USER MOD reduce.3.24.130724 H: found=0, std=0, add=668, rem=0, adj=18 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 454 THR OG1 : rot 180:sc= 0.0138 USER MOD Set 1.2: A 455 THR OG1 : rot 180:sc= 0 USER MOD Set 2.1: A 426 LYS NZ :NH3+ -169:sc= 1.91 (180deg=1.62) USER MOD Set 2.2: A 436 THR OG1 : rot -23:sc= 0.161 USER MOD Single : A 421 THR OG1 : rot 180:sc= 0 USER MOD Single : A 429 LYS NZ :NH3+ 159:sc= 1.1 (180deg=0.774) USER MOD Single : A 440 GLN : amide:sc= -0.287 X(o=-0.29,f=-0.17) USER MOD Single : A 443 THR OG1 : rot 180:sc= 0 USER MOD Single : A 445 LYS NZ :NH3+ -147:sc= -0.0348 (180deg=-2.35!) USER MOD Single : A 456 TYR OH : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl 145:sc= -5.57! (180deg=-7.71!) USER MOD Single : A 464 ASN : amide:sc= -1.04! C(o=-1!,f=-6.7!) USER MOD Single : A 466 SER OG : rot -37:sc= 0.0708 USER MOD Single : A 471 LYS NZ :NH3+ 164:sc= -0.0699 (180deg=-0.354) USER MOD Single : A 476 SER OG : rot -42:sc= 0.356 USER MOD Single : A 477 MET CE :methyl -164:sc= -0.0847 (180deg=-0.422) USER MOD Single : A 482 THR OG1 : rot -100:sc= -0.142 USER MOD Single : A 485 HIS : no HD1:sc= -0.165 X(o=-0.17,f=-0.043) USER MOD Single : A 489 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 495 MET CE :methyl 160:sc= -0.107 (180deg=-0.56) USER MOD Single : A 501 LYS NZ :NH3+ -176:sc= 1.23 (180deg=1.21) USER MOD Single : A 502 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0201) USER MOD Single : A 505 GLN : amide:sc= -0.129 K(o=-0.13,f=-0.66) USER MOD ----------------------------------------------------------------- ATOM 470 N VAL A 419 -9.356 0.884 -1.443 1.00 0.00 N ATOM 471 CA VAL A 419 -8.235 -0.009 -1.541 1.00 0.00 C ATOM 472 C VAL A 419 -7.337 0.541 -2.604 1.00 0.00 C ATOM 473 O VAL A 419 -7.743 1.444 -3.341 1.00 0.00 O ATOM 474 CB VAL A 419 -8.630 -1.488 -1.911 1.00 0.00 C ATOM 475 CG1 VAL A 419 -9.331 -2.194 -0.761 1.00 0.00 C ATOM 476 CG2 VAL A 419 -9.507 -1.527 -3.154 1.00 0.00 C ATOM 0 HA VAL A 419 -7.755 -0.065 -0.564 1.00 0.00 H new ATOM 0 HB VAL A 419 -7.701 -2.019 -2.117 1.00 0.00 H new ATOM 0 HG11 VAL A 419 -9.586 -3.211 -1.059 1.00 0.00 H new ATOM 0 HG12 VAL A 419 -8.669 -2.225 0.105 1.00 0.00 H new ATOM 0 HG13 VAL A 419 -10.241 -1.653 -0.503 1.00 0.00 H new ATOM 0 HG21 VAL A 419 -9.764 -2.561 -3.386 1.00 0.00 H new ATOM 0 HG22 VAL A 419 -10.419 -0.958 -2.974 1.00 0.00 H new ATOM 0 HG23 VAL A 419 -8.967 -1.090 -3.994 1.00 0.00 H new ATOM 486 N GLY A 420 -6.156 0.039 -2.690 1.00 0.00 N ATOM 487 CA GLY A 420 -5.243 0.494 -3.688 1.00 0.00 C ATOM 488 C GLY A 420 -4.743 -0.659 -4.486 1.00 0.00 C ATOM 489 O GLY A 420 -4.982 -1.812 -4.115 1.00 0.00 O ATOM 0 H GLY A 420 -5.794 -0.692 -2.078 1.00 0.00 H new ATOM 0 HA2 GLY A 420 -5.736 1.213 -4.342 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -4.407 1.012 -3.218 1.00 0.00 H new ATOM 493 N THR A 421 -4.051 -0.383 -5.540 1.00 0.00 N ATOM 494 CA THR A 421 -3.512 -1.413 -6.366 1.00 0.00 C ATOM 495 C THR A 421 -1.978 -1.353 -6.293 1.00 0.00 C ATOM 496 O THR A 421 -1.386 -0.254 -6.221 1.00 0.00 O ATOM 497 CB THR A 421 -3.978 -1.225 -7.823 1.00 0.00 C ATOM 498 OG1 THR A 421 -5.376 -0.845 -7.831 1.00 0.00 O ATOM 499 CG2 THR A 421 -3.833 -2.529 -8.587 1.00 0.00 C ATOM 0 H THR A 421 -3.842 0.565 -5.855 1.00 0.00 H new ATOM 0 HA THR A 421 -3.861 -2.384 -6.016 1.00 0.00 H new ATOM 0 HB THR A 421 -3.369 -0.453 -8.292 1.00 0.00 H new ATOM 0 HG1 THR A 421 -5.676 -0.723 -8.756 1.00 0.00 H new ATOM 0 HG21 THR A 421 -4.165 -2.387 -9.616 1.00 0.00 H new ATOM 0 HG22 THR A 421 -2.788 -2.839 -8.582 1.00 0.00 H new ATOM 0 HG23 THR A 421 -4.442 -3.298 -8.112 1.00 0.00 H new ATOM 507 N VAL A 422 -1.347 -2.504 -6.238 1.00 0.00 N ATOM 508 CA VAL A 422 0.099 -2.572 -6.183 1.00 0.00 C ATOM 509 C VAL A 422 0.642 -2.343 -7.585 1.00 0.00 C ATOM 510 O VAL A 422 0.234 -3.028 -8.521 1.00 0.00 O ATOM 511 CB VAL A 422 0.601 -3.944 -5.656 1.00 0.00 C ATOM 512 CG1 VAL A 422 2.118 -3.955 -5.528 1.00 0.00 C ATOM 513 CG2 VAL A 422 -0.048 -4.291 -4.328 1.00 0.00 C ATOM 0 H VAL A 422 -1.814 -3.411 -6.230 1.00 0.00 H new ATOM 0 HA VAL A 422 0.453 -1.808 -5.491 1.00 0.00 H new ATOM 0 HB VAL A 422 0.313 -4.704 -6.383 1.00 0.00 H new ATOM 0 HG11 VAL A 422 2.445 -4.926 -5.157 1.00 0.00 H new ATOM 0 HG12 VAL A 422 2.567 -3.769 -6.504 1.00 0.00 H new ATOM 0 HG13 VAL A 422 2.430 -3.177 -4.831 1.00 0.00 H new ATOM 0 HG21 VAL A 422 0.322 -5.257 -3.983 1.00 0.00 H new ATOM 0 HG22 VAL A 422 0.197 -3.525 -3.592 1.00 0.00 H new ATOM 0 HG23 VAL A 422 -1.130 -4.341 -4.454 1.00 0.00 H new ATOM 523 N ILE A 423 1.561 -1.419 -7.728 1.00 0.00 N ATOM 524 CA ILE A 423 2.051 -1.052 -9.039 1.00 0.00 C ATOM 525 C ILE A 423 3.182 -1.973 -9.518 1.00 0.00 C ATOM 526 O ILE A 423 3.267 -2.298 -10.708 1.00 0.00 O ATOM 527 CB ILE A 423 2.453 0.445 -9.122 1.00 0.00 C ATOM 528 CG1 ILE A 423 3.514 0.799 -8.087 1.00 0.00 C ATOM 529 CG2 ILE A 423 1.220 1.347 -8.957 1.00 0.00 C ATOM 530 CD1 ILE A 423 3.924 2.252 -8.094 1.00 0.00 C ATOM 0 H ILE A 423 1.986 -0.907 -6.955 1.00 0.00 H new ATOM 0 HA ILE A 423 1.216 -1.193 -9.726 1.00 0.00 H new ATOM 0 HB ILE A 423 2.882 0.616 -10.109 1.00 0.00 H new ATOM 0 HG12 ILE A 423 3.138 0.544 -7.096 1.00 0.00 H new ATOM 0 HG13 ILE A 423 4.396 0.183 -8.262 1.00 0.00 H new ATOM 0 HG21 ILE A 423 1.523 2.392 -9.018 1.00 0.00 H new ATOM 0 HG22 ILE A 423 0.502 1.130 -9.748 1.00 0.00 H new ATOM 0 HG23 ILE A 423 0.759 1.159 -7.987 1.00 0.00 H new ATOM 0 HD11 ILE A 423 4.682 2.420 -7.329 1.00 0.00 H new ATOM 0 HD12 ILE A 423 4.332 2.510 -9.071 1.00 0.00 H new ATOM 0 HD13 ILE A 423 3.055 2.876 -7.887 1.00 0.00 H new ATOM 542 N GLU A 424 4.035 -2.383 -8.601 1.00 0.00 N ATOM 543 CA GLU A 424 5.120 -3.329 -8.881 1.00 0.00 C ATOM 544 C GLU A 424 5.568 -3.985 -7.579 1.00 0.00 C ATOM 545 O GLU A 424 5.399 -3.420 -6.507 1.00 0.00 O ATOM 546 CB GLU A 424 6.326 -2.648 -9.562 1.00 0.00 C ATOM 547 CG GLU A 424 6.897 -1.505 -8.757 1.00 0.00 C ATOM 548 CD GLU A 424 8.229 -1.006 -9.239 1.00 0.00 C ATOM 549 OE1 GLU A 424 9.263 -1.553 -8.813 1.00 0.00 O ATOM 550 OE2 GLU A 424 8.282 -0.031 -10.009 1.00 0.00 O ATOM 0 H GLU A 424 4.003 -2.072 -7.630 1.00 0.00 H new ATOM 0 HA GLU A 424 4.736 -4.080 -9.572 1.00 0.00 H new ATOM 0 HB2 GLU A 424 7.106 -3.390 -9.731 1.00 0.00 H new ATOM 0 HB3 GLU A 424 6.021 -2.278 -10.541 1.00 0.00 H new ATOM 0 HG2 GLU A 424 6.187 -0.678 -8.771 1.00 0.00 H new ATOM 0 HG3 GLU A 424 6.996 -1.823 -7.719 1.00 0.00 H new ATOM 557 N ALA A 425 6.126 -5.153 -7.671 1.00 0.00 N ATOM 558 CA ALA A 425 6.589 -5.869 -6.511 1.00 0.00 C ATOM 559 C ALA A 425 7.805 -6.652 -6.899 1.00 0.00 C ATOM 560 O ALA A 425 7.842 -7.205 -8.000 1.00 0.00 O ATOM 561 CB ALA A 425 5.502 -6.800 -6.004 1.00 0.00 C ATOM 0 H ALA A 425 6.276 -5.642 -8.553 1.00 0.00 H new ATOM 0 HA ALA A 425 6.836 -5.170 -5.712 1.00 0.00 H new ATOM 0 HB1 ALA A 425 5.863 -7.337 -5.127 1.00 0.00 H new ATOM 0 HB2 ALA A 425 4.620 -6.218 -5.736 1.00 0.00 H new ATOM 0 HB3 ALA A 425 5.242 -7.515 -6.785 1.00 0.00 H new ATOM 567 N LYS A 426 8.803 -6.686 -6.042 1.00 0.00 N ATOM 568 CA LYS A 426 10.017 -7.420 -6.346 1.00 0.00 C ATOM 569 C LYS A 426 10.714 -7.768 -5.045 1.00 0.00 C ATOM 570 O LYS A 426 10.245 -7.404 -3.964 1.00 0.00 O ATOM 571 CB LYS A 426 10.989 -6.622 -7.278 1.00 0.00 C ATOM 572 CG LYS A 426 11.950 -5.666 -6.565 1.00 0.00 C ATOM 573 CD LYS A 426 11.246 -4.472 -5.903 1.00 0.00 C ATOM 574 CE LYS A 426 10.772 -3.460 -6.901 1.00 0.00 C ATOM 575 NZ LYS A 426 10.006 -2.354 -6.283 1.00 0.00 N ATOM 0 H LYS A 426 8.801 -6.219 -5.135 1.00 0.00 H new ATOM 0 HA LYS A 426 9.737 -8.323 -6.888 1.00 0.00 H new ATOM 0 HB2 LYS A 426 11.576 -7.335 -7.857 1.00 0.00 H new ATOM 0 HB3 LYS A 426 10.394 -6.048 -7.988 1.00 0.00 H new ATOM 0 HG2 LYS A 426 12.503 -6.219 -5.805 1.00 0.00 H new ATOM 0 HG3 LYS A 426 12.680 -5.294 -7.284 1.00 0.00 H new ATOM 0 HD2 LYS A 426 10.396 -4.831 -5.323 1.00 0.00 H new ATOM 0 HD3 LYS A 426 11.930 -3.994 -5.202 1.00 0.00 H new ATOM 0 HE2 LYS A 426 11.632 -3.048 -7.429 1.00 0.00 H new ATOM 0 HE3 LYS A 426 10.148 -3.956 -7.645 1.00 0.00 H new ATOM 0 HZ1 LYS A 426 9.548 -1.790 -7.028 1.00 0.00 H new ATOM 0 HZ2 LYS A 426 9.280 -2.746 -5.650 1.00 0.00 H new ATOM 0 HZ3 LYS A 426 10.651 -1.748 -5.737 1.00 0.00 H new ATOM 589 N LEU A 427 11.784 -8.480 -5.140 1.00 0.00 N ATOM 590 CA LEU A 427 12.568 -8.792 -3.991 1.00 0.00 C ATOM 591 C LEU A 427 13.770 -7.861 -3.941 1.00 0.00 C ATOM 592 O LEU A 427 14.249 -7.376 -4.986 1.00 0.00 O ATOM 593 CB LEU A 427 13.062 -10.240 -4.065 1.00 0.00 C ATOM 594 CG LEU A 427 14.322 -10.540 -4.936 1.00 0.00 C ATOM 595 CD1 LEU A 427 14.726 -11.985 -4.793 1.00 0.00 C ATOM 596 CD2 LEU A 427 14.091 -10.216 -6.405 1.00 0.00 C ATOM 0 H LEU A 427 12.142 -8.863 -6.015 1.00 0.00 H new ATOM 0 HA LEU A 427 11.956 -8.668 -3.098 1.00 0.00 H new ATOM 0 HB2 LEU A 427 13.271 -10.574 -3.049 1.00 0.00 H new ATOM 0 HB3 LEU A 427 12.243 -10.854 -4.440 1.00 0.00 H new ATOM 0 HG LEU A 427 15.124 -9.897 -4.573 1.00 0.00 H new ATOM 0 HD11 LEU A 427 15.606 -12.179 -5.406 1.00 0.00 H new ATOM 0 HD12 LEU A 427 14.957 -12.197 -3.749 1.00 0.00 H new ATOM 0 HD13 LEU A 427 13.907 -12.626 -5.120 1.00 0.00 H new ATOM 0 HD21 LEU A 427 14.994 -10.440 -6.973 1.00 0.00 H new ATOM 0 HD22 LEU A 427 13.265 -10.817 -6.785 1.00 0.00 H new ATOM 0 HD23 LEU A 427 13.849 -9.158 -6.511 1.00 0.00 H new ATOM 608 N ASP A 428 14.227 -7.576 -2.782 1.00 0.00 N ATOM 609 CA ASP A 428 15.463 -6.877 -2.626 1.00 0.00 C