USER MOD reduce.3.24.130724 H: found=0, std=0, add=688, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 689 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 481 ASN : amide:sc= 0.444 K(o=1.3,f=-1.4!) USER MOD Set 1.2: A 527 CYS SG : rot 80:sc= 0.854 USER MOD Set 2.1: A 470 GLN :FLIP amide:sc= 0.543 F(o=-1.9,f=-0.58) USER MOD Set 2.2: A 471 GLN :FLIP amide:sc= -1.12 F(o=-1.9,f=-0.58) USER MOD Single : A 459 SER OG : rot 180:sc= 0 USER MOD Single : A 463 LYS NZ :NH3+ -166:sc= 0 (180deg=-0.231) USER MOD Single : A 464 ASN : amide:sc= -0.549 X(o=-0.55,f=-0.64) USER MOD Single : A 466 MET CE :methyl 177:sc= 0 (180deg=-0.00776) USER MOD Single : A 473 THR OG1 : rot 30:sc= 1.02 USER MOD Single : A 474 CYS SG : rot 50:sc= -0.134 USER MOD Single : A 484 LYS NZ :NH3+ -162:sc= -0.0231 (180deg=-0.372) USER MOD Single : A 486 ASN : amide:sc= -12.7! C(o=-13!,f=-13!) USER MOD Single : A 489 ASN :FLIP amide:sc= 0.269 F(o=-13!,f=0.27) USER MOD Single : A 490 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 491 GLN : amide:sc= -0.168 X(o=-0.17,f=-0.17) USER MOD Single : A 493 HIS : no HE2:sc= -4! C(o=-4!,f=-6.2!) USER MOD Single : A 501 GLN : amide:sc= -3.05! C(o=-3!,f=-8.5!) USER MOD Single : A 505 GLN : amide:sc= 0 K(o=0,f=-0.73) USER MOD Single : A 512 THR OG1 : rot 8:sc= 0.598 USER MOD Single : A 516 LYS NZ :NH3+ -135:sc= -7.11! (180deg=-11!) USER MOD Single : A 518 ASN : amide:sc= -2.43! C(o=-2.4!,f=-3.3!) USER MOD Single : A 522 ASN :FLIP amide:sc= -2.15! C(o=-9.1!,f=-2.1!) USER MOD Single : A 525 LYS NZ :NH3+ -122:sc= 0 (180deg=-1.2) USER MOD Single : A 526 ASN : amide:sc= -2.71! X(o=-2.7!,f=-2.3) USER MOD Single : A 529 LYS NZ :NH3+ -125:sc= -0.193 (180deg=-3.21!) USER MOD Single : A 533 SER OG : rot 180:sc= 0 USER MOD Single : A 534 THR OG1 : rot 180:sc= 0 USER MOD Single : A 536 TYR OH : rot 180:sc= 0 USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 538 ASN :FLIP amide:sc= -1.43 F(o=-3.7!,f=-1.4) USER MOD ----------------------------------------------------------------- ATOM 385 N ASP A 456 4.831 14.934 12.279 1.00 0.00 N ATOM 386 CA ASP A 456 3.401 15.009 12.014 1.00 0.00 C ATOM 387 C ASP A 456 3.015 14.001 10.941 1.00 0.00 C ATOM 388 O ASP A 456 1.876 13.541 10.891 1.00 0.00 O ATOM 389 CB ASP A 456 3.028 16.420 11.555 1.00 0.00 C ATOM 390 CG ASP A 456 3.877 16.817 10.353 1.00 0.00 C ATOM 391 OD1 ASP A 456 4.779 16.066 10.017 1.00 0.00 O ATOM 392 OD2 ASP A 456 3.615 17.865 9.787 1.00 0.00 O ATOM 0 HA ASP A 456 2.861 14.777 12.932 1.00 0.00 H new ATOM 0 HB2 ASP A 456 1.971 16.459 11.293 1.00 0.00 H new ATOM 0 HB3 ASP A 456 3.181 17.129 12.369 1.00 0.00 H new ATOM 397 N ASP A 457 3.980 13.657 10.093 1.00 0.00 N ATOM 398 CA ASP A 457 3.743 12.697 9.024 1.00 0.00 C ATOM 399 C ASP A 457 2.941 11.510 9.540 1.00 0.00 C ATOM 400 O ASP A 457 2.058 11.004 8.849 1.00 0.00 O ATOM 401 CB ASP A 457 5.082 12.201 8.473 1.00 0.00 C ATOM 402 CG ASP A 457 5.769 13.312 7.689 1.00 0.00 C ATOM 403 OD1 ASP A 457 5.096 14.262 7.328 1.00 0.00 O ATOM 404 OD2 ASP A 457 6.963 13.196 7.459 1.00 0.00 O ATOM 0 H ASP A 457 4.930 14.028 10.126 1.00 0.00 H new ATOM 0 HA ASP A 457 3.177 13.190 8.234 1.00 0.00 H new ATOM 0 HB2 ASP A 457 5.722 11.874 9.292 1.00 0.00 H new ATOM 0 HB3 ASP A 457 4.921 11.336 7.829 1.00 0.00 H new ATOM 409 N LEU A 458 3.247 11.075 10.757 1.00 0.00 N ATOM 410 CA LEU A 458 2.535 9.950 11.343 1.00 0.00 C ATOM 411 C LEU A 458 1.057 10.295 11.477 1.00 0.00 C ATOM 412 O LEU A 458 0.185 9.472 11.193 1.00 0.00 O ATOM 413 CB LEU A 458 3.117 9.617 12.723 1.00 0.00 C ATOM 414 CG LEU A 458 2.343 8.456 13.368 1.00 0.00 C ATOM 415 CD1 LEU A 458 2.379 7.217 12.457 1.00 0.00 C ATOM 416 CD2 LEU A 458 2.987 8.119 14.719 1.00 0.00 C ATOM 0 H LEU A 458 3.973 11.479 11.349 1.00 0.00 H new ATOM 0 HA LEU A 458 2.647 9.081 10.694 1.00 0.00 H new ATOM 0 HB2 LEU A 458 4.169 9.351 12.626 1.00 0.00 H new ATOM 0 HB3 LEU A 458 3.069 10.496 13.366 1.00 0.00 H new ATOM 0 HG LEU A 458 1.304 8.752 13.512 1.00 0.00 H new ATOM 0 HD11 LEU A 458 1.827 6.403 12.927 1.00 0.00 H new ATOM 0 HD12 LEU A 458 1.923 7.458 11.497 1.00 0.00 H new ATOM 0 HD13 LEU A 458 3.413 6.910 12.300 1.00 0.00 H new ATOM 0 HD21 LEU A 458 2.445 7.296 15.185 1.00 0.00 H new ATOM 0 HD22 LEU A 458 4.026 7.828 14.564 1.00 0.00 H new ATOM 0 HD23 LEU A 458 2.948 8.993 15.369 1.00 0.00 H new ATOM 428 N SER A 459 0.784 11.520 11.916 1.00 0.00 N ATOM 429 CA SER A 459 -0.591 11.973 12.088 1.00 0.00 C ATOM 430 C SER A 459 -1.333 11.961 10.755 1.00 0.00 C ATOM 431 O SER A 459 -2.504 11.589 10.693 1.00 0.00 O ATOM 432 CB SER A 459 -0.610 13.385 12.675 1.00 0.00 C ATOM 433 OG SER A 459 0.091 13.389 13.911 1.00 0.00 O ATOM 0 H SER A 459 1.493 12.213 12.158 1.00 0.00 H new ATOM 0 HA SER A 459 -1.093 11.290 12.774 1.00 0.00 H new ATOM 0 HB2 SER A 459 -0.149 14.086 11.980 1.00 0.00 H new ATOM 0 HB3 SER A 459 -1.638 13.715 12.826 1.00 0.00 H new ATOM 0 HG SER A 459 0.082 14.293 14.289 1.00 0.00 H new ATOM 439 N LEU A 460 -0.648 12.373 9.691 1.00 0.00 N ATOM 440 CA LEU A 460 -1.265 12.408 8.368 1.00 0.00 C ATOM 441 C LEU A 460 -1.694 11.007 7.946 1.00 0.00 C ATOM 442 O LEU A 460 -2.807 10.810 7.458 1.00 0.00 O ATOM 443 CB LEU A 460 -0.258 12.979 7.347 1.00 0.00 C ATOM 444 CG LEU A 460 -0.303 14.516 7.348 1.00 0.00 C ATOM 445 CD1 LEU A 460 0.055 15.044 8.739 1.00 0.00 C ATOM 446 CD2 LEU A 460 0.702 15.058 6.318 1.00 0.00 C ATOM 0 H LEU A 460 0.323 12.684 9.718 1.00 0.00 H new ATOM 0 HA LEU A 460 -2.148 13.046 8.404 1.00 0.00 H new ATOM 0 HB2 LEU A 460 0.748 12.639 7.591 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -0.489 12.603 6.350 1.00 0.00 H new ATOM 0 HG LEU A 460 -1.308 14.847 7.087 1.00 0.00 H new ATOM 0 HD11 LEU A 460 0.022 16.133 8.734 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -0.660 14.662 9.468 1.00 0.00 H new ATOM 0 HD13 LEU A 460 1.058 14.713 9.007 1.00 0.00 H new ATOM 0 HD21 LEU A 460 0.671 16.148 6.318 1.00 0.00 H new ATOM 0 HD22 LEU A 460 1.706 14.724 6.579 1.00 0.00 H new ATOM 0 HD23 LEU A 460 0.442 14.687 5.326 1.00 0.00 H new ATOM 458 N ILE A 461 -0.815 10.037 8.150 1.00 0.00 N ATOM 459 CA ILE A 461 -1.124 8.660 7.796 1.00 0.00 C ATOM 460 C ILE A 461 -2.211 8.116 8.716 1.00 0.00 C ATOM 461 O ILE A 461 -3.125 7.419 8.272 1.00 0.00 O ATOM 462 CB ILE A 461 0.131 7.792 7.898 1.00 0.00 C ATOM 463 CG1 ILE A 461 1.237 8.396 7.029 1.00 0.00 C ATOM 464 CG2 ILE A 461 -0.185 6.384 7.394 1.00 0.00 C ATOM 465 CD1 ILE A 461 2.559 7.679 7.308 1.00 0.00 C ATOM 0 H ILE A 461 0.111 10.176 8.555 1.00 0.00 H new ATOM 0 HA ILE A 461 -1.484 8.635 6.768 1.00 0.00 H new ATOM 0 HB ILE A 461 0.459 7.748 8.936 1.00 0.00 H new ATOM 0 HG12 ILE A 461 0.977 8.303 5.975 1.00 0.00 H new ATOM 0 HG13 ILE A 461 1.338 9.461 7.239 1.00 0.00 H new ATOM 0 HG21 ILE A 461 0.708 5.763 7.466 1.00 0.00 H new ATOM 0 HG22 ILE A 461 -0.979 5.950 8.002 1.00 0.00 H new ATOM 0 HG23 ILE A 461 -0.510 6.434 6.355 1.00 0.00 H new ATOM 0 HD11 ILE A 461 3.345 8.111 6.688 1.00 0.00 H new ATOM 0 HD12 ILE A 461 2.821 7.795 8.360 1.00 0.00 H new ATOM 0 HD13 ILE A 461 2.454 6.619 7.075 1.00 0.00 H new ATOM 477 N ARG A 462 -2.094 8.426 10.006 1.00 0.00 N ATOM 478 CA ARG A 462 -3.062 7.956 10.990 1.00 0.00 C ATOM 479 C ARG A 462 -4.465 8.466 10.662 1.00 0.00 C ATOM 480 O ARG A 462 -5.437 7.713 10.715 1.00 0.00 O ATOM 481 CB ARG A 462 -2.658 8.435 12.388 1.00 0.00 C ATOM 482 CG ARG A 462 -3.625 7.859 13.429 1.00 0.00 C ATOM 483 CD ARG A 462 -3.203 8.308 14.828 1.00 0.00 C ATOM 484 NE ARG A 462 -4.055 7.682 15.836 1.00 0.00 N ATOM 485 CZ ARG A 462 -3.768 6.483 16.340 1.00 0.00 C ATOM 486 NH1 ARG A 462 -2.707 5.839 15.934 1.00 0.00 N ATOM 487 NH2 ARG A 462 -4.548 5.950 17.241 1.00 0.00 N ATOM 0 H ARG A 462 -1.342 8.998 10.391 1.00 0.00 H new ATOM 0 HA ARG A 462 -3.073 6.866 10.964 1.00 0.00 H new ATOM 0 HB2 ARG A 462 -1.638 8.120 12.611 1.00 0.00 H new ATOM 0 HB3 ARG A 462 -2.671 9.524 12.428 1.00 0.00 H new ATOM 0 HG2 ARG A 462 -4.641 8.194 13.220 1.00 0.00 H new ATOM 0 HG3 ARG A 462 -3.630 6.771 13.372 1.00 0.00 H new ATOM 0 HD2 ARG A 462 -2.161 8.041 15.005 1.00 0.00 H new ATOM 0 HD3 ARG A 462 -3.272 9.393 14.906 1.00 0.00 H new ATOM 0 HE ARG A 462 -4.888 8.174 16.161 1.00 0.00 H new ATOM 0 HH11 ARG A 462 -2.097 6.254 15.230 1.00 0.00 H new ATOM 0 HH12 ARG A 462 -2.489 4.921 16.321 1.00 0.00 H new ATOM 0 HH21 ARG A 462 -5.377 6.452 17.559 1.00 0.00 H new ATOM 0 HH22 ARG A 462 -4.328 5.032 17.627 1.00 0.00 H new ATOM 501 N LYS A 463 -4.565 9.752 10.328 1.00 0.00 N ATOM 502 CA LYS A 463 -5.855 10.353 10.000 1.00 0.00 C ATOM 503 C LYS A 463 -6.443 9.725 8.740 1.00 0.00 C ATOM 504 O LYS A 463 -7.646 9.473 8.666 1.00 0.00 O ATOM 505 CB LYS A 463 -5.686 11.864 9.795 1.00 0.00 C ATOM 506 CG LYS A 463 -5.301 12.547 11.119 1.00 0.00 C ATOM 507 CD LYS A 463 -6.547 12.798 11.981 1.00 0.00 C ATOM 508 CE LYS A 463 -6.157 13.631 13.203 1.00 0.00 C ATOM 509 NZ LYS A 463 -5.243 12.840 14.073 1.00 0.00 N ATOM 0 H LYS A 463 -3.773 10.393 10.278 1.00 0.00 H new ATOM 0 HA LYS A 463 -6.540 10.171 10.828 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -4.918 12.052 9.045 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.614 12.292 9.415 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -4.595 11.922 11.665 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -4.798 13.492 10.914 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -7.307 13.319 11.399 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -6.982 11.850 12.297 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -5.668 14.553 12.887 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -7.049 13.918 13.760 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -5.166 13.298 15.003 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -5.622 11.879 14.