0.00 H new ATOM 0 HG2 ARG A 458 4.668 -2.007 10.879 1.00 0.00 H new ATOM 0 HG3 ARG A 458 3.004 -2.362 11.299 1.00 0.00 H new ATOM 0 HD2 ARG A 458 3.867 -3.707 13.272 1.00 0.00 H new ATOM 0 HD3 ARG A 458 5.481 -3.146 12.886 1.00 0.00 H new ATOM 0 HE ARG A 458 3.399 -1.062 13.251 1.00 0.00 H new ATOM 0 HH11 ARG A 458 6.255 -2.702 14.532 1.00 0.00 H new ATOM 0 HH12 ARG A 458 6.470 -1.535 15.841 1.00 0.00 H new ATOM 0 HH21 ARG A 458 3.665 0.414 14.931 1.00 0.00 H new ATOM 0 HH22 ARG A 458 5.005 0.230 16.068 1.00 0.00 H new ATOM 1064 N VAL A 459 4.539 -1.987 7.971 1.00 0.00 N ATOM 1065 CA VAL A 459 5.454 -1.172 7.172 1.00 0.00 C ATOM 1066 C VAL A 459 6.727 -0.840 7.942 1.00 0.00 C ATOM 1067 O VAL A 459 6.688 -0.133 8.947 1.00 0.00 O ATOM 1068 CB VAL A 459 4.791 0.127 6.691 1.00 0.00 C ATOM 1069 CG1 VAL A 459 5.737 0.919 5.802 1.00 0.00 C ATOM 1070 CG2 VAL A 459 3.512 -0.183 5.953 1.00 0.00 C ATOM 0 H VAL A 459 3.640 -1.543 8.161 1.00 0.00 H new ATOM 0 HA VAL A 459 5.716 -1.771 6.300 1.00 0.00 H new ATOM 0 HB VAL A 459 4.554 0.736 7.564 1.00 0.00 H new ATOM 0 HG11 VAL A 459 5.246 1.835 5.473 1.00 0.00 H new ATOM 0 HG12 VAL A 459 6.637 1.171 6.362 1.00 0.00 H new ATOM 0 HG13 VAL A 459 6.007 0.320 4.932 1.00 0.00 H new ATOM 0 HG21 VAL A 459 3.051 0.746 5.617 1.00 0.00 H new ATOM 0 HG22 VAL A 459 3.733 -0.811 5.090 1.00 0.00 H new ATOM 0 HG23 VAL A 459 2.826 -0.708 6.618 1.00 0.00 H new ATOM 1080 N ARG A 460 7.833 -1.366 7.462 1.00 0.00 N ATOM 1081 CA ARG A 460 9.129 -1.178 8.090 1.00 0.00 C ATOM 1082 C ARG A 460 9.700 0.180 7.673 1.00 0.00 C ATOM 1083 O ARG A 460 10.036 1.013 8.512 1.00 0.00 O ATOM 1084 CB ARG A 460 10.066 -2.366 7.698 1.00 0.00 C ATOM 1085 CG ARG A 460 11.390 -2.497 8.481 1.00 0.00 C ATOM 1086 CD ARG A 460 12.440 -1.459 8.098 1.00 0.00 C ATOM 1087 NE ARG A 460 13.637 -1.560 8.946 1.00 0.00 N ATOM 1088 CZ ARG A 460 14.679 -0.718 8.924 1.00 0.00 C ATOM 1089 NH1 ARG A 460 14.843 0.117 7.897 1.00 0.00 N ATOM 1090 NH2 ARG A 460 15.610 -0.787 9.875 1.00 0.00 N ATOM 0 H ARG A 460 7.862 -1.940 6.620 1.00 0.00 H new ATOM 0 HA ARG A 460 9.038 -1.175 9.176 1.00 0.00 H new ATOM 0 HB2 ARG A 460 9.507 -3.294 7.819 1.00 0.00 H new ATOM 0 HB3 ARG A 460 10.306 -2.274 6.639 1.00 0.00 H new ATOM 0 HG2 ARG A 460 11.180 -2.411 9.547 1.00 0.00 H new ATOM 0 HG3 ARG A 460 11.801 -3.493 8.316 1.00 0.00 H new ATOM 0 HD2 ARG A 460 12.721 -1.594 7.054 1.00 0.00 H new ATOM 0 HD3 ARG A 460 12.014 -0.460 8.187 1.00 0.00 H new ATOM 0 HE ARG A 460 13.677 -2.336 9.606 1.00 0.00 H new ATOM 0 HH11 ARG A 460 14.175 0.115 7.127 1.00 0.00 H new ATOM 0 HH12 ARG A 460 15.637 0.757 7.882 1.00 0.00 H new ATOM 0 HH21 ARG A 460 15.529 -1.480 10.619 1.00 0.00 H new ATOM 0 HH22 ARG A 460 16.404 -0.146 9.859 1.00 0.00 H new ATOM 1104 N ALA A 461 9.797 0.396 6.395 1.00 0.00 N ATOM 1105 CA ALA A 461 10.307 1.625 5.857 1.00 0.00 C ATOM 1106 C ALA A 461 9.409 2.078 4.750 1.00 0.00 C ATOM 1107 O ALA A 461 8.741 1.255 4.107 1.00 0.00 O ATOM 1108 CB ALA A 461 11.713 1.418 5.328 1.00 0.00 C ATOM 0 H ALA A 461 9.521 -0.284 5.687 1.00 0.00 H new ATOM 0 HA ALA A 461 10.338 2.382 6.641 1.00 0.00 H new ATOM 0 HB1 ALA A 461 12.091 2.356 4.922 1.00 0.00 H new ATOM 0 HB2 ALA A 461 12.362 1.086 6.139 1.00 0.00 H new ATOM 0 HB3 ALA A 461 11.699 0.662 4.542 1.00 0.00 H new ATOM 1114 N MET A 462 9.378 3.358 4.537 1.00 0.00 N ATOM 1115 CA MET A 462 8.582 3.930 3.501 1.00 0.00 C ATOM 1116 C MET A 462 9.520 4.540 2.520 1.00 0.00 C ATOM 1117 O MET A 462 10.308 5.415 2.872 1.00 0.00 O ATOM 1118 CB MET A 462 7.684 5.020 4.067 1.00 0.00 C ATOM 1119 CG MET A 462 6.660 5.572 3.086 1.00 0.00 C ATOM 1120 SD MET A 462 5.412 4.370 2.662 1.00 0.00 S ATOM 1121 CE MET A 462 4.713 4.131 4.280 1.00 0.00 C ATOM 0 H MET A 462 9.909 4.037 5.082 1.00 0.00 H new ATOM 0 HA MET A 462 7.954 3.168 3.040 1.00 0.00 H new ATOM 0 HB2 MET A 462 7.158 4.624 4.936 1.00 0.00 H new ATOM 0 HB3 MET A 462 8.309 5.841 4.419 1.00 0.00 H new ATOM 0 HG2 MET A 462 6.182 6.451 3.519 1.00 0.00 H new ATOM 0 HG3 MET A 462 7.169 5.900 2.179 1.00 0.00 H new ATOM 0 HE1 MET A 462 3.715 3.703 4.186 1.00 0.00 H new ATOM 0 HE2 MET A 462 5.346 3.453 4.853 1.00 0.00 H new ATOM 0 HE3 MET A 462 4.649 5.090 4.794 1.00 0.00 H new ATOM 1131 N VAL A 463 9.506 4.059 1.345 1.00 0.00 N ATOM 1132 CA VAL A 463 10.339 4.579 0.321 1.00 0.00 C ATOM 1133 C VAL A 463 9.416 5.131 -0.728 1.00 0.00 C ATOM 1134 O VAL A 463 8.411 4.532 -1.012 1.00 0.00 O ATOM 1135 CB VAL A 463 11.254 3.470 -0.274 1.00 0.00 C ATOM 1136 CG1 VAL A 463 12.211 4.043 -1.296 1.00 0.00 C ATOM 1137 CG2 VAL A 463 12.030 2.760 0.833 1.00 0.00 C ATOM 0 H VAL A 463 8.912 3.283 1.053 1.00 0.00 H new ATOM 0 HA VAL A 463 11.004 5.350 0.710 1.00 0.00 H new ATOM 0 HB VAL A 463 10.613 2.744 -0.774 1.00 0.00 H new ATOM 0 HG11 VAL A 463 12.838 3.245 -1.695 1.00 0.00 H new ATOM 0 HG12 VAL A 463 11.645 4.500 -2.108 1.00 0.00 H new ATOM 0 HG13 VAL A 463 12.840 4.797 -0.823 1.00 0.00 H new ATOM 0 HG21 VAL A 463 12.664 1.988 0.396 1.00 0.00 H new ATOM 0 HG22 VAL A 463 12.651 3.482 1.363 1.00 0.00 H new ATOM 0 HG23 VAL A 463 11.330 2.302 1.532 1.00 0.00 H new ATOM 1147 N ASN