ATOM 610 C ASP A 428 16.366 -7.752 -1.826 1.00 0.00 C ATOM 611 O ASP A 428 16.030 -8.124 -0.713 1.00 0.00 O ATOM 612 CB ASP A 428 15.304 -5.521 -1.942 1.00 0.00 C ATOM 613 CG ASP A 428 16.622 -4.774 -1.883 1.00 0.00 C ATOM 614 OD1 ASP A 428 17.447 -5.069 -1.007 1.00 0.00 O ATOM 615 OD2 ASP A 428 16.875 -3.901 -2.734 1.00 0.00 O ATOM 0 H ASP A 428 13.761 -7.817 -1.907 1.00 0.00 H new ATOM 0 HA ASP A 428 15.873 -6.664 -3.613 1.00 0.00 H new ATOM 0 HB2 ASP A 428 14.569 -4.923 -2.481 1.00 0.00 H new ATOM 0 HB3 ASP A 428 14.919 -5.664 -0.932 1.00 0.00 H new ATOM 620 N LYS A 429 17.482 -8.116 -2.409 1.00 0.00 N ATOM 621 CA LYS A 429 18.463 -8.992 -1.779 1.00 0.00 C ATOM 622 C LYS A 429 18.904 -8.577 -0.343 1.00 0.00 C ATOM 623 O LYS A 429 19.275 -9.444 0.461 1.00 0.00 O ATOM 624 CB LYS A 429 19.689 -9.289 -2.705 1.00 0.00 C ATOM 625 CG LYS A 429 20.601 -8.106 -3.181 1.00 0.00 C ATOM 626 CD LYS A 429 19.968 -7.171 -4.238 1.00 0.00 C ATOM 627 CE LYS A 429 19.276 -5.961 -3.618 1.00 0.00 C ATOM 628 NZ LYS A 429 18.540 -5.140 -4.618 1.00 0.00 N ATOM 0 H LYS A 429 17.746 -7.813 -3.346 1.00 0.00 H new ATOM 0 HA LYS A 429 17.920 -9.926 -1.638 1.00 0.00 H new ATOM 0 HB2 LYS A 429 20.326 -10.004 -2.184 1.00 0.00 H new ATOM 0 HB3 LYS A 429 19.311 -9.790 -3.597 1.00 0.00 H new ATOM 0 HG2 LYS A 429 20.879 -7.510 -2.312 1.00 0.00 H new ATOM 0 HG3 LYS A 429 21.522 -8.520 -3.591 1.00 0.00 H new ATOM 0 HD2 LYS A 429 20.743 -6.829 -4.924 1.00 0.00 H new ATOM 0 HD3 LYS A 429 19.245 -7.734 -4.828 1.00 0.00 H new ATOM 0 HE2 LYS A 429 18.580 -6.300 -2.851 1.00 0.00 H new ATOM 0 HE3 LYS A 429 20.020 -5.338 -3.121 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 17.820 -4.566 -4.134 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 19.207 -4.513 -5.112 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 18.078 -5.766 -5.308 1.00 0.00 H new ATOM 642 N GLY A 430 18.808 -7.298 -0.006 1.00 0.00 N ATOM 643 CA GLY A 430 19.243 -6.856 1.306 1.00 0.00 C ATOM 644 C GLY A 430 18.111 -6.317 2.177 1.00 0.00 C ATOM 645 O GLY A 430 18.111 -6.504 3.396 1.00 0.00 O ATOM 0 H GLY A 430 18.440 -6.564 -0.611 1.00 0.00 H new ATOM 0 HA2 GLY A 430 19.721 -7.690 1.821 1.00 0.00 H new ATOM 0 HA3 GLY A 430 19.999 -6.080 1.186 1.00 0.00 H new ATOM 649 N ARG A 431 17.160 -5.635 1.566 1.00 0.00 N ATOM 650 CA ARG A 431 16.054 -5.023 2.306 1.00 0.00 C ATOM 651 C ARG A 431 14.873 -5.984 2.436 1.00 0.00 C ATOM 652 O ARG A 431 13.946 -5.753 3.235 1.00 0.00 O ATOM 653 CB ARG A 431 15.615 -3.714 1.638 1.00 0.00 C ATOM 654 CG ARG A 431 16.744 -2.704 1.488 1.00 0.00 C ATOM 655 CD ARG A 431 16.288 -1.428 0.798 1.00 0.00 C ATOM 656 NE ARG A 431 15.356 -0.643 1.621 1.00 0.00 N ATOM 657 CZ ARG A 431 14.737 0.479 1.225 1.00 0.00 C ATOM 658 NH1 ARG A 431 14.831 0.897 -0.049 1.00 0.00 N ATOM 659 NH2 ARG A 431 14.011 1.170 2.100 1.00 0.00 N ATOM 0 H ARG A 431 17.125 -5.487 0.557 1.00 0.00 H new ATOM 0 HA ARG A 431 16.411 -4.796 3.311 1.00 0.00 H new ATOM 0 HB2 ARG A 431 15.204 -3.937 0.654 1.00 0.00 H new ATOM 0 HB3 ARG A 431 14.813 -3.267 2.225 1.00 0.00 H new ATOM 0 HG2 ARG A 431 17.143 -2.460 2.472 1.00 0.00 H new ATOM 0 HG3 ARG A 431 17.557 -3.153 0.917 1.00 0.00 H new ATOM 0 HD2 ARG A 431 17.159 -0.817 0.559 1.00 0.00 H new ATOM 0 HD3 ARG A 431 15.807 -1.682 -0.147 1.00 0.00 H new ATOM 0 HE ARG A 431 15.166 -0.977 2.566 1.00 0.00 H new ATOM 0 HH11 ARG A 431 15.376 0.360 -0.723 1.00 0.00 H new ATOM 0 HH12 ARG A 431 14.357 1.751 -0.342 1.00 0.00 H new ATOM 0 HH21 ARG A 431 13.929 0.845 3.063 1.00 0.00 H new ATOM 0 HH22 ARG A 431 13.537 2.024 1.807 1.00 0.00 H new ATOM 673 N GLY A 432 14.887 -7.032 1.643 1.00 0.00 N ATOM 674 CA GLY A 432 13.869 -8.041 1.735 1.00 0.00 C ATOM 675 C GLY A 432 12.722 -7.750 0.804 1.00 0.00 C ATOM 676 O GLY A 432 12.938 -7.252 -0.301 1.00 0.00 O ATOM 0 H GLY A 432 15.595 -7.203 0.929 1.00 0.00 H new ATOM 0 HA2 GLY A 432 14.297 -9.014 1.495 1.00 0.00 H new ATOM 0 HA3 GLY A 432 13.502 -8.098 2.760 1.00 0.00 H new ATOM 680 N PRO A 433 11.488 -8.073 1.199 1.00 0.00 N ATOM 681 CA PRO A 433 10.309 -7.782 0.393 1.00 0.00 C ATOM 682 C PRO A 433 10.055 -6.282 0.278 1.00 0.00 C ATOM 683 O PRO A 433 9.817 -5.592 1.285 1.00 0.00 O ATOM 684 CB PRO A 433 9.163 -8.455 1.165 1.00 0.00 C ATOM 685 CG PRO A 433 9.833 -9.420 2.077 1.00 0.00 C ATOM 686 CD PRO A 433 11.144 -8.793 2.431 1.00 0.00 C ATOM 0 HA PRO A 433 10.417 -8.143 -0.630 1.00 0.00 H new ATOM 0 HB2 PRO A 433 8.579 -7.723 1.723 1.00 0.00 H new ATOM 0 HB3 PRO A 433 8.475 -8.962 0.489 1.00 0.00 H new ATOM 0 HG2 PRO A 433 9.231 -9.600 2.968 1.00 0.00 H new ATOM 0 HG3 PRO A 433 9.978 -10.384 1.590 1.00 0.00 H new ATOM 0 HD2 PRO A 433 11.056 -8.120 3.284 1.00 0.00 H new ATOM 0 HD3 PRO A 433 11.895 -9.539 2.689 1.00 0.00 H new ATOM 694 N VAL A 434 10.142 -5.799 -0.924 1.00 0.00 N ATOM 695 CA VAL A 434 9.884 -4.424 -1.273 1.00 0.00 C ATOM 696 C VAL A 434 8.758 -4.377 -2.304 1.00 0.00 C ATOM 697 O VAL A 434 8.824 -5.024 -3.368 1.00 0.00 O ATOM 698 CB VAL A 434 11.158 -3.711 -1.828 1.00 0.00 C ATOM 699 CG1 VAL A 434 12.089 -3.309 -0.713 1.00 0.00 C ATOM 700 CG2 VAL A 434 11.909 -4.633 -2.741 1.00 0.00 C ATOM 0 H VAL A 434 10.405 -6.371 -1.726 1.00 0.00 H new ATOM 0 HA VAL A 434 9.589 -3.890 -0.370 1.00 0.00 H new ATOM 0 HB VAL A 434 10.824 -2.823 -2.364 1.00 0.00 H new ATOM 0 HG11 VAL A 434 12.966 -2.815 -1.131 1.00 0.00 H new ATOM 0 HG12 VAL A 434 11.575 -2.625 -0.038 1.00 0.00 H new ATOM 0 HG13 VAL A 434 12.401 -4.196 -0.162 1.00 0.00 H new ATOM 0 HG21 VAL A 434 12.795 -4.125 -3.122 1.00 0.00 H new ATOM 0 HG22 VAL A 434 12.210 -5.525 -2.191 1.00 0.00 H new ATOM 0 HG23 VAL A 434 11.269 -4.920 -3.575 1.00 0.00 H new ATOM 710 N ALA A 435 7.736 -3.658 -1.996 1.00 0.00 N ATOM 711 CA ALA A 435 6.582 -3.592 -2.852 1.00 0.00 C ATOM 712 C ALA A 435 6.200 -2.166 -3.094 1.00 0.00 C ATOM 713 O ALA A 435 5.983 -1.411 -2.150 1.00 0.00 O ATOM 714 CB ALA A 435 5.417 -4.346 -2.234 1.00 0.00 C ATOM 0 H ALA A 435 7.667 -3.096 -1.147 1.00 0.00 H new ATOM 0 HA ALA A 435 6.832 -4.058 -3.805 1.00 0.00 H new ATOM 0 HB1 ALA A 435 4.553 -4.285 -2.895 1.00 0.00 H new ATOM 0 HB2 ALA A 435 5.694 -5.391 -2.093 1.00 0.00 H new ATOM 0 HB3 ALA A 435 5.168 -3.903 -1.270 1.00 0.00 H new ATOM 720 N THR A 436 6.108 -1.792 -4.330 1.00 0.00 N ATOM 721 CA THR A 436 5.752 -0.468 -4.655 1.00 0.00 C ATOM 722 C THR A 436 4.284 -0.463 -4.965 1.00 0.00 C ATOM 723 O THR A 436 3.806 -1.190 -5.848 1.00 0.00 O ATOM 724 CB THR A 436 6.522 0.027 -5.867 1.00 0.00 C ATOM 725 OG1 THR A 436 7.816 -0.601 -5.872 1.00 0.00 O ATOM 726 CG2 THR A 436 6.725 1.532 -5.766 1.00 0.00 C ATOM 0 H THR A 436 6.279 -2.400 -5.131 1.00 0.00 H new ATOM 0 HA THR A 436 5.988 0.191 -3.820 1.00 0.00 H new ATOM 0 HB THR A 436 5.967 -0.212 -6.775 1.00 0.00 H new ATOM 0 HG1 THR A 436 8.046 -0.885 -4.962 1.00 0.00 H new ATOM 0 HG21 THR A 436 7.278 1.884 -6.637 1.00 0.00 H new ATOM 0 HG22 THR A 436 5.755 2.028 -5.727 1.00 0.00 H new ATOM 0 HG23 THR A 436 7.288 1.763 -4.862 1.00 0.00 H new ATOM 734 N LEU A 437 3.576 0.305 -4.265 1.00 0.00 N ATOM 735 CA LEU A 437 2.179 0.375 -4.429 1.00 0.00 C ATOM 736 C LEU A 437 1.761 1.810 -4.506 1.00 0.00 C ATOM 737 O LEU A 437 2.589 2.702 -4.321 1.00 0.00 O ATOM 738 CB LEU A 437 1.497 -0.385 -3.274 1.00 0.00 C ATOM 739 CG LEU A 437 1.896 -0.010 -1.819 1.00 0.00 C ATOM 740 CD1 LEU A 437 1.440 1.386 -1.432 1.00 0.00 C ATOM 741 CD2 LEU A 437 1.346 -1.025 -0.842 1.00 0.00 C ATOM 0 H LEU A 437 3.947 0.922 -3.542 1.00 0.00 H new ATOM 0 HA LEU A 437 1.870 -0.101 -5.360 1.00 0.00 H new ATOM 0 HB2 LEU A 437 0.420 -0.245 -3.372 1.00 0.00 H new ATOM 0 HB3 LEU A 437 1.694 -1.448 -3.411 1.00 0.00 H new ATOM 0 HG LEU A 437 2.985 -0.018 -1.777 1.00 0.00 H new ATOM 0 HD11 LEU A 437 1.744 1.597 -0.407 1.00 0.00 H new ATOM 0 HD12 LEU A 437 1.894 2.116 -2.103 1.00 0.00 H new ATOM 0 HD13 LEU A 437 0.354 1.448 -1.508 1.00 0.00 H new ATOM 0 HD21 LEU A 437 1.634 -0.748 0.172 1.00 0.00 H new ATOM 0 HD22 LEU A 437 0.259 -1.049 -0.916 1.00 0.00 H new ATOM 0 HD23 LEU A 437 1.748 -2.011 -1.077 1.00 0.00 H new ATOM 753 N LEU A 438 0.525 2.052 -4.792 1.00 0.00 N ATOM 754 CA LEU A 438 0.040 3.383 -4.751 1.00 0.00 C ATOM 755 C LEU A 438 -1.142 3.439 -3.820 1.00 0.00 C ATOM 756 O LEU A 438 -2.215 2.883 -4.118 1.00 0.00 O ATOM 757 CB LEU A 438 -0.278 3.919 -6.138 1.00 0.00 C ATOM 758 CG LEU A 438 -0.702 5.376 -6.160 1.00 0.00 C ATOM 759 CD1 LEU A 438 -0.012 6.132 -7.258 1.00 0.00 C ATOM 760 CD2 LEU A 438 -2.211 5.530 -6.232 1.00 0.00 C ATOM 0 H LEU A 438 -0.162 1.346 -5.055 1.00 0.00 H new ATOM 0 HA LEU A 438 0.819 4.040 -4.365 1.00 0.00 H new ATOM 0 HB2 LEU A 438 0.600 3.798 -6.772 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -1.072 3.314 -6.576 1.00 0.00 H new ATOM 0 HG LEU A 438 -0.387 5.816 -5.214 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -0.339 7.172 -7.245 1.00 0.00 H new ATOM 0 HD12 LEU A 438 1.067 6.089 -7.107 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -0.262 5.685 -8.220 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -2.468 6.589 -6.246 1.00 0.00 H new ATOM 0 HD22 LEU A 438 -2.582 5.055 -7.140 1.00 0.00 H new ATOM 0 HD23 LEU A 438 -2.667 5.057 -5.362 1.00 0.00 H new ATOM 772 N VAL A 439 -0.945 4.091 -2.696 1.00 0.00 N ATOM 773 CA VAL A 439 -1.945 4.119 -1.646 1.00 0.00 C ATOM 774 C VAL A 439 -3.160 4.920 -2.051 1.00 0.00 C ATOM 775 O VAL A 439 -3.071 6.093 -2.424 1.00 0.00 O ATOM 776 CB VAL A 439 -1.378 4.567 -0.251 1.00 0.00 C ATOM 777 CG1 