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -4.302 12.790 13.633 1.00 0.00 H new ATOM 523 N ASN A 464 -5.590 9.485 7.750 1.00 0.00 N ATOM 524 CA ASN A 464 -6.035 8.895 6.491 1.00 0.00 C ATOM 525 C ASN A 464 -6.021 7.371 6.575 1.00 0.00 C ATOM 526 O ASN A 464 -6.237 6.684 5.578 1.00 0.00 O ATOM 527 CB ASN A 464 -5.115 9.353 5.357 1.00 0.00 C ATOM 528 CG ASN A 464 -5.322 10.841 5.092 1.00 0.00 C ATOM 529 OD1 ASN A 464 -6.375 11.241 4.594 1.00 0.00 O ATOM 530 ND2 ASN A 464 -4.381 11.689 5.402 1.00 0.00 N ATOM 0 H ASN A 464 -4.591 9.688 7.793 1.00 0.00 H new ATOM 0 HA ASN A 464 -7.055 9.224 6.294 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -4.075 9.163 5.621 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -5.324 8.781 4.453 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -4.516 12.686 5.232 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -3.510 11.356 5.814 1.00 0.00 H new ATOM 537 N ARG A 465 -5.763 6.851 7.771 1.00 0.00 N ATOM 538 CA ARG A 465 -5.723 5.407 7.969 1.00 0.00 C ATOM 539 C ARG A 465 -7.085 4.782 7.676 1.00 0.00 C ATOM 540 O ARG A 465 -7.172 3.761 6.994 1.00 0.00 O ATOM 541 CB ARG A 465 -5.321 5.094 9.412 1.00 0.00 C ATOM 542 CG ARG A 465 -5.181 3.581 9.596 1.00 0.00 C ATOM 543 CD ARG A 465 -4.738 3.278 11.029 1.00 0.00 C ATOM 544 NE ARG A 465 -5.766 3.693 11.976 1.00 0.00 N ATOM 545 CZ ARG A 465 -5.566 3.604 13.286 1.00 0.00 C ATOM 546 NH1 ARG A 465 -4.443 3.120 13.744 1.00 0.00 N ATOM 547 NH2 ARG A 465 -6.494 3.994 14.118 1.00 0.00 N ATOM 0 H ARG A 465 -5.580 7.402 8.610 1.00 0.00 H new ATOM 0 HA ARG A 465 -4.989 4.986 7.282 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -4.379 5.587 9.652 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -6.070 5.485 10.101 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -6.131 3.089 9.386 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -4.454 3.184 8.888 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -4.543 2.211 11.138 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -3.804 3.797 11.245 1.00 0.00 H new ATOM 0 HE ARG A 465 -6.653 4.057 11.627 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -3.719 2.810 13.096 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -4.290 3.052 14.750 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -7.374 4.368 13.762 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -6.339 3.925 15.124 1.00 0.00 H new ATOM 561 N MET A 466 -8.144 5.396 8.198 1.00 0.00 N ATOM 562 CA MET A 466 -9.492 4.883 7.981 1.00 0.00 C ATOM 563 C MET A 466 -9.892 5.043 6.522 1.00 0.00 C ATOM 564 O MET A 466 -10.526 4.163 5.941 1.00 0.00 O ATOM 565 CB MET A 466 -10.495 5.618 8.874 1.00 0.00 C ATOM 566 CG MET A 466 -11.892 5.019 8.684 1.00 0.00 C ATOM 567 SD MET A 466 -13.052 5.820 9.823 1.00 0.00 S ATOM 568 CE MET A 466 -13.429 7.273 8.807 1.00 0.00 C ATOM 0 H MET A 466 -8.096 6.240 8.768 1.00 0.00 H new ATOM 0 HA MET A 466 -9.499 3.824 8.238 1.00 0.00 H new ATOM 0 HB2 MET A 466 -10.193 5.538 9.918 1.00 0.00 H new ATOM 0 HB3 MET A 466 -10.507 6.679 8.626 1.00 0.00 H new ATOM 0 HG2 MET A 466 -12.222 5.158 7.654 1.00 0.00 H new ATOM 0 HG3 MET A 466 -11.867 3.945 8.869 1.00 0.00 H new ATOM 0 HE1 MET A 466 -14.179 7.884 9.309 1.00 0.00 H new ATOM 0 HE2 MET A 466 -12.522 7.860 8.661 1.00 0.00 H new ATOM 0 HE3 MET A 466 -13.813 6.951 7.839 1.00 0.00 H new ATOM 578 N ALA A 467 -9.518 6.178 5.937 1.00 0.00 N ATOM 579 CA ALA A 467 -9.844 6.448 4.545 1.00 0.00 C ATOM 580 C ALA A 467 -9.197 5.407 3.647 1.00 0.00 C ATOM 581 O ALA A 467 -9.790 4.973 2.658 1.00 0.00 O ATOM 582 CB ALA A 467 -9.351 7.841 4.152 1.00 0.00 C ATOM 0 H ALA A 467 -8.993 6.918 6.403 1.00 0.00 H new ATOM 0 HA ALA A 467 -10.926 6.403 4.424 1.00 0.00 H new ATOM 0 HB1 ALA A 467 -9.600 8.034 3.108 1.00 0.00 H new ATOM 0 HB2 ALA A 467 -9.831 8.588 4.784 1.00 0.00 H new ATOM 0 HB3 ALA A 467 -8.270 7.895 4.283 1.00 0.00 H new ATOM 588 N LEU A 468 -7.977 5.010 3.992 1.00 0.00 N ATOM 589 CA LEU A 468 -7.267 4.019 3.199 1.00 0.00 C ATOM 590 C LEU A 468 -8.039 2.706 3.209 1.00 0.00 C ATOM 591 O LEU A 468 -8.237 2.087 2.164 1.00 0.00 O ATOM 592 CB LEU A 468 -5.862 3.797 3.776 1.00 0.00 C ATOM 593 CG LEU A 468 -5.022 2.928 2.818 1.00 0.00 C ATOM 594 CD1 LEU A 468 -4.476 3.785 1.662 1.00 0.00 C ATOM 595 CD2 LEU A 468 -3.845 2.305 3.584 1.00 0.00 C ATOM 0 H LEU A 468 -7.466 5.355 4.805 1.00 0.00 H new ATOM 0 HA LEU A 468 -7.179 4.378 2.174 1.00 0.00 H new ATOM 0 HB2 LEU A 468 -5.370 4.757 3.933 1.00 0.00 H new ATOM 0 HB3 LEU A 468 -5.934 3.312 4.750 1.00 0.00 H new ATOM 0 HG LEU A 468 -5.657 2.141 2.412 1.00 0.00 H new ATOM 0 HD11 LEU A 468 -3.885 3.160 0.993 1.00 0.00 H new ATOM 0 HD12 LEU A 468 -5.307 4.223 1.109 1.00 0.00 H new ATOM 0 HD13 LEU A 468 -3.849 4.581 2.064 1.00 0.00 H new ATOM 0 HD21 LEU A 468 -3.253 1.691 2.905 1.00 0.00 H new ATOM 0 HD22 LEU A 468 -3.220 3.097 3.997 1.00 0.00 H new ATOM 0 HD23 LEU A 468 -4.226 1.684 4.395 1.00 0.00 H new ATOM 607 N PHE A 469 -8.479 2.292 4.394 1.00 0.00 N ATOM 608 CA PHE A 469 -9.237 1.056 4.523 1.00 0.00 C ATOM 609 C PHE A 469 -10.549 1.155 3.747 1.00 0.00 C ATOM 610 O PHE A 469 -10.924 0.229 3.031 1.00 0.00 O ATOM 611 CB PHE A 469 -9.516 0.762 6.009 1.00 0.00 C ATOM 612 CG PHE A 469 -10.529 -0.355 6.134 1.00 0.00 C ATOM 613 CD1 PHE A 469 -10.168 -1.669 5.815 1.00 0.00 C ATOM 614 CD2 PHE A 469 -11.833 -0.072 6.561 1.00 0.00 C ATOM 615 CE1 PHE A 469 -11.111 -2.699 5.923 1.00 0.00 C ATOM 616 CE2 PHE A 469 -12.773 -1.098 6.671 1.00 0.00 C ATOM 617 CZ PHE A 469 -12.415 -2.414 6.350 1.00 0.00 C ATOM 0 H PHE A 469 -8.324 2.791 5.270 1.00 0.00 H new ATOM 0 HA PHE A 469 -8.649 0.238 4.106 1.00 0.00 H new ATOM 0 HB2 PHE A 469 -8.591 0.483 6.513 1.00 0.00 H new ATOM 0 HB3 PHE A 469 -9.889 1.660 6.502 1.00 0.00 H new ATOM 0 HD1 PHE A 469 -9.163 -1.889 5.486 1.00 0.00 H new ATOM 0 HD2 PHE A 469 -12.112 0.942 6.806 1.00 0.00 H new ATOM 0 HE1 PHE A 469 -10.833 -3.713 5.677 1.00 0.00 H new ATOM 0 HE2 PHE A 469 -13.777 -0.877 7.004 1.00 0.00 H new ATOM 0 HZ PHE A 469 -13.143 -3.208 6.432 1.00 0.00 H new ATOM 627 N GLN A 470 -11.244 2.278 3.902 1.00 0.00 N ATOM 628 CA GLN A 470 -12.514 2.472 3.212 1.00 0.00 C ATOM 629 C GLN A 470 -12.303 2.519 1.701 1.00 0.00 C ATOM 630 O GLN A 470 -13.070 1.926 0.942 1.00 0.00 O ATOM 631 CB GLN A 470 -13.176 3.767 3.684 1.00 0.00 C ATOM 632 CG GLN A 470 -14.569 3.880 3.064 1.00 0.00 C ATOM 633 CD GLN A 470 -15.272 5.127 3.588 1.00 0.00 C ATOM 634 OE1 GLN A 470 -15.736 6.008 2.743 1.00 0.00 O flip ATOM 635 NE2 GLN A 470 -15.402 5.305 4.800 1.00 0.00 N flip ATOM 0 H GLN A 470 -10.954 3.058 4.492 1.00 0.00 H new ATOM 0 HA GLN A 470 -13.165 1.630 3.447 1.00 0.00 H new ATOM 0 HB2 GLN A 470 -13.248 3.776 4.772 1.00 0.00 H new ATOM 0 HB3 GLN A 470 -12.568 4.625 3.398 1.00 0.00 H new ATOM 0 HG2 GLN A 470 -14.490 3.926 1.978 1.00 0.00 H new ATOM 0 HG3 GLN A 470 -15.156 2.993 3.304 1.00 0.00 H new ATOM 0 HE21 GLN A 470 -15.039 4.616 5.459 1.00 0.00 H new ATOM 0 HE22 GLN A 470 -15.873 6.142 5.145 1.00 0.00 H new ATOM 644 N GLN A 471 -11.257 3.226 1.269 1.00 0.00 N ATOM 645 CA GLN A 471 -10.946 3.347 -0.158 1.00 0.00 C ATOM 646 C GLN A 471 -9.745 2.469 -0.506 1.00 0.00 C ATOM 647 O GLN A 471 -8.638 2.967 -0.710 1.00 0.00 O ATOM 648 CB GLN A 471 -10.640 4.823 -0.507 1.00 0.00 C ATOM 649 CG GLN A 471 -11.944 5.587 -0.802 1.00 0.00 C ATOM 650 CD GLN A 471 -12.725 5.810 0.487 1.00 0.00 C ATOM 651 OE1 GLN A 471 -12.086 6.123 1.578 1.00 0.00 O flip ATOM 652 NE2 GLN A 471 -13.950 5.694 0.500 1.00 0.00 N flip ATOM 0 H GLN A 471 -10.612 3.722 1.884 1.00 0.00 H new ATOM 0 HA GLN A 471 -11.807 3.016 -0.739 1.00 0.00 H new ATOM 0 HB2 GLN A 471 -10.113 5.297 0.321 1.00 0.00 H new ATOM 0 HB3 GLN A 471 -9.980 4.869 -1.373 1.00 0.00 H new ATOM 0 HG2 GLN A 471 -11.715 6.546 -1.268 1.00 0.00 H new ATOM 0 HG3 GLN A 471 -12.551 5.025 -1.511 1.00 0.00 H new ATOM 0 HE21 GLN A 471 -14.448 5.449 -0.356 1.00 0.00 H new ATOM 0 HE22 GLN A 471 -14.467 5.843 1.366 1.00 0.00 H new ATOM 661 N LEU A 472 -9.974 1.159 -0.578 1.00 0.00 N ATOM 662 CA LEU A 472 -8.906 0.210 -0.908 1.00 0.00 C ATOM 663 C LEU A 472 -9.034 -0.239 -2.364 1.00 0.00 C ATOM 664 O LEU A 472 -10.110 -0.638 -2.810 1.00 0.00 O ATOM 665 CB LEU A 472 -8.989 -1.007 0.034 1.00 0.00 C ATOM 666 CG LEU A 472 -10.283 -1.825 -0.242 1.00 0.00 C ATOM 667 CD1 LEU A 472 -9.969 -3.038 -1.134 1.00 0.00 C ATOM 668 CD2 LEU A 472 -10.890 -2.321 1.084 1.00 0.00 C ATOM 0 H LEU A 472 -10.884 0.729 -0.414 1.00 0.00 H new ATOM 0 HA LEU A 472 -7.939 0.697 -0.779 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.114 -1.642 -0.105 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -8.978 -0.672 1.071 1.00 0.00 H new ATOM 0 HG LEU A 472 -10.996 -1.176 -0.751 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -10.884 -3.601 -1.318 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -9.557 -2.695 -2.083 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -9.243 -3.679 -0.634 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -11.795 -2.892 0.879 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -10.169 -2.956 1.599 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -11.136 -1.466 1.714 1.00 0.00 H new ATOM 680 N THR A 473 -7.932 -0.165 -3.106 1.00 0.00 N ATOM 681 CA THR A 473 -7.944 -0.568 -4.512 1.00 0.00 C ATOM 682 C THR A 473 -6.529 -0.889 -4.986 1.00 0.00 C ATOM 683 O THR A 473 -6.306 -1.162 -6.166 1.00 0.00 O ATOM 684 CB THR A 473 -8.540 0.558 -5.377 1.00 0.00 C ATOM 685 OG1 THR A 473 -7.906 0.568 -6.650 1.00 0.00 O ATOM 686 CG2 THR A 473 -8.322 1.911 -4.694 1.00 0.00 C ATOM 0 H THR A 473 -7.030 0.166 -2.764 1.00 0.00 H new ATOM 0 HA THR A 473 -8.559 -1.462 -4.612 1.00 0.00 H new ATOM 0 HB THR A 473 -9.609 0.383 -5.500 1.00 0.00 H new ATOM 0 HG1 THR A 473 -7.619 -0.340 -6.879 1.00 0.00 H new ATOM 0 HG21 THR A 473 -8.746 2.703 -5.311 1.00 0.00 H new ATOM 0 HG22 THR A 473 -8.811 1.910 -3.720 1.00 0.00 H new ATOM 0 HG23 THR A 473 -7.254 2.085 -4.564 1.00 0.00 H new ATOM 694 N CYS A 474 -5.577 -0.859 -4.054 1.00 0.00 N ATOM 695 CA CYS A 474 -4.180 -1.147 -4.379 1.00 0.00 C ATOM 696 C CYS A 474 -3.484 -1.803 -3.189 1.00 0.00 C ATOM 697 O CYS A 474 -2.767 -1.141 -2.439 1.00 0.00 O ATOM 698 CB CYS A 474 -3.461 0.154 -4.740 1.00 0.00 C ATOM 699 SG CYS A 474 -3.697 1.359 -3.408 1.00 0.00 S ATOM 0 H CYS A 474 -5.746 -0.639 -3.072 1.00 0.00 H new ATOM 0 HA CYS A 474 -4.148 -1.831 -5.227 1.00 0.00 H new ATOM 0 HB2 CYS A 474 -2.398 -0.034 -4.891 1.00 0.00 H new ATOM 0 HB3 CYS A 474 -3.851 0.550 -5.678 1.00 0.00 H new ATOM 0 HG CYS A 474 -3.407 0.807 -2.267 1.00 0.00 H new ATOM 705 N VAL A 475 -3.704 -3.110 -3.022 1.00 0.00 N ATOM 706 CA VAL A 475 -3.098 -3.860 -1.916 1.00 0.00 C ATOM 707 C VAL A 475 -2.132 -4.919 -2.446 1.00 0.00 C ATOM 708 O VAL A 475 -1.415 -5.560 -1.678 1.00 0.00 O ATOM 709 CB VAL A 475 -4.198 -4.527 -1.083 1.00 0.00 C ATOM 710 CG1 VAL A 475 -3.600 -5.114 0.199 1.00 0.00 C ATOM 711 CG2 VAL A 475 -5.252 -3.480 -0.714 1.00 0.00 C ATOM 0 H VAL A 475 -4.295 -3.670 -3.636 1.00 0.00 H new ATOM 0 HA VAL A 475 -2.537 -3.166 -1.290 1.00 0.00 H new ATOM 0 HB VAL A 475 -4.655 -5.328 -1.665 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -4.388 -5.586 0.785 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -2.845 -5.857 -0.059 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -3.140 -4.317 0.784 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -6.038 -3.948 -0.121 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -4.786 -2.683 -0.134 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -5.684 -3.062 -1.623 1.00 0.00 H new ATOM 721 N LEU A 476 -2.115 -5.091 -3.767 1.00 0.00 N ATOM 722 CA LEU A 476 -1.229 -6.066 -4.406 1.00 0.00 C ATOM 723 C LEU A 476 0.132 -5.446 -4.754 1.00 0.00 C ATOM 724 O LEU A 476 1.158 -6.121 -4.670 1.00 0.00 O ATOM 725 CB LEU A 476 -1.881 -6.617 -5.686 1.00 0.00 C ATOM 726 CG LEU A 476 -3.397 -6.726 -5.497 1.00 0.00 C ATOM 727 CD1 LEU A 476 -4.028 -7.298 -6.769 1.00 0.00 C ATOM 728 CD2 LEU A 476 -3.701 -7.651 -4.316 1.00 0.00 C ATOM 0 H LEU A 476 -2.704 -4.569 -4.416 1.00 0.00 H new ATOM 0 HA LEU A 476 -1.066 -6.877 -3.697 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -1.657 -5.962 -6.528 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -1.465 -7.596 -5.924 1.00 0.00 H new ATOM 0 HG LEU A 476 -3.810 -5.737 -5.298 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -5.107 -7.376 -6.636 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -3.813 -6.639 -7.610 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -3.614 -8.287 -6.968 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -4.780 -7.728 -4.182 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -3.288 -8.640 -4.513 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -3.251 -7.244 -3.410 1.00 0.00 H new ATOM 740 N PRO A 477 0.170 -4.195 -5.159 1.00 0.00 N ATOM 741 CA PRO A 477 1.440 -3.524 -5.536 1.00 0.00 C ATOM 742 C PRO A 477 2.175 -2.958 -4.323 1.00 0.00 C ATOM 743 O PRO A 477 3.398 -3.056 -4.228 1.00 0.00 O ATOM 744 CB PRO A 477 0.980 -2.415 -6.496 1.00 0.00 C ATOM 745 CG PRO A 477 -0.432 -2.081 -6.088 1.00 0.00 C ATOM 746 CD PRO A 477 -0.980 -3.280 -5.290 1.00 0.00 C ATOM 0 HA PRO A 477 2.159 -4.207 -5.988 1.00 0.00 H new ATOM 0 HB2 PRO A 477 1.626 -1.540 -6.422 1.00 0.00 H new ATOM 0 HB3 PRO A 477 1.019 -2.753 -7.532 1.00 0.00 H new ATOM 0 HG2 PRO A 477 -0.452 -1.176 -5.481 1.00 0.00 H new ATOM 0 HG3 PRO A 477 -1.050 -1.890 -6.966 1.00 0.00 H new ATOM 0 HD2 PRO A 477 -1.353 -2.970 -4.314 1.00 0.00 H new ATOM 0 HD3 PRO A 477 -1.810 -3.758 -5.811 1.00 0.00 H new ATOM 754 N ILE A 478 1.424 -2.368 -3.402 1.00 0.00 N ATOM 755 CA ILE A 478 2.023 -1.794 -2.206 1.00 0.00 C ATOM 756 C ILE A 478 2.548 -2.894 -1.289 1.00 0.00 C ATOM 757 O ILE A 478 3.635 -2.775 -0.724 1.00 0.00 O ATOM 758 CB ILE A 478 0.983 -0.949 -1.463 1.00 0.00 C ATOM 759 CG1 ILE A 478 1.661 -0.143 -0.351 1.00 0.00 C ATOM 760 CG2 ILE A 478 -0.073 -1.867 -0.849 1.00 0.00 C ATOM 761 CD1 ILE A 478 0.704 0.944 0.144 1.00 0.00 C ATOM 0 H ILE A 478 0.410 -2.275 -3.459 1.00 0.00 H new ATOM 0 HA ILE A 478 2.860 -1.161 -2.503 1.00 0.00 H new ATOM 0 HB ILE A 478 0.512 -0.263 -2.167 1.00 0.00 H new ATOM 0 HG12 ILE A 478 1.939 -0.801 0.472 1.00 0.00 H new ATOM 0 HG13 ILE A 478 2.581 0.308 -0.723 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -0.814 -1.267 -0.320 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -0.564 -2.436 -1.639 1.00 0.00 H new ATOM 0 HG23 ILE A 478 0.404 -2.554 -0.150 1.00 0.00 H new ATOM 0 HD11 ILE A 478 1.185 1.519 0.936 1.00 0.00 H new ATOM 0 HD12 ILE A 478 0.448 1.607 -0.682 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -0.203 0.481 0.532 1.00 0.00 H new ATOM 773 N LEU A 479 1.769 -3.964 -1.150 1.00 0.00 N ATOM 774 CA LEU A 479 2.167 -5.079 -0.302 1.00 0.00 C ATOM 775 C LEU A 479 3.441 -5.708 -0.843 1.00 0.00 C ATOM 776 O LEU A 479 4.349 -6.051 -0.085 1.00 0.00 O ATOM 777 CB LEU A 479 1.049 -6.130 -0.250 1.00 0.00 C ATOM 778 CG LEU A 479 1.449 -7.297 0.672 1.00 0.00 C ATOM 779 CD1 LEU A 479 1.696 -6.787 2.104 1.00 0.00 C ATOM 780 CD2 LEU A 479 0.318 -8.336 0.684 1.00 0.00 C ATOM 0 H LEU A 479 0.866 -4.080 -1.610 1.00 0.00 H new ATOM 0 HA LEU A 479 2.349 -4.708 0.707 1.00 0.00 H new ATOM 0 HB2 LEU A 479 0.128 -5.672 0.111 1.00 0.00 H new ATOM 0 HB3 LEU A 479 0.847 -6.504 -1.253 1.00 0.00 H new ATOM 0 HG LEU A 479 2.368 -7.750 0.299 1.00 0.00 H new ATOM 0 HD11 LEU A 479 1.978 -7.623 2.744 1.00 0.00 H new ATOM 0 HD12 LEU A 479 2.499 -6.050 2.094 1.00 0.00 H new ATOM 0 HD13 LEU A 479 0.786 -6.326 2.488 1.00 0.00 H new ATOM 0 HD21 LEU A 479 0.593 -9.166 1.335 1.00 0.00 H new ATOM 0 HD22 LEU A 479 -0.597 -7.873 1.053 1.00 0.00 H new ATOM 0 HD23 LEU A 479 0.154 -8.707 -0.328 1.00 0.00 H new ATOM 792 N ASP A 480 3.501 -5.858 -2.161 1.00 0.00 N ATOM 793 CA ASP A 480 4.669 -6.450 -2.797 1.00 0.00 C ATOM 794 C ASP A 480 5.912 -5.614 -2.509 1.00 0.00 C ATOM 795 O ASP A 480 6.991 -6.158 -2.276 1.00 0.00 O ATOM 796 CB ASP A 480 4.454 -6.546 -4.308 1.00 0.00 C ATOM 797 CG ASP A 480 5.661 -7.210 -4.962 1.00 0.00 C ATOM 798 OD1 ASP A 480 6.630 -7.452 -4.261 1.00 0.00 O ATOM 799 OD2 ASP A 480 5.600 -7.466 -6.154 1.00 0.00 O ATOM 0 H ASP A 480 2.760 -5.580 -2.805 1.00 0.00 H new ATOM 0 HA ASP A 480 4.813 -7.451 -2.390 1.00 0.00 H new ATOM 0 HB2 ASP A 480 3.552 -7.121 -4.520 1.00 0.00 H new ATOM 0 HB3 ASP A 480 4.304 -5.551 -4.727 1.00 0.00 H new ATOM 804 N ASN A 481 5.757 -4.294 -2.534 1.00 0.00 N ATOM 805 CA ASN A 481 6.883 -3.403 -2.278 1.00 0.00 C ATOM 806 C ASN A 481 7.406 -3.597 -0.857 1.00 0.00 C ATOM 807 O ASN A 481 8.615 -3.639 -0.628 1.00 0.00 O ATOM 808 CB ASN A 481 6.438 -1.952 -2.467 1.00 0.00 C ATOM 809 CG ASN A 481 6.173 -1.677 -3.943 1.00 0.00 C ATOM 810 OD1 ASN A 481 6.684 -2.385 -4.810 1.00 0.00 O ATOM 811 ND2 ASN A 481 5.390 -0.689 -4.282 1.00 0.00 N ATOM 0 H ASN A 481 4.874 -3.822 -2.727 1.00 0.00 H new ATOM 0 HA ASN A 481 7.683 -3.637 -2.980 1.00 0.00 H new ATOM 0 HB2 ASN A 481 5.536 -1.761 -1.885 1.00 0.00 H new ATOM 0 HB3 ASN A 481 7.207 -1.275 -2.095 1.00 0.00 H new ATOM 0 HD21 ASN A 481 5.201 -0.503 -5.267 1.00 0.00 H new ATOM 0 HD22 ASN A 481 4.967 -0.103 -3.562 1.00 0.00 H new ATOM 818 N LEU A 482 6.482 -3.717 0.093 1.00 0.00 N ATOM 819 CA LEU A 482 6.845 -3.909 1.494 1.00 0.00 C ATOM 820 C LEU A 482 7.435 -5.302 1.713 1.00 0.00 C ATOM 821 O LEU A 482 8.267 -5.500 2.599 1.00 0.00 O ATOM 822 CB LEU A 482 5.605 -3.718 2.386 1.00 0.00 C ATOM 823 CG LEU A 482 5.327 -2.214 2.604 1.00 0.00 C ATOM 824 CD1 LEU A 482 3.844 -2.004 2.923 1.00 0.00 C ATOM 825 CD2 LEU A 482 6.164 -1.687 3.782 1.00 0.00 C ATOM 0 H LEU A 482 5.478 -3.685 -0.082 1.00 0.00 H new ATOM 0 HA LEU A 482 7.599 -3.169 1.761 1.00 0.00 H new ATOM 0 HB2 LEU A 482 4.739 -4.191 1.923 1.00 0.00 H new ATOM 0 HB3 LEU A 482 5.761 -4.209 3.347 1.00 0.00 H new ATOM 0 HG LEU A 482 5.594 -1.675 1.695 1.00 0.00 H new ATOM 0 HD11 LEU A 482 3.652 -0.942 3.076 1.00 0.00 H new ATOM 0 HD12 LEU A 482 3.238 -2.366 2.092 1.00 0.00 H new ATOM 0 HD13 LEU A 482 3.585 -2.554 3.828 1.00 0.00 H new ATOM 0 HD21 LEU A 482 5.961 -0.626 3.927 1.00 0.00 H new ATOM 0 HD22 LEU A 482 5.902 -2.234 4.688 1.00 0.00 H new ATOM 0 HD23 LEU A 482 7.223 -1.827 3.567 1.00 0.00 H new ATOM 837 N LEU A 483 6.980 -6.263 0.920 1.00 0.00 N ATOM 838 CA LEU A 483 7.443 -7.642 1.049 1.00 0.00 C ATOM 839 C LEU A 483 8.968 -7.693 0.916 1.00 0.00 C ATOM 840 O LEU A 483 9.637 -8.485 1.578 1.00 0.00 O ATOM 841 CB LEU A 483 6.778 -8.509 -0.039 1.00 0.00 C ATOM 842 CG LEU A 483 6.599 -9.957 0.445 1.00 0.00 C ATOM 843 CD1 LEU A 483 6.008 -10.802 -0.689 1.00 0.00 C ATOM 844 CD2 LEU A 483 7.948 -10.548 0.880 1.00 0.00 C ATOM 0 H LEU A 483 6.292 -6.116 0.181 1.00 0.00 H new ATOM 0 HA LEU A 483 7.168 -8.030 2.030 1.00 0.00 H new ATOM 0 HB2 LEU A 483 5.808 -8.087 -0.303 1.00 0.00 H new ATOM 0 HB3 LEU A 483 7.388 -8.496 -0.942 1.00 0.00 H new ATOM 0 HG LEU A 483 5.923 -9.963 1.300 1.00 0.00 H new ATOM 0 HD11 LEU A 483 5.880 -11.829 -0.348 1.00 0.00 H new ATOM 0 HD12 LEU A 483 5.041 -10.393 -0.981 1.00 0.00 H new ATOM 0 HD13 LEU A 483 6.683 -10.785 -1.545 1.00 0.00 H new ATOM 0 HD21 LEU A 483 7.803 -11.574 1.220 1.00 0.00 H new ATOM 0 HD22 LEU A 483 8.638 -10.539 0.036 1.00 0.00 H new ATOM 0 HD23 LEU A 483 8.361 -9.951 1.693 1.00 0.00 H new ATOM 856 N LYS A 484 9.517 -6.834 0.065 1.00 0.00 N ATOM 857 CA LYS A 484 10.962 -6.792 -0.130 1.00 0.00 C ATOM 858 C LYS A 484 11.676 -6.571 1.203 1.00 0.00 C ATOM 859 O LYS A 484 12.688 -7.209 1.488 1.00 0.00 O ATOM 860 CB LYS A 484 11.327 -5.664 -1.097 1.00 0.00 C ATOM 861 CG LYS A 484 12.828 -5.705 -1.388 1.00 0.00 C ATOM 862 CD LYS A 484 13.176 -4.639 -2.428 1.00 0.00 C ATOM 863 CE LYS A 484 14.673 -4.692 -2.734 1.00 0.00 C ATOM 864 NZ LYS A 484 15.440 -4.279 -1.525 1.00 0.00 N ATOM 0 H LYS A 484 8.991 -6.164 -0.496 1.00 0.00 H new ATOM 0 HA LYS A 484 11.281 -7.747 -0.548 1.00 0.00 H new ATOM 0 HB2 LYS A 484 10.763 -5.769 -2.024 1.00 0.00 H new ATOM 0 HB3 LYS A 484 11.056 -4.700 -0.667 1.00 0.00 H new ATOM 0 HG2 LYS A 484 13.392 -5.531 -0.471 1.00 0.00 H new ATOM 0 HG3 LYS A 484 13.111 -6.692 -1.754 1.00 0.00 H new ATOM 0 HD2 LYS A 484 12.602 -4.805 -3.340 1.00 0.00 H new ATOM 0 HD3 LYS A 484 12.905 -3.651 -2.056 1.00 0.00 H new ATOM 0 HE2 LYS A 484 14.959 -5.701 -3.033 1.00 0.00 H new ATOM 0 HE3 LYS A 484 14.908 -4.033 -3.570 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 16.409 -4.020 -1.