A 464 9.698 6.275 -1.248 1.00 0.00 N ATOM 1148 CA ASN A 464 8.801 6.846 -2.236 1.00 0.00 C ATOM 1149 C ASN A 464 9.345 6.588 -3.616 1.00 0.00 C ATOM 1150 O ASN A 464 10.422 6.004 -3.745 1.00 0.00 O ATOM 1151 CB ASN A 464 8.590 8.339 -2.002 1.00 0.00 C ATOM 1152 CG ASN A 464 9.756 9.206 -2.418 1.00 0.00 C ATOM 1153 OD1 ASN A 464 9.831 9.658 -3.533 1.00 0.00 O ATOM 1154 ND2 ASN A 464 10.667 9.424 -1.541 1.00 0.00 N ATOM 0 H ASN A 464 10.520 6.836 -1.023 1.00 0.00 H new ATOM 0 HA ASN A 464 7.827 6.367 -2.140 1.00 0.00 H new ATOM 0 HB2 ASN A 464 7.702 8.658 -2.548 1.00 0.00 H new ATOM 0 HB3 ASN A 464 8.390 8.504 -0.943 1.00 0.00 H new ATOM 0 HD21 ASN A 464 11.480 9.992 -1.780 1.00 0.00 H new ATOM 0 HD22 ASN A 464 10.578 9.029 -0.605 1.00 0.00 H new ATOM 1161 N ASP A 465 8.642 7.065 -4.631 1.00 0.00 N ATOM 1162 CA ASP A 465 9.006 6.846 -6.036 1.00 0.00 C ATOM 1163 C ASP A 465 10.426 7.317 -6.373 1.00 0.00 C ATOM 1164 O ASP A 465 11.087 6.719 -7.226 1.00 0.00 O ATOM 1165 CB ASP A 465 7.996 7.504 -6.990 1.00 0.00 C ATOM 1166 CG ASP A 465 8.015 9.022 -6.961 1.00 0.00 C ATOM 1167 OD1 ASP A 465 7.447 9.621 -6.025 1.00 0.00 O ATOM 1168 OD2 ASP A 465 8.582 9.644 -7.894 1.00 0.00 O ATOM 0 H ASP A 465 7.795 7.620 -4.510 1.00 0.00 H new ATOM 0 HA ASP A 465 8.980 5.766 -6.179 1.00 0.00 H new ATOM 0 HB2 ASP A 465 8.200 7.168 -8.007 1.00 0.00 H new ATOM 0 HB3 ASP A 465 6.994 7.159 -6.736 1.00 0.00 H new ATOM 1173 N SER A 466 10.924 8.332 -5.677 1.00 0.00 N ATOM 1174 CA SER A 466 12.254 8.838 -5.950 1.00 0.00 C ATOM 1175 C SER A 466 13.314 7.877 -5.400 1.00 0.00 C ATOM 1176 O SER A 466 14.441 7.821 -5.898 1.00 0.00 O ATOM 1177 CB SER A 466 12.424 10.214 -5.328 1.00 0.00 C ATOM 1178 OG SER A 466 11.391 11.085 -5.738 1.00 0.00 O ATOM 0 H SER A 466 10.428 8.814 -4.927 1.00 0.00 H new ATOM 0 HA SER A 466 12.383 8.918 -7.029 1.00 0.00 H new ATOM 0 HB2 SER A 466 12.423 10.129 -4.241 1.00 0.00 H new ATOM 0 HB3 SER A 466 13.390 10.630 -5.614 1.00 0.00 H new ATOM 0 HG SER A 466 10.596 10.933 -5.185 1.00 0.00 H new ATOM 1184 N GLY A 467 12.941 7.110 -4.391 1.00 0.00 N ATOM 1185 CA GLY A 467 13.861 6.148 -3.811 1.00 0.00 C ATOM 1186 C GLY A 467 14.464 6.660 -2.537 1.00 0.00 C ATOM 1187 O GLY A 467 15.590 6.318 -2.170 1.00 0.00 O ATOM 0 H GLY A 467 12.017 7.133 -3.960 1.00 0.00 H new ATOM 0 HA2 GLY A 467 13.336 5.213 -3.616 1.00 0.00 H new ATOM 0 HA3 GLY A 467 14.653 5.925 -4.525 1.00 0.00 H new ATOM 1191 N ARG A 468 13.711 7.472 -1.859 1.00 0.00 N ATOM 1192 CA ARG A 468 14.142 8.086 -0.644 1.00 0.00 C ATOM 1193 C ARG A 468 13.269 7.589 0.487 1.00 0.00 C ATOM 1194 O ARG A 468 12.059 7.352 0.281 1.00 0.00 O ATOM 1195 CB ARG A 468 13.973 9.579 -0.779 1.00 0.00 C ATOM 1196 CG ARG A 468 14.714 10.190 -1.952 1.00 0.00 C ATOM 1197 CD ARG A 468 14.184 11.565 -2.218 1.00 0.00 C ATOM 1198 NE ARG A 468 14.734 12.170 -3.424 1.00 0.00 N ATOM 1199 CZ ARG A 468 14.099 13.098 -4.153 1.00 0.00 C ATOM 1200 NH1 ARG A 468 12.897 13.537 -3.782 1.00 0.00 N ATOM 1201 NH2 ARG A 468 14.655 13.567 -5.250 1.00 0.00 N ATOM 0 H ARG A 468 12.765 7.729 -2.141 1.00 0.00 H new ATOM 0 HA ARG A 468 15.185 7.843 -0.441 1.00 0.00 H new ATOM 0 HB2 ARG A 468 12.911 9.805 -0.878 1.00 0.00 H new ATOM 0 HB3 ARG A 468 14.316 10.056 0.139 1.00 0.00 H new ATOM 0 HG2 ARG A 468 15.782 10.236 -1.737 1.00 0.00 H new ATOM 0 HG3 ARG A 468 14.594 9.565 -2.837 1.00 0.00 H new ATOM 0 HD2 ARG A 468 13.099 11.518 -2.306 1.00 0.00 H new ATOM 0 HD3 ARG A 468 14.407 12.205 -1.364 1.00 0.00 H new ATOM 0 HE ARG A 468 15.659 11.869 -3.732 1.00 0.00 H new ATOM 0 HH11 ARG A 468 12.456 13.167 -2.940 1.00 0.00 H new ATOM 0 HH12 ARG A 468 12.417 14.243 -4.340 1.00 0.00 H new ATOM 0 HH21 ARG A 468 15.569 13.224 -5.545 1.00 0.00 H new ATOM 0 HH22 ARG A 468 14.172 14.273 -5.805 1.00 0.00 H new ATOM 1215 N ARG A 469 13.864 7.425 1.637 1.00 0.00 N ATOM 1216 CA ARG A 469 13.179 6.990 2.830 1.00 0.00 C ATOM 1217 C ARG A 469 12.373 8.139 3.427 1.00 0.00 C ATOM 1218 O ARG A 469 12.886 9.234 3.621 1.00 0.00 O ATOM 1219 CB ARG A 469 14.202 6.462 3.855 1.00 0.00 C ATOM 1220 CG ARG A 469 13.667 6.278 5.276 1.00 0.00 C ATOM 1221 CD ARG A 469 12.606 5.207 5.399 1.00 0.00 C ATOM 1222 NE ARG A 469 11.995 5.261 6.736 1.00 0.00 N ATOM 1223 CZ ARG A 469 12.274 4.449 7.771 1.00 0.00 C ATOM 1224 NH1 ARG A 469 13.159 3.471 7.640 1.00 0.00 N ATOM 1225 NH2 ARG A 469 11.687 4.646 8.945 1.00 0.00 N ATOM 0 H ARG A 469 14.860 7.593 1.777 1.00 0.00 H new ATOM 0 HA ARG A 469 12.490 6.186 2.571 1.00 0.00 H new ATOM 0 HB2 ARG A 469 14.585 5.505 3.502 1.00 0.00 H new ATOM 0 HB3 ARG A 469 15.047 7.150 3.889 1.00 0.00 H new ATOM 0 HG2 ARG A 469 14.498 6.030 5.937 1.00 0.00 H new ATOM 0 HG3 ARG A 469 13.255 7.225 5.624 1.00 0.00 H new ATOM 0 HD2 ARG A 469 11.842 5.349 4.634 1.00 0.00 H new ATOM 0 HD3 ARG A 469 13.047 4.225 5.230 1.00 0.00 H new ATOM 0 HE ARG A 469 11.292 5.984 6.893 1.00 0.00 H new ATOM 0 HH11 ARG A 469 13.635 3.330 6.749 1.00 0.00 H new ATOM 0 HH12 ARG A 469 13.364 2.860 8.430 1.00 0.00 H new ATOM 0 HH21 ARG A 469 11.025 5.413 9.062 1.00 0.00 H new ATOM 0 HH22 ARG A 469 11.898 4.030 9.730 1.00 0.00 H new ATOM 1239 