VAL A 439 -0.742 5.937 -0.306 1.00 0.00 C ATOM 778 CG2 VAL A 439 -2.461 4.515 0.830 1.00 0.00 C ATOM 0 H VAL A 439 -0.095 4.613 -2.482 1.00 0.00 H new ATOM 0 HA VAL A 439 -2.264 3.086 -1.511 1.00 0.00 H new ATOM 0 HB VAL A 439 -0.595 3.856 0.013 1.00 0.00 H new ATOM 0 HG11 VAL A 439 -0.365 6.203 0.682 1.00 0.00 H new ATOM 0 HG12 VAL A 439 0.083 5.927 -1.019 1.00 0.00 H new ATOM 0 HG13 VAL A 439 -1.484 6.670 -0.621 1.00 0.00 H new ATOM 0 HG21 VAL A 439 -2.038 4.830 1.784 1.00 0.00 H new ATOM 0 HG22 VAL A 439 -3.279 5.181 0.558 1.00 0.00 H new ATOM 0 HG23 VAL A 439 -2.837 3.496 0.919 1.00 0.00 H new ATOM 788 N GLN A 440 -4.289 4.266 -2.030 1.00 0.00 N ATOM 789 CA GLN A 440 -5.510 4.896 -2.401 1.00 0.00 C ATOM 790 C GLN A 440 -6.498 4.811 -1.252 1.00 0.00 C ATOM 791 O GLN A 440 -7.444 5.576 -1.182 1.00 0.00 O ATOM 792 CB GLN A 440 -6.069 4.211 -3.649 1.00 0.00 C ATOM 793 CG GLN A 440 -7.273 4.896 -4.250 1.00 0.00 C ATOM 794 CD GLN A 440 -6.953 6.295 -4.724 1.00 0.00 C ATOM 795 OE1 GLN A 440 -6.559 6.491 -5.859 1.00 0.00 O ATOM 796 NE2 GLN A 440 -7.160 7.272 -3.883 1.00 0.00 N ATOM 0 H GLN A 440 -4.381 3.288 -1.756 1.00 0.00 H new ATOM 0 HA GLN A 440 -5.334 5.948 -2.625 1.00 0.00 H new ATOM 0 HB2 GLN A 440 -5.283 4.158 -4.402 1.00 0.00 H new ATOM 0 HB3 GLN A 440 -6.338 3.186 -3.396 1.00 0.00 H new ATOM 0 HG2 GLN A 440 -7.645 4.306 -5.088 1.00 0.00 H new ATOM 0 HG3 GLN A 440 -8.072 4.938 -3.510 1.00 0.00 H new ATOM 0 HE21 GLN A 440 -7.491 7.071 -2.939 1.00 0.00 H new ATOM 0 HE22 GLN A 440 -6.991 8.236 -4.170 1.00 0.00 H new ATOM 805 N ALA A 441 -6.208 3.930 -0.305 1.00 0.00 N ATOM 806 CA ALA A 441 -7.137 3.603 0.767 1.00 0.00 C ATOM 807 C ALA A 441 -7.098 4.619 1.909 1.00 0.00 C ATOM 808 O ALA A 441 -7.861 4.520 2.865 1.00 0.00 O ATOM 809 CB ALA A 441 -6.838 2.205 1.280 1.00 0.00 C ATOM 0 H ALA A 441 -5.324 3.423 -0.258 1.00 0.00 H new ATOM 0 HA ALA A 441 -8.147 3.640 0.358 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -7.532 1.956 2.083 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -6.951 1.487 0.467 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -5.816 2.167 1.658 1.00 0.00 H new ATOM 815 N GLY A 442 -6.208 5.578 1.819 1.00 0.00 N ATOM 816 CA GLY A 442 -6.129 6.577 2.840 1.00 0.00 C ATOM 817 C GLY A 442 -4.742 7.105 3.001 1.00 0.00 C ATOM 818 O GLY A 442 -4.270 7.871 2.188 1.00 0.00 O ATOM 0 H GLY A 442 -5.539 5.682 1.056 1.00 0.00 H new ATOM 0 HA2 GLY A 442 -6.803 7.398 2.596 1.00 0.00 H new ATOM 0 HA3 GLY A 442 -6.468 6.156 3.786 1.00 0.00 H new ATOM 822 N THR A 443 -4.076 6.676 4.026 1.00 0.00 N ATOM 823 CA THR A 443 -2.746 7.145 4.336 1.00 0.00 C ATOM 824 C THR A 443 -1.928 5.978 4.866 1.00 0.00 C ATOM 825 O THR A 443 -2.384 5.252 5.748 1.00 0.00 O ATOM 826 CB THR A 443 -2.814 8.278 5.394 1.00 0.00 C ATOM 827 OG1 THR A 443 -3.704 9.312 4.927 1.00 0.00 O ATOM 828 CG2 THR A 443 -1.437 8.884 5.648 1.00 0.00 C ATOM 0 H THR A 443 -4.436 5.984 4.683 1.00 0.00 H new ATOM 0 HA THR A 443 -2.276 7.544 3.437 1.00 0.00 H new ATOM 0 HB THR A 443 -3.180 7.851 6.328 1.00 0.00 H new ATOM 0 HG1 THR A 443 -3.751 10.029 5.593 1.00 0.00 H new ATOM 0 HG21 THR A 443 -1.519 9.675 6.394 1.00 0.00 H new ATOM 0 HG22 THR A 443 -0.761 8.111 6.012 1.00 0.00 H new ATOM 0 HG23 THR A 443 -1.046 9.300 4.720 1.00 0.00 H new ATOM 836 N LEU A 444 -0.758 5.799 4.322 1.00 0.00 N ATOM 837 CA LEU A 444 0.112 4.687 4.668 1.00 0.00 C ATOM 838 C LEU A 444 1.249 5.277 5.493 1.00 0.00 C ATOM 839 O LEU A 444 1.711 6.370 5.175 1.00 0.00 O ATOM 840 CB LEU A 444 0.635 4.098 3.333 1.00 0.00 C ATOM 841 CG LEU A 444 1.056 2.615 3.270 1.00 0.00 C ATOM 842 CD1 LEU A 444 1.378 2.265 1.850 1.00 0.00 C ATOM 843 CD2 LEU A 444 2.253 2.319 4.121 1.00 0.00 C ATOM 0 H LEU A 444 -0.367 6.423 3.616 1.00 0.00 H new ATOM 0 HA LEU A 444 -0.383 3.900 5.237 1.00 0.00 H new ATOM 0 HB2 LEU A 444 -0.141 4.249 2.583 1.00 0.00 H new ATOM 0 HB3 LEU A 444 1.494 4.695 3.027 1.00 0.00 H new ATOM 0 HG LEU A 444 0.225 2.021 3.650 1.00 0.00 H new ATOM 0 HD11 LEU A 444 1.677 1.218 1.792 1.00 0.00 H new ATOM 0 HD12 LEU A 444 0.498 2.426 1.227 1.00 0.00 H new ATOM 0 HD13 LEU A 444 2.193 2.896 1.496 1.00 0.00 H new ATOM 0 HD21 LEU A 444 2.505 1.262 4.039 1.00 0.00 H new ATOM 0 HD22 LEU A 444 3.097 2.921 3.784 1.00 0.00 H new ATOM 0 HD23 LEU A 444 2.029 2.559 5.160 1.00 0.00 H new ATOM 855 N LYS A 445 1.670 4.623 6.552 1.00 0.00 N ATOM 856 CA LYS A 445 2.748 5.162 7.370 1.00 0.00 C ATOM 857 C LYS A 445 3.620 4.032 7.945 1.00 0.00 C ATOM 858 O LYS A 445 3.162 2.914 8.137 1.00 0.00 O ATOM 859 CB LYS A 445 2.173 6.016 8.511 1.00 0.00 C ATOM 860 CG LYS A 445 3.220 6.603 9.437 1.00 0.00 C ATOM 861 CD LYS A 445 2.744 6.730 10.869 1.00 0.00 C ATOM 862 CE LYS A 445 2.512 5.361 11.526 1.00 0.00 C ATOM 863 NZ LYS A 445 1.157 4.820 11.337 1.00 0.00 N ATOM 0 H LYS A 445 1.293 3.730 6.869 1.00 0.00 H new ATOM 0 HA LYS A 445 3.374 5.790 6.736 1.00 0.00 H new ATOM 0 HB2 LYS A 445 1.587 6.829 8.082 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.487 5.404 9.098 1.00 0.00 H new ATOM 0 HG2 LYS A 445 4.111 5.976 9.411 1.00 0.00 H new ATOM 0 HG3 LYS A 445 3.511 7.587 9.069 1.00 0.00 H new ATOM 0 HD2 LYS A 445 3.480 7.288 11.447 1.00 0.00 H new ATOM 0 HD3 LYS A 445 1.818 7.304 10.893 1.00 0.00 H new ATOM 0 HE2 LYS A 445 3.234 4.651 11.123 1.00 0.00 H new ATOM 0 HE3 LYS A 445 2.711 5.445 12.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 0.884 4.267 12.175 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 0.486 5.603 11.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 1.142 4.207 10.497 1.00 0.00 H new ATOM 877 N VAL A 446 4.884 4.335 8.194 1.00 0.00 N ATOM 878 CA VAL A 446 5.791 3.388 8.803 1.00 0.00 C ATOM 879 C VAL A 446 5.332 3.012 10.202 1.00 0.00 C ATOM 880 O VAL A 446 5.043 3.867 11.028 1.00 0.00 O ATOM 881 CB VAL A 446 7.265 3.893 8.820 1.00 0.00 C ATOM 882 CG1 VAL A 446 7.784 4.084 7.409 1.00 0.00 C ATOM 883 CG2 VAL A 446 7.413 5.196 9.611 1.00 0.00 C ATOM 0 H VAL A 446 5.304 5.240 7.980 1.00 0.00 H new ATOM 0 HA VAL A 446 5.771 2.494 8.180 1.00 0.00 H new ATOM 0 HB VAL A 446 7.859 3.128 9.319 1.00 0.00 H new ATOM 0 HG11 VAL A 446 8.815 4.437 7.445 1.00 0.00 H new ATOM 0 HG12 VAL A 446 7.744 3.135 6.875 1.00 0.00 H new ATOM 0 HG13 VAL A 446 7.167 4.818 6.891 1.00 0.00 H new ATOM 0 HG21 VAL A 446 8.456 5.513 9.598 1.00 0.00 H new ATOM 0 HG22 VAL A 446 6.793 5.969 9.158 1.00 0.00 H new ATOM 0 HG23 VAL A 446 7.096 5.034 10.641 1.00 0.00 H new ATOM 893 N GLY A 447 5.240 1.739 10.452 1.00 0.00 N ATOM 894 CA GLY A 447 4.804 1.297 11.738 1.00 0.00 C ATOM 895 C GLY A 447 3.367 0.806 11.774 1.00 0.00 C ATOM 896 O GLY A 447 2.958 0.226 12.772 1.00 0.00 O ATOM 0 H GLY A 447 5.459 0.997 9.788 1.00 0.00 H new ATOM 0 HA2 GLY A 447 5.459 0.494 12.075 1.00 0.00 H new ATOM 0 HA3 GLY A 447 4.914 2.117 12.448 1.00 0.00 H new ATOM 900 N ASP A 448 2.590 1.018 10.719 1.00 0.00 N ATOM 901 CA ASP A 448 1.211 0.499 10.722 1.00 0.00 C ATOM 902 C ASP A 448 1.067 -0.786 9.909 1.00 0.00 C ATOM 903 O ASP A 448 1.880 -1.051 9.004 1.00 0.00 O ATOM 904 CB ASP A 448 0.101 1.556 10.393 1.00 0.00 C ATOM 905 CG ASP A 448 0.237 2.318 9.093 1.00 0.00 C ATOM 906 OD1 ASP A 448 0.114 1.742 8.027 1.00 0.00 O ATOM 907 OD2 ASP A 448 0.398 3.563 9.167 1.00 0.00 O ATOM 0 H ASP A 448 2.867 1.524 9.878 1.00 0.00 H new ATOM 0 HA ASP A 448 1.024 0.240 11.764 1.00 0.00 H new ATOM 0 HB2 ASP A 448 -0.861 1.044 10.386 1.00 0.00 H new ATOM 0 HB3 ASP A 448 0.071 2.280 11.208 1.00 0.00 H new ATOM 912 N PRO A 449 0.115 -1.677 10.311 1.00 0.00 N ATOM 913 CA PRO A 449 -0.137 -2.933 9.616 1.00 0.00 C ATOM 914 C PRO A 449 -0.967 -2.756 8.338 1.00 0.00 C ATOM 915 O PRO A 449 -2.095 -2.224 8.354 1.00 0.00 O ATOM 916 CB PRO A 449 -0.888 -3.776 10.645 1.00 0.00 C ATOM 917 CG PRO A 449 -1.597 -2.786 11.501 1.00 0.00 C ATOM 918 CD PRO A 449 -0.756 -1.536 11.504 1.00 0.00 C ATOM 0 HA PRO A 449 0.791 -3.392 9.274 1.00 0.00 H new ATOM 0 HB2 PRO A 449 -1.590 -4.457 10.163 1.00 0.00 H new ATOM 0 HB3 PRO A 449 -0.203 -4.388 11.232 1.00 0.00 H new ATOM 0 HG2 PRO A 449 -2.594 -2.581 11.111 1.00 0.00 H new ATOM 0 HG3 PRO A 449 -1.723 -3.170 12.513 1.00 0.00 H new ATOM 0 HD2 PRO A 449 -1.374 -0.640 11.441 1.00 0.00 H new ATOM 0 HD3 PRO A 449 -0.168 -1.454 12.418 1.00 0.00 H new ATOM 926 N ILE A 450 -0.417 -3.238 7.266 1.00 0.00 N ATOM 927 CA ILE A 450 -1.003 -3.132 5.958 1.00 0.00 C ATOM 928 C ILE A 450 -1.337 -4.513 5.414 1.00 0.00 C ATOM 929 O ILE A 450 -0.686 -5.498 5.771 1.00 0.00 O ATOM 930 CB ILE A 450 -0.063 -2.335 4.986 1.00 0.00 C ATOM 931 CG1 ILE A 450 1.399 -2.866 5.000 1.00 0.00 C ATOM 932 CG2 ILE A 450 -0.088 -0.853 5.306 1.00 0.00 C ATOM 933 CD1 ILE A 450 1.651 -4.101 4.160 1.00 0.00 C ATOM 0 H ILE A 450 0.476 -3.730 7.273 1.00 0.00 H new ATOM 0 HA ILE A 450 -1.934 -2.571 6.037 1.00 0.00 H new ATOM 0 HB ILE A 450 -0.452 -2.489 3.980 1.00 0.00 H new ATOM 0 HG12 ILE A 450 2.059 -2.071 4.654 1.00 0.00 H new ATOM 0 HG13 ILE A 450 1.678 -3.085 6.031 1.00 0.00 H new ATOM 0 HG21 ILE A 450 0.571 -0.321 4.619 1.00 0.00 H new ATOM 0 HG22 ILE A 450 -1.105 -0.475 5.199 1.00 0.00 H new ATOM 0 HG23 ILE A 450 0.252 -0.696 6.330 1.00 0.00 H new ATOM 0 HD11 ILE A 450 2.700 -4.387 4.240 1.00 0.00 H new ATOM 0 HD12 ILE A 450 1.024 -4.918 4.517 1.00 0.00 H new ATOM 0 HD13 ILE A 450 1.411 -3.888 3.118 1.00 0.00 H new ATOM 945 N VAL A 451 -2.341 -4.595 4.576 1.00 0.00 N ATOM 946 CA VAL A 451 -2.750 -5.863 3.994 1.00 0.00 C ATOM 947 C VAL A 451 -2.535 -5.797 2.494 1.00 0.00 C ATOM 948 O VAL A 451 -3.096 -4.929 1.841 1.00 0.00 O ATOM 949 CB VAL A 451 -4.256 -6.161 4.277 1.00 0.00 C ATOM 950 CG1 VAL A 451 -4.663 -7.522 3.721 1.00 0.00 C ATOM 951 CG2 VAL A 451 -4.567 -6.078 5.768 1.00 0.00 C ATOM 0 H VAL A 451 -2.898 -3.795 4.276 1.00 0.00 H new ATOM 0 HA VAL A 451 -2.155 -6.659 4.441 1.00 0.00 H new ATOM 0 HB VAL A 451 -4.840 -5.396 3.766 1.00 0.00 H new ATOM 0 HG11 VAL A 451 -5.717 -7.701 3.933 1.00 0.00 H new ATOM 0 HG12 VAL A 451 -4.502 -7.537 2.643 1.00 0.00 H new ATOM 0 HG13 VAL A 451 -4.061 -8.301 4.189 1.00 0.00 H new ATOM 0 HG21 VAL A 451 -5.623 -6.291 5.932 1.00 0.00 H new ATOM 0 HG22 VAL A 451 -3.962 -6.807 6.307 1.00 0.00 H new ATOM 0 HG23 VAL A 451 -4.338 -5.077 6.132 1.00 0.00 H new ATOM 961 N VAL A 452 -1.719 -6.685 1.964 1.00 0.00 N ATOM 962 CA VAL A 452 -1.411 -6.723 0.541 1.00 0.00 C ATOM 963 C VAL A 452 -1.690 -8.120 0.013 1.00 0.00 C ATOM 964 O VAL A 452 -0.984 -9.081 0.368 1.00 0.00 O ATOM 965 CB VAL A 452 0.084 -6.367 0.250 1.00 0.00 C ATOM 966 CG1 VAL A 452 0.383 -6.430 -1.246 1.00 0.00 C ATOM 967 CG2 VAL A 452 0.435 -4.994 0.796 1.00 0.00 C ATOM 0 H VAL A 452 -1.246 -7.407 2.508 1.00 0.00 H new ATOM 0 HA VAL A 452 -2.037 -5.980 0.046 1.00 0.00 H new ATOM 0 HB VAL A 452 0.701 -7.109 0.757 1.00 0.00 H new ATOM 0 HG11 VAL A 452 1.429 -6.178 -1.419 1.00 0.00 H new ATOM 0 HG12 VAL A 452 0.187 -7.437 -1.614 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -0.253 -5.720 -1.774 1.00 0.00 H new ATOM 0 HG21 VAL A 452 1.480 -4.773 0.580 1.00 0.00 H new ATOM 0 HG22 VAL A 452 -0.200 -4.243 0.327 1.00 0.00 H new ATOM 0 HG23 VAL A 452 0.277 -4.980 1.874 1.00 0.00 H new ATOM 977 N GLY A 453 -2.702 -8.240 -0.810 1.00 0.00 N ATOM 978 CA GLY A 453 -3.055 -9.515 -1.366 1.00 0.00 C ATOM 979 C GLY A 453 -3.516 -10.492 -0.309 1.00 0.00 C ATOM 980 O GLY A 453 -4.542 -10.284 0.341 1.00 0.00 O ATOM 0 H GLY A 453 -3.295 -7.466 -1.108 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -3.846 -9.381 -2.104 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -2.195 -9.930 -1.892 1.00 0.00 H new ATOM 984 N THR A 454 -2.753 -11.527 -0.109 1.00 0.00 N ATOM 985 CA THR A 454 -3.086 -12.551 0.841 1.00 0.00 C ATOM 986 C THR A 454 -2.246 -12.430 2.115 1.00 0.00 C ATOM 987 O THR A 454 -2.366 -13.243 3.030 1.00 0.00 O ATOM 988 CB THR A 454 -2.861 -13.932 0.202 1.00 0.00 C ATOM 989 OG1 THR A 454 -1.569 -13.945 -0.450 1.00 0.00 O ATOM 990 CG2 THR A 454 -3.949 -14.245 -0.818 1.00 0.00 C ATOM 0 H THR A 454 -1.875 -11.686 -0.604 1.00 0.00 H new ATOM 0 HA THR A 454 -4.134 -12.432 1.118 1.00 0.00 H new ATOM 0 HB THR A 454 -2.897 -14.691 0.984 1.00 0.00 H new ATOM 0 HG1 THR A 454 -1.417 -14.823 -0.858 1.00 0.00 H new ATOM 0 HG21 THR A 454 -3.766 -15.227 -1.255 1.00 0.00 H new ATOM 0 HG22 THR A 454 -4.921 -14.242 -0.325 1.00 0.00 H new ATOM 0 HG23 THR A 454 -3.939 -13.490 -1.604 1.00 0.00 H new ATOM 998 N THR A 455 -1.422 -11.420 2.184 1.00 0.00 N ATOM 999 CA THR A 455 -0.530 -11.269 3.295 1.00 0.00 C ATOM 1000 C THR A 455 -0.713 -9.903 3.952 1.00 0.00 C ATOM 1001 O THR A 455 -1.113 -8.947 3.303 1.00 0.00 O ATOM 1002 CB THR A 455 0.927 -11.411 2.805 1.00 0.00 C ATOM 1003 OG1 THR A 455 1.046 -12.619 2.040 1.00 0.00 O ATOM 1004 CG2 THR A 455 1.884 -11.467 3.983 1.00 0.00 C ATOM 0 H THR A 455 -1.352 -10.687 1.478 1.00 0.00 H new ATOM 0 HA THR A 455 -0.753 -12.042 4.030 1.00 0.00 H new ATOM 0 HB THR A 455 1.180 -10.547 2.190 1.00 0.00 H new ATOM 0 HG1 THR A 455 1.968 -12.716 1.723 1.00 0.00 H new ATOM 0 HG21 THR A 455 2.906 -11.567 3.617 1.00 0.00 H new ATOM 0 HG22 THR A 455 1.796 -10.551 4.567 1.00 0.00 H new ATOM 0 HG23 THR A 455 1.638 -12.323 4.611 1.00 0.00 H new ATOM 1012 N TYR A 456 -0.445 -9.819 5.228 1.00 0.00 N ATOM 1013 CA TYR A 456 -0.464 -8.571 5.910 1.00 0.00 C ATOM 1014 C TYR A 456 0.856 -8.424 6.637 1.00 0.00 C ATOM 1015 O TYR A 456 1.424 -9.419 7.118 1.00 0.00 O ATOM 1016 CB TYR A 456 -1.672 -8.428 6.869 1.00 0.00 C ATOM 1017 CG TYR A 456 -1.643 -9.296 8.112 1.00 0.00 C ATOM 1018 CD1 TYR A 456 -2.062 -10.621 8.082 1.00 0.00 C ATOM 1019 CD2 TYR A 456 -1.213 -8.771 9.322 1.00 0.00 C ATOM 1020 CE1 TYR A 456 -2.050 -11.391 9.227 1.00 0.00 C ATOM 1021 CE2 TYR A 456 -1.195 -9.534 10.462 1.00 0.00 C ATOM 1022 CZ TYR A 456 -1.613 -10.843 10.415 1.00 0.00 C ATOM 1023 OH TYR A 456 -1.606 -11.600 11.566 1.00 0.00 O ATOM 0 H TYR A 456 -0.209 -10.619 5.816 1.00 0.00 H new ATOM 0 HA TYR A 456 -0.587 -7.766 5.185 1.00 0.00 H new ATOM 0 HB2 TYR A 456 -1.742 -7.386 7.180 1.00 0.00 H new ATOM 0 HB3 TYR A 456 -2.581 -8.656 6.312 1.00 0.00 H new ATOM 0 HD1 TYR A 456 -2.401 -11.053 7.152 1.00 0.00 H new ATOM 0 HD2 TYR A 456 -0.886 -7.743 9.367 1.00 0.00 H new ATOM 0 HE1 TYR A 456 -2.381 -12.418 9.193 1.00 0.00 H new ATOM 0 HE2 TYR A 456 -0.853 -9.108 11.394 1.00 0.00 H new ATOM 0 HH TYR A 456 -1.267 -11.060 12.311 1.00 0.00 H new ATOM 1033 N GLY A 457 1.341 -7.233 6.696 1.00 0.00 N ATOM 1034 CA GLY A 457 2.605 -6.977 7.309 1.00 0.00 C ATOM 1035 C GLY A 457 2.605 -5.637 7.950 1.00 0.00 C ATOM 1036 O GLY A 457 1.546 -5.038 8.116 1.00 0.00 O ATOM 0 H GLY A 457 0.876 -6.406 6.322 1.00 0.00 H new ATOM 0 HA2 GLY A 457 2.818 -7.744 8.054 1.00 0.00 H new ATOM 0 HA3 GLY A 457 3.397 -7.030 6.562 1.00 0.00 H new ATOM 1040 N ARG A 458 3.754 -5.134 8.272 1.00 0.00 N ATOM 1041 CA ARG A 458 3.838 -3.872 8.944 1.00 0.00 C ATOM 1042 C ARG A 458 4.920 -3.071 8.287 1.00 0.00 C ATOM 1043 O ARG A 458 5.992 -3.591 8.018 1.00 0.00 O ATOM 1044 CB ARG A 458 4.117 -4.094 10.425 1.00 0.00 C ATOM 1045 CG ARG A 458 3.915 -2.879 11.301 1.00 0.00 C ATOM 1046 CD ARG A 458 4.077 -3.269 12.762 1.00 0.00 C ATOM 1047 NE ARG A 458 3.650 -2.213 13.668 1.00 0.00 N ATOM 1048 CZ ARG A 458 3.362 -2.368 14.964 1.00 0.00 C ATOM 1049 NH1 ARG A 458 3.486 -3.561 15.557 1.00 0.00 N ATOM 1050 NH2 ARG A 458 2.933 -1.333 15.657 1.00 0.00 N ATOM 0 H ARG A 458 4.652 -5.578 8.080 1.00 0.00 H new ATOM 0 HA ARG A 458 2.898 -3.325 8.872 1.00 0.00 H new ATOM 0 HB2 ARG A 458 3.471 -4.895 10.785 1.00 0.00 H new ATOM 0 HB3 ARG A 458 5.145 -4.438 10.538 1.00 0.00 H new ATOM 0 HG2 ARG A 458 4.637 -2.105 11.039 1.00 0.00 H new ATOM 0 HG3 ARG A 458 2.923 -2.459 11.134 1.00 0.00 H new ATOM 0 HD2 ARG A 458 3.498 -4.171 12.961 1.00 0.00 H new ATOM 0 HD3 ARG A 458 5.122 -3.511 12.957 1.00 0.00 H new ATOM 0 HE ARG A 458 3.563 -1.274 13.280 1.00 0.00 H new ATOM 0 HH11 ARG A 458 3.804 -4.367 15.019 1.00 0.00 H new ATOM 0 HH12 ARG A 458 3.263 -3.664 16.547 1.00 0.00 H new ATOM 0 HH21 ARG A 458 2.824 -0.426 15.204 1.00 0.00 H new ATOM 0 HH22 ARG A 458 2.710 -1.439 16.647 1.00 0.00 H new ATOM 1064 N VAL A 459 4.638 -1.831 8.029 1.00 0.00 N ATOM 1065 CA VAL A 459 5.520 -0.978 7.261 1.00 0.00 C ATOM 1066 C VAL A 459 6.838 -0.683 7.967 1.00 0.00 C ATOM 1067 O VAL A 459 6.871 -0.126 9.078 1.00 0.00 O ATOM 1068 CB VAL A 459 4.838 0.329 6.900 1.00 0.00 C ATOM 1069 CG1 VAL A 459 5.729 1.160 5.980 1.00 0.00 C ATOM 1070 CG2 VAL A 459 3.504 0.049 6.256 1.00 0.00 C ATOM 0 H VAL A 459 3.784 -1.370 8.344 1.00 0.00 H new ATOM 0 HA VAL A 459 5.753 -1.536 6.354 1.00 0.00 H new ATOM 0 HB VAL A 459 4.668 0.906 7.809 1.00 0.00 H new ATOM 0 HG11 VAL A 459 5.225 2.094 5.731 1.00 0.00 H new ATOM 0 HG12 VAL A 459 6.670 1.379 6.485 1.00 0.00 H new ATOM 0 HG13 VAL A 459 5.930 0.601 5.066 1.00 0.00 H new ATOM 0 HG21 VAL A 459 3.019 0.991 5.999 1.00 0.00 H new ATOM 0 HG22 VAL A 459 3.653 -0.541 5.352 1.00 0.00 H new ATOM 0 HG23 VAL A 459 2.874 -0.506 6.951 1.00 0.00 H new ATOM 1080 N ARG A 460 7.905 -1.046 7.306 1.00 0.00 N ATOM 1081 CA ARG A 460 9.242 -0.829 7.792 1.00 0.00 C ATOM 1082 C ARG A 460 9.758 0.571 7.388 1.00 0.00 C ATOM 1083 O ARG A 460 10.043 1.410 8.234 1.00 0.00 O ATOM 1084 CB ARG A 460 10.146 -1.927 7.192 1.00 0.00 C ATOM 1085 CG ARG A 460 11.630 -1.767 7.439 1.00 0.00 C ATOM 1086 CD ARG A 460 11.904 -1.795 8.892 1.00 0.00 C ATOM 1087 NE ARG A 460 13.330 -1.636 9.201 1.00 0.00 N ATOM 1088 CZ ARG A 460 14.094 -2.575 9.785 1.00 0.00 C ATOM 1089 NH1 ARG A 460 13.615 -3.803 9.980 1.00 0.00 N ATOM 1090 NH2 ARG A 460 15.333 -2.283 10.157 1.00 0.00 N ATOM 0 H ARG A 460 7.869 -1.509 6.398 1.00 0.00 H new ATOM 0 HA ARG A 460 9.253 -0.877 8.881 1.00 0.00 H new ATOM 0 HB2 ARG A 460 9.832 -2.890 7.595 1.00 0.00 H new ATOM 0 HB3 ARG A 460 9.978 -1.961 6.116 1.00 0.00 H new ATOM 0 HG2 ARG A 460 12.179 -2.566 6.941 1.00 0.00 H new ATOM 0 HG3 ARG A 460 11.979 -0.827 7.012 1.00 0.00 H new ATOM 0 HD2 ARG A 460 11.340 -1.000 9.380 1.00 0.00 H new ATOM 0 HD3 ARG A 460 11.549 -2.739 9.307 1.00 0.00 H new ATOM 0 HE ARG A 460 13.772 -0.750 8.955 1.00 0.00 H new ATOM 0 HH11 ARG A 460 12.666 -4.033 9.686 1.00 0.00 H new ATOM 0 HH12 ARG A 460 14.198 -4.513 10.423 1.00 0.00 H new ATOM 0 HH21 ARG A 460 15.705 -1.346 10.000 1.00 0.00 H new ATOM 0 HH22 ARG A 460 15.914 -2.995 10.600 1.00 0.00 H new ATOM 1104 N ALA A 461 9.839 0.800 6.113 1.00 0.00 N ATOM 1105 CA ALA A 461 10.320 2.041 5.545 1.00 0.00 C ATOM 1106 C ALA A 461 9.408 2.458 4.441 1.00 0.00 C ATOM 1107 O ALA A 461 8.725 1.619 3.844 1.00 0.00 O ATOM 1108 CB ALA A 461 11.737 1.852 5.007 1.00 0.00 C ATOM 0 H ALA A 461 9.566 0.113 5.410 1.00 0.00 H new ATOM 0 HA ALA A 461 10.338 2.813 6.315 1.00 0.00 H new ATOM 0 HB1 ALA A 461 12.093 2.790 4.581 1.00 0.00 H new ATOM 0 HB2 ALA A 461 12.397 1.549 5.820 1.00 0.00 H new ATOM 0 HB3 ALA A 461 11.734 1.082 4.236 1.00 0.00 H new ATOM 1114 N MET A 462 9.393 3.730 4.178 1.00 0.00 N ATOM 