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 14.975 -3.461 -1.082 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 15.472 -5.068 -0.848 1.00 0.00 H new ATOM 878 N ALA A 485 11.141 -5.664 2.020 1.00 0.00 N ATOM 879 CA ALA A 485 11.742 -5.371 3.325 1.00 0.00 C ATOM 880 C ALA A 485 10.673 -4.951 4.329 1.00 0.00 C ATOM 881 O ALA A 485 10.218 -3.808 4.323 1.00 0.00 O ATOM 882 CB ALA A 485 12.779 -4.256 3.183 1.00 0.00 C ATOM 0 H ALA A 485 10.302 -5.124 1.807 1.00 0.00 H new ATOM 0 HA ALA A 485 12.228 -6.276 3.690 1.00 0.00 H new ATOM 0 HB1 ALA A 485 13.221 -4.044 4.157 1.00 0.00 H new ATOM 0 HB2 ALA A 485 13.560 -4.571 2.491 1.00 0.00 H new ATOM 0 HB3 ALA A 485 12.296 -3.357 2.800 1.00 0.00 H new ATOM 888 N ASN A 486 10.282 -5.883 5.194 1.00 0.00 N ATOM 889 CA ASN A 486 9.267 -5.602 6.204 1.00 0.00 C ATOM 890 C ASN A 486 9.347 -6.612 7.347 1.00 0.00 C ATOM 891 O ASN A 486 10.231 -7.468 7.371 1.00 0.00 O ATOM 892 CB ASN A 486 7.877 -5.642 5.572 1.00 0.00 C ATOM 893 CG ASN A 486 7.723 -6.899 4.729 1.00 0.00 C ATOM 894 OD1 ASN A 486 6.698 -7.082 4.077 1.00 0.00 O ATOM 895 ND2 ASN A 486 8.688 -7.778 4.700 1.00 0.00 N ATOM 0 H ASN A 486 10.650 -6.834 5.216 1.00 0.00 H new ATOM 0 HA ASN A 486 9.450 -4.607 6.608 1.00 0.00 H new ATOM 0 HB2 ASN A 486 7.114 -5.621 6.350 1.00 0.00 H new ATOM 0 HB3 ASN A 486 7.725 -4.758 4.952 1.00 0.00 H new ATOM 0 HD21 ASN A 486 8.593 -8.621 4.134 1.00 0.00 H new ATOM 0 HD22 ASN A 486 9.537 -7.621 5.243 1.00 0.00 H new ATOM 902 N VAL A 487 8.420 -6.501 8.296 1.00 0.00 N ATOM 903 CA VAL A 487 8.396 -7.408 9.439 1.00 0.00 C ATOM 904 C VAL A 487 7.790 -8.753 9.044 1.00 0.00 C ATOM 905 O VAL A 487 8.114 -9.787 9.627 1.00 0.00 O ATOM 906 CB VAL A 487 7.583 -6.781 10.578 1.00 0.00 C ATOM 907 CG1 VAL A 487 7.429 -7.783 11.727 1.00 0.00 C ATOM 908 CG2 VAL A 487 8.303 -5.529 11.086 1.00 0.00 C ATOM 0 H VAL A 487 7.681 -5.798 8.296 1.00 0.00 H new ATOM 0 HA VAL A 487 9.419 -7.576 9.775 1.00 0.00 H new ATOM 0 HB VAL A 487 6.595 -6.512 10.206 1.00 0.00 H new ATOM 0 HG11 VAL A 487 6.850 -7.328 12.531 1.00 0.00 H new ATOM 0 HG12 VAL A 487 6.913 -8.673 11.367 1.00 0.00 H new ATOM 0 HG13 VAL A 487 8.414 -8.061 12.102 1.00 0.00 H new ATOM 0 HG21 VAL A 487 7.727 -5.081 11.896 1.00 0.00 H new ATOM 0 HG22 VAL A 487 9.293 -5.802 11.452 1.00 0.00 H new ATOM 0 HG23 VAL A 487 8.403 -4.811 10.272 1.00 0.00 H new ATOM 918 N ILE A 488 6.919 -8.731 8.040 1.00 0.00 N ATOM 919 CA ILE A 488 6.280 -9.955 7.567 1.00 0.00 C ATOM 920 C ILE A 488 7.229 -10.727 6.653 1.00 0.00 C ATOM 921 O ILE A 488 7.912 -10.146 5.810 1.00 0.00 O ATOM 922 CB ILE A 488 4.977 -9.619 6.824 1.00 0.00 C ATOM 923 CG1 ILE A 488 5.272 -8.678 5.654 1.00 0.00 C ATOM 924 CG2 ILE A 488 4.003 -8.931 7.785 1.00 0.00 C ATOM 925 CD1 ILE A 488 3.991 -8.439 4.853 1.00 0.00 C ATOM 0 H ILE A 488 6.641 -7.886 7.541 1.00 0.00 H new ATOM 0 HA ILE A 488 6.040 -10.581 8.427 1.00 0.00 H new ATOM 0 HB ILE A 488 4.536 -10.541 6.446 1.00 0.00 H new ATOM 0 HG12 ILE A 488 5.663 -7.731 6.026 1.00 0.00 H new ATOM 0 HG13 ILE A 488 6.040 -9.109 5.012 1.00 0.00 H new ATOM 0 HG21 ILE A 488 3.079 -8.693 7.258 1.00 0.00 H new ATOM 0 HG22 ILE A 488 3.783 -9.597 8.619 1.00 0.00 H new ATOM 0 HG23 ILE A 488 4.452 -8.013 8.163 1.00 0.00 H new ATOM 0 HD11 ILE A 488 4.203 -7.769 4.020 1.00 0.00 H new ATOM 0 HD12 ILE A 488 3.619 -9.389 4.469 1.00 0.00 H new ATOM 0 HD13 ILE A 488 3.237 -7.989 5.499 1.00 0.00 H new ATOM 937 N ASN A 489 7.277 -12.044 6.839 1.00 0.00 N ATOM 938 CA ASN A 489 8.146 -12.902 6.034 1.00 0.00 C ATOM 939 C ASN A 489 7.332 -13.624 4.970 1.00 0.00 C ATOM 940 O ASN A 489 6.137 -13.376 4.814 1.00 0.00 O ATOM 941 CB ASN A 489 8.843 -13.931 6.929 1.00 0.00 C ATOM 942 CG ASN A 489 7.828 -14.615 7.839 1.00 0.00 C ATOM 943 OD1 ASN A 489 6.568 -14.282 7.771 1.00 0.00 O flip ATOM 944 ND2 ASN A 489 8.195 -15.481 8.635 1.00 0.00 N flip ATOM 0 H ASN A 489 6.726 -12.541 7.539 1.00 0.00 H new ATOM 0 HA ASN A 489 8.897 -12.278 5.549 1.00 0.00 H new ATOM 0 HB2 ASN A 489 9.349 -14.675 6.314 1.00 0.00 H new ATOM 0 HB3 ASN A 489 9.608 -13.441 7.530 1.00 0.00 H new ATOM 0 HD21 ASN A 489 9.180 -15.741 8.688 1.00 0.00 H new ATOM 0 HD22 ASN A 489 7.514 -15.938 9.241 1.00 0.00 H new ATOM 951 N LYS A 490 7.988 -14.517 4.241 1.00 0.00 N ATOM 952 CA LYS A 490 7.314 -15.270 3.192 1.00 0.00 C ATOM 953 C LYS A 490 6.208 -16.134 3.791 1.00 0.00 C ATOM 954 O LYS A 490 5.415 -16.729 3.067 1.00 0.00 O ATOM 955 CB LYS A 490 8.323 -16.156 2.453 1.00 0.00 C ATOM 956 CG LYS A 490 8.932 -17.172 3.426 1.00 0.00 C ATOM 957 CD LYS A 490 9.983 -18.012 2.698 1.00 0.00 C ATOM 958 CE LYS A 490 10.574 -19.039 3.666 1.00 0.00 C ATOM 959 NZ LYS A 490 11.611 -19.848 2.965 1.00 0.00 N ATOM 0 H LYS A 490 8.978 -14.736 4.355 1.00 0.00 H new ATOM 0 HA LYS A 490 6.870 -14.568 2.486 1.00 0.00 H new ATOM 0 HB2 LYS A 490 7.831 -16.676 1.631 1.00 0.00 H new ATOM 0 HB3 LYS A 490 9.109 -15.541 2.016 1.00 0.00 H new ATOM 0 HG2 LYS A 490 9.387 -16.655 4.271 1.00 0.00 H new ATOM 0 HG3 LYS A 490 8.152 -17.817 3.830 1.00 0.00 H new ATOM 0 HD2 LYS A 490 9.532 -18.518 1.844 1.00 0.00 H new ATOM 0 HD3 LYS A 490 10.771 -17.369 2.307 1.00 0.00 H new ATOM 0 HE2 LYS A 490 11.013 -18.533 4.526 1.00 0.00 H new ATOM 0 HE3 LYS A 490 9.787 -19.690 4.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 12.012 -20.545 3.624 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 11.179 -20.342 2.158 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 12.367 -19.221 2.622 1.00 0.00 H new ATOM 973 N GLN A 491 6.166 -16.200 5.118 1.00 0.00 N ATOM 974 CA GLN A 491 5.151 -16.996 5.808 1.00 0.00 C ATOM 975 C GLN A 491 3.878 -16.186 6.027 1.00 0.00 C ATOM 976 O GLN A 491 2.806 -16.566 5.562 1.00 0.00 O ATOM 977 CB GLN A 491 5.697 -17.476 7.158 1.00 0.00 C ATOM 978 CG GLN A 491 6.697 -18.609 6.928 1.00 0.00 C ATOM 979 CD GLN A 491 5.953 -19.880 6.535 1.00 0.00 C ATOM 980 OE1 GLN A 491 5.232 -20.456 7.350 1.00 0.00 O ATOM 981 NE2 GLN A 491 6.066 -20.342 5.322 1.00 0.00 N ATOM 0 H GLN A 491 6.818 -15.716 5.736 1.00 0.00 H new ATOM 0 HA GLN A 491 4.908 -17.856 5.184 1.00 0.00 H new ATOM 0 HB2 GLN A 491 6.180 -16.651 7.681 1.00 0.00 H new ATOM 0 HB3 GLN A 491 4.880 -17.821 7.791 1.00 0.00 H new ATOM 0 HG2 GLN A 491 7.401 -18.331 6.144 1.00 0.00 H new ATOM 0 HG3 GLN A 491 7.279 -18.782 7.833 1.00 0.00 H new ATOM 0 HE21 GLN A 491 6.664 -19.864 4.648 1.00 0.00 H new ATOM 0 HE22 GLN A 491 5.557 -21.182 5.047 1.00 0.00 H new ATOM 990 N GLU A 492 3.999 -15.073 6.741 1.00 0.00 N ATOM 991 CA GLU A 492 2.842 -14.232 7.016 1.00 0.00 C ATOM 992 C GLU A 492 2.287 -13.641 5.724 1.00 0.00 C ATOM 993 O GLU A 492 1.074 -13.505 5.563 1.00 0.00 O ATOM 994 CB GLU A 492 3.237 -13.111 7.981 1.00 0.00 C ATOM 995 CG GLU A 492 3.569 -13.718 9.348 1.00 0.00 C ATOM 996 CD GLU A 492 4.059 -12.632 10.298 1.00 0.00 C ATOM 997 OE1 GLU A 492 4.105 -11.488 9.883 1.00 0.00 O ATOM 998 OE2 GLU A 492 4.385 -12.961 11.427 1.00 0.00 O ATOM 0 H GLU A 492 4.877 -14.735 7.136 1.00 0.00 H new ATOM 0 HA GLU A 492 2.065 -14.844 7.474 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.098 -12.567 7.593 1.00 0.00 H new ATOM 0 HB3 GLU A 492 2.422 -12.393 8.076 1.00 0.00 H new ATOM 0 HG2 GLU A 492 2.686 -14.204 9.763 1.00 0.00 H new ATOM 0 HG3 GLU A 492 4.333 -14.487 9.237 1.00 0.00 H new ATOM 1005 N HIS A 493 3.180 -13.298 4.802 1.00 0.00 N ATOM 1006 CA HIS A 493 2.765 -12.731 3.524 1.00 0.00 C ATOM 1007 C HIS A 493 2.000 -13.767 2.694 1.00 0.00 C ATOM 1008 O HIS A 493 0.993 -13.449 2.061 1.00 0.00 O ATOM 1009 CB HIS A 493 3.990 -12.251 2.741 1.00 0.00 C ATOM 1010 CG HIS A 493 3.541 -11.579 1.474 1.00 0.00 C ATOM 1011 ND1 HIS A 493 3.336 -12.285 0.298 1.00 0.00 N ATOM 1012 CD2 HIS A 493 3.250 -10.269 1.183 1.00 0.00 C ATOM 1013 CE1 HIS A 493 2.940 -11.405 -0.639 1.00 0.00 C ATOM 1014 NE2 HIS A 493 2.871 -10.162 -0.153 1.00 0.00 N ATOM 0 H HIS A 493 4.189 -13.402 4.914 1.00 0.00 H new ATOM 0 HA HIS A 493 2.106 -11.886 3.723 1.00 0.00 H new ATOM 0 HB2 HIS A 493 4.573 -11.557 3.346 1.00 0.00 H new ATOM 0 HB3 HIS A 493 4.640 -13.095 2.508 1.00 0.00 H new ATOM 0 HD1 HIS A 493 3.462 -13.289 0.167 1.00 0.00 H new ATOM 0 HD2 HIS A 493 3.306 -9.448 1.882 1.00 0.00 H new ATOM 0 HE1 HIS A 493 2.706 -11.670 -1.659 1.00 0.00 H new ATOM 1022 N ASP A 494 2.495 -15.004 2.699 1.00 0.00 N ATOM 1023 CA ASP A 494 1.864 -16.085 1.937 1.00 0.00 C ATOM 1024 C ASP A 494 0.463 -16.401 2.454 1.00 0.00 C ATOM 1025 O ASP A 494 -0.440 -16.707 1.676 1.00 0.00 O ATOM 1026 CB ASP A 494 2.721 -17.347 2.012 1.00 0.00 C ATOM 1027 CG ASP A 494 2.050 -18.480 1.242 1.00 0.00 C ATOM 1028 OD1 ASP A 494 1.808 -18.304 0.059 1.00 0.00 O ATOM 1029 OD2 ASP A 494 1.791 -19.508 1.846 1.00 0.00 O ATOM 0 H ASP A 494 3.327 -15.283 3.219 1.00 0.00 H new ATOM 0 HA ASP A 494 1.780 -15.749 0.904 1.00 0.00 H new ATOM 0 HB2 ASP A 494 3.710 -17.150 1.597 1.00 