N VAL A 470 11.130 7.866 3.702 1.00 0.00 N ATOM 1240 CA VAL A 470 10.214 8.785 4.333 1.00 0.00 C ATOM 1241 C VAL A 470 9.451 8.003 5.395 1.00 0.00 C ATOM 1242 O VAL A 470 9.738 6.813 5.597 1.00 0.00 O ATOM 1243 CB VAL A 470 9.234 9.461 3.308 1.00 0.00 C ATOM 1244 CG1 VAL A 470 9.974 10.423 2.393 1.00 0.00 C ATOM 1245 CG2 VAL A 470 8.502 8.427 2.470 1.00 0.00 C ATOM 0 H VAL A 470 10.706 6.964 3.486 1.00 0.00 H new ATOM 0 HA VAL A 470 10.773 9.607 4.781 1.00 0.00 H new ATOM 0 HB VAL A 470 8.501 10.018 3.892 1.00 0.00 H new ATOM 0 HG11 VAL A 470 9.270 10.875 1.695 1.00 0.00 H new ATOM 0 HG12 VAL A 470 10.445 11.204 2.990 1.00 0.00 H new ATOM 0 HG13 VAL A 470 10.739 9.881 1.837 1.00 0.00 H new ATOM 0 HG21 VAL A 470 7.833 8.931 1.773 1.00 0.00 H new ATOM 0 HG22 VAL A 470 9.226 7.832 1.913 1.00 0.00 H new ATOM 0 HG23 VAL A 470 7.921 7.775 3.122 1.00 0.00 H new ATOM 1255 N LYS A 471 8.532 8.623 6.081 1.00 0.00 N ATOM 1256 CA LYS A 471 7.800 7.915 7.122 1.00 0.00 C ATOM 1257 C LYS A 471 6.322 7.792 6.801 1.00 0.00 C ATOM 1258 O LYS A 471 5.647 6.879 7.294 1.00 0.00 O ATOM 1259 CB LYS A 471 7.981 8.584 8.496 1.00 0.00 C ATOM 1260 CG LYS A 471 7.512 10.037 8.566 1.00 0.00 C ATOM 1261 CD LYS A 471 7.613 10.604 9.977 1.00 0.00 C ATOM 1262 CE LYS A 471 9.040 10.568 10.499 1.00 0.00 C ATOM 1263 NZ LYS A 471 9.159 11.162 11.840 1.00 0.00 N ATOM 0 H LYS A 471 8.267 9.599 5.951 1.00 0.00 H new ATOM 0 HA LYS A 471 8.223 6.911 7.162 1.00 0.00 H new ATOM 0 HB2 LYS A 471 7.437 8.004 9.242 1.00 0.00 H new ATOM 0 HB3 LYS A 471 9.036 8.543 8.769 1.00 0.00 H new ATOM 0 HG2 LYS A 471 8.112 10.644 7.888 1.00 0.00 H new ATOM 0 HG3 LYS A 471 6.479 10.101 8.223 1.00 0.00 H new ATOM 0 HD2 LYS A 471 7.250 11.632 9.983 1.00 0.00 H new ATOM 0 HD3 LYS A 471 6.967 10.034 10.645 1.00 0.00 H new ATOM 0 HE2 LYS A 471 9.388 9.535 10.529 1.00 0.00 H new ATOM 0 HE3 LYS A 471 9.691 11.103 9.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 10.149 11.115 12.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 8.853 12.155 11.808 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 8.559 10.636 12.507 1.00 0.00 H new ATOM 1277 N GLU A 472 5.820 8.679 5.977 1.00 0.00 N ATOM 1278 CA GLU A 472 4.406 8.725 5.723 1.00 0.00 C ATOM 1279 C GLU A 472 4.157 9.377 4.368 1.00 0.00 C ATOM 1280 O GLU A 472 4.897 10.278 3.967 1.00 0.00 O ATOM 1281 CB GLU A 472 3.766 9.523 6.866 1.00 0.00 C ATOM 1282 CG GLU A 472 2.260 9.578 6.898 1.00 0.00 C ATOM 1283 CD GLU A 472 1.792 10.355 8.095 1.00 0.00 C ATOM 1284 OE1 GLU A 472 1.595 9.755 9.181 1.00 0.00 O ATOM 1285 OE2 GLU A 472 1.668 11.598 8.000 1.00 0.00 O ATOM 0 H GLU A 472 6.370 9.375 5.474 1.00 0.00 H new ATOM 0 HA GLU A 472 3.967 7.728 5.687 1.00 0.00 H new ATOM 0 HB2 GLU A 472 4.110 9.100 7.810 1.00 0.00 H new ATOM 0 HB3 GLU A 472 4.142 10.545 6.819 1.00 0.00 H new ATOM 0 HG2 GLU A 472 1.887 10.043 5.986 1.00 0.00 H new ATOM 0 HG3 GLU A 472 1.853 8.567 6.930 1.00 0.00 H new ATOM 1292 N ALA A 473 3.166 8.899 3.659 1.00 0.00 N ATOM 1293 CA ALA A 473 2.810 9.426 2.361 1.00 0.00 C ATOM 1294 C ALA A 473 1.310 9.373 2.190 1.00 0.00 C ATOM 1295 O ALA A 473 0.659 8.446 2.692 1.00 0.00 O ATOM 1296 CB ALA A 473 3.489 8.638 1.265 1.00 0.00 C ATOM 0 H ALA A 473 2.577 8.126 3.967 1.00 0.00 H new ATOM 0 HA ALA A 473 3.144 10.461 2.294 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.209 9.049 0.295 1.00 0.00 H new ATOM 0 HB2 ALA A 473 4.570 8.701 1.388 1.00 0.00 H new ATOM 0 HB3 ALA A 473 3.178 7.595 1.321 1.00 0.00 H new ATOM 1302 N GLY A 474 0.770 10.332 1.481 1.00 0.00 N ATOM 1303 CA GLY A 474 -0.654 10.429 1.326 1.00 0.00 C ATOM 1304 C GLY A 474 -1.158 9.701 0.100 1.00 0.00 C ATOM 1305 O GLY A 474 -0.360 9.178 -0.683 1.00 0.00 O ATOM 0 H GLY A 474 1.301 11.059 1.001 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -1.141 10.021 2.212 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -0.938 11.479 1.262 1.00 0.00 H new ATOM 1309 N PRO A 475 -2.482 9.683 -0.109 1.00 0.00 N ATOM 1310 CA PRO A 475 -3.106 8.973 -1.224 1.00 0.00 C ATOM 1311 C PRO A 475 -2.738 9.537 -2.591 1.00 0.00 C ATOM 1312 O PRO A 475 -2.253 10.683 -2.711 1.00 0.00 O ATOM 1313 CB PRO A 475 -4.599 9.138 -0.964 1.00 0.00 C ATOM 1314 CG PRO A 475 -4.693 10.382 -0.161 1.00 0.00 C ATOM 1315 CD PRO A 475 -3.487 10.364 0.725 1.00 0.00 C ATOM 0 HA PRO A 475 -2.772 7.936 -1.263 1.00 0.00 H new ATOM 0 HB2 PRO A 475 -5.159 9.222 -1.896 1.00 0.00 H new ATOM 0 HB3 PRO A 475 -5.006 8.283 -0.424 1.00 0.00 H new ATOM 0 HG2 PRO A 475 -4.700 11.265 -0.800 1.00 0.00 H new ATOM 0 HG3 PRO A 475 -5.612 10.405 0.424 1.00 0.00 H new ATOM 0 HD2 PRO A 475 -3.171 11.371 0.999 1.00 0.00 H new ATOM 0 HD3 PRO A 475 -3.675 9.825 1.654 1.00 0.00 H new ATOM 1323 N SER A 476 -2.957 8.704 -3.603 1.00 0.00 N ATOM 1324 CA SER A 476 -2.682 8.995 -5.000 1.00 0.00 C ATOM 1325 C SER A 476 -1.164 9.108 -5.255 1.00 0.00 C ATOM 1326 O SER A 476 -0.725 9.597 -6.313 1.00 0.00 O ATOM 1327 CB SER A 476 -3.443 10.263 -5.470 1.00 0.00 C ATOM 1328 OG SER A 476 -3.340 10.450 -6.886 1.00 0.00 O ATOM 0 H SER A 476 -3.346 7.772 -3.464 1.00 0.00 H new ATOM 0 HA SER A 476 -3.050 8.160 -5.597 