1115 CA MET A 462 8.555 4.300 3.170 1.00 0.00 C ATOM 1116 C MET A 462 9.450 5.043 2.217 1.00 0.00 C ATOM 1117 O MET A 462 10.164 5.955 2.632 1.00 0.00 O ATOM 1118 CB MET A 462 7.629 5.318 3.810 1.00 0.00 C ATOM 1119 CG MET A 462 6.466 5.758 2.941 1.00 0.00 C ATOM 1120 SD MET A 462 5.173 4.541 2.893 1.00 0.00 S ATOM 1121 CE MET A 462 4.738 4.579 4.619 1.00 0.00 C ATOM 0 H MET A 462 9.973 4.411 4.667 1.00 0.00 H new ATOM 0 HA MET A 462 7.976 3.524 2.670 1.00 0.00 H new ATOM 0 HB2 MET A 462 7.234 4.897 4.735 1.00 0.00 H new ATOM 0 HB3 MET A 462 8.213 6.197 4.083 1.00 0.00 H new ATOM 0 HG2 MET A 462 6.065 6.698 3.321 1.00 0.00 H new ATOM 0 HG3 MET A 462 6.822 5.949 1.929 1.00 0.00 H new ATOM 0 HE1 MET A 462 3.664 4.426 4.727 1.00 0.00 H new ATOM 0 HE2 MET A 462 5.272 3.789 5.146 1.00 0.00 H new ATOM 0 HE3 MET A 462 5.011 5.546 5.042 1.00 0.00 H new ATOM 1131 N VAL A 463 9.485 4.648 0.995 1.00 0.00 N ATOM 1132 CA VAL A 463 10.258 5.372 0.008 1.00 0.00 C ATOM 1133 C VAL A 463 9.325 5.694 -1.127 1.00 0.00 C ATOM 1134 O VAL A 463 8.604 4.830 -1.567 1.00 0.00 O ATOM 1135 CB VAL A 463 11.463 4.546 -0.533 1.00 0.00 C ATOM 1136 CG1 VAL A 463 12.344 5.410 -1.413 1.00 0.00 C ATOM 1137 CG2 VAL A 463 12.282 3.935 0.599 1.00 0.00 C ATOM 0 H VAL A 463 8.993 3.829 0.639 1.00 0.00 H new ATOM 0 HA VAL A 463 10.676 6.267 0.469 1.00 0.00 H new ATOM 0 HB VAL A 463 11.059 3.727 -1.129 1.00 0.00 H new ATOM 0 HG11 VAL A 463 13.181 4.818 -1.783 1.00 0.00 H new ATOM 0 HG12 VAL A 463 11.762 5.782 -2.256 1.00 0.00 H new ATOM 0 HG13 VAL A 463 12.723 6.252 -0.834 1.00 0.00 H new ATOM 0 HG21 VAL A 463 13.113 3.367 0.181 1.00 0.00 H new ATOM 0 HG22 VAL A 463 12.670 4.729 1.237 1.00 0.00 H new ATOM 0 HG23 VAL A 463 11.649 3.272 1.189 1.00 0.00 H new ATOM 1147 N ASN A 464 9.304 6.910 -1.590 1.00 0.00 N ATOM 1148 CA ASN A 464 8.365 7.242 -2.640 1.00 0.00 C ATOM 1149 C ASN A 464 9.051 7.160 -3.975 1.00 0.00 C ATOM 1150 O ASN A 464 10.267 6.976 -4.027 1.00 0.00 O ATOM 1151 CB ASN A 464 7.716 8.615 -2.421 1.00 0.00 C ATOM 1152 CG ASN A 464 8.545 9.794 -2.866 1.00 0.00 C ATOM 1153 OD1 ASN A 464 8.447 10.238 -3.999 1.00 0.00 O ATOM 1154 ND2 ASN A 464 9.345 10.314 -2.001 1.00 0.00 N ATOM 0 H ASN A 464 9.903 7.673 -1.274 1.00 0.00 H new ATOM 0 HA ASN A 464 7.553 6.515 -2.616 1.00 0.00 H new ATOM 0 HB2 ASN A 464 6.765 8.639 -2.952 1.00 0.00 H new ATOM 0 HB3 ASN A 464 7.492 8.728 -1.360 1.00 0.00 H new ATOM 0 HD21 ASN A 464 9.918 11.119 -2.255 1.00 0.00 H new ATOM 0 HD22 ASN A 464 9.405 9.921 -1.062 1.00 0.00 H new ATOM 1161 N ASP A 465 8.289 7.339 -5.036 1.00 0.00 N ATOM 1162 CA ASP A 465 8.781 7.218 -6.424 1.00 0.00 C ATOM 1163 C ASP A 465 9.957 8.159 -6.725 1.00 0.00 C ATOM 1164 O ASP A 465 10.807 7.854 -7.554 1.00 0.00 O ATOM 1165 CB ASP A 465 7.647 7.472 -7.424 1.00 0.00 C ATOM 1166 CG ASP A 465 8.095 7.350 -8.871 1.00 0.00 C ATOM 1167 OD1 ASP A 465 8.031 6.238 -9.440 1.00 0.00 O ATOM 1168 OD2 ASP A 465 8.509 8.366 -9.469 1.00 0.00 O ATOM 0 H ASP A 465 7.299 7.575 -4.975 1.00 0.00 H new ATOM 0 HA ASP A 465 9.146 6.196 -6.532 1.00 0.00 H new ATOM 0 HB2 ASP A 465 6.840 6.763 -7.238 1.00 0.00 H new ATOM 0 HB3 ASP A 465 7.240 8.469 -7.258 1.00 0.00 H new ATOM 1173 N SER A 466 10.028 9.269 -6.022 1.00 0.00 N ATOM 1174 CA SER A 466 11.084 10.228 -6.246 1.00 0.00 C ATOM 1175 C SER A 466 12.379 9.764 -5.555 1.00 0.00 C ATOM 1176 O SER A 466 13.461 10.338 -5.761 1.00 0.00 O ATOM 1177 CB SER A 466 10.655 11.628 -5.774 1.00 0.00 C ATOM 1178 OG SER A 466 11.599 12.618 -6.150 1.00 0.00 O ATOM 0 H SER A 466 9.366 9.528 -5.291 1.00 0.00 H new ATOM 0 HA SER A 466 11.282 10.293 -7.316 1.00 0.00 H new ATOM 0 HB2 SER A 466 9.681 11.873 -6.198 1.00 0.00 H new ATOM 0 HB3 SER A 466 10.539 11.628 -4.690 1.00 0.00 H new ATOM 0 HG SER A 466 12.505 12.252 -6.074 1.00 0.00 H new ATOM 1184 N GLY A 467 12.267 8.744 -4.717 1.00 0.00 N ATOM 1185 CA GLY A 467 13.440 8.170 -4.105 1.00 0.00 C ATOM 1186 C GLY A 467 13.687 8.718 -2.741 1.00 0.00 C ATOM 1187 O GLY A 467 14.700 8.429 -2.118 1.00 0.00 O ATOM 0 H GLY A 467 11.385 8.306 -4.452 1.00 0.00 H new ATOM 0 HA2 GLY A 467 13.324 7.088 -4.045 1.00 0.00 H new ATOM 0 HA3 GLY A 467 14.308 8.363 -4.735 1.00 0.00 H new ATOM 1191 N ARG A 468 12.764 9.514 -2.275 1.00 0.00 N ATOM 1192 CA ARG A 468 12.879 10.094 -0.968 1.00 0.00 C ATOM 1193 C ARG A 468 12.300 9.186 0.062 1.00 0.00 C ATOM 1194 O ARG A 468 11.184 8.649 -0.112 1.00 0.00 O ATOM 1195 CB ARG A 468 12.257 11.489 -0.882 1.00 0.00 C ATOM 1196 CG ARG A 468 13.172 12.624 -1.326 1.00 0.00 C ATOM 1197 CD ARG A 468 13.594 12.509 -2.777 1.00 0.00 C ATOM 1198 NE ARG A 468 14.579 13.524 -3.112 1.00 0.00 N ATOM 1199 CZ ARG A 468 15.242 13.618 -4.261 1.00 0.00 C ATOM 1200 NH1 ARG A 468 14.992 12.774 -5.259 1.00 0.00 N ATOM 1201 NH2 ARG A 468 16.150 14.578 -4.414 1.00 0.00 N ATOM 0 H ARG A 468 11.920 9.776 -2.785 1.00 0.00 H new ATOM 0 HA ARG A 468 13.943 10.218 -0.769 1.00 0.00 H new ATOM 0 HB2 ARG A 468 11.355 11.508 -1.493 1.00 0.00 H new ATOM 0 HB3 ARG A 468 11.948 11.671 0.147 1.00 0.00 H new ATOM 0 HG2 ARG A 468 12.661 13.575 -1.176 1.00 0.00 H new ATOM 0 HG3 ARG A 468 14.060 12.636 -0.694 1.00 0.00 H new ATOM 0 HD2 ARG A 468 14.009 11.518 -2.962 1.00 0.00 H new ATOM 0 HD3 ARG A 468 12.722 12.615 -3.423 1.00 0.00 H new ATOM 0 HE ARG A 468 14.780 14.228 -2.402 1.00 0.00 H new ATOM 0 HH11 ARG A 468 14.286 12.046 -5.147 1.00 0.00 H new ATOM 0 HH12 ARG A 468 15.506 12.855 -6.136 1.00 0.00 H new ATOM 0 HH21 ARG A 468 16.332 15.233 -3.654 1.00 0.00 H new ATOM 0 HH22 ARG A 468 16.664 14.659 -5.291 1.00 0.00 H new ATOM 1215 N ARG A 469 13.063 8.976 1.086 1.00 0.00 N ATOM 1216 CA ARG A 469 12.692 8.143 2.186 1.00 0.00 C ATOM 1217 C ARG A 469 11.807 8.994 3.086 1.00 0.00 C ATOM 1218 O ARG A 469 12.191 10.100 3.467 1.00 0.00 O ATOM 1219 CB ARG A 469 13.977 7.710 2.910 1.00 0.00 C ATOM 1220 CG ARG A 469 13.895 6.441 3.756 1.00 0.00 C ATOM 1221 CD ARG A 469 12.942 6.542 4.922 1.00 0.00 C ATOM 1222 NE ARG A 469 13.044 5.359 5.775 1.00 0.00 N ATOM 1223 CZ ARG A 469 12.309 5.087 6.856 1.00 0.00 C ATOM 1224 NH1 ARG A 469 11.324 5.892 7.247 1.00 0.00 N ATOM 1225 NH2 ARG A 469 12.578 3.999 7.547 1.00 0.00 N ATOM 0 H ARG A 469 13.989 9.392 1.184 1.00 0.00 H new ATOM 0 HA ARG A 469 12.155 7.245 1.881 1.00 0.00 H new ATOM 0 HB2 ARG A 469 14.758 7.570 2.162 1.00 0.00 H new ATOM 0 HB3 ARG A 469 14.296 8.529 3.555 1.00 0.00 H new ATOM 0 HG2 ARG A 469 13.588 5.611 3.119 1.00 0.00 H new ATOM 0 HG3 ARG A 469 14.890 6.202 4.132 1.00 0.00 H new ATOM 0 HD2 ARG A 469 13.164 7.437 5.504 1.00 0.00 H new ATOM 0 HD3 ARG A 469 11.921 6.646 4.556 1.00 0.00 H new ATOM 0 HE ARG A 469 13.750 4.670 5.517 1.00 0.00 H new ATOM 0 HH11 ARG A 469 11.116 6.739 6.717 1.00 0.00 H new ATOM 0 HH12 ARG A 469 10.777 5.662 8.076 1.00 0.00 H new ATOM 0 HH21 ARG A 469 13.336 3.383 7.253 1.00 0.00 H new ATOM 0 HH22 ARG A 469 12.029 3.773 8.376 1.00 0.00 H new ATOM 1239 N VAL A 470 10.651 8.504 3.412 1.00 0.00 N ATOM 1240 CA VAL A 470 9.689 9.271 4.157 1.00 0.00 C ATOM 1241 C VAL A 470 9.104 8.433 5.266 1.00 0.00 C ATOM 1242 O VAL A 470 9.499 7.269 5.440 1.00 0.00 O ATOM 1243 CB VAL A 470 8.571 9.877 3.237 1.00 0.00 C ATOM 1244 CG1 VAL A 470 9.139 10.990 2.365 1.00 0.00 C ATOM 1245 CG2 VAL A 470 7.954 8.812 2.350 1.00 0.00 C ATOM 0 H VAL A 470 10.343 7.562 3.171 1.00 0.00 H new ATOM 0 HA VAL A 470 10.209 10.119 4.602 1.00 0.00 H new ATOM 0 HB VAL A 470 7.798 10.285 3.888 1.00 0.00 H new ATOM 0 HG11 VAL A 470 8.349 11.397 1.734 1.00 0.00 H new ATOM 0 HG12 VAL A 470 9.541 11.780 2.999 1.00 0.00 H new ATOM 0 HG13 VAL A 470 9.935 10.590 1.737 1.00 0.00 H new ATOM 0 HG21 VAL A 470 7.183 9.262 1.724 1.00 0.00 H new ATOM 0 HG22 VAL A 470 8.726 8.374 1.717 1.00 0.00 H new ATOM 0 HG23 VAL A 470 7.509 8.034 2.971 1.00 0.00 H new ATOM 1255 N LYS A 471 8.237 9.012 6.041 1.00 0.00 N ATOM 1256 CA LYS A 471 7.618 8.311 7.142 1.00 0.00 C ATOM 1257 C LYS A 471 6.197 7.910 6.790 1.00 0.00 C ATOM 1258 O LYS A 471 5.730 6.835 7.179 1.00 0.00 O ATOM 1259 CB LYS A 471 7.647 9.171 8.406 1.00 0.00 C ATOM 1260 CG LYS A 471 9.054 9.558 8.833 1.00 0.00 C ATOM 1261 CD LYS A 471 9.051 10.464 10.049 1.00 0.00 C ATOM 1262 CE LYS A 471 10.460 10.906 10.419 1.00 0.00 C ATOM 1263 NZ LYS A 471 11.133 11.646 9.320 1.00 0.00 N ATOM 0 H LYS A 471 7.935 9.980 5.934 1.00 0.00 H new ATOM 0 HA LYS A 471 8.186 7.401 7.336 1.00 0.00 H new ATOM 0 HB2 LYS A 471 7.064 10.076 8.236 1.00 0.00 H new ATOM 0 HB3 LYS A 471 7.164 8.628 9.218 1.00 0.00 H new ATOM 0 HG2 LYS A 471 9.626 8.657 9.054 1.00 0.00 H new ATOM 0 HG3 LYS A 471 9.558 10.061 8.008 1.00 0.00 H new ATOM 0 HD2 LYS A 471 8.434 11.340 9.850 1.00 0.00 H new ATOM 0 HD3 LYS A 471 8.599 9.941 10.892 1.00 0.00 H new ATOM 0 HE2 LYS A 471 10.417 11.539 11.306 1.00 0.00 H new ATOM 0 HE3 LYS A 471 11.055 10.031 10.680 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 11.959 12.153 9.