0.00 H new ATOM 0 HB3 ASP A 494 2.864 -17.638 3.053 1.00 0.00 H new ATOM 1034 N ILE A 495 0.289 -16.343 3.768 1.00 0.00 N ATOM 1035 CA ILE A 495 -1.010 -16.645 4.366 1.00 0.00 C ATOM 1036 C ILE A 495 -2.076 -15.662 3.879 1.00 0.00 C ATOM 1037 O ILE A 495 -3.192 -16.064 3.550 1.00 0.00 O ATOM 1038 CB ILE A 495 -0.901 -16.591 5.896 1.00 0.00 C ATOM 1039 CG1 ILE A 495 -0.044 -17.766 6.392 1.00 0.00 C ATOM 1040 CG2 ILE A 495 -2.297 -16.675 6.525 1.00 0.00 C ATOM 1041 CD1 ILE A 495 0.321 -17.566 7.867 1.00 0.00 C ATOM 0 H ILE A 495 1.019 -16.093 4.435 1.00 0.00 H new ATOM 0 HA ILE A 495 -1.308 -17.648 4.061 1.00 0.00 H new ATOM 0 HB ILE A 495 -0.434 -15.650 6.187 1.00 0.00 H new ATOM 0 HG12 ILE A 495 -0.589 -18.702 6.268 1.00 0.00 H new ATOM 0 HG13 ILE A 495 0.863 -17.843 5.792 1.00 0.00 H new ATOM 0 HG21 ILE A 495 -2.210 -16.636 7.611 1.00 0.00 H new ATOM 0 HG22 ILE A 495 -2.903 -15.837 6.179 1.00 0.00 H new ATOM 0 HG23 ILE A 495 -2.772 -17.611 6.233 1.00 0.00 H new ATOM 0 HD11 ILE A 495 0.928 -18.404 8.208 1.00 0.00 H new ATOM 0 HD12 ILE A 495 0.885 -16.640 7.980 1.00 0.00 H new ATOM 0 HD13 ILE A 495 -0.590 -17.511 8.463 1.00 0.00 H new ATOM 1147 N GLN A 501 -9.562 -12.359 1.923 1.00 0.00 N ATOM 1148 CA GLN A 501 -10.314 -11.273 1.302 1.00 0.00 C ATOM 1149 C GLN A 501 -9.557 -9.949 1.454 1.00 0.00 C ATOM 1150 O GLN A 501 -8.926 -9.702 2.482 1.00 0.00 O ATOM 1151 CB GLN A 501 -11.698 -11.178 1.964 1.00 0.00 C ATOM 1152 CG GLN A 501 -12.222 -12.593 2.308 1.00 0.00 C ATOM 1153 CD GLN A 501 -11.750 -12.997 3.705 1.00 0.00 C ATOM 1154 OE1 GLN A 501 -11.785 -12.181 4.625 1.00 0.00 O ATOM 1155 NE2 GLN A 501 -11.305 -14.206 3.918 1.00 0.00 N ATOM 0 HA GLN A 501 -10.435 -11.475 0.238 1.00 0.00 H new ATOM 0 HB2 GLN A 501 -11.636 -10.575 2.870 1.00 0.00 H new ATOM 0 HB3 GLN A 501 -12.396 -10.676 1.294 1.00 0.00 H new ATOM 0 HG2 GLN A 501 -13.311 -12.608 2.264 1.00 0.00 H new ATOM 0 HG3 GLN A 501 -11.864 -13.312 1.571 1.00 0.00 H new ATOM 0 HE21 GLN A 501 -11.277 -14.881 3.154 1.00 0.00 H new ATOM 0 HE22 GLN A 501 -10.986 -14.475 4.849 1.00 0.00 H new ATOM 1164 N ILE A 502 -9.619 -9.102 0.427 1.00 0.00 N ATOM 1165 CA ILE A 502 -8.926 -7.808 0.464 1.00 0.00 C ATOM 1166 C ILE A 502 -9.136 -7.114 1.824 1.00 0.00 C ATOM 1167 O ILE A 502 -8.172 -6.675 2.445 1.00 0.00 O ATOM 1168 CB ILE A 502 -9.383 -6.895 -0.718 1.00 0.00 C ATOM 1169 CG1 ILE A 502 -10.180 -7.714 -1.759 1.00 0.00 C ATOM 1170 CG2 ILE A 502 -8.176 -6.244 -1.407 1.00 0.00 C ATOM 1171 CD1 ILE A 502 -9.310 -8.806 -2.403 1.00 0.00 C ATOM 0 H ILE A 502 -10.135 -9.283 -0.434 1.00 0.00 H new ATOM 0 HA ILE A 502 -7.858 -7.990 0.345 1.00 0.00 H new ATOM 0 HB ILE A 502 -10.021 -6.114 -0.304 1.00 0.00 H new ATOM 0 HG12 ILE A 502 -11.044 -8.172 -1.278 1.00 0.00 H new ATOM 0 HG13 ILE A 502 -10.561 -7.048 -2.533 1.00 0.00 H new ATOM 0 HG21 ILE A 502 -8.521 -5.613 -2.226 1.00 0.00 H new ATOM 0 HG22 ILE A 502 -7.630 -5.636 -0.686 1.00 0.00 H new ATOM 0 HG23 ILE A 502 -7.518 -7.020 -1.799 1.00 0.00 H new ATOM 0 HD11 ILE A 502 -9.903 -9.362 -3.129 1.00 0.00 H new ATOM 0 HD12 ILE A 502 -8.460 -8.345 -2.905 1.00 0.00 H new ATOM 0 HD13 ILE A 502 -8.950 -9.487 -1.631 1.00 0.00 H new ATOM 1183 N PRO A 503 -10.354 -7.018 2.309 1.00 0.00 N ATOM 1184 CA PRO A 503 -10.666 -6.372 3.638 1.00 0.00 C ATOM 1185 C PRO A 503 -9.677 -6.729 4.749 1.00 0.00 C ATOM 1186 O PRO A 503 -9.090 -5.826 5.345 1.00 0.00 O ATOM 1187 CB PRO A 503 -12.103 -6.866 3.885 1.00 0.00 C ATOM 1188 CG PRO A 503 -12.656 -6.760 2.517 1.00 0.00 C ATOM 1189 CD PRO A 503 -11.611 -7.472 1.681 1.00 0.00 C ATOM 0 HA PRO A 503 -10.577 -5.286 3.631 1.00 0.00 H new ATOM 0 HB2 PRO A 503 -12.132 -7.886 4.267 1.00 0.00 H new ATOM 0 HB3 PRO A 503 -12.640 -6.243 4.600 1.00 0.00 H new ATOM 0 HG2 PRO A 503 -13.633 -7.237 2.437 1.00 0.00 H new ATOM 0 HG3 PRO A 503 -12.782 -5.722 2.210 1.00 0.00 H new ATOM 0 HD2 PRO A 503 -11.721 -8.555 1.726 1.00 0.00 H new ATOM 0 HD3 PRO A 503 -11.667 -7.189 0.630 1.00 0.00 H new ATOM 1197 N LEU A 504 -9.448 -8.012 4.996 1.00 0.00 N ATOM 1198 CA LEU A 504 -8.475 -8.415 6.011 1.00 0.00 C ATOM 1199 C LEU A 504 -7.070 -7.982 5.591 1.00 0.00 C ATOM 1200 O LEU A 504 -6.298 -7.481 6.405 1.00 0.00 O ATOM 1201 CB LEU A 504 -8.533 -9.933 6.192 1.00 0.00 C ATOM 1202 CG LEU A 504 -9.871 -10.326 6.844 1.00 0.00 C ATOM 1203 CD1 LEU A 504 -10.021 -11.854 6.810 1.00 0.00 C ATOM 1204 CD2 LEU A 504 -9.934 -9.825 8.303 1.00 0.00 C ATOM 0 H LEU A 504 -9.913 -8.783 4.517 1.00 0.00 H new ATOM 0 HA LEU A 504 -8.715 -7.932 6.958 1.00 0.00 H new ATOM 0 HB2 LEU A 504 -8.428 -10.428 5.227 1.00 0.00 H new ATOM 0 HB3 LEU A 504 -7.702 -10.267 6.814 1.00 0.00 H new ATOM 0 HG LEU A 504 -10.686 -9.863 6.287 1.00 0.00 H new ATOM 0 HD11 LEU A 504 -10.967 -12.137 7.271 1.00 0.00 H new ATOM 0 HD12 LEU A 504 -10.004 -12.198 5.776 1.00 0.00 H new ATOM 0 HD13 LEU A 504 -9.199 -12.313 7.359 1.00 0.00 H new ATOM 0 HD21 LEU A 504 -10.887 -10.113 8.746 1.00 0.00 H new ATOM 0 HD22 LEU A 504 -9.119 -10.269 8.875 1.00 0.00 H new ATOM 0 HD23 LEU A 504 -9.840 -8.739 8.319 1.00 0.00 H new ATOM 1216 N GLN A 505 -6.743 -8.171 4.312 1.00 0.00 N ATOM 1217 CA GLN A 505 -5.424 -7.784 3.814 1.00 0.00 C ATOM 1218 C GLN A 505 -5.174 -6.307 4.079 1.00 0.00 C ATOM 1219 O GLN A 505 -4.085 -5.917 4.498 1.00 0.00 O ATOM 1220 CB GLN A 505 -5.298 -8.057 2.313 1.00 0.00 C ATOM 1221 CG GLN A 505 -5.424 -9.558 2.048 1.00 0.00 C ATOM 1222 CD GLN A 505 -4.914 -9.884 0.649 1.00 0.00 C ATOM 1223 OE1 GLN A 505 -5.529 -9.504 -0.347 1.00 0.00 O ATOM 1224 NE2 GLN A 505 -3.813 -10.573 0.520 1.00 0.00 N ATOM 0 H GLN A 505 -7.362 -8.582 3.613 1.00 0.00 H new ATOM 0 HA GLN A 505 -4.681 -8.382 4.342 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -6.072 -7.516 1.769 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -4.338 -7.693 1.947 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -4.854 -10.116 2.791 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -6.465 -9.867 2.146 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -3.307 -10.886 1.349 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -3.459 -10.799 -0.409 1.00 0.00 H new ATOM 1233 N ALA A 506 -6.191 -5.490 3.841 1.00 0.00 N ATOM 1234 CA ALA A 506 -6.064 -4.062 4.066 1.00 0.00 C ATOM 1235 C ALA A 506 -5.771 -3.801 5.535 1.00 0.00 C ATOM 1236 O ALA A 506 -4.943 -2.957 5.872 1.00 0.00 O ATOM 1237 CB ALA A 506 -7.358 -3.350 3.665 1.00 0.00 C ATOM 0 H ALA A 506 -7.103 -5.790 3.496 1.00 0.00 H new ATOM 0 HA ALA A 506 -5.245 -3.678 3.458 1.00 0.00 H new ATOM 0 HB1 ALA A 506 -7.252 -2.279 3.838 1.00 0.00 H new ATOM 0 HB2 ALA A 506 -7.560 -3.529 2.609 1.00 0.00 H new ATOM 0 HB3 ALA A 506 -8.185 -3.734 4.262 1.00 0.00 H new ATOM 1243 N ARG A 507 -6.457 -4.532 6.407 1.00 0.00 N ATOM 1244 CA ARG A 507 -6.257 -4.370 7.838 1.00 0.00 C ATOM 1245 C ARG A 507 -4.862 -4.835 8.235 1.00 0.00 C ATOM 1246 O ARG A 507 -4.180 -4.181 9.024 1.00 0.00 O ATOM 1247 CB ARG A 507 -7.315 -5.164 8.609 1.00 0.00 C ATOM 1248 CG ARG A 507 -7.156 -4.924 10.115 1.00 0.00 C ATOM 1249 CD ARG A 507 -8.230 -5.709 10.868 1.00 0.00 C ATOM 1250 NE ARG A 507 -9.554 -5.187 10.543 1.00 0.00 N ATOM 1251 CZ ARG A 507 -10.648 -5.698 11.099 1.00 0.00 C ATOM 1252 NH1 ARG A 507 -10.549 -6.677 11.955 1.00 0.00 N ATOM 1253 NH2 ARG A 507 -11.821 -5.220 10.788 1.00 0.00 N ATOM 0 H ARG A 507 -7.149 -5.235 6.149 1.00 0.00 H new ATOM 0 HA ARG A 507 -6.356 -3.313 8.087 1.00 0.00 H new ATOM 0 HB2 ARG A 507 -8.312 -4.864 8.288 1.00 0.00 H new ATOM 0 HB3 ARG A 507 -7.216 -6.227 8.389 1.00 0.00 H new ATOM 0 HG2 ARG A 507 -6.164 -5.237 10.442 1.00 0.00 H new ATOM 0 HG3 ARG A 507 -7.244 -3.860 10.337 1.00 0.00 H new ATOM 0 HD2 ARG A 507 -8.172 -6.765 10.604 1.00 0.00 H new ATOM 0 HD3 ARG A 507 -8.057 -5.639 11.942 1.00 0.00 H new ATOM 0 HE ARG A 507 -9.641 -4.418 9.879 1.00 0.00 H new ATOM 0 HH11 ARG A 507 -9.632 -7.051 12.198 1.00 0.00 H new ATOM 0 HH12 ARG A 507 -11.389 -7.069 12.381 1.00 0.00 H new ATOM 0 HH21 ARG A 507 -11.899 -4.454 10.118 1.00 0.00 H new ATOM 0 HH22 ARG A 507 -12.661 -5.612 11.214 1.00 0.00 H new ATOM 1267 N GLU A 508 -4.438 -5.969 7.683 1.00 0.00 N ATOM 1268 CA GLU A 508 -3.117 -6.497 7.998 1.00 0.00 C ATOM 1269 C GLU A 508 -2.050 -5.516 7.525 1.00 0.00 C ATOM 1270 O GLU A 508 -1.079 -5.251 8.235 1.00 0.00 O ATOM 1271 CB GLU A 508 -2.907 -7.859 7.325 1.00 0.00 C ATOM 1272 CG GLU A 508 -1.599 -8.483 7.830 1.00 0.00 C ATOM 1273 CD GLU A 508 -1.757 -8.919 9.282 1.00 0.00 C ATOM 1274 OE1 GLU A 508 -2.873 -8.887 9.773 1.00 0.00 O ATOM 1275 OE2 GLU A 508 -0.758 -9.279 9.882 1.00 0.00 O ATOM 0 H GLU A 508 -4.980 -6.531 7.027 1.00 0.00 H new ATOM 0 HA GLU A 508 -3.039 -6.629 9.077 1.00 0.00 H new ATOM 0 HB2 GLU A 508 -3.746 -8.519 7.546 1.00 0.00 H new ATOM 0 HB3 GLU A 508 -2.871 -7.740 6.242 1.00 0.00 H new ATOM 0 HG2 GLU A 508 -1.332 -9.340 7.211 1.00 0.00 H new ATOM 0 HG3 GLU A 508 -0.786 -7.762 7.744 1.00 0.00 H new ATOM 1282 N LEU A 509 -2.239 -4.979 6.324 1.00 0.00 N ATOM 1283 CA LEU A 509 -1.284 -4.021 5.771 1.00 0.00 C ATOM 1284 C LEU A 509 -1.209 -2.777 6.651 1.00 0.00 C ATOM 1285 O LEU A 509 -0.127 -2.275 6.935 1.00 0.00 O ATOM 1286 CB LEU A 509 -1.709 -3.626 4.349 1.00 0.00 C ATOM 1287 CG LEU A 509 -0.790 -2.524 3.793 1.00 0.00 C ATOM 1288 CD1 LEU A 509 0.671 -2.985 3.833 1.00 0.00 C ATOM 1289 CD2 LEU A 509 -1.191 -2.222 2.346 1.00 0.00 C ATOM 0 H LEU A 509 -3.034 -5.186 5.720 1.00 0.00 H new ATOM 0 HA LEU A 509 -0.299 -4.487 5.738 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -1.673 -4.499 3.698 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -2.741 -3.276 4.357 1.00 0.00 H new ATOM 0 HG LEU A 509 -0.893 -1.627 4.403 1.00 0.00 H new ATOM 0 HD11 LEU A 509 1.312 -2.197 3.437 1.00 0.00 H new ATOM 0 HD12 LEU A 509 0.956 -3.202 4.862 