1.00 0.00 H new ATOM 0 HB2 SER A 476 -4.493 10.182 -5.189 1.00 0.00 H new ATOM 0 HB3 SER A 476 -3.043 11.138 -4.958 1.00 0.00 H new ATOM 0 HG SER A 476 -2.409 10.324 -7.166 1.00 0.00 H new ATOM 1334 N MET A 477 -0.375 8.608 -4.329 1.00 0.00 N ATOM 1335 CA MET A 477 1.059 8.686 -4.427 1.00 0.00 C ATOM 1336 C MET A 477 1.709 7.308 -4.439 1.00 0.00 C ATOM 1337 O MET A 477 1.311 6.418 -3.671 1.00 0.00 O ATOM 1338 CB MET A 477 1.630 9.553 -3.298 1.00 0.00 C ATOM 1339 CG MET A 477 3.144 9.503 -3.192 1.00 0.00 C ATOM 1340 SD MET A 477 3.811 10.718 -2.043 1.00 0.00 S ATOM 1341 CE MET A 477 5.558 10.359 -2.177 1.00 0.00 C ATOM 0 H MET A 477 -0.713 8.137 -3.490 1.00 0.00 H new ATOM 0 HA MET A 477 1.295 9.157 -5.381 1.00 0.00 H new ATOM 0 HB2 MET A 477 1.320 10.586 -3.454 1.00 0.00 H new ATOM 0 HB3 MET A 477 1.198 9.230 -2.351 1.00 0.00 H new ATOM 0 HG2 MET A 477 3.447 8.506 -2.874 1.00 0.00 H new ATOM 0 HG3 MET A 477 3.577 9.668 -4.178 1.00 0.00 H new ATOM 0 HE1 MET A 477 6.133 11.251 -1.928 1.00 0.00 H new ATOM 0 HE2 MET A 477 5.818 9.556 -1.488 1.00 0.00 H new ATOM 0 HE3 MET A 477 5.789 10.051 -3.197 1.00 0.00 H new ATOM 1351 N PRO A 478 2.663 7.096 -5.368 1.00 0.00 N ATOM 1352 CA PRO A 478 3.447 5.869 -5.421 1.00 0.00 C ATOM 1353 C PRO A 478 4.469 5.790 -4.289 1.00 0.00 C ATOM 1354 O PRO A 478 5.306 6.696 -4.112 1.00 0.00 O ATOM 1355 CB PRO A 478 4.200 5.961 -6.751 1.00 0.00 C ATOM 1356 CG PRO A 478 4.197 7.406 -7.122 1.00 0.00 C ATOM 1357 CD PRO A 478 2.992 8.015 -6.487 1.00 0.00 C ATOM 0 HA PRO A 478 2.805 4.993 -5.327 1.00 0.00 H new ATOM 0 HB2 PRO A 478 5.218 5.585 -6.650 1.00 0.00 H new ATOM 0 HB3 PRO A 478 3.713 5.359 -7.518 1.00 0.00 H new ATOM 0 HG2 PRO A 478 5.106 7.896 -6.773 1.00 0.00 H new ATOM 0 HG3 PRO A 478 4.165 7.526 -8.205 1.00 0.00 H new ATOM 0 HD2 PRO A 478 3.199 9.023 -6.127 1.00 0.00 H new ATOM 0 HD3 PRO A 478 2.166 8.093 -7.194 1.00 0.00 H new ATOM 1365 N VAL A 479 4.417 4.715 -3.554 1.00 0.00 N ATOM 1366 CA VAL A 479 5.364 4.441 -2.494 1.00 0.00 C ATOM 1367 C VAL A 479 5.689 2.975 -2.474 1.00 0.00 C ATOM 1368 O VAL A 479 4.944 2.160 -3.017 1.00 0.00 O ATOM 1369 CB VAL A 479 4.904 4.908 -1.077 1.00 0.00 C ATOM 1370 CG1 VAL A 479 4.974 6.414 -0.951 1.00 0.00 C ATOM 1371 CG2 VAL A 479 3.499 4.426 -0.768 1.00 0.00 C ATOM 0 H VAL A 479 3.709 3.991 -3.671 1.00 0.00 H new ATOM 0 HA VAL A 479 6.251 5.032 -2.722 1.00 0.00 H new ATOM 0 HB VAL A 479 5.587 4.466 -0.352 1.00 0.00 H new ATOM 0 HG11 VAL A 479 4.648 6.711 0.046 1.00 0.00 H new ATOM 0 HG12 VAL A 479 6.000 6.745 -1.111 1.00 0.00 H new ATOM 0 HG13 VAL A 479 4.324 6.872 -1.697 1.00 0.00 H new ATOM 0 HG21 VAL A 479 3.208 4.767 0.225 1.00 0.00 H new ATOM 0 HG22 VAL A 479 2.806 4.827 -1.507 1.00 0.00 H new ATOM 0 HG23 VAL A 479 3.473 3.337 -0.800 1.00 0.00 H new ATOM 1381 N GLU A 480 6.786 2.660 -1.888 1.00 0.00 N ATOM 1382 CA GLU A 480 7.281 1.336 -1.801 1.00 0.00 C ATOM 1383 C GLU A 480 7.455 0.994 -0.336 1.00 0.00 C ATOM 1384 O GLU A 480 8.223 1.647 0.388 1.00 0.00 O ATOM 1385 CB GLU A 480 8.595 1.267 -2.573 1.00 0.00 C ATOM 1386 CG GLU A 480 9.199 -0.107 -2.726 1.00 0.00 C ATOM 1387 CD GLU A 480 10.340 -0.085 -3.712 1.00 0.00 C ATOM 1388 OE1 GLU A 480 10.081 0.135 -4.916 1.00 0.00 O ATOM 1389 OE2 GLU A 480 11.515 -0.251 -3.317 1.00 0.00 O ATOM 0 H GLU A 480 7.389 3.348 -1.437 1.00 0.00 H new ATOM 0 HA GLU A 480 6.596 0.610 -2.238 1.00 0.00 H new ATOM 0 HB2 GLU A 480 8.432 1.684 -3.567 1.00 0.00 H new ATOM 0 HB3 GLU A 480 9.321 1.908 -2.074 1.00 0.00 H new ATOM 0 HG2 GLU A 480 9.555 -0.462 -1.759 1.00 0.00 H new ATOM 0 HG3 GLU A 480 8.436 -0.809 -3.062 1.00 0.00 H new ATOM 1396 N ILE A 481 6.695 0.032 0.107 1.00 0.00 N ATOM 1397 CA ILE A 481 6.708 -0.377 1.491 1.00 0.00 C ATOM 1398 C ILE A 481 7.550 -1.618 1.672 1.00 0.00 C ATOM 1399 O ILE A 481 7.974 -2.247 0.694 1.00 0.00 O ATOM 1400 CB ILE A 481 5.292 -0.671 2.018 1.00 0.00 C ATOM 1401 CG1 ILE A 481 4.654 -1.843 1.262 1.00 0.00 C ATOM 1402 CG2 ILE A 481 4.440 0.577 1.910 1.00 0.00 C ATOM 1403 CD1 ILE A 481 3.316 -2.257 1.811 1.00 0.00 C ATOM 0 H ILE A 481 6.047 -0.494 -0.479 1.00 0.00 H new ATOM 0 HA ILE A 481 7.131 0.453 2.057 1.00 0.00 H new ATOM 0 HB ILE A 481 5.360 -0.961 3.067 1.00 0.00 H new ATOM 0 HG12 ILE A 481 4.538 -1.568 0.214 1.00 0.00 H new ATOM 0 HG13 ILE A 481 5.331 -2.697 1.295 1.00 0.00 H new ATOM 0 HG21 ILE A 481 3.438 0.367 2.284 1.00 0.00 H new ATOM 0 HG22 ILE A 481 4.888 1.376 2.502 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.381 0.888 0.867 1.00 0.00 H new ATOM 0 HD11 ILE A 481 2.925 -3.090 1.227 1.00 0.00 H new ATOM 0 HD12 ILE A 481 3.428 -2.564 2.851 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.623 -1.417 1.753 1.00 0.00 H new ATOM 1415 N THR A 482 7.747 -1.977 2.909 1.00 0.00 N ATOM 1416 CA THR A 482 8.537 -3.112 3.315 1.00 0.00 C ATOM 1417 C THR A 482 7.946 -3.652 4.608 1.00 0.00 C ATOM 1418 O THR A 482 7.122 -2.970 5.227 1.00 0.00 O ATOM 1419 CB THR A 482 9.986 -2.661 3.579 1.00 0.00 C ATOM 1420 OG1 THR A 482 9.953 -1.398 4.260 1.00 0.00 O ATOM 1421 CG2 THR A 482 10.791 -2.539 2.297 1.00 0.00 C ATOM 0 H THR A 482 7.346 -1.468 3.697 1.00 