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 11.443 10.975 8.589 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 10.469 12.329 8.904 1.00 0.00 H new ATOM 1277 N GLU A 472 5.520 8.748 6.038 1.00 0.00 N ATOM 1278 CA GLU A 472 4.167 8.457 5.638 1.00 0.00 C ATOM 1279 C GLU A 472 3.939 8.786 4.180 1.00 0.00 C ATOM 1280 O GLU A 472 4.727 9.518 3.561 1.00 0.00 O ATOM 1281 CB GLU A 472 3.099 9.129 6.546 1.00 0.00 C ATOM 1282 CG GLU A 472 3.053 10.656 6.552 1.00 0.00 C ATOM 1283 CD GLU A 472 4.298 11.306 7.106 1.00 0.00 C ATOM 1284 OE1 GLU A 472 4.438 11.390 8.339 1.00 0.00 O ATOM 1285 OE2 GLU A 472 5.149 11.768 6.314 1.00 0.00 O ATOM 0 H GLU A 472 5.886 9.635 5.693 1.00 0.00 H new ATOM 0 HA GLU A 472 4.039 7.382 5.767 1.00 0.00 H new ATOM 0 HB2 GLU A 472 2.118 8.762 6.243 1.00 0.00 H new ATOM 0 HB3 GLU A 472 3.264 8.791 7.569 1.00 0.00 H new ATOM 0 HG2 GLU A 472 2.894 11.008 5.533 1.00 0.00 H new ATOM 0 HG3 GLU A 472 2.194 10.981 7.139 1.00 0.00 H new ATOM 1292 N ALA A 473 2.892 8.236 3.640 1.00 0.00 N ATOM 1293 CA ALA A 473 2.539 8.411 2.270 1.00 0.00 C ATOM 1294 C ALA A 473 1.094 8.819 2.153 1.00 0.00 C ATOM 1295 O ALA A 473 0.203 8.182 2.756 1.00 0.00 O ATOM 1296 CB ALA A 473 2.765 7.128 1.519 1.00 0.00 C ATOM 0 H ALA A 473 2.246 7.639 4.157 1.00 0.00 H new ATOM 0 HA ALA A 473 3.164 9.195 1.843 1.00 0.00 H new ATOM 0 HB1 ALA A 473 2.494 7.266 0.472 1.00 0.00 H new ATOM 0 HB2 ALA A 473 3.816 6.847 1.587 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.149 6.340 1.952 1.00 0.00 H new ATOM 1302 N GLY A 474 0.862 9.868 1.414 1.00 0.00 N ATOM 1303 CA GLY A 474 -0.471 10.332 1.188 1.00 0.00 C ATOM 1304 C GLY A 474 -1.077 9.624 -0.001 1.00 0.00 C ATOM 1305 O GLY A 474 -0.346 9.024 -0.788 1.00 0.00 O ATOM 0 H GLY A 474 1.588 10.419 0.956 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -1.080 10.155 2.074 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -0.465 11.408 1.015 1.00 0.00 H new ATOM 1309 N PRO A 475 -2.396 9.677 -0.172 1.00 0.00 N ATOM 1310 CA PRO A 475 -3.072 8.984 -1.266 1.00 0.00 C ATOM 1311 C PRO A 475 -2.687 9.534 -2.623 1.00 0.00 C ATOM 1312 O PRO A 475 -2.259 10.696 -2.748 1.00 0.00 O ATOM 1313 CB PRO A 475 -4.554 9.192 -0.978 1.00 0.00 C ATOM 1314 CG PRO A 475 -4.615 10.407 -0.114 1.00 0.00 C ATOM 1315 CD PRO A 475 -3.336 10.439 0.669 1.00 0.00 C ATOM 0 HA PRO A 475 -2.796 7.931 -1.311 1.00 0.00 H new ATOM 0 HB2 PRO A 475 -5.118 9.335 -1.899 1.00 0.00 H new ATOM 0 HB3 PRO A 475 -4.983 8.327 -0.472 1.00 0.00 H new ATOM 0 HG2 PRO A 475 -4.722 11.308 -0.719 1.00 0.00 H new ATOM 0 HG3 PRO A 475 -5.477 10.366 0.552 1.00 0.00 H new ATOM 0 HD2 PRO A 475 -2.991 11.460 0.832 1.00 0.00 H new ATOM 0 HD3 PRO A 475 -3.456 9.982 1.651 1.00 0.00 H new ATOM 1323 N SER A 476 -2.772 8.658 -3.618 1.00 0.00 N ATOM 1324 CA SER A 476 -2.443 8.952 -5.000 1.00 0.00 C ATOM 1325 C SER A 476 -0.905 9.036 -5.184 1.00 0.00 C ATOM 1326 O SER A 476 -0.401 9.502 -6.214 1.00 0.00 O ATOM 1327 CB SER A 476 -3.192 10.222 -5.499 1.00 0.00 C ATOM 1328 OG SER A 476 -3.006 10.455 -6.890 1.00 0.00 O ATOM 0 H SER A 476 -3.081 7.696 -3.477 1.00 0.00 H new ATOM 0 HA SER A 476 -2.791 8.133 -5.630 1.00 0.00 H new ATOM 0 HB2 SER A 476 -4.257 10.117 -5.291 1.00 0.00 H new ATOM 0 HB3 SER A 476 -2.842 11.089 -4.939 1.00 0.00 H new ATOM 0 HG SER A 476 -2.067 10.299 -7.125 1.00 0.00 H new ATOM 1334 N MET A 477 -0.172 8.534 -4.200 1.00 0.00 N ATOM 1335 CA MET A 477 1.276 8.519 -4.255 1.00 0.00 C ATOM 1336 C MET A 477 1.827 7.091 -4.349 1.00 0.00 C ATOM 1337 O MET A 477 1.349 6.189 -3.642 1.00 0.00 O ATOM 1338 CB MET A 477 1.894 9.212 -3.040 1.00 0.00 C ATOM 1339 CG MET A 477 3.407 9.060 -3.000 1.00 0.00 C ATOM 1340 SD MET A 477 4.215 9.892 -1.612 1.00 0.00 S ATOM 1341 CE MET A 477 3.749 11.598 -1.885 1.00 0.00 C ATOM 0 H MET A 477 -0.564 8.130 -3.349 1.00 0.00 H new ATOM 0 HA MET A 477 1.552 9.066 -5.157 1.00 0.00 H new ATOM 0 HB2 MET A 477 1.637 10.271 -3.058 1.00 0.00 H new ATOM 0 HB3 MET A 477 1.464 8.796 -2.129 1.00 0.00 H new ATOM 0 HG2 MET A 477 3.651 7.998 -2.961 1.00 0.00 H new ATOM 0 HG3 MET A 477 3.822 9.448 -3.930 1.00 0.00 H new ATOM 0 HE1 MET A 477 4.391 12.250 -1.293 1.00 0.00 H new ATOM 0 HE2 MET A 477 3.861 11.841 -2.942 1.00 0.00 H new ATOM 0 HE3 MET A 477 2.711 11.744 -1.587 1.00 0.00 H new ATOM 1351 N PRO A 478 2.813 6.857 -5.255 1.00 0.00 N ATOM 1352 CA PRO A 478 3.510 5.583 -5.346 1.00 0.00 C ATOM 1353 C PRO A 478 4.614 5.487 -4.286 1.00 0.00 C ATOM 1354 O PRO A 478 5.496 6.364 -4.209 1.00 0.00 O ATOM 1355 CB PRO A 478 4.164 5.620 -6.736 1.00 0.00 C ATOM 1356 CG PRO A 478 3.724 6.896 -7.375 1.00 0.00 C ATOM 1357 CD PRO A 478 3.302 7.800 -6.270 1.00 0.00 C ATOM 0 HA PRO A 478 2.838 4.739 -5.194 1.00 0.00 H new ATOM 0 HB2 PRO A 478 5.250 5.580 -6.655 1.00 0.00 H new ATOM 0 HB3 PRO A 478 3.857 4.761 -7.333 1.00 0.00 H new ATOM 0 HG2 PRO A 478 4.535 7.341 -7.951 1.00 0.00 H new ATOM 0 HG3 PRO A 478 2.901 6.719 -8.067 1.00 0.00 H new ATOM 0 HD2 PRO A 478 4.132 8.401 -5.899 1.00 0.00 H new ATOM 0 HD3 PRO A 478 2.523 8.493 -6.588 1.00 0.00 H new ATOM 1365 N VAL A 479 4.579 4.436 -3.502 1.00 0.00 N ATOM 1366 CA VAL A 479 5.555 4.212 -2.452 1.00 0.00 C ATOM 1367 C VAL A 479 6.004 2.770 -2.387 1.00 0.00 C ATOM 1368 O VAL A 479 5.223 1.845 -2.630 1.00 0.00 O ATOM 1369 CB VAL A 479 5.074 4.673 -1.042 1.00 0.00 C ATOM 1370 CG1 VAL A 479 5.134 6.180 -0.920 1.00 0.00 C ATOM 1371 CG2 VAL A 479 3.656 4.191 -0.769 1.00 0.00 C ATOM 0 H VAL A 479 3.870 3.706 -3.572 1.00 0.00 H new ATOM 0 HA VAL A 479 6.404 4.837 -2.729 1.00 0.00 H new ATOM 0 HB VAL A 479 5.743 4.233 -0.303 1.00 0.00 H new ATOM 0 HG11 VAL A 479 4.794 6.479 0.072 1.00 0.00 H new ATOM 0 HG12 VAL A 479 6.160 6.516 -1.068 1.00 0.00 H new ATOM 0 HG13 VAL A 479 4.491 6.632 -1.675 1.00 0.00 H new ATOM 0 HG21 VAL A 479 3.342 4.525 0.220 1.00 0.00 H new ATOM 0 HG22 VAL A 479 2.981 4.601 -1.521 1.00 0.00 H new ATOM 0 HG23 VAL A 479 3.627 3.102 -0.811 1.00 0.00 H new ATOM 1381 N GLU A 480 7.265 2.613 -2.110 1.00 0.00 N ATOM 1382 CA GLU A 480 7.915 1.348 -1.926 1.00 0.00 C ATOM 1383 C GLU A 480 7.820 1.052 -0.437 1.00 0.00 C ATOM 1384 O GLU A 480 8.408 1.785 0.388 1.00 0.00 O ATOM 1385 CB GLU A 480 9.401 1.504 -2.307 1.00 0.00 C ATOM 1386 CG GLU A 480 10.239 0.221 -2.365 1.00 0.00 C ATOM 1387 CD GLU A 480 10.061 -0.558 -3.651 1.00 0.00 C ATOM 1388 OE1 GLU A 480 9.134 -1.352 -3.763 1.00 0.00 O ATOM 1389 OE2 GLU A 480 10.877 -0.380 -4.600 1.00 0.00 O ATOM 0 H GLU A 480 7.900 3.404 -2.001 1.00 0.00 H new ATOM 0 HA GLU A 480 7.467 0.559 -2.530 1.00 0.00 H new ATOM 0 HB2 GLU A 480 9.452 1.988 -3.282 1.00 0.00 H new ATOM 0 HB3 GLU A 480 9.866 2.181 -1.591 1.00 0.00 H new ATOM 0 HG2 GLU A 480 11.292 0.478 -2.248 1.00 0.00 H new ATOM 0 HG3 GLU A 480 9.971 -0.417 -1.523 1.00 0.00 H new ATOM 1396 N ILE A 481 7.064 0.059 -0.086 1.00 0.00 N ATOM 1397 CA ILE A 481 6.915 -0.312 1.294 1.00 0.00 C ATOM 1398 C ILE A 481 7.773 -1.520 1.591 1.00 0.00 C ATOM 1399 O ILE A 481 8.252 -2.205 0.679 1.00 0.00 O ATOM 1400 CB ILE A 481 5.452 -0.638 1.707 1.00 0.00 C ATOM 1401 CG1 ILE A 481 4.919 -1.871 0.963 1.00 0.00 C ATOM 1402 CG2 ILE A 481 4.553 0.573 1.477 1.00 0.00 C ATOM 1403 CD1 ILE A 481 3.617 -2.394 1.520 1.00 0.00 C ATOM 0 H ILE A 481 6.534 -0.517 -0.740 1.00 0.00 H new ATOM 0 HA ILE A 481 7.227 0.558 1.871 1.00 0.00 H new ATOM 0 HB ILE A 481 5.447 -0.875 2.771 1.00 0.00 H new ATOM 0 HG12 ILE A 481 4.780 -1.619 -0.088 1.00 0.00 H new ATOM 0 HG13 ILE A 481 5.667 -2.663 1.005 1.00 0.00 H new ATOM 0 HG21 ILE A 481 3.532 0.329 1.771 1.00 0.00 H new ATOM 0 HG22 ILE A 481 4.912 1.411 2.074 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.572 0.845 0.422 1.00 0.00 H new ATOM 0 HD11 ILE A 481 3.300 -3.265 0.947 1.00 0.00 H new ATOM 0 HD12 ILE A 481 3.755 -2.677 2.563 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.855 -1.618 1.453 1.00 0.00 H new ATOM 1415 N THR A 482 7.925 -1.796 2.843 1.00 0.00 N ATOM 1416 CA THR A 482 8.717 -2.895 3.319 1.00 0.00 C ATOM 1417 C THR A 482 8.067 -3.438 4.569 1.00 0.00 C ATOM 1418 O THR A 482 7.203 -2.767 5.144 1.00 0.00 O ATOM 1419 CB THR A 482 10.131 -2.410 3.660 1.00 0.00 C ATOM 1420 OG1 THR A 482 10.048 -1.061 4.129 1.00 0.00 O ATOM 1421 CG2 THR A 482 11.064 -2.477 2.479 1.00 0.00 C ATOM 0 H THR A 482 7.492 -1.252 3.589 1.00 0.00 H new ATOM 0 HA THR A 482 8.781 -3.666 2.551 1.00 0.00 H new ATOM 0 HB THR A 482 10.539 -3.068 4.427 1.00 0.00 H new ATOM 0 HG1 THR A 482 10.291 -0.447 3.405 1.00 0.00 H new ATOM 0 HG21 THR A 482 12.051 -2.122 2.775 1.00 0.00 H new ATOM 0 HG22 THR A 482 11.138 -3.507 2.131 1.00 0.00 H new ATOM 0 HG23 THR A 482 10.679 -1.850 1.675 1.00 0.00 H new ATOM 1429 N GLY A 483 8.465 -4.618 4.987 1.00 0.00 N ATOM 1430 CA GLY A 483 7.933 -5.188 6.200 1.00 0.00 C ATOM 1431 C GLY A 483 6.755 -6.110 5.968 1.00 0.00 C ATOM 1432 O GLY A 483 6.047 -6.468 6.915 1.00 0.00 O ATOM 0 H GLY A 483 9.152 -5.198 4.506 1.00 0.00 H new ATOM 0 HA2 GLY A 483 8.722 -5.741 6.709 1.00 0.00 H new ATOM 0 HA3 GLY A 483 7.628 -4.382 6.867 1.00 0.00 H new ATOM 1436 N LEU A 484 6.521 -6.492 4.719 1.00 0.00 N ATOM 1437 CA LEU A 484 5.446 -7.431 4.428 1.00 0.00 C ATOM 1438 C LEU A 484 5.879 -8.835 4.850 1.00 0.00 C ATOM 1439 O LEU A 484 5.071 -9.649 5.264 1.00 0.00 O ATOM 1440 CB LEU A 484 5.077 -7.410 2.940 1.00 0.00 C ATOM 1441 CG LEU A 484 3.869 -8.274 2.543 1.00 0.00 C ATOM 1442 CD1 LEU A 484 2.592 -7.762 3.198 1.00 0.00 C ATOM 1443 CD2 LEU A 484 3.714 -8.315 1.042 1.00 0.00 C ATOM 0 H LEU A 484 7.049 -6.174 3.906 1.00 0.00 H new ATOM 0 HA LEU A 484 4.560 -7.136 4.990 1.00 0.00 H new ATOM 0 HB2 LEU A 484 4.875 -6.379 2.649 1.00 0.00 H new ATOM 0 HB3 LEU A 484 5.942 -7.740 2.365 1.00 0.00 H new ATOM 0 HG LEU A 484 4.049 -9.288 2.900 1.00 0.00 H new ATOM 0 HD11 LEU A 484 1.753 -8.391 2.900 1.00 0.00 H new ATOM 0 HD12 LEU A 484 2.702 -7.792 4.282 1.00 0.00 H new ATOM 0 HD13 LEU A 484 2.407 -6.736 2.881 1.00 0.00 H new ATOM 0 HD21 LEU A 484 2.854 -8.932 0.782 1.00 0.00 H new ATOM 0 HD22 LEU A 484 3.563 -7.304 0.664 