1.00 0.00 H new ATOM 0 HD13 LEU A 509 0.785 -3.884 3.228 1.00 0.00 H new ATOM 0 HD21 LEU A 509 -0.544 -1.442 1.945 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -1.087 -3.125 1.744 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -2.227 -1.884 2.318 1.00 0.00 H new ATOM 1301 N ILE A 510 -2.360 -2.284 7.083 1.00 0.00 N ATOM 1302 CA ILE A 510 -2.395 -1.099 7.933 1.00 0.00 C ATOM 1303 C ILE A 510 -1.711 -1.382 9.268 1.00 0.00 C ATOM 1304 O ILE A 510 -0.954 -0.556 9.776 1.00 0.00 O ATOM 1305 CB ILE A 510 -3.844 -0.656 8.157 1.00 0.00 C ATOM 1306 CG1 ILE A 510 -4.413 -0.107 6.845 1.00 0.00 C ATOM 1307 CG2 ILE A 510 -3.898 0.433 9.230 1.00 0.00 C ATOM 1308 CD1 ILE A 510 -5.933 -0.002 6.951 1.00 0.00 C ATOM 0 H ILE A 510 -3.274 -2.679 6.863 1.00 0.00 H new ATOM 0 HA ILE A 510 -1.856 -0.293 7.435 1.00 0.00 H new ATOM 0 HB ILE A 510 -4.434 -1.511 8.487 1.00 0.00 H new ATOM 0 HG12 ILE A 510 -3.984 0.872 6.633 1.00 0.00 H new ATOM 0 HG13 ILE A 510 -4.140 -0.761 6.017 1.00 0.00 H new ATOM 0 HG21 ILE A 510 -4.932 0.742 9.383 1.00 0.00 H new ATOM 0 HG22 ILE A 510 -3.494 0.044 10.164 1.00 0.00 H new ATOM 0 HG23 ILE A 510 -3.307 1.290 8.908 1.00 0.00 H new ATOM 0 HD11 ILE A 510 -6.337 0.389 6.017 1.00 0.00 H new ATOM 0 HD12 ILE A 510 -6.353 -0.989 7.143 1.00 0.00 H new ATOM 0 HD13 ILE A 510 -6.195 0.669 7.769 1.00 0.00 H new ATOM 1320 N ASP A 511 -1.987 -2.551 9.829 1.00 0.00 N ATOM 1321 CA ASP A 511 -1.400 -2.930 11.108 1.00 0.00 C ATOM 1322 C ASP A 511 0.123 -2.979 11.003 1.00 0.00 C ATOM 1323 O ASP A 511 0.830 -2.660 11.958 1.00 0.00 O ATOM 1324 CB ASP A 511 -1.926 -4.299 11.540 1.00 0.00 C ATOM 1325 CG ASP A 511 -1.352 -4.675 12.901 1.00 0.00 C ATOM 1326 OD1 ASP A 511 -0.563 -3.903 13.423 1.00 0.00 O ATOM 1327 OD2 ASP A 511 -1.706 -5.730 13.401 1.00 0.00 O ATOM 0 H ASP A 511 -2.609 -3.250 9.423 1.00 0.00 H new ATOM 0 HA ASP A 511 -1.680 -2.183 11.851 1.00 0.00 H new ATOM 0 HB2 ASP A 511 -3.015 -4.280 11.588 1.00 0.00 H new ATOM 0 HB3 ASP A 511 -1.653 -5.052 10.801 1.00 0.00 H new ATOM 1332 N THR A 512 0.622 -3.380 9.837 1.00 0.00 N ATOM 1333 CA THR A 512 2.063 -3.469 9.624 1.00 0.00 C ATOM 1334 C THR A 512 2.680 -2.077 9.483 1.00 0.00 C ATOM 1335 O THR A 512 3.886 -1.907 9.639 1.00 0.00 O ATOM 1336 CB THR A 512 2.360 -4.304 8.374 1.00 0.00 C ATOM 1337 OG1 THR A 512 1.565 -3.841 7.295 1.00 0.00 O ATOM 1338 CG2 THR A 512 2.044 -5.775 8.648 1.00 0.00 C ATOM 0 H THR A 512 0.055 -3.646 9.032 1.00 0.00 H new ATOM 0 HA THR A 512 2.508 -3.955 10.492 1.00 0.00 H new ATOM 0 HB THR A 512 3.415 -4.205 8.117 1.00 0.00 H new ATOM 0 HG1 THR A 512 1.109 -3.014 7.556 1.00 0.00 H new ATOM 0 HG21 THR A 512 2.257 -6.365 7.756 1.00 0.00 H new ATOM 0 HG22 THR A 512 2.659 -6.131 9.474 1.00 0.00 H new ATOM 0 HG23 THR A 512 0.991 -5.878 8.909 1.00 0.00 H new ATOM 1346 N ILE A 513 1.848 -1.083 9.196 1.00 0.00 N ATOM 1347 CA ILE A 513 2.327 0.293 9.059 1.00 0.00 C ATOM 1348 C ILE A 513 2.357 0.965 10.427 1.00 0.00 C ATOM 1349 O ILE A 513 3.277 1.722 10.737 1.00 0.00 O ATOM 1350 CB ILE A 513 1.409 1.079 8.112 1.00 0.00 C ATOM 1351 CG1 ILE A 513 1.563 0.554 6.673 1.00 0.00 C ATOM 1352 CG2 ILE A 513 1.736 2.578 8.164 1.00 0.00 C ATOM 1353 CD1 ILE A 513 3.001 0.732 6.151 1.00 0.00 C ATOM 0 H ILE A 513 0.845 -1.199 9.054 1.00 0.00 H new ATOM 0 HA ILE A 513 3.334 0.279 8.643 1.00 0.00 H new ATOM 0 HB ILE A 513 0.377 0.939 8.434 1.00 0.00 H new ATOM 0 HG12 ILE A 513 1.292 -0.501 6.640 1.00 0.00 H new ATOM 0 HG13 ILE A 513 0.870 1.082 6.017 1.00 0.00 H new ATOM 0 HG21 ILE A 513 1.075 3.118 7.486 1.00 0.00 H new ATOM 0 HG22 ILE A 513 1.594 2.946 9.180 1.00 0.00 H new ATOM 0 HG23 ILE A 513 2.772 2.735 7.863 1.00 0.00 H new ATOM 0 HD11 ILE A 513 3.068 0.349 5.133 1.00 0.00 H new ATOM 0 HD12 ILE A 513 3.263 1.790 6.159 1.00 0.00 H new ATOM 0 HD13 ILE A 513 3.691 0.183 6.791 1.00 0.00 H new ATOM 1365 N LEU A 514 1.339 0.694 11.237 1.00 0.00 N ATOM 1366 CA LEU A 514 1.257 1.291 12.562 1.00 0.00 C ATOM 1367 C LEU A 514 2.439 0.834 13.422 1.00 0.00 C ATOM 1368 O LEU A 514 3.063 1.637 14.113 1.00 0.00 O ATOM 1369 CB LEU A 514 -0.078 0.892 13.228 1.00 0.00 C ATOM 1370 CG LEU A 514 -0.549 1.978 14.226 1.00 0.00 C ATOM 1371 CD1 LEU A 514 0.553 2.265 15.255 1.00 0.00 C ATOM 1372 CD2 LEU A 514 -0.916 3.279 13.467 1.00 0.00 C ATOM 0 H LEU A 514 0.567 0.071 11.001 1.00 0.00 H new ATOM 0 HA LEU A 514 1.298 2.376 12.469 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -0.839 0.742 12.463 1.00 0.00 H new ATOM 0 HB3 LEU A 514 0.041 -0.058 13.749 1.00 0.00 H new ATOM 0 HG LEU A 514 -1.433 1.612 14.748 1.00 0.00 H new ATOM 0 HD11 LEU A 514 0.210 3.030 15.951 1.00 0.00 H new ATOM 0 HD12 LEU A 514 0.785 1.352 15.804 1.00 0.00 H new ATOM 0 HD13 LEU A 514 1.448 2.617 14.741 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -1.246 4.035 14.179 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -0.042 3.645 12.928 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -1.719 3.073 12.759 1.00 0.00 H new ATOM 1384 N VAL A 515 2.745 -0.464 13.379 1.00 0.00 N ATOM 1385 CA VAL A 515 3.851 -0.997 14.170 1.00 0.00 C ATOM 1386 C VAL A 515 5.177 -0.385 13.721 1.00 0.00 C ATOM 1387 O VAL A 515 5.982 0.042 14.550 1.00 0.00 O ATOM 1388 CB VAL A 515 3.908 -2.523 14.041 1.00 0.00 C ATOM 1389 CG1 VAL A 515 4.313 -2.910 12.618 1.00 0.00 C ATOM 1390 CG2 VAL A 515 4.930 -3.083 15.036 1.00 0.00 C ATOM 0 H VAL A 515 2.251 -1.154 12.814 1.00 0.00 H new ATOM 0 HA VAL A 515 3.683 -0.735 15.215 1.00 0.00 H new ATOM 0 HB VAL A 515 2.924 -2.938 14.258 1.00 0.00 H new ATOM 0 HG11 VAL A 515 4.352 -3.996 12.533 1.00 0.00 H new ATOM 0 HG12 VAL A 515 3.582 -2.517 11.912 1.00 0.00 H new ATOM 0 HG13 VAL A 515 5.295 -2.493 12.393 1.00 0.00 H new ATOM 0 HG21 VAL A 515 4.970 -4.168 14.944 1.00 0.00 H new ATOM 0 HG22 VAL A 515 5.913 -2.664 14.822 1.00 0.00 H new ATOM 0 HG23 VAL A 515 4.634 -2.816 16.050 1.00 0.00 H new ATOM 1400 N LYS A 516 5.400 -0.341 12.408 1.00 0.00 N ATOM 1401 CA LYS A 516 6.633 0.229 11.871 1.00 0.00 C ATOM 1402 C LYS A 516 6.727 1.716 12.193 1.00 0.00 C ATOM 1403 O LYS A 516 7.774 2.200 12.626 1.00 0.00 O ATOM 1404 CB LYS A 516 6.683 0.039 10.357 1.00 0.00 C ATOM 1405 CG LYS A 516 6.883 -1.440 10.026 1.00 0.00 C ATOM 1406 CD LYS A 516 6.896 -1.627 8.509 1.00 0.00 C ATOM 1407 CE LYS A 516 7.067 -3.109 8.180 1.00 0.00 C ATOM 1408 NZ LYS A 516 7.015 -3.294 6.703 1.00 0.00 N ATOM 0 H LYS A 516 4.750 -0.690 11.704 1.00 0.00 H new ATOM 0 HA LYS A 516 7.474 -0.288 12.334 1.00 0.00 H new ATOM 0 HB2 LYS A 516 5.759 0.400 9.905 1.00 0.00 H new ATOM 0 HB3 LYS A 516 7.496 0.629 9.934 1.00 0.00 H new ATOM 0 HG2 LYS A 516 7.820 -1.796 10.455 1.00 0.00 H new ATOM 0 HG3 LYS A 516 6.084 -2.034 10.469 1.00 0.00 H new ATOM 0 HD2 LYS A 516 5.968 -1.253 8.078 1.00 0.00 H new ATOM 0 HD3 LYS A 516 7.708 -1.049 8.068 1.00 0.00 H new ATOM 0 HE2 LYS A 516 8.017 -3.473 8.570 1.00 0.00 H new ATOM 0 HE3 LYS A 516 6.281 -3.693 8.659 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 6.407 -4.106 6.476 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 6.628 -2.437 6.259 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 7.974 -3.468 6.341 1.00 0.00 H new ATOM 1422 N GLY A 517 5.627 2.437 11.984 1.00 0.00 N ATOM 1423 CA GLY A 517 5.599 3.871 12.264 1.00 0.00 C ATOM 1424 C GLY A 517 6.195 4.679 11.121 1.00 0.00 C ATOM 1425 O GLY A 517 6.325 4.184 10.003 1.00 0.00 O ATOM 0 H GLY A 517 4.751 2.056 11.625 1.00 0.00 H new ATOM 0 HA2 GLY A 517 4.570 4.188 12.436 1.00 0.00 H new ATOM 0 HA3 GLY A 517 6.153 4.074 13.181 1.00 0.00 H new ATOM 1429 N ASN A 518 6.551 5.930 11.409 1.00 0.00 N ATOM 1430 CA ASN A 518 7.127 6.797 10.395 1.00 0.00 C ATOM 1431 C ASN A 518 8.203 6.059 9.609 1.00 0.00 C ATOM 1432 O ASN A 518 8.606 6.488 8.531 1.00 0.00 O ATOM 1433 CB ASN A 518 7.725 8.032 11.056 1.00 0.00 C ATOM 1434 CG ASN A 518 6.620 8.838 11.729 1.00 0.00 C ATOM 1435 OD1 ASN A 518 5.923 9.609 11.070 1.00 0.00 O ATOM 1436 ND2 ASN A 518 6.420 8.699 13.013 1.00 0.00 N ATOM 0 H ASN A 518 6.450 6.359 12.329 1.00 0.00 H new ATOM 0 HA ASN A 518 6.340 7.100 9.705 1.00 0.00 H new ATOM 0 HB2 ASN A 518 8.473 7.737 11.792 1.00 0.00 H new ATOM 0 HB3 ASN A 518 8.234 8.645 10.312 1.00 0.00 H new ATOM 0 HD21 ASN A 518 5.683 9.231 13.475 1.00 0.00 H new ATOM 0 HD22 ASN A 518 7.001 8.058 13.553 1.00 0.00 H new ATOM 1443 N ALA A 519 8.663 4.945 10.152 1.00 0.00 N ATOM 1444 CA ALA A 519 9.684 4.158 9.483 1.00 0.00 C ATOM 1445 C ALA A 519 9.148 3.631 8.159 1.00 0.00 C ATOM 1446 O ALA A 519 9.885 3.537 7.177 1.00 0.00 O ATOM 1447 CB ALA A 519 10.117 2.991 10.371 1.00 0.00 C ATOM 0 H ALA A 519 8.349 4.568 11.046 1.00 0.00 H new ATOM 0 HA ALA A 519 10.548 4.794 9.291 1.00 0.00 H new ATOM 0 HB1 ALA A 519 10.883 2.408 9.859 1.00 0.00 H new ATOM 0 HB2 ALA A 519 10.520 3.376 11.307 1.00 0.00 H new ATOM 0 HB3 ALA A 519 9.257 2.355 10.581 1.00 0.00 H new ATOM 1453 N ALA A 520 7.859 3.288 8.137 1.00 0.00 N ATOM 1454 CA ALA A 520 7.235 2.772 6.917 1.00 0.00 C ATOM 1455 C ALA A 520 6.599 3.897 6.116 1.00 0.00 C ATOM 1456 O ALA A 520 6.135 3.678 5.000 1.00 0.00 O ATOM 1457 CB ALA A 520 6.164 1.741 7.263 1.00 0.00 C ATOM 0 H ALA A 520 7.233 3.357 8.939 1.00 0.00 H new ATOM 0 HA ALA A 520 8.015 2.303 6.317 1.00 0.00 H new ATOM 0 HB1 ALA A 520 5.709 1.367 6.346 1.00 0.00 H new ATOM 0 HB2 ALA A 520 6.618 0.913 7.807 1.00 0.00 H new ATOM 0 HB3 ALA A 520 5.398 2.206 7.884 1.00 0.00 H new ATOM 1463 N ALA A 521 6.572 5.099 6.682 1.00 0.00 N ATOM 1464 CA ALA A 521 5.979 6.229 5.979 1.00 0.00 C ATOM 1465 C ALA A 521 6.677 6.440 4.643 1.00 0.00 C ATOM 1466 O ALA A 521 6.030 6.670 3.630 1.00 0.00 O ATOM 1467 CB ALA A 521 6.090 7.503 6.818 1.00 0.00 C ATOM 0 H ALA A 521 6.946 5.313 7.607 1.00 0.00 H new ATOM 0 HA ALA A 521 4.925 6.009 5.807 1.00 0.00 H new