0.00 H new ATOM 0 HA THR A 482 8.533 -3.875 2.537 1.00 0.00 H new ATOM 0 HB THR A 482 10.477 -3.417 4.192 1.00 0.00 H new ATOM 0 HG1 THR A 482 10.274 -0.694 3.659 1.00 0.00 H new ATOM 0 HG21 THR A 482 11.806 -2.219 2.534 1.00 0.00 H new ATOM 0 HG22 THR A 482 10.824 -3.506 1.794 1.00 0.00 H new ATOM 0 HG23 THR A 482 10.322 -1.805 1.641 1.00 0.00 H new ATOM 1429 N GLY A 483 8.348 -4.835 5.019 1.00 0.00 N ATOM 1430 CA GLY A 483 7.868 -5.377 6.282 1.00 0.00 C ATOM 1431 C GLY A 483 6.679 -6.306 6.136 1.00 0.00 C ATOM 1432 O GLY A 483 5.947 -6.555 7.096 1.00 0.00 O ATOM 0 H GLY A 483 8.996 -5.436 4.510 1.00 0.00 H new ATOM 0 HA2 GLY A 483 8.681 -5.916 6.768 1.00 0.00 H new ATOM 0 HA3 GLY A 483 7.594 -4.552 6.940 1.00 0.00 H new ATOM 1436 N LEU A 484 6.461 -6.801 4.936 1.00 0.00 N ATOM 1437 CA LEU A 484 5.396 -7.763 4.729 1.00 0.00 C ATOM 1438 C LEU A 484 5.915 -9.155 5.099 1.00 0.00 C ATOM 1439 O LEU A 484 5.181 -10.006 5.604 1.00 0.00 O ATOM 1440 CB LEU A 484 4.931 -7.743 3.272 1.00 0.00 C ATOM 1441 CG LEU A 484 3.688 -8.576 2.959 1.00 0.00 C ATOM 1442 CD1 LEU A 484 2.469 -8.004 3.658 1.00 0.00 C ATOM 1443 CD2 LEU A 484 3.457 -8.651 1.472 1.00 0.00 C ATOM 0 H LEU A 484 6.996 -6.560 4.102 1.00 0.00 H new ATOM 0 HA LEU A 484 4.544 -7.505 5.358 1.00 0.00 H new ATOM 0 HB2 LEU A 484 4.734 -6.709 2.987 1.00 0.00 H new ATOM 0 HB3 LEU A 484 5.749 -8.096 2.644 1.00 0.00 H new ATOM 0 HG LEU A 484 3.855 -9.587 3.332 1.00 0.00 H new ATOM 0 HD11 LEU A 484 1.596 -8.612 3.422 1.00 0.00 H new ATOM 0 HD12 LEU A 484 2.633 -8.007 4.736 1.00 0.00 H new ATOM 0 HD13 LEU A 484 2.302 -6.981 3.319 1.00 0.00 H new ATOM 0 HD21 LEU A 484 2.568 -9.248 1.272 1.00 0.00 H new ATOM 0 HD22 LEU A 484 3.316 -7.646 1.075 1.00 0.00 H new ATOM 0 HD23 LEU A 484 4.320 -9.113 0.993 1.00 0.00 H new ATOM 1455 N HIS A 485 7.212 -9.341 4.835 1.00 0.00 N ATOM 1456 CA HIS A 485 7.973 -10.573 5.084 1.00 0.00 C ATOM 1457 C HIS A 485 7.440 -11.720 4.200 1.00 0.00 C ATOM 1458 O HIS A 485 7.670 -12.908 4.438 1.00 0.00 O ATOM 1459 CB HIS A 485 7.994 -10.912 6.597 1.00 0.00 C ATOM 1460 CG HIS A 485 8.961 -12.005 6.992 1.00 0.00 C ATOM 1461 ND1 HIS A 485 10.327 -11.848 6.995 1.00 0.00 N ATOM 1462 CD2 HIS A 485 8.736 -13.286 7.372 1.00 0.00 C ATOM 1463 CE1 HIS A 485 10.885 -12.992 7.359 1.00 0.00 C ATOM 1464 NE2 HIS A 485 9.962 -13.914 7.605 1.00 0.00 N ATOM 0 H HIS A 485 7.787 -8.606 4.424 1.00 0.00 H new ATOM 0 HA HIS A 485 9.014 -10.422 4.798 1.00 0.00 H new ATOM 0 HB2 HIS A 485 8.243 -10.008 7.153 1.00 0.00 H new ATOM 0 HB3 HIS A 485 6.990 -11.208 6.902 1.00 0.00 H new ATOM 0 HD2 HIS A 485 7.765 -13.747 7.478 1.00 0.00 H new ATOM 0 HE1 HIS A 485 11.949 -13.154 7.444 1.00 0.00 H new ATOM 0 HE2 HIS A 485 10.116 -14.878 7.902 1.00 0.00 H new ATOM 1472 N ASP A 486 6.784 -11.332 3.152 1.00 0.00 N ATOM 1473 CA ASP A 486 6.256 -12.229 2.165 1.00 0.00 C ATOM 1474 C ASP A 486 6.382 -11.469 0.871 1.00 0.00 C ATOM 1475 O ASP A 486 6.828 -10.306 0.895 1.00 0.00 O ATOM 1476 CB ASP A 486 4.786 -12.570 2.443 1.00 0.00 C ATOM 1477 CG ASP A 486 4.317 -13.840 1.742 1.00 0.00 C ATOM 1478 OD1 ASP A 486 4.049 -13.813 0.532 1.00 0.00 O ATOM 1479 OD2 ASP A 486 4.196 -14.898 2.404 1.00 0.00 O ATOM 0 H ASP A 486 6.593 -10.350 2.951 1.00 0.00 H new ATOM 0 HA ASP A 486 6.787 -13.181 2.155 1.00 0.00 H new ATOM 0 HB2 ASP A 486 4.644 -12.683 3.518 1.00 0.00 H new ATOM 0 HB3 ASP A 486 4.161 -11.736 2.125 1.00 0.00 H new ATOM 1484 N VAL A 487 5.985 -12.040 -0.218 1.00 0.00 N ATOM 1485 CA VAL A 487 6.179 -11.406 -1.493 1.00 0.00 C ATOM 1486 C VAL A 487 4.829 -11.217 -2.180 1.00 0.00 C ATOM 1487 O VAL A 487 4.193 -12.192 -2.606 1.00 0.00 O ATOM 1488 CB VAL A 487 7.141 -12.222 -2.410 1.00 0.00 C ATOM 1489 CG1 VAL A 487 7.470 -11.442 -3.676 1.00 0.00 C ATOM 1490 CG2 VAL A 487 8.422 -12.580 -1.667 1.00 0.00 C ATOM 0 H VAL A 487 5.522 -12.948 -0.257 1.00 0.00 H new ATOM 0 HA VAL A 487 6.644 -10.436 -1.319 1.00 0.00 H new ATOM 0 HB VAL A 487 6.634 -13.145 -2.692 1.00 0.00 H new ATOM 0 HG11 VAL A 487 8.142 -12.030 -4.301 1.00 0.00 H new ATOM 0 HG12 VAL A 487 6.551 -11.236 -4.225 1.00 0.00 H new ATOM 0 HG13 VAL A 487 7.952 -10.502 -3.409 1.00 0.00 H new ATOM 0 HG21 VAL A 487 9.078 -13.149 -2.326 1.00 0.00 H new ATOM 0 HG22 VAL A 487 8.927 -11.667 -1.352 1.00 0.00 H new ATOM 0 HG23 VAL A 487 8.179 -13.181 -0.791 1.00 0.00 H new ATOM 1500 N PRO A 488 4.365 -9.971 -2.285 1.00 0.00 N ATOM 1501 CA PRO A 488 3.092 -9.653 -2.909 1.00 0.00 C ATOM 1502 C PRO A 488 3.229 -9.591 -4.427 1.00 0.00 C ATOM 1503 O PRO A 488 4.329 -9.744 -4.956 1.00 0.00 O ATOM 1504 CB PRO A 488 2.757 -8.287 -2.338 1.00 0.00 C ATOM 1505 CG PRO A 488 4.072 -7.645 -2.055 1.00 0.00 C ATOM 1506 CD PRO A 488 5.070 -8.754 -1.828 1.00 0.00 C ATOM 0 HA PRO A 488 2.322 -10.399 -2.713 1.00 0.00 H new ATOM 0 HB2 PRO A 488 2.176 -7.697 -3.046 1.00 0.00 H new ATOM 0 HB3 PRO A 488 2.159 -8.376 -1.431 1.00 0.00 H new ATOM 0 HG2 PRO A 488 4.380 -7.015 -2.889 1.00 0.00 H new ATOM 0 HG3 PRO A 488 4.005 -7.002 -1.178 1.00 0.00 H new ATOM 0 HD2 PRO A 488 5.987 -8.588 -2.394 1.00 0.00 H new ATOM 0 HD3 PRO A 488 5.353 -8.827 -0.778 1.00 0.00 H new ATOM 