1.00 0.00 H new ATOM 0 HD23 LEU A 484 4.613 -8.739 0.595 1.00 0.00 H new ATOM 1455 N HIS A 485 7.193 -9.073 4.737 1.00 0.00 N ATOM 1456 CA HIS A 485 7.861 -10.329 5.113 1.00 0.00 C ATOM 1457 C HIS A 485 7.333 -11.531 4.272 1.00 0.00 C ATOM 1458 O HIS A 485 7.501 -12.703 4.628 1.00 0.00 O ATOM 1459 CB HIS A 485 7.694 -10.553 6.640 1.00 0.00 C ATOM 1460 CG HIS A 485 8.575 -11.613 7.244 1.00 0.00 C ATOM 1461 ND1 HIS A 485 9.861 -11.377 7.674 1.00 0.00 N ATOM 1462 CD2 HIS A 485 8.330 -12.922 7.498 1.00 0.00 C ATOM 1463 CE1 HIS A 485 10.350 -12.515 8.161 1.00 0.00 C ATOM 1464 NE2 HIS A 485 9.456 -13.493 8.079 1.00 0.00 N ATOM 0 H HIS A 485 7.841 -8.376 4.370 1.00 0.00 H new ATOM 0 HA HIS A 485 8.925 -10.256 4.890 1.00 0.00 H new ATOM 0 HB2 HIS A 485 7.889 -9.610 7.150 1.00 0.00 H new ATOM 0 HB3 HIS A 485 6.655 -10.814 6.839 1.00 0.00 H new ATOM 0 HD2 HIS A 485 7.406 -13.439 7.283 1.00 0.00 H new ATOM 0 HE1 HIS A 485 11.343 -12.628 8.569 1.00 0.00 H new ATOM 0 HE2 HIS A 485 9.571 -14.461 8.380 1.00 0.00 H new ATOM 1472 N ASP A 486 6.743 -11.236 3.139 1.00 0.00 N ATOM 1473 CA ASP A 486 6.242 -12.269 2.252 1.00 0.00 C ATOM 1474 C ASP A 486 6.343 -11.746 0.830 1.00 0.00 C ATOM 1475 O ASP A 486 6.789 -10.609 0.634 1.00 0.00 O ATOM 1476 CB ASP A 486 4.804 -12.632 2.601 1.00 0.00 C ATOM 1477 CG ASP A 486 4.444 -14.056 2.225 1.00 0.00 C ATOM 1478 OD1 ASP A 486 4.400 -14.384 1.029 1.00 0.00 O ATOM 1479 OD2 ASP A 486 4.197 -14.878 3.136 1.00 0.00 O ATOM 0 H ASP A 486 6.595 -10.284 2.804 1.00 0.00 H new ATOM 0 HA ASP A 486 6.833 -13.178 2.359 1.00 0.00 H new ATOM 0 HB2 ASP A 486 4.650 -12.495 3.671 1.00 0.00 H new ATOM 0 HB3 ASP A 486 4.128 -11.946 2.091 1.00 0.00 H new ATOM 1484 N VAL A 487 5.930 -12.527 -0.135 1.00 0.00 N ATOM 1485 CA VAL A 487 6.018 -12.144 -1.523 1.00 0.00 C ATOM 1486 C VAL A 487 4.730 -11.407 -1.961 1.00 0.00 C ATOM 1487 O VAL A 487 3.609 -11.939 -1.830 1.00 0.00 O ATOM 1488 CB VAL A 487 6.311 -13.371 -2.465 1.00 0.00 C ATOM 1489 CG1 VAL A 487 5.211 -14.422 -2.422 1.00 0.00 C ATOM 1490 CG2 VAL A 487 6.572 -12.916 -3.898 1.00 0.00 C ATOM 0 H VAL A 487 5.522 -13.449 0.019 1.00 0.00 H new ATOM 0 HA VAL A 487 6.864 -11.464 -1.620 1.00 0.00 H new ATOM 0 HB VAL A 487 7.215 -13.845 -2.082 1.00 0.00 H new ATOM 0 HG11 VAL A 487 5.467 -15.244 -3.091 1.00 0.00 H new ATOM 0 HG12 VAL A 487 5.109 -14.800 -1.405 1.00 0.00 H new ATOM 0 HG13 VAL A 487 4.269 -13.976 -2.740 1.00 0.00 H new ATOM 0 HG21 VAL A 487 6.771 -13.785 -4.525 1.00 0.00 H new ATOM 0 HG22 VAL A 487 5.697 -12.388 -4.277 1.00 0.00 H new ATOM 0 HG23 VAL A 487 7.434 -12.250 -3.917 1.00 0.00 H new ATOM 1500 N PRO A 488 4.854 -10.157 -2.416 1.00 0.00 N ATOM 1501 CA PRO A 488 3.727 -9.408 -2.912 1.00 0.00 C ATOM 1502 C PRO A 488 3.503 -9.658 -4.411 1.00 0.00 C ATOM 1503 O PRO A 488 4.322 -10.317 -5.083 1.00 0.00 O ATOM 1504 CB PRO A 488 4.130 -7.943 -2.672 1.00 0.00 C ATOM 1505 CG PRO A 488 5.601 -7.956 -2.334 1.00 0.00 C ATOM 1506 CD PRO A 488 6.088 -9.370 -2.464 1.00 0.00 C ATOM 0 HA PRO A 488 2.796 -9.688 -2.419 1.00 0.00 H new ATOM 0 HB2 PRO A 488 3.940 -7.338 -3.559 1.00 0.00 H new ATOM 0 HB3 PRO A 488 3.548 -7.508 -1.859 1.00 0.00 H new ATOM 0 HG2 PRO A 488 6.153 -7.298 -3.005 1.00 0.00 H new ATOM 0 HG3 PRO A 488 5.764 -7.587 -1.321 1.00 0.00 H new ATOM 0 HD2 PRO A 488 6.628 -9.525 -3.398 1.00 0.00 H new ATOM 0 HD3 PRO A 488 6.767 -9.637 -1.655 1.00 0.00 H new ATOM 1514 N GLN A 489 2.405 -9.153 -4.936 1.00 0.00 N ATOM 1515 CA GLN A 489 2.119 -9.287 -6.341 1.00 0.00 C ATOM 1516 C GLN A 489 1.793 -7.941 -6.946 1.00 0.00 C ATOM 1517 O GLN A 489 1.005 -7.174 -6.385 1.00 0.00 O ATOM 1518 CB GLN A 489 0.963 -10.260 -6.571 1.00 0.00 C ATOM 1519 CG GLN A 489 1.332 -11.687 -6.262 1.00 0.00 C ATOM 1520 CD GLN A 489 0.187 -12.657 -6.391 1.00 0.00 C ATOM 1521 OE1 GLN A 489 -0.739 -12.476 -7.196 1.00 0.00 O ATOM 1522 NE2 GLN A 489 0.249 -13.692 -5.618 1.00 0.00 N ATOM 0 H GLN A 489 1.697 -8.645 -4.405 1.00 0.00 H new ATOM 0 HA GLN A 489 3.008 -9.686 -6.829 1.00 0.00 H new ATOM 0 HB2 GLN A 489 0.117 -9.966 -5.950 1.00 0.00 H new ATOM 0 HB3 GLN A 489 0.636 -10.190 -7.609 1.00 0.00 H new ATOM 0 HG2 GLN A 489 2.135 -11.997 -6.931 1.00 0.00 H new ATOM 0 HG3 GLN A 489 1.726 -11.738 -5.247 1.00 0.00 H new ATOM 0 HE21 GLN A 489 1.030 -13.799 -4.971 1.00 0.00 H new ATOM 0 HE22 GLN A 489 -0.483 -14.401 -5.655 1.00 0.00 H new ATOM 1531 N ALA A 490 2.426 -7.640 -8.052 1.00 0.00 N ATOM 1532 CA ALA A 490 2.139 -6.449 -8.801 1.00 0.00 C ATOM 1533 C ALA A 490 0.793 -6.613 -9.473 1.00 0.00 C ATOM 1534 O ALA A 490 0.553 -7.623 -10.147 1.00 0.00 O ATOM 1535 CB ALA A 490 3.225 -6.208 -9.833 1.00 0.00 C ATOM 0 H ALA A 490 3.160 -8.221 -8.458 1.00 0.00 H new ATOM 0 HA ALA A 490 2.110 -5.587 -8.134 1.00 0.00 H new ATOM 0 HB1 ALA A 490 2.998 -5.302 -10.396 1.00 0.00 H new ATOM 0 HB2 ALA A 490 4.185 -6.092 -9.330 1.00 0.00 H new ATOM 0 HB3 ALA A 490 3.273 -7.057 -10.515 1.00 0.00 H new ATOM 1541 N GLY A 491 -0.078 -5.665 -9.282 1.00 0.00 N ATOM 1542 CA GLY A 491 -1.380 -5.755 -9.868 1.00 0.00 C ATOM 1543 C GLY A 491 -2.413 -6.276 -8.897 1.00 0.00 C ATOM 1544 O GLY A 491 -3.578 -6.425 -9.256 1.00 0.00 O ATOM 0 H GLY A 491 0.090 -4.825 -8.728 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -1.684 -4.771 -10.224 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -1.340 -6.411 -10.738 1.00 0.00 H new ATOM 1548 N ASP A 492 -2.000 -6.580 -7.677 1.00 0.00 N ATOM 1549 CA ASP A 492 -2.952 -7.056 -6.673 1.00 0.00 C ATOM 1550 C ASP A 492 -3.505 -5.840 -5.944 1.00 0.00 C ATOM 1551 O ASP A 492 -3.119 -4.695 -6.233 1.00 0.00 O ATOM 1552 CB ASP A 492 -2.293 -8.000 -5.644 1.00 0.00 C ATOM 1553 CG ASP A 492 -3.270 -9.007 -5.016 1.00 0.00 C ATOM 1554 OD1 ASP A 492 -4.189 -8.603 -4.294 1.00 0.00 O ATOM 1555 OD2 ASP A 492 -3.132 -10.211 -5.250 1.00 0.00 O ATOM 0 H ASP A 492 -1.034 -6.510 -7.357 1.00 0.00 H new ATOM 0 HA ASP A 492 -3.737 -7.620 -7.178 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -1.485 -8.546 -6.130 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -1.842 -7.402 -4.852 1.00 0.00 H new ATOM 1560 N ARG A 493 -4.335 -6.078 -5.002 1.00 0.00 N ATOM 1561 CA ARG A 493 -4.984 -5.060 -4.251 1.00 0.00 C ATOM 1562 C ARG A 493 -4.381 -5.040 -2.876 1.00 0.00 C ATOM 1563 O ARG A 493 -3.873 -6.059 -2.391 1.00 0.00 O ATOM 1564 CB ARG A 493 -6.483 -5.359 -4.083 1.00 0.00 C ATOM 1565 CG ARG A 493 -7.372 -5.369 -5.344 1.00 0.00 C ATOM 1566 CD ARG A 493 -7.043 -6.511 -6.303 1.00 0.00 C ATOM 1567 NE ARG A 493 -6.997 -7.816 -5.624 1.00 0.00 N ATOM 1568 CZ ARG A 493 -6.965 -9.002 -6.234 1.00 0.00 C ATOM 1569 NH1 ARG A 493 -7.177 -9.089 -7.545 1.00 0.00 N ATOM 1570 NH2 ARG A 493 -6.755 -10.103 -5.522 1.00 0.00 N ATOM 0 H ARG A 493 -4.595 -7.022 -4.717 1.00 0.00 H new ATOM 0 HA ARG A 493 -4.861 -4.113 -4.776 1.00 0.00 H new ATOM 0 HB2 ARG A 493 -6.576 -6.333 -3.603 1.00 0.00 H new ATOM 0 HB3 ARG A 493 -6.894 -4.623 -3.392 1.00 0.00 H new ATOM 0 HG2 ARG A 493 -8.417 -5.445 -5.043 1.00 0.00 H new ATOM 0 HG3 ARG A 493 -7.259 -4.420 -5.868 1.00 0.00 H new ATOM 0 HD2 ARG A 493 -7.790 -6.543 -7.096 1.00 0.00 H new ATOM 0 HD3 ARG A 493 -6.081 -6.317 -6.778 1.00 0.00 H new ATOM 0 HE ARG A 493 -6.989 -7.813 -4.604 1.00 0.00 H new ATOM 0 HH11 ARG A 493 -7.365 -8.246 -8.088 1.00 0.00 H new ATOM 0 HH12 ARG A 493 -7.151 -9.998 -8.007 1.00 0.00 H new ATOM 0 HH21 ARG A 493 -6.619 -10.040 -4.513 1.00 0.00 H new ATOM 0 HH22 ARG A 493 -6.730 -11.012 -5.984 1.00 0.00 H new ATOM 1584 N PHE A 494 -4.417 -3.918 -2.263 1.00 0.00 N ATOM 1585 CA PHE A 494 -3.993 -3.811 -0.900 1.00 0.00 C ATOM 1586 C PHE A 494 -4.904 -2.861 -0.180 1.00 0.00 C ATOM 1587 O PHE A 494 -5.495 -1.951 -0.795 1.00 0.00 O ATOM 1588 CB PHE A 494 -2.526 -3.352 -0.774 1.00 0.00 C ATOM 1589 CG PHE A 494 -2.277 -1.971 -1.263 1.00 0.00 C ATOM 1590 CD1 PHE A 494 -2.010 -1.738 -2.582 1.00 0.00 C ATOM 1591 CD2 PHE A 494 -2.334 -0.902 -0.396 1.00 0.00 C ATOM 1592 CE1 PHE A 494 -1.802 -0.468 -3.031 1.00 0.00 C ATOM 1593 CE2 PHE A 494 -2.131 0.373 -0.843 1.00 0.00 C ATOM 1594 CZ PHE A 494 -1.865 0.584 -2.165 1.00 0.00 C ATOM 0 H PHE A 494 -4.738 -3.044 -2.680 1.00 0.00 H new ATOM 0 HA PHE A 494 -4.048 -4.801 -0.448 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -2.226 -3.415 0.272 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -1.892 -4.042 -1.330 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -1.963 -2.566 -3.274 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -2.542 -1.074 0.650 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -1.587 -0.294 -4.075 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -2.181 1.206 -0.157 1.00 0.00 H new ATOM 0 HZ PHE A 494 -1.704 1.589 -2.527 1.00 0.00 H new ATOM 1604 N MET A 495 -4.996 -3.031 1.089 1.00 0.00 N ATOM 1605 CA MET A 495 -5.828 -2.197 1.898 1.00 0.00 C ATOM 1606 C MET A 495 -5.012 -1.617 3.025 1.00 0.00 C ATOM 1607 O MET A 495 -4.393 -2.349 3.804 1.00 0.00 O ATOM 1608 CB MET A 495 -7.025 -2.973 2.457 1.00 0.00 C ATOM 1609 CG MET A 495 -8.002 -2.106 3.253 1.00 0.00 C ATOM 1610 SD MET A 495 -9.366 -3.046 3.983 1.00 0.00 S ATOM 1611 CE MET A 495 -8.478 -4.125 5.111 1.00 0.00 C ATOM 0 H MET A 495 -4.496 -3.755 1.605 1.00 0.00 H new ATOM 0 HA MET A 495 -6.218 -1.392 1.275 1.00 0.00 H new ATOM 0 HB2 MET A 495 -7.560 -3.443 1.632 1.00 0.00 H new ATOM 0 HB3 MET A 495 -6.659 -3.775 3.098 1.00 0.00 H new ATOM 0 HG2 MET A 495 -7.458 -1.593 4.046 1.00 0.00 H new ATOM 0 HG3 MET A 495 -8.410 -1.336 