ATOM 0 HB1 ALA A 521 5.642 8.336 6.276 1.00 0.00 H new ATOM 0 HB2 ALA A 521 5.567 7.362 7.764 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.140 7.720 7.013 1.00 0.00 H new ATOM 1473 N ASN A 522 8.002 6.348 4.642 1.00 0.00 N ATOM 1474 CA ASN A 522 8.758 6.536 3.407 1.00 0.00 C ATOM 1475 C ASN A 522 8.313 5.521 2.357 1.00 0.00 C ATOM 1476 O ASN A 522 8.052 5.878 1.207 1.00 0.00 O ATOM 1477 CB ASN A 522 10.260 6.379 3.689 1.00 0.00 C ATOM 1478 CG ASN A 522 10.605 4.911 3.928 1.00 0.00 C ATOM 1479 OD1 ASN A 522 9.908 4.218 4.786 1.00 0.00 O flip ATOM 1480 ND2 ASN A 522 11.530 4.381 3.312 1.00 0.00 N flip ATOM 0 H ASN A 522 8.568 6.148 5.467 1.00 0.00 H new ATOM 0 HA ASN A 522 8.569 7.539 3.024 1.00 0.00 H new ATOM 0 HB2 ASN A 522 10.837 6.763 2.847 1.00 0.00 H new ATOM 0 HB3 ASN A 522 10.537 6.971 4.561 1.00 0.00 H new ATOM 0 HD21 ASN A 522 12.074 4.924 2.642 1.00 0.00 H new ATOM 0 HD22 ASN A 522 11.752 3.399 3.472 1.00 0.00 H new ATOM 1487 N ILE A 523 8.218 4.259 2.758 1.00 0.00 N ATOM 1488 CA ILE A 523 7.794 3.209 1.843 1.00 0.00 C ATOM 1489 C ILE A 523 6.354 3.461 1.419 1.00 0.00 C ATOM 1490 O ILE A 523 6.007 3.325 0.246 1.00 0.00 O ATOM 1491 CB ILE A 523 7.916 1.841 2.520 1.00 0.00 C ATOM 1492 CG1 ILE A 523 9.396 1.528 2.758 1.00 0.00 C ATOM 1493 CG2 ILE A 523 7.312 0.760 1.616 1.00 0.00 C ATOM 1494 CD1 ILE A 523 9.522 0.324 3.694 1.00 0.00 C ATOM 0 H ILE A 523 8.427 3.940 3.704 1.00 0.00 H new ATOM 0 HA ILE A 523 8.434 3.216 0.961 1.00 0.00 H new ATOM 0 HB ILE A 523 7.382 1.858 3.470 1.00 0.00 H new ATOM 0 HG12 ILE A 523 9.891 1.318 1.810 1.00 0.00 H new ATOM 0 HG13 ILE A 523 9.896 2.393 3.193 1.00 0.00 H new ATOM 0 HG21 ILE A 523 7.401 -0.212 2.102 1.00 0.00 H new ATOM 0 HG22 ILE A 523 6.260 0.981 1.437 1.00 0.00 H new ATOM 0 HG23 ILE A 523 7.845 0.741 0.666 1.00 0.00 H new ATOM 0 HD11 ILE A 523 10.576 0.103 3.862 1.00 0.00 H new ATOM 0 HD12 ILE A 523 9.043 0.552 4.646 1.00 0.00 H new ATOM 0 HD13 ILE A 523 9.037 -0.541 3.241 1.00 0.00 H new ATOM 1506 N PHE A 524 5.522 3.834 2.386 1.00 0.00 N ATOM 1507 CA PHE A 524 4.121 4.111 2.111 1.00 0.00 C ATOM 1508 C PHE A 524 4.017 5.261 1.111 1.00 0.00 C ATOM 1509 O PHE A 524 3.256 5.189 0.146 1.00 0.00 O ATOM 1510 CB PHE A 524 3.397 4.482 3.413 1.00 0.00 C ATOM 1511 CG PHE A 524 1.901 4.349 3.219 1.00 0.00 C ATOM 1512 CD1 PHE A 524 1.340 3.087 2.994 1.00 0.00 C ATOM 1513 CD2 PHE A 524 1.081 5.483 3.262 1.00 0.00 C ATOM 1514 CE1 PHE A 524 -0.040 2.957 2.807 1.00 0.00 C ATOM 1515 CE2 PHE A 524 -0.301 5.351 3.076 1.00 0.00 C ATOM 1516 CZ PHE A 524 -0.862 4.089 2.849 1.00 0.00 C ATOM 0 H PHE A 524 5.794 3.950 3.362 1.00 0.00 H new ATOM 0 HA PHE A 524 3.653 3.222 1.688 1.00 0.00 H new ATOM 0 HB2 PHE A 524 3.728 3.832 4.223 1.00 0.00 H new ATOM 0 HB3 PHE A 524 3.647 5.503 3.702 1.00 0.00 H new ATOM 0 HD1 PHE A 524 1.973 2.213 2.965 1.00 0.00 H new ATOM 0 HD2 PHE A 524 1.513 6.457 3.438 1.00 0.00 H new ATOM 0 HE1 PHE A 524 -0.471 1.983 2.630 1.00 0.00 H new ATOM 0 HE2 PHE A 524 -0.935 6.225 3.108 1.00 0.00 H new ATOM 0 HZ PHE A 524 -1.928 3.989 2.706 1.00 0.00 H new ATOM 1526 N LYS A 525 4.799 6.315 1.349 1.00 0.00 N ATOM 1527 CA LYS A 525 4.809 7.479 0.466 1.00 0.00 C ATOM 1528 C LYS A 525 5.324 7.100 -0.915 1.00 0.00 C ATOM 1529 O LYS A 525 4.769 7.517 -1.928 1.00 0.00 O ATOM 1530 CB LYS A 525 5.707 8.568 1.058 1.00 0.00 C ATOM 1531 CG LYS A 525 5.015 9.200 2.265 1.00 0.00 C ATOM 1532 CD LYS A 525 5.981 10.166 2.954 1.00 0.00 C ATOM 1533 CE LYS A 525 5.288 10.813 4.149 1.00 0.00 C ATOM 1534 NZ LYS A 525 6.238 11.741 4.827 1.00 0.00 N ATOM 0 H LYS A 525 5.433 6.385 2.145 1.00 0.00 H new ATOM 0 HA LYS A 525 3.788 7.850 0.373 1.00 0.00 H new ATOM 0 HB2 LYS A 525 6.665 8.142 1.357 1.00 0.00 H new ATOM 0 HB3 LYS A 525 5.917 9.329 0.306 1.00 0.00 H new ATOM 0 HG2 LYS A 525 4.117 9.730 1.947 1.00 0.00 H new ATOM 0 HG3 LYS A 525 4.697 8.426 2.963 1.00 0.00 H new ATOM 0 HD2 LYS A 525 6.873 9.632 3.282 1.00 0.00 H new ATOM 0 HD3 LYS A 525 6.309 10.932 2.251 1.00 0.00 H new ATOM 0 HE2 LYS A 525 4.403 11.357 3.820 1.00 0.00 H new ATOM 0 HE3 LYS A 525 4.950 10.047 4.847 1.00 0.00 H new ATOM 0 HZ1 LYS A 525 6.353 11.455 5.820 1.00 0.00 H new ATOM 0 HZ2 LYS A 525 7.160 11.705 4.348 1.00 0.00 H new ATOM 0 HZ3 LYS A 525 5.864 12.711 4.786 1.00 0.00 H new ATOM 1548 N ASN A 526 6.395 6.314 -0.943 1.00 0.00 N ATOM 1549 CA ASN A 526 6.986 5.892 -2.204 1.00 0.00 C ATOM 1550 C ASN A 526 5.991 5.077 -3.022 1.00 0.00 C ATOM 1551 O ASN A 526 5.904 5.227 -4.240 1.00 0.00 O ATOM 1552 CB ASN A 526 8.231 5.048 -1.929 1.00 0.00 C ATOM 1553 CG ASN A 526 9.316 5.905 -1.283 1.00 0.00 C ATOM 1554 OD1 ASN A 526 9.545 7.040 -1.701 1.00 0.00 O ATOM 1555 ND2 ASN A 526 9.995 5.424 -0.278 1.00 0.00 N ATOM 0 H ASN A 526 6.868 5.959 -0.112 1.00 0.00 H new ATOM 0 HA ASN A 526 7.259 6.781 -2.773 1.00 0.00 H new ATOM 0 HB2 ASN A 526 7.977 4.215 -1.274 1.00 0.00 H new ATOM 0 HB3 ASN A 526 8.602 4.620 -2.860 1.00 0.00 H new ATOM 0 HD21 ASN A 526 10.719 5.989 0.165 1.00 0.00 H new ATOM 0 HD22 ASN A 526 9.801 4.483 0.065 1.00 0.00 H new ATOM 1562 N CYS A 527 5.248 4.212 -2.346 1.00 0.00 N ATOM 1563 CA CYS A 527 4.265 3.377 -3.021 1.00 0.00 C ATOM 1564 C CYS A 527 3.137 4.228 -3.592 1.00 0.00 C ATOM 1565 O CYS A 527 2.696 4.012 -4.718 1.00 0.00 O ATOM 1566 CB CYS A 527 3.689 2.359 -2.039 1.00 0.00 C ATOM 1567 SG CYS A 527 4.990 1.217 -1.514 1.00 0.00 S ATOM 0 H CYS A 527 5.306 4.071 -1.338 1.00 0.00 H new ATOM 0 HA CYS A 527 4.760 2.856 -3.841 1.00 0.00 H new ATOM 0 HB2 CYS A 527 3.270 2.871 -1.173 1.00 0.00 H new ATOM 0 HB3 CYS A 527 2.874 1.807 -2.508 1.00 0.00 H new ATOM 0 HG CYS A 527 5.717 1.780 -0.596 1.00 0.00 H new ATOM 1573 N LEU A 528 2.670 5.195 -2.810 1.00 0.00 N ATOM 1574 CA LEU A 528 1.589 6.065 -3.259 1.00 0.00 C ATOM 1575 C LEU A 528 2.022 6.886 -4.466 1.00 0.00 C ATOM 1576 O LEU A 528 1.258 7.059 -5.415 1.00 0.00 O ATOM 1577 CB LEU A 528 1.165 7.006 -2.129 1.00 0.00 C ATOM 1578 CG LEU A 528 0.472 6.210 -1.014 1.00 0.00 C ATOM 1579 CD1 LEU A 528 0.287 7.116 0.212 1.00 0.00 C ATOM 1580 CD2 LEU A 528 -0.903 5.687 -1.494 1.00 0.00 C ATOM 0 H LEU A 528 3.018 5.395 -1.872 1.00 0.00 H new ATOM 0 HA LEU A 528 0.745 5.437 -3.545 1.00 0.00 H new ATOM 0 HB2 LEU A 528 2.037 7.524 -1.729 1.00 0.00 H new ATOM 0 HB3 LEU A 528 0.490 7.770 -2.515 1.00 0.00 H new ATOM 0 HG LEU A 528 1.092 5.353 -0.749 1.00 0.00 H new ATOM 0 HD11 LEU A 528 -0.205 6.556 1.007 1.00 0.00 H new ATOM 0 HD12 LEU A 528 1.261 7.461 0.560 1.00 0.00 H new ATOM 0 HD13 LEU A 528 -0.326 7.975 -0.060 1.00 0.00 H new ATOM 0 HD21 LEU A 528 -1.379 5.125 -0.690 1.00 0.00 H new ATOM 0 HD22 LEU A 528 -1.536 6.530 -1.772 1.00 0.00 H new ATOM 0 HD23 LEU A 528 -0.764 5.037 -2.358 1.00 0.00 H new ATOM 1592 N LYS A 529 3.249 7.391 -4.426 1.00 0.00 N ATOM 1593 CA LYS A 529 3.764 8.190 -5.525 1.00 0.00 C ATOM 1594 C LYS A 529 3.833 7.367 -6.806 1.00 0.00 C ATOM 1595 O LYS A 529 3.467 7.843 -7.882 1.00 0.00 O ATOM 1596 CB LYS A 529 5.157 8.718 -5.181 1.00 0.00 C ATOM 1597 CG LYS A 529 5.050 9.817 -4.124 1.00 0.00 C ATOM 1598 CD LYS A 529 6.453 10.317 -3.770 1.00 0.00 C ATOM 1599 CE LYS A 529 6.347 11.492 -2.796 1.00 0.00 C ATOM 1600 NZ LYS A 529 5.760 11.017 -1.512 1.00 0.00 N ATOM 0 H LYS A 529 3.899 7.262 -3.651 1.00 0.00 H new ATOM 0 HA LYS A 529 3.086 9.029 -5.684 1.00 0.00 H new ATOM 0 HB2 LYS A 529 5.782 7.905 -4.811 1.00 0.00 H new ATOM 0 HB3 LYS A 529 5.639 9.109 -6.077 1.00 0.00 H new ATOM 0 HG2 LYS A 529 4.442 10.640 -4.499 1.00 0.00 H new ATOM 0 HG3 LYS A 529 4.553 9.433 -3.233 1.00 0.00 H new ATOM 0 HD2 LYS A 529 7.035 9.512 -3.322 1.00 0.00 H new ATOM 0 HD3 LYS A 529 6.979 10.626 -4.673 1.00 0.00 H new ATOM 0 HE2 LYS A 529 7.332 11.924 -2.621 1.00 0.00 H new ATOM 0 HE3 LYS A 529 5.726 12.279 -3.224 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 4.923 11.590 -1.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 5.482 10.019 -1.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 6.465 11.110 -0.753 1.00 0.00 H new ATOM 1614 N GLU A 530 4.309 6.133 -6.686 1.00 0.00 N ATOM 1615 CA GLU A 530 4.425 5.255 -7.846 1.00 0.00 C ATOM 1616 C GLU A 530 3.068 4.680 -8.242 1.00 0.00 C ATOM 1617 O GLU A 530 2.704 4.682 -9.417 1.00 0.00 O ATOM 1618 CB GLU A 530 5.391 4.111 -7.536 1.00 0.00 C ATOM 1619 CG GLU A 530 6.810 4.662 -7.387 1.00 0.00 C ATOM 1620 CD GLU A 530 7.763 3.542 -6.985 1.00 0.00 C ATOM 1621 OE1 GLU A 530 7.306 2.418 -6.863 1.00 0.00 O ATOM 1622 OE2 GLU A 530 8.935 3.825 -6.803 1.00 0.00 O ATOM 0 H GLU A 530 4.618 5.720 -5.806 1.00 0.00 H new ATOM 0 HA GLU A 530 4.805 5.846 -8.679 1.00 0.00 H new ATOM 0 HB2 GLU A 530 5.089 3.605 -6.619 1.00 0.00 H new ATOM 0 HB3 GLU A 530 5.360 3.369 -8.334 1.00 0.00 H new ATOM 0 HG2 GLU A 530 7.136 5.109 -8.326 1.00 0.00 H new ATOM 0 HG3 GLU A 530 6.826 5.452 -6.636 1.00 0.00 H new ATOM 1629 N ILE A 531 2.328 4.185 -7.255 1.00 0.00 N ATOM 1630 CA ILE A 531 1.018 3.605 -7.518 1.00 0.00 C ATOM 1631 C ILE A 531 0.064 4.672 -8.044 1.00 0.00 C ATOM 1632 O ILE A 531 -0.676 4.436 -8.997 1.00 0.00 O ATOM 1633 CB ILE A 531 0.453 2.983 -6.236 1.00 0.00 C ATOM 1634 CG1 ILE A 531 1.294 1.758 -5.848 1.00 0.00 C ATOM 1635 CG2 ILE A 531 -0.999 2.545 -6.463 1.00 0.00 C ATOM 1636 CD1 ILE A 531 0.902 1.298 -4.441 1.00 0.00 C ATOM 0 H ILE A 531 2.610 4.174 -6.275 1.00 0.00 H new ATOM 0 HA ILE A 531 1.125 2.827 -8.274 1.00 0.00 H new ATOM 0 HB ILE A 531 0.486 3.723 -5.437 1.00 0.00 H new ATOM 0 HG12 ILE A 531 1.134 0.952 -6.564 1.00 0.00 H new ATOM 0 HG13 ILE A 531 2.355 2.007 -5.879 1.00 0.00 H new ATOM 0 HG21 ILE A 531 -1.393 2.104 -5.548 1.00 0.00 H new ATOM 0 HG22 ILE A 531 -1.602 3.411 -6.738 1.00 0.00 H new ATOM 0 HG23 ILE A 531 -1.036 1.808 -7.266 1.00 0.00 H new ATOM 0 HD11 ILE A 531 1.498 0.428 -4.163 1.00 