1514 N GLN A 489 2.141 -9.401 -5.126 1.00 0.00 N ATOM 1515 CA GLN A 489 2.192 -9.354 -6.570 1.00 0.00 C ATOM 1516 C GLN A 489 1.733 -8.022 -7.110 1.00 0.00 C ATOM 1517 O GLN A 489 0.899 -7.333 -6.501 1.00 0.00 O ATOM 1518 CB GLN A 489 1.379 -10.484 -7.188 1.00 0.00 C ATOM 1519 CG GLN A 489 1.964 -11.856 -6.938 1.00 0.00 C ATOM 1520 CD GLN A 489 1.110 -12.967 -7.484 1.00 0.00 C ATOM 1521 OE1 GLN A 489 -0.115 -12.856 -7.556 1.00 0.00 O ATOM 1522 NE2 GLN A 489 1.728 -14.041 -7.873 1.00 0.00 N ATOM 0 H GLN A 489 1.211 -9.276 -4.725 1.00 0.00 H new ATOM 0 HA GLN A 489 3.237 -9.484 -6.851 1.00 0.00 H new ATOM 0 HB2 GLN A 489 0.365 -10.452 -6.789 1.00 0.00 H new ATOM 0 HB3 GLN A 489 1.303 -10.321 -8.263 1.00 0.00 H new ATOM 0 HG2 GLN A 489 2.954 -11.911 -7.390 1.00 0.00 H new ATOM 0 HG3 GLN A 489 2.095 -11.999 -5.865 1.00 0.00 H new ATOM 0 HE21 GLN A 489 2.744 -14.100 -7.799 1.00 0.00 H new ATOM 0 HE22 GLN A 489 1.198 -14.826 -8.252 1.00 0.00 H new ATOM 1531 N ALA A 490 2.313 -7.651 -8.219 1.00 0.00 N ATOM 1532 CA ALA A 490 1.949 -6.463 -8.943 1.00 0.00 C ATOM 1533 C ALA A 490 0.571 -6.657 -9.539 1.00 0.00 C ATOM 1534 O ALA A 490 0.229 -7.764 -9.966 1.00 0.00 O ATOM 1535 CB ALA A 490 2.955 -6.219 -10.048 1.00 0.00 C ATOM 0 H ALA A 490 3.070 -8.179 -8.655 1.00 0.00 H new ATOM 0 HA ALA A 490 1.941 -5.604 -8.272 1.00 0.00 H new ATOM 0 HB1 ALA A 490 2.680 -5.319 -10.598 1.00 0.00 H new ATOM 0 HB2 ALA A 490 3.947 -6.091 -9.615 1.00 0.00 H new ATOM 0 HB3 ALA A 490 2.963 -7.071 -10.728 1.00 0.00 H new ATOM 1541 N GLY A 491 -0.228 -5.627 -9.545 1.00 0.00 N ATOM 1542 CA GLY A 491 -1.556 -5.746 -10.084 1.00 0.00 C ATOM 1543 C GLY A 491 -2.530 -6.311 -9.076 1.00 0.00 C ATOM 1544 O GLY A 491 -3.709 -6.528 -9.389 1.00 0.00 O ATOM 0 H GLY A 491 0.013 -4.703 -9.187 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -1.903 -4.766 -10.413 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -1.533 -6.388 -10.965 1.00 0.00 H new ATOM 1548 N ASP A 492 -2.052 -6.607 -7.885 1.00 0.00 N ATOM 1549 CA ASP A 492 -2.933 -7.121 -6.863 1.00 0.00 C ATOM 1550 C ASP A 492 -3.437 -5.950 -6.052 1.00 0.00 C ATOM 1551 O ASP A 492 -3.059 -4.794 -6.307 1.00 0.00 O ATOM 1552 CB ASP A 492 -2.241 -8.127 -5.947 1.00 0.00 C ATOM 1553 CG ASP A 492 -3.217 -9.113 -5.327 1.00 0.00 C ATOM 1554 OD1 ASP A 492 -3.859 -8.776 -4.328 1.00 0.00 O ATOM 1555 OD2 ASP A 492 -3.361 -10.231 -5.855 1.00 0.00 O ATOM 0 H ASP A 492 -1.076 -6.502 -7.606 1.00 0.00 H new ATOM 0 HA ASP A 492 -3.754 -7.652 -7.345 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -1.488 -8.674 -6.515 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -1.717 -7.592 -5.155 1.00 0.00 H new ATOM 1560 N ARG A 493 -4.227 -6.222 -5.081 1.00 0.00 N ATOM 1561 CA ARG A 493 -4.868 -5.212 -4.323 1.00 0.00 C ATOM 1562 C ARG A 493 -4.409 -5.252 -2.889 1.00 0.00 C ATOM 1563 O ARG A 493 -4.135 -6.324 -2.330 1.00 0.00 O ATOM 1564 CB ARG A 493 -6.385 -5.369 -4.387 1.00 0.00 C ATOM 1565 CG ARG A 493 -7.070 -4.953 -5.711 1.00 0.00 C ATOM 1566 CD ARG A 493 -6.783 -5.902 -6.873 1.00 0.00 C ATOM 1567 NE ARG A 493 -7.260 -7.260 -6.588 1.00 0.00 N ATOM 1568 CZ ARG A 493 -6.751 -8.387 -7.097 1.00 0.00 C ATOM 1569 NH1 ARG A 493 -5.842 -8.350 -8.067 1.00 0.00 N ATOM 1570 NH2 ARG A 493 -7.208 -9.550 -6.675 1.00 0.00 N ATOM 0 H ARG A 493 -4.451 -7.172 -4.784 1.00 0.00 H new ATOM 0 HA ARG A 493 -4.597 -4.247 -4.752 1.00 0.00 H new ATOM 0 HB2 ARG A 493 -6.628 -6.413 -4.191 1.00 0.00 H new ATOM 0 HB3 ARG A 493 -6.822 -4.783 -3.579 1.00 0.00 H new ATOM 0 HG2 ARG A 493 -8.147 -4.902 -5.552 1.00 0.00 H new ATOM 0 HG3 ARG A 493 -6.740 -3.950 -5.982 1.00 0.00 H new ATOM 0 HD2 ARG A 493 -7.264 -5.528 -7.777 1.00 0.00 H new ATOM 0 HD3 ARG A 493 -5.711 -5.925 -7.069 1.00 0.00 H new ATOM 0 HE ARG A 493 -8.048 -7.352 -5.946 1.00 0.00 H new ATOM 0 HH11 ARG A 493 -5.523 -7.453 -8.433 1.00 0.00 H new ATOM 0 HH12 ARG A 493 -5.463 -9.219 -8.445 1.00 0.00 H new ATOM 0 HH21 ARG A 493 -7.942 -9.583 -5.968 1.00 0.00 H new ATOM 0 HH22 ARG A 493 -6.827 -10.416 -7.056 1.00 0.00 H new ATOM 1584 N PHE A 494 -4.319 -4.106 -2.300 1.00 0.00 N ATOM 1585 CA PHE A 494 -3.950 -3.996 -0.915 1.00 0.00 C ATOM 1586 C PHE A 494 -4.912 -3.072 -0.225 1.00 0.00 C ATOM 1587 O PHE A 494 -5.563 -2.243 -0.877 1.00 0.00 O ATOM 1588 CB PHE A 494 -2.506 -3.498 -0.745 1.00 0.00 C ATOM 1589 CG PHE A 494 -2.262 -2.105 -1.237 1.00 0.00 C ATOM 1590 CD1 PHE A 494 -2.010 -1.860 -2.562 1.00 0.00 C ATOM 1591 CD2 PHE A 494 -2.301 -1.043 -0.364 1.00 0.00 C ATOM 1592 CE1 PHE A 494 -1.795 -0.584 -3.006 1.00 0.00 C ATOM 1593 CE2 PHE A 494 -2.087 0.241 -0.802 1.00 0.00 C ATOM 1594 CZ PHE A 494 -1.838 0.466 -2.130 1.00 0.00 C ATOM 0 H PHE A 494 -4.498 -3.214 -2.760 1.00 0.00 H new ATOM 0 HA PHE A 494 -3.999 -4.987 -0.463 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -2.241 -3.547 0.311 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -1.837 -4.178 -1.273 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -1.981 -2.682 -3.262 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -2.503 -1.221 0.682 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -1.591 -0.405 -4.051 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -2.115 1.066 -0.106 1.00 0.00 H new ATOM 0 HZ PHE A 494 -1.676 1.473 -2.486 1.00 0.00 H new ATOM 1604 N MET A 495 -4.989 -3.182 1.058 1.00 0.00 N ATOM 1605 CA MET A 495 -5.893 -2.374 1.830 1.00 0.00 C ATOM 1606 C MET A 495 -5.167 -1.779 3.008 1.00 0.00 C ATOM 1607 O MET A 495 -4.629 -2.497 3.859 1.00 0.00 O ATOM 1608 CB MET A 495 -7.095 -3.205 2.299 1.00 0.00 C ATOM 1609 CG MET A 495 -8.141 -2.417 3.079 1.00 0.00 C ATOM 1610 SD MET A 495 -9.550 -3.435 3.562 1.00 0.00 S ATOM 1611 CE MET A 495 -10.569 -2.219 4.407 1.00 0.00 C ATOM 0 H MET A 495 -4.430 -3.833 1.609 1.00 0.00 H new ATOM 0 HA MET A 495 -6.267 -1.566 1.202 1.00 0.00 H new ATOM 0 HB2 MET A 495 -7.572 -3.655 1.428 1.00 0.00 H new ATOM 0 HB3 MET A 495 -6.734 -4.023 2.923 1.00 0.00 H new ATOM 0 HG2 MET A 495 -7.681 -1.992 3.971 1.00 0.00 H new ATOM 0 HG3 MET A 495 -8.491 -1.582 2.472 1.00 0.00 H new ATOM 0 HE1 MET A 495 -11.481 -2.695 4.766 1.00 0.00 H new ATOM 0 HE2 MET A 495 -10.018 -1.807 5.252 1.00 0.00 H new ATOM 0 HE3 MET A 495 -10.827 -1.417 3.716 1.00 0.00 H new ATOM 1621 N VAL A 496 -5.115 -0.480 3.027 1.00 0.00 N ATOM 1622 CA VAL A 496 -4.514 0.239 4.109 1.00 0.00 C ATOM 1623 C VAL A 496 -5.608 0.981 4.848 1.00 0.00 C ATOM 1624 O VAL A 496 -6.169 1.953 4.340 1.00 0.00 O ATOM 1625 CB VAL A 496 -3.435 1.258 3.609 1.00 0.00 C ATOM 1626 CG1 VAL A 496 -2.830 2.024 4.775 1.00 0.00 C ATOM 1627 CG2 VAL A 496 -2.342 0.537 2.854 1.00 0.00 C ATOM 0 H VAL A 496 -5.491 0.113 2.287 1.00 0.00 H new ATOM 0 HA VAL A 496 -4.009 -0.472 4.763 1.00 0.00 H new ATOM 0 HB VAL A 496 -3.926 1.967 2.942 1.00 0.00 H new ATOM 0 HG11 VAL A 496 -2.084 2.725 4.402 1.00 0.00 H new ATOM 0 HG12 VAL A 496 -3.615 2.573 5.296 1.00 0.00 H new ATOM 0 HG13 VAL A 496 -2.358 1.324 5.464 1.00 0.00 H new ATOM 0 HG21 VAL A 496 -1.599 1.258 2.513 1.00 0.00 H new ATOM 0 HG22 VAL A 496 -1.866 -0.191 3.510 1.00 0.00 H new ATOM 0 HG23 VAL A 496 -2.772 0.024 1.994 1.00 0.00 H new ATOM 1684 N GLU A 500 -4.436 6.655 12.622 1.00 0.00 N ATOM 1685 CA GLU A 500 -4.082 8.020 13.029 1.00 0.00 C ATOM 1686 C GLU A 500 -4.772 9.087 12.156 1.00 0.00 C ATOM 1687 O GLU A 500 -4.855 10.269 12.527 1.00 0.00 O ATOM 1688 CB GLU A 500 -2.557 8.177 13.093 1.00 0.00 C ATOM 1689 CG GLU A 500 -1.930 7.229 14.121 1.00 0.00 C ATOM 1690 CD GLU A 500 -0.421 7.298 14.203 1.00 0.00 C ATOM 1691 OE1 GLU A 500 0.115 8.253 14.797 1.00 0.00 O ATOM 1692 OE2 GLU A 500 0.268 6.405 13.690 1.00 0.00 O ATOM 0 HA GLU A 500 -4.465 8.190 14.035 1.00 0.00 H new ATOM 0 HB2 GLU A 500 -2.130 7.981 12.110 1.00 0.00 H new ATOM 0 HB3 GLU A 500 -2.308 9.207 13.349 1.00 0.00 H new ATOM 0 HG2 GLU A 500 -2.345 7.454 15.104 1.00 0.00 H new ATOM 0 HG3 GLU A 500 -2.221 6.207 13.878 1.00 0.00 H new ATOM 1699 N LYS A 501 -5.273 8.642 11.023 1.00 0.00 N ATOM 1700 CA LYS A 501 -6.114 9.438 10.137 1.00 0.00 C ATOM 1701 C LYS A 501 -7.378 9.803 10.887 1.00 0.00 C ATOM 1702 O LYS A 501 -7.756 10.975 10.996 1.00 0.00 O ATOM 1703 CB LYS A 501 -6.475 8.572 8.937 1.00 0.00 C ATOM 1704 CG LYS A 501 -7.262 9.243 7.829 1.00 0.00 C ATOM 1705 CD LYS A 501 -7.387 8.292 6.647 1.00 0.00 C ATOM 1706 CE LYS A 501 -8.199 8.878 5.507 1.00 0.00 C ATOM 1707 NZ LYS A 501 -9.614 9.074 5.862 1.00 0.00 N ATOM 0 H LYS A 501 -5.106 7.696 10.680 1.00 0.00 H new ATOM 0 HA LYS A 501 -5.601 10.343 9.811 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -5.552 8.179 8.510 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -7.050 7.717 9.294 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -8.252 9.524 8.190 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -6.763 10.161 7.519 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -6.391 8.037 6.285 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -7.853 7.364 6.980 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -7.767 9.834 5.212 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -8.133 8.218 4.642 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -10.144 9.379 5.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -10.010 8.180 6.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -9.689 9.802 6.601 1.00 0.00 H new ATOM 1721 N LYS A 502 -7.994 8.777 11.446 1.00 0.00 N ATOM 1722 CA LYS A 502 -9.210 8.921 12.228 1.00 0.00 C ATOM 1723 C LYS A 502 -8.921 9.741 13.465 1.00 0.00 C ATOM 1724 O LYS A 502 -9.702 10.592 13.833 1.00 0.00 O ATOM 1725 CB LYS A 502 -9.757 7.560 12.657 1.00 0.00 C ATOM 1726 CG LYS A 502 -10.144 6.620 11.529 1.00 0.00 C ATOM 1727 CD LYS A 502 -10.730 5.279 12.039 1.00 0.00 C ATOM 1728 CE LYS A 502 -9.701 4.341 12.728 1.00 0.00 C ATOM 1729 NZ LYS A 502 -9.218 4.805 14.063 1.00 0.00 N ATOM 0 H LYS A 502 -7.663 7.815 11.370 1.00 0.00 H new ATOM 0 HA LYS A 502 -9.954 9.418 11.605 1.00 0.00 H new ATOM 0 HB2 LYS A 502 -9.007 7.066 13.275 1.00 0.00 H new ATOM 0 HB3 LYS A 502 -10.632 7.723 13.286 1.00 0.00 H new ATOM 0 HG2 LYS A 502 -10.876 7.111 10.888 1.00 0.00 H new ATOM 0 HG3 LYS A 502 -9.267 6.418 10.914 1.00 0.00 H new ATOM 0 HD2 LYS A 502 -11.534 5.494 12.743 1.00 0.00 H new ATOM 0 HD3 LYS A 502 -11.177 4.750 11.197 1.00 0.00 