2.598 1.00 0.00 H new ATOM 0 HE1 MET A 495 -9.163 -4.500 5.871 1.00 0.00 H new ATOM 0 HE2 MET A 495 -8.057 -4.964 4.557 1.00 0.00 H new ATOM 0 HE3 MET A 495 -7.674 -3.567 5.591 1.00 0.00 H new ATOM 1621 N VAL A 496 -4.972 -0.318 3.075 1.00 0.00 N ATOM 1622 CA VAL A 496 -4.301 0.396 4.133 1.00 0.00 C ATOM 1623 C VAL A 496 -5.371 1.058 4.960 1.00 0.00 C ATOM 1624 O VAL A 496 -6.096 1.919 4.451 1.00 0.00 O ATOM 1625 CB VAL A 496 -3.340 1.487 3.578 1.00 0.00 C ATOM 1626 CG1 VAL A 496 -2.653 2.226 4.711 1.00 0.00 C ATOM 1627 CG2 VAL A 496 -2.306 0.877 2.662 1.00 0.00 C ATOM 0 H VAL A 496 -5.407 0.286 2.378 1.00 0.00 H new ATOM 0 HA VAL A 496 -3.699 -0.300 4.717 1.00 0.00 H new ATOM 0 HB VAL A 496 -3.938 2.197 3.007 1.00 0.00 H new ATOM 0 HG11 VAL A 496 -1.986 2.984 4.300 1.00 0.00 H new ATOM 0 HG12 VAL A 496 -3.403 2.706 5.340 1.00 0.00 H new ATOM 0 HG13 VAL A 496 -2.076 1.520 5.308 1.00 0.00 H new ATOM 0 HG21 VAL A 496 -1.646 1.659 2.287 1.00 0.00 H new ATOM 0 HG22 VAL A 496 -1.720 0.141 3.213 1.00 0.00 H new ATOM 0 HG23 VAL A 496 -2.804 0.390 1.824 1.00 0.00 H new ATOM 1684 N GLU A 500 -7.223 2.314 14.746 1.00 0.00 N ATOM 1685 CA GLU A 500 -8.214 2.984 15.574 1.00 0.00 C ATOM 1686 C GLU A 500 -9.390 3.487 14.770 1.00 0.00 C ATOM 1687 O GLU A 500 -10.490 3.573 15.273 1.00 0.00 O ATOM 1688 CB GLU A 500 -7.606 4.153 16.305 1.00 0.00 C ATOM 1689 CG GLU A 500 -6.967 5.164 15.378 1.00 0.00 C ATOM 1690 CD GLU A 500 -6.745 6.475 16.028 1.00 0.00 C ATOM 1691 OE1 GLU A 500 -5.795 6.626 16.800 1.00 0.00 O ATOM 1692 OE2 GLU A 500 -7.541 7.389 15.779 1.00 0.00 O ATOM 0 HA GLU A 500 -8.567 2.237 16.284 1.00 0.00 H new ATOM 0 HB2 GLU A 500 -8.378 4.647 16.895 1.00 0.00 H new ATOM 0 HB3 GLU A 500 -6.856 3.786 17.005 1.00 0.00 H new ATOM 0 HG2 GLU A 500 -6.014 4.773 15.023 1.00 0.00 H new ATOM 0 HG3 GLU A 500 -7.602 5.300 14.502 1.00 0.00 H new ATOM 1699 N LYS A 501 -9.155 3.800 13.527 1.00 0.00 N ATOM 1700 CA LYS A 501 -10.179 4.366 12.695 1.00 0.00 C ATOM 1701 C LYS A 501 -11.264 3.357 12.393 1.00 0.00 C ATOM 1702 O LYS A 501 -12.450 3.683 12.383 1.00 0.00 O ATOM 1703 CB LYS A 501 -9.570 4.950 11.438 1.00 0.00 C ATOM 1704 CG LYS A 501 -8.732 6.220 11.672 1.00 0.00 C ATOM 1705 CD LYS A 501 -9.518 7.316 12.395 1.00 0.00 C ATOM 1706 CE LYS A 501 -8.707 8.610 12.547 1.00 0.00 C ATOM 1707 NZ LYS A 501 -7.456 8.439 13.344 1.00 0.00 N ATOM 0 H LYS A 501 -8.255 3.671 13.064 1.00 0.00 H new ATOM 0 HA LYS A 501 -10.659 5.180 13.238 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -8.940 4.194 10.968 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -10.370 5.181 10.734 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -7.848 5.965 12.257 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -8.381 6.601 10.713 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -10.434 7.527 11.844 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -9.814 6.958 13.381 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -8.449 8.986 11.557 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -9.331 9.367 13.023 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -6.993 9.362 13.465 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -7.690 8.044 14.277 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -6.813 7.791 12.846 1.00 0.00 H new ATOM 1721 N LYS A 502 -10.867 2.141 12.162 1.00 0.00 N ATOM 1722 CA LYS A 502 -11.830 1.084 11.962 1.00 0.00 C ATOM 1723 C LYS A 502 -12.341 0.619 13.346 1.00 0.00 C ATOM 1724 O LYS A 502 -13.539 0.394 13.533 1.00 0.00 O ATOM 1725 CB LYS A 502 -11.194 -0.098 11.195 1.00 0.00 C ATOM 1726 CG LYS A 502 -12.138 -0.849 10.220 1.00 0.00 C ATOM 1727 CD LYS A 502 -13.398 -1.404 10.884 1.00 0.00 C ATOM 1728 CE LYS A 502 -14.258 -2.213 9.903 1.00 0.00 C ATOM 1729 NZ LYS A 502 -14.761 -1.415 8.766 1.00 0.00 N ATOM 0 H LYS A 502 -9.891 1.851 12.106 1.00 0.00 H new ATOM 0 HA LYS A 502 -12.663 1.455 11.364 1.00 0.00 H new ATOM 0 HB2 LYS A 502 -10.340 0.276 10.630 1.00 0.00 H new ATOM 0 HB3 LYS A 502 -10.807 -0.813 11.921 1.00 0.00 H new ATOM 0 HG2 LYS A 502 -12.430 -0.171 9.418 1.00 0.00 H new ATOM 0 HG3 LYS A 502 -11.590 -1.671 9.759 1.00 0.00 H new ATOM 0 HD2 LYS A 502 -13.115 -2.037 11.725 1.00 0.00 H new ATOM 0 HD3 LYS A 502 -13.987 -0.581 11.288 1.00 0.00 H new ATOM 0 HE2 LYS A 502 -13.671 -3.047 9.520 1.00 0.00 H new ATOM 0 HE3 LYS A 502 -15.105 -2.640 10.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 502 -15.401 -1.997 8.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 502 -15.276 -0.586 9.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 502 -13.960 -1.099 8.182 1.00 0.00 H new ATOM 1743 N ALA A 503 -11.431 0.543 14.322 1.00 0.00 N ATOM 1744 CA ALA A 503 -11.758 0.040 15.655 1.00 0.00 C ATOM 1745 C ALA A 503 -12.768 0.903 16.370 1.00 0.00 C ATOM 1746 O ALA A 503 -13.797 0.408 16.813 1.00 0.00 O ATOM 1747 CB ALA A 503 -10.519 -0.104 16.517 1.00 0.00 C ATOM 0 H ALA A 503 -10.457 0.826 14.210 1.00 0.00 H new ATOM 0 HA ALA A 503 -12.203 -0.943 15.499 1.00 0.00 H new ATOM 0 HB1 ALA A 503 -10.802 -0.480 17.500 1.00 0.00 H new ATOM 0 HB2 ALA A 503 -9.827 -0.803 16.046 1.00 0.00 H new ATOM 0 HB3 ALA A 503 -10.036 0.867 16.625 1.00 0.00 H new ATOM 1753 N ARG A 504 -12.500 2.193 16.447 1.00 0.00 N ATOM 1754 CA ARG A 504 -13.318 3.143 17.207 1.00 0.00 C ATOM 1755 C ARG A 504 -14.690 3.325 16.581 1.00 0.00 C ATOM 1756 O ARG A 504 -15.610 3.821 17.217 1.00 0.00 O ATOM 1757 CB ARG A 504 -12.559 4.468 17.380 1.00 0.00 C ATOM 1758 CG ARG A 504 -13.161 5.446 18.378 1.00 0.00 C ATOM 1759 CD ARG A 504 -12.203 6.598 18.650 1.00 0.00 C ATOM 1760 NE ARG A 504 -11.926 7.396 17.448 1.00 0.00 N ATOM 1761 CZ ARG A 504 -10.704 7.703 16.975 1.00 0.00 C ATOM 1762 NH1 ARG A 504 -9.607 7.149 17.490 1.00 0.00 N ATOM 1763 NH2 ARG A 504 -10.588 8.533 15.954 1.00 0.00 N ATOM 0 H ARG A 504 -11.701 2.624 15.981 1.00 0.00 H new ATOM 0 HA ARG A 504 -13.499 2.737 18.202 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -11.538 4.243 17.689 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -12.497 4.960 16.409 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -14.103 5.834 17.991 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -13.388 4.928 19.310 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -12.625 7.243 19.421 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -11.267 6.202 19.043 1.00 0.00 H new ATOM 0 HE ARG A 504 -12.729 7.748 16.927 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -9.685 6.480 18.256 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -8.689 7.394 17.118 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -11.422 8.938 15.528 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -9.664 8.769 15.591 1.00 0.00 H new ATOM 1777 N GLN A 505 -14.823 2.901 15.354 1.00 0.00 N ATOM 1778 CA GLN A 505 -16.095 2.926 14.690 1.00 0.00 C ATOM 1779 C GLN A 505 -16.925 1.702 15.128 1.00 0.00 C ATOM 1780 O GLN A 505 -18.151 1.775 15.280 1.00 0.00 O ATOM 1781 CB GLN A 505 -15.901 2.938 13.170 1.00 0.00 C ATOM 1782 CG GLN A 505 -17.191 3.106 12.385 1.00 0.00 C ATOM 1783 CD GLN A 505 -17.907 4.406 12.711 1.00 0.00 C ATOM 1784 OE1 GLN A 505 -17.286 5.419 13.049 1.00 0.00 O ATOM 1785 NE2 GLN A 505 -19.202 4.387 12.635 1.00 0.00 N ATOM 0 H GLN A 505 -14.058 2.531 14.790 1.00 0.00 H new ATOM 0 HA GLN A 505 -16.631 3.833 14.967 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -15.219 3.747 12.907 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -15.422 2.007 12.868 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -16.970 3.075 11.318 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -17.854 2.267 12.598 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -19.684 3.534 12.352 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -19.738 5.226 12.858 1.00 0.00 H new ATOM 1794 N ILE A 506 -16.246 0.594 15.376 1.00 0.00 N ATOM 1795 CA ILE A 506 -16.914 -0.637 15.772 1.00 0.00 C ATOM 1796 C ILE A 506 -17.125 -0.695 17.296 1.00 0.00 C ATOM 1797 O ILE A 506 -18.252 -0.848 17.753 1.00 0.00 O ATOM 1798 CB ILE A 506 -16.128 -1.895 15.292 1.00 0.00 C ATOM 1799 CG1 ILE A 506 -15.958 -1.889 13.759 1.00 0.00 C ATOM 1800 CG2 ILE A 506 -16.805 -3.190 15.750 1.00 0.00 C ATOM 1801 CD1 ILE A 506 -17.263 -1.840 12.975 1.00 0.00 C ATOM 0 H ILE A 506 -15.231 0.521 15.310 1.00 0.00 H new ATOM 0 HA ILE A 506 -17.890 -0.638 15.287 1.00 0.00 H new ATOM 0 HB ILE A 506 -15.140 -1.854 15.750 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -15.348 -1.030 13.478 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -15.406 -2.782 13.465 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -16.229 -4.046 15.397 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -16.854 -3.210 16.839 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -17.814 -3.238 15.340 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -17.046 -1.839 11.907 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -17.868 -2.712 13.221 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -17.810 -0.934 13.235 1.00 0.00 H new ATOM 1813 N GLY A 507 -16.056 -0.541 18.066 1.00 0.00 N ATOM 1814 CA GLY A 507 -16.186 -0.594 19.513 1.00 0.00 C ATOM 1815 C GLY A 507 -14.977 -0.043 20.249 1.00 0.00 C ATOM 1816 O GLY A 507 -14.879 -0.181 21.469 1.00 0.00 O ATOM 0 H GLY A 507 -15.109 -0.382 17.721 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -17.071 -0.032 19.811 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -16.347 -1.628 19.818 1.00 0.00 H new