0.00 H new ATOM 0 HD12 ILE A 531 1.084 2.104 -3.731 1.00 0.00 H new ATOM 0 HD13 ILE A 531 -0.155 1.033 -4.426 1.00 0.00 H new ATOM 1648 N ASP A 532 0.090 5.847 -7.416 1.00 0.00 N ATOM 1649 CA ASP A 532 -0.782 6.946 -7.830 1.00 0.00 C ATOM 1650 C ASP A 532 -0.135 8.294 -7.527 1.00 0.00 C ATOM 1651 O ASP A 532 -0.363 8.878 -6.468 1.00 0.00 O ATOM 1652 CB ASP A 532 -2.125 6.843 -7.102 1.00 0.00 C ATOM 1653 CG ASP A 532 -2.902 5.633 -7.611 1.00 0.00 C ATOM 1654 OD1 ASP A 532 -2.834 5.367 -8.799 1.00 0.00 O ATOM 1655 OD2 ASP A 532 -3.555 4.991 -6.805 1.00 0.00 O ATOM 0 H ASP A 532 0.699 6.062 -6.626 1.00 0.00 H new ATOM 0 HA ASP A 532 -0.943 6.873 -8.906 1.00 0.00 H new ATOM 0 HB2 ASP A 532 -1.960 6.754 -6.028 1.00 0.00 H new ATOM 0 HB3 ASP A 532 -2.705 7.752 -7.262 1.00 0.00 H new ATOM 1660 N SER A 533 0.670 8.786 -8.465 1.00 0.00 N ATOM 1661 CA SER A 533 1.339 10.070 -8.285 1.00 0.00 C ATOM 1662 C SER A 533 0.313 11.180 -8.078 1.00 0.00 C ATOM 1663 O SER A 533 0.536 12.105 -7.297 1.00 0.00 O ATOM 1664 CB SER A 533 2.196 10.385 -9.510 1.00 0.00 C ATOM 1665 OG SER A 533 1.370 10.421 -10.666 1.00 0.00 O ATOM 0 H SER A 533 0.873 8.320 -9.349 1.00 0.00 H new ATOM 0 HA SER A 533 1.976 10.010 -7.403 1.00 0.00 H new ATOM 0 HB2 SER A 533 2.699 11.343 -9.379 1.00 0.00 H new ATOM 0 HB3 SER A 533 2.973 9.630 -9.628 1.00 0.00 H new ATOM 0 HG SER A 533 1.917 10.625 -11.453 1.00 0.00 H new ATOM 1671 N THR A 534 -0.811 11.075 -8.774 1.00 0.00 N ATOM 1672 CA THR A 534 -1.869 12.070 -8.653 1.00 0.00 C ATOM 1673 C THR A 534 -2.436 12.081 -7.235 1.00 0.00 C ATOM 1674 O THR A 534 -2.694 13.143 -6.668 1.00 0.00 O ATOM 1675 CB THR A 534 -2.988 11.774 -9.657 1.00 0.00 C ATOM 1676 OG1 THR A 534 -2.419 11.548 -10.939 1.00 0.00 O ATOM 1677 CG2 THR A 534 -3.942 12.967 -9.724 1.00 0.00 C ATOM 0 H THR A 534 -1.014 10.316 -9.425 1.00 0.00 H new ATOM 0 HA THR A 534 -1.445 13.051 -8.868 1.00 0.00 H new ATOM 0 HB THR A 534 -3.539 10.888 -9.341 1.00 0.00 H new ATOM 0 HG1 THR A 534 -3.132 11.357 -11.584 1.00 0.00 H new ATOM 0 HG21 THR A 534 -4.738 12.757 -10.438 1.00 0.00 H new ATOM 0 HG22 THR A 534 -4.375 13.142 -8.739 1.00 0.00 H new ATOM 0 HG23 THR A 534 -3.394 13.854 -10.042 1.00 0.00 H new ATOM 1685 N LEU A 535 -2.635 10.892 -6.670 1.00 0.00 N ATOM 1686 CA LEU A 535 -3.181 10.779 -5.322 1.00 0.00 C ATOM 1687 C LEU A 535 -2.276 11.490 -4.325 1.00 0.00 C ATOM 1688 O LEU A 535 -2.755 12.184 -3.429 1.00 0.00 O ATOM 1689 CB LEU A 535 -3.314 9.298 -4.936 1.00 0.00 C ATOM 1690 CG LEU A 535 -3.802 9.160 -3.484 1.00 0.00 C ATOM 1691 CD1 LEU A 535 -5.125 9.921 -3.293 1.00 0.00 C ATOM 1692 CD2 LEU A 535 -4.014 7.676 -3.171 1.00 0.00 C ATOM 0 H LEU A 535 -2.428 10.001 -7.121 1.00 0.00 H new ATOM 0 HA LEU A 535 -4.165 11.247 -5.302 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -4.013 8.802 -5.609 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -2.352 8.798 -5.051 1.00 0.00 H new ATOM 0 HG LEU A 535 -3.056 9.581 -2.810 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -5.460 9.815 -2.261 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -4.974 10.976 -3.519 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -5.881 9.511 -3.963 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -4.360 7.567 -2.143 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -4.760 7.264 -3.851 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -3.073 7.140 -3.296 1.00 0.00 H new ATOM 1704 N TYR A 536 -0.969 11.316 -4.481 1.00 0.00 N ATOM 1705 CA TYR A 536 -0.019 11.957 -3.582 1.00 0.00 C ATOM 1706 C TYR A 536 -0.169 13.471 -3.655 1.00 0.00 C ATOM 1707 O TYR A 536 -0.152 14.156 -2.631 1.00 0.00 O ATOM 1708 CB TYR A 536 1.410 11.559 -3.954 1.00 0.00 C ATOM 1709 CG TYR A 536 2.383 12.305 -3.072 1.00 0.00 C ATOM 1710 CD1 TYR A 536 2.613 11.876 -1.759 1.00 0.00 C ATOM 1711 CD2 TYR A 536 3.052 13.434 -3.568 1.00 0.00 C ATOM 1712 CE1 TYR A 536 3.514 12.572 -0.943 1.00 0.00 C ATOM 1713 CE2 TYR A 536 3.952 14.127 -2.751 1.00 0.00 C ATOM 1714 CZ TYR A 536 4.184 13.697 -1.438 1.00 0.00 C ATOM 1715 OH TYR A 536 5.070 14.382 -0.634 1.00 0.00 O ATOM 0 H TYR A 536 -0.547 10.744 -5.212 1.00 0.00 H new ATOM 0 HA TYR A 536 -0.225 11.628 -2.564 1.00 0.00 H new ATOM 0 HB2 TYR A 536 1.543 10.484 -3.833 1.00 0.00 H new ATOM 0 HB3 TYR A 536 1.602 11.788 -5.002 1.00 0.00 H new ATOM 0 HD1 TYR A 536 2.096 11.009 -1.376 1.00 0.00 H new ATOM 0 HD2 TYR A 536 2.873 13.768 -4.579 1.00 0.00 H new ATOM 0 HE1 TYR A 536 3.692 12.240 0.069 1.00 0.00 H new ATOM 0 HE2 TYR A 536 4.469 14.995 -3.133 1.00 0.00 H new ATOM 0 HH TYR A 536 5.448 15.136 -1.133 1.00 0.00 H new ATOM 1725 N LYS A 537 -0.308 13.987 -4.870 1.00 0.00 N ATOM 1726 CA LYS A 537 -0.458 15.422 -5.064 1.00 0.00 C ATOM 1727 C LYS A 537 -1.800 15.894 -4.510 1.00 0.00 C ATOM 1728 O LYS A 537 -2.106 17.086 -4.533 1.00 0.00 O ATOM 1729 CB LYS A 537 -0.365 15.768 -6.561 1.00 0.00 C ATOM 1730 CG LYS A 537 -0.012 17.251 -6.732 1.00 0.00 C ATOM 1731 CD LYS A 537 0.208 17.562 -8.213 1.00 0.00 C ATOM 1732 CE LYS A 537 0.567 19.041 -8.373 1.00 0.00 C ATOM 1733 NZ LYS A 537 0.811 19.339 -9.813 1.00 0.00 N ATOM 0 H LYS A 537 -0.320 13.437 -5.729 1.00 0.00 H new ATOM 0 HA LYS A 537 0.345 15.929 -4.529 1.00 0.00 H new ATOM 0 HB2 LYS A 537 0.392 15.147 -7.041 1.00 0.00 H new ATOM 0 HB3 LYS A 537 -1.313 15.552 -7.053 1.00 0.00 H new ATOM 0 HG2 LYS A 537 -0.814 17.874 -6.335 1.00 0.00 H new ATOM 0 HG3 LYS A 537 0.887 17.488 -6.163 1.00 0.00 H new ATOM 0 HD2 LYS A 537 1.007 16.937 -8.613 1.00 0.00 H new ATOM 0 HD3 LYS A 537 -0.692 17.331 -8.782 1.00 0.00 H new ATOM 0 HE2 LYS A 537 -0.241 19.666 -7.993 1.00 0.00 H new ATOM 0 HE3 LYS A 537 1.455 19.277 -7.786 1.00 0.00 H new ATOM 0 HZ1 LYS A 537 1.055 20.344 -9.923 1.00 0.00 H new ATOM 0 HZ2 LYS A 537 1.596 18.752 -10.161 1.00 0.00 H new ATOM 0 HZ3 LYS A 537 -0.048 19.129 -10.361 1.00 0.00 H new ATOM 1747 N ASN A 538 -2.607 14.947 -4.016 1.00 0.00 N ATOM 1748 CA ASN A 538 -3.924 15.279 -3.454 1.00 0.00 C ATOM 1749 C ASN A 538 -3.981 14.945 -1.964 1.00 0.00 C ATOM 1750 O ASN A 538 -4.899 15.362 -1.259 1.00 0.00 O ATOM 1751 CB ASN A 538 -5.017 14.509 -4.198 1.00 0.00 C ATOM 1752 CG ASN A 538 -5.044 14.939 -5.661 1.00 0.00 C ATOM 1753 OD1 ASN A 538 -5.010 14.033 -6.600 1.00 0.00 O flip ATOM 1754 ND2 ASN A 538 -5.093 16.133 -5.957 1.00 0.00 N flip ATOM 0 H ASN A 538 -2.375 13.954 -3.993 1.00 0.00 H new ATOM 0 HA ASN A 538 -4.087 16.350 -3.574 1.00 0.00 H new ATOM 0 HB2 ASN A 538 -4.832 13.437 -4.127 1.00 0.00 H new ATOM 0 HB3 ASN A 538 -5.986 14.697 -3.736 1.00 0.00 H new ATOM 0 HD21 ASN A 538 -5.120 16.840 -5.222 1.00 0.00 H new ATOM 0 HD22 ASN A 538 -5.107 16.415 -6.937 1.00 0.00 H new ATOM 1761 N LEU A 539 -3.001 14.179 -1.488 1.00 0.00 N ATOM 1762 CA LEU A 539 -2.954 13.790 -0.074 1.00 0.00 C ATOM 1763 C LEU A 539 -2.149 14.790 0.764 1.00 0.00 C ATOM 1764 O LEU A 539 -2.718 15.638 1.449 1.00 0.00 O ATOM 1765 CB LEU A 539 -2.333 12.389 0.052 1.00 0.00 C ATOM 1766 CG LEU A 539 -2.189 11.983 1.533 1.00 0.00 C ATOM 1767 CD1 LEU A 539 -3.544 12.079 2.247 1.00 0.00 C ATOM 1768 CD2 LEU A 539 -1.673 10.540 1.610 1.00 0.00 C ATOM 0 H LEU A 539 -2.233 13.816 -2.053 1.00 0.00 H new ATOM 0 HA LEU A 539 -3.975 13.783 0.307 1.00 0.00 H new ATOM 0 HB2 LEU A 539 -2.956 11.662 -0.470 1.00 0.00 H new ATOM 0 HB3 LEU A 539 -1.355 12.375 -0.430 1.00 0.00 H new ATOM 0 HG LEU A 539 -1.486 12.658 2.021 1.00 0.00 H new ATOM 0 HD11 LEU A 539 -3.426 11.789 3.291 1.00 0.00 H new ATOM 0 HD12 LEU A 539 -3.911 13.104 2.194 1.00 0.00 H new ATOM 0 HD13 LEU A 539 -4.258 11.412 1.764 1.00 0.00 H new ATOM 0 HD21 LEU A 539 -1.569 10.246 2.654 1.00 0.00 H new ATOM 0 HD22 LEU A 539 -2.379 9.874 1.114 1.00 0.00 H new ATOM 0 HD23 LEU A 539 -0.704 10.473 1.116 1.00 0.00 H new ATOM 1780 N PHE A 540 -0.822 14.663 0.720 1.00 0.00 N ATOM 1781 CA PHE A 540 0.062 15.541 1.495 1.00 0.00 C ATOM 1782 C PHE A 540 0.006 16.990 1.004 1.00 0.00 C ATOM 1783 O PHE A 540 0.076 17.925 1.802 1.00 0.00 O ATOM 1784 CB PHE A 540 1.503 15.030 1.409 1.00 0.00 C ATOM 1785 CG PHE A 540 1.617 13.714 2.138 1.00 0.00 C ATOM 1786 CD1 PHE A 540 1.388 12.514 1.453 1.00 0.00 C ATOM 1787 CD2 PHE A 540 1.952 13.686 3.501 1.00 0.00 C ATOM 1788 CE1 PHE A 540 1.494 11.291 2.126 1.00 0.00 C ATOM 1789 CE2 PHE A 540 2.058 12.463 4.172 1.00 0.00 C ATOM 1790 CZ PHE A 540 1.828 11.265 3.486 1.00 0.00 C ATOM 0 H PHE A 540 -0.335 13.964 0.159 1.00 0.00 H new ATOM 0 HA PHE A 540 -0.283 15.525 2.529 1.00 0.00 H new ATOM 0 HB2 PHE A 540 1.794 14.906 0.366 1.00 0.00 H new ATOM 0 HB3 PHE A 540 2.185 15.760 1.846 1.00 0.00 H new ATOM 0 HD1 PHE A 540 1.129 12.532 0.405 1.00 0.00 H new ATOM 0 HD2 PHE A 540 2.128 14.610 4.032 1.00 0.00 H new ATOM 0 HE1 PHE A 540 1.318 10.367 1.596 1.00 0.00 H new ATOM 0 HE2 PHE A 540 2.318 12.443 5.220 1.00 0.00 H new ATOM 0 HZ PHE A 540 1.908 10.321 4.005 1.00 0.00 H new ATOM 1800 N VAL A 541 -0.094 17.166 -0.304 1.00 0.00 N ATOM 1801 CA VAL A 541 -0.136 18.504 -0.889 1.00 0.00 C ATOM 1802 C VAL A 541 -1.453 19.223 -0.578 1.00 0.00 C ATOM 1803 O VAL A 541 -1.485 20.172 0.205 1.00 0.00 O ATOM 1804 CB VAL A 541 0.047 18.400 -2.405 1.00 0.00 C ATOM 1805 CG1 VAL A 541 -0.138 19.780 -3.049 1.00 0.00 C ATOM 1806 CG2 VAL A 541 1.450 17.873 -2.720 1.00 0.00 C ATOM 0 H VAL A 541 -0.148 16.405 -0.981 1.00 0.00 H new ATOM 0 HA VAL A 541 0.672 19.089 -0.449 1.00 0.00 H new ATOM 0 HB VAL A 541 -0.698 17.713 -2.807 1.00 0.00 H new ATOM 0 HG11 VAL A 541 -0.006 19.699 -4.128 1.00 0.00 H new ATOM 0 HG12 VAL A 541 -1.140 20.151 -2.833 1.00 0.00 H new ATOM 0 HG13 VAL A 541 0.601 20.472 -2.645 1.00 0.00 H new ATOM 0 HG21 VAL A 541 1.577 17.800 -3.800 1.00 0.00 H new ATOM 0 HG22 VAL A 541 2.195 18.556 -2.312 1.00 0.00 H new ATOM 0 HG23 VAL A 541 1.577 16.887 -2.272 1.00 0.00 H new