H new ATOM 0 HE2 LYS A 502 -10.152 3.355 12.844 1.00 0.00 H new ATOM 0 HE3 LYS A 502 -8.841 4.223 12.068 1.00 0.00 H new ATOM 0 HZ1 LYS A 502 -9.206 4.003 14.726 1.00 0.00 H new ATOM 0 HZ2 LYS A 502 -8.257 5.191 13.969 1.00 0.00 H new ATOM 0 HZ3 LYS A 502 -9.854 5.544 14.425 1.00 0.00 H new ATOM 1743 N ALA A 503 -7.767 9.485 14.082 1.00 0.00 N ATOM 1744 CA ALA A 503 -7.327 10.185 15.290 1.00 0.00 C ATOM 1745 C ALA A 503 -7.397 11.695 15.104 1.00 0.00 C ATOM 1746 O ALA A 503 -8.022 12.400 15.880 1.00 0.00 O ATOM 1747 CB ALA A 503 -5.907 9.769 15.651 1.00 0.00 C ATOM 0 H ALA A 503 -7.106 8.780 13.755 1.00 0.00 H new ATOM 0 HA ALA A 503 -7.998 9.910 16.104 1.00 0.00 H new ATOM 0 HB1 ALA A 503 -5.591 10.296 16.551 1.00 0.00 H new ATOM 0 HB2 ALA A 503 -5.877 8.694 15.831 1.00 0.00 H new ATOM 0 HB3 ALA A 503 -5.235 10.018 14.830 1.00 0.00 H new ATOM 1753 N ARG A 504 -6.784 12.164 14.066 1.00 0.00 N ATOM 1754 CA ARG A 504 -6.778 13.581 13.716 1.00 0.00 C ATOM 1755 C ARG A 504 -8.211 14.108 13.475 1.00 0.00 C ATOM 1756 O ARG A 504 -8.556 15.206 13.911 1.00 0.00 O ATOM 1757 CB ARG A 504 -5.890 13.819 12.484 1.00 0.00 C ATOM 1758 CG ARG A 504 -5.856 15.261 11.987 1.00 0.00 C ATOM 1759 CD ARG A 504 -5.290 16.225 13.023 1.00 0.00 C ATOM 1760 NE ARG A 504 -5.360 17.608 12.548 1.00 0.00 N ATOM 1761 CZ ARG A 504 -4.539 18.607 12.909 1.00 0.00 C ATOM 1762 NH1 ARG A 504 -3.541 18.400 13.775 1.00 0.00 N ATOM 1763 NH2 ARG A 504 -4.716 19.813 12.389 1.00 0.00 N ATOM 0 H ARG A 504 -6.260 11.579 13.416 1.00 0.00 H new ATOM 0 HA ARG A 504 -6.364 14.138 14.557 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -4.873 13.508 12.722 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -6.238 13.179 11.674 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -5.255 15.315 11.080 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -6.865 15.573 11.719 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -5.846 16.129 13.956 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -4.254 15.964 13.240 1.00 0.00 H new ATOM 0 HE ARG A 504 -6.100 17.833 11.882 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -3.394 17.472 14.172 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -2.926 19.170 14.038 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -5.470 19.975 11.722 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -4.098 20.579 12.656 1.00 0.00 H new ATOM 1777 N GLN A 505 -9.037 13.299 12.828 1.00 0.00 N ATOM 1778 CA GLN A 505 -10.425 13.673 12.529 1.00 0.00 C ATOM 1779 C GLN A 505 -11.265 13.772 13.799 1.00 0.00 C ATOM 1780 O GLN A 505 -11.990 14.756 14.005 1.00 0.00 O ATOM 1781 CB GLN A 505 -11.069 12.662 11.575 1.00 0.00 C ATOM 1782 CG GLN A 505 -10.458 12.613 10.189 1.00 0.00 C ATOM 1783 CD GLN A 505 -10.596 13.921 9.448 1.00 0.00 C ATOM 1784 OE1 GLN A 505 -11.588 14.152 8.766 1.00 0.00 O ATOM 1785 NE2 GLN A 505 -9.611 14.765 9.549 1.00 0.00 N ATOM 0 H GLN A 505 -8.774 12.371 12.495 1.00 0.00 H new ATOM 0 HA GLN A 505 -10.396 14.653 12.052 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -11.002 11.670 12.021 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -12.129 12.898 11.481 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -9.402 12.355 10.270 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -10.936 11.821 9.613 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -8.802 14.537 10.126 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -9.648 15.654 9.051 1.00 0.00 H new ATOM 1794 N ILE A 506 -11.140 12.772 14.648 1.00 0.00 N ATOM 1795 CA ILE A 506 -11.906 12.676 15.878 1.00 0.00 C ATOM 1796 C ILE A 506 -11.448 13.740 16.871 1.00 0.00 C ATOM 1797 O ILE A 506 -12.249 14.291 17.627 1.00 0.00 O ATOM 1798 CB ILE A 506 -11.762 11.247 16.504 1.00 0.00 C ATOM 1799 CG1 ILE A 506 -12.289 10.183 15.521 1.00 0.00 C ATOM 1800 CG2 ILE A 506 -12.493 11.145 17.840 1.00 0.00 C ATOM 1801 CD1 ILE A 506 -12.109 8.751 15.984 1.00 0.00 C ATOM 0 H ILE A 506 -10.497 11.994 14.503 1.00 0.00 H new ATOM 0 HA ILE A 506 -12.957 12.846 15.645 1.00 0.00 H new ATOM 0 HB ILE A 506 -10.703 11.067 16.692 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -13.349 10.363 15.345 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -11.782 10.308 14.564 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -12.372 10.140 18.245 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -12.077 11.871 18.539 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -13.553 11.351 17.691 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -12.508 8.072 15.230 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -11.048 8.547 16.131 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -12.641 8.603 16.924 1.00 0.00 H new ATOM 1813 N GLY A 507 -10.184 14.060 16.821 1.00 0.00 N ATOM 1814 CA GLY A 507 -9.632 15.016 17.739 1.00 0.00 C ATOM 1815 C GLY A 507 -8.809 14.320 18.782 1.00 0.00 C ATOM 1816 O GLY A 507 -8.674 14.792 19.903 1.00 0.00 O ATOM 0 H GLY A 507 -9.517 13.672 16.154 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -9.015 15.735 17.199 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -10.435 15.579 18.215 1.00 0.00 H new