USER MOD reduce.3.24.130724 H: found=0, std=0, add=688, rem=0, adj=13 USER MOD reduce.3.24.130724 removed 689 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 481 ASN : amide:sc= -1.11 K(o=-1.3,f=-2.4!) USER MOD Set 1.2: A 527 CYS SG : rot 74:sc= -0.183 USER MOD Single : A 459 SER OG : rot 180:sc= 0 USER MOD Single : A 463 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 ASN : amide:sc= -2.33! C(o=-2.3!,f=-3!) USER MOD Single : A 466 MET CE :methyl 154:sc= -0.196 (180deg=-1.16) USER MOD Single : A 470 GLN : amide:sc= 0 X(o=0,f=-0.049) USER MOD Single : A 471 GLN : amide:sc= 0 X(o=0,f=-0.0027) USER MOD Single : A 473 THR OG1 : rot -26:sc= 0.294 USER MOD Single : A 474 CYS SG : rot 59:sc= 0.21 USER MOD Single : A 484 LYS NZ :NH3+ -161:sc= -0.0528 (180deg=-0.57) USER MOD Single : A 486 ASN : amide:sc= -14.4! C(o=-14!,f=-18!) USER MOD Single : A 489 ASN : amide:sc= -5.58! C(o=-5.6!,f=-4!) USER MOD Single : A 490 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 491 GLN : amide:sc= -0.191 K(o=-0.19,f=-0.84) USER MOD Single : A 493 HIS : no HE2:sc= -4.02! C(o=-4!,f=-8.6!) USER MOD Single : A 501 GLN : amide:sc= 0 K(o=0,f=-1.5!) USER MOD Single : A 505 GLN : amide:sc= -1.1 X(o=-1.1,f=-1.4) USER MOD Single : A 512 THR OG1 : rot -30:sc= -0.11 USER MOD Single : A 516 LYS NZ :NH3+ -141:sc= -3.23! (180deg=-3.98!) USER MOD Single : A 518 ASN : amide:sc= -1.6 K(o=-1.6,f=-2.9!) USER MOD Single : A 522 ASN : amide:sc= -2.83! C(o=-2.8!,f=-13!) USER MOD Single : A 525 LYS NZ :NH3+ -125:sc= -1.24 (180deg=-3.4!) USER MOD Single : A 526 ASN : amide:sc= -2.94! C(o=-2.9!,f=-3.9!) USER MOD Single : A 529 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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 : amide:sc= -5.3! C(o=-5.3!,f=-15!) USER MOD ----------------------------------------------------------------- ATOM 385 N ASP A 456 4.723 14.886 11.456 1.00 0.00 N ATOM 386 CA ASP A 456 3.332 15.208 11.166 1.00 0.00 C ATOM 387 C ASP A 456 2.785 14.274 10.094 1.00 0.00 C ATOM 388 O ASP A 456 1.606 13.926 10.106 1.00 0.00 O ATOM 389 CB ASP A 456 3.220 16.660 10.694 1.00 0.00 C ATOM 390 CG ASP A 456 4.122 16.887 9.485 1.00 0.00 C ATOM 391 OD1 ASP A 456 4.834 15.966 9.121 1.00 0.00 O ATOM 392 OD2 ASP A 456 4.092 17.978 8.943 1.00 0.00 O ATOM 0 HA ASP A 456 2.747 15.080 12.077 1.00 0.00 H new ATOM 0 HB2 ASP A 456 2.186 16.888 10.435 1.00 0.00 H new ATOM 0 HB3 ASP A 456 3.503 17.336 11.501 1.00 0.00 H new ATOM 397 N ASP A 457 3.651 13.866 9.175 1.00 0.00 N ATOM 398 CA ASP A 457 3.243 12.973 8.100 1.00 0.00 C ATOM 399 C ASP A 457 2.629 11.705 8.682 1.00 0.00 C ATOM 400 O ASP A 457 1.670 11.169 8.135 1.00 0.00 O ATOM 401 CB ASP A 457 4.454 12.600 7.244 1.00 0.00 C ATOM 402 CG ASP A 457 5.151 13.862 6.747 1.00 0.00 C ATOM 403 OD1 ASP A 457 4.462 14.747 6.267 1.00 0.00 O ATOM 404 OD2 ASP A 457 6.364 13.926 6.855 1.00 0.00 O ATOM 0 H ASP A 457 4.634 14.137 9.153 1.00 0.00 H new ATOM 0 HA ASP A 457 2.504 13.483 7.482 1.00 0.00 H new ATOM 0 HB2 ASP A 457 5.150 11.996 7.827 1.00 0.00 H new ATOM 0 HB3 ASP A 457 4.137 11.992 6.397 1.00 0.00 H new ATOM 409 N LEU A 458 3.187 11.229 9.790 1.00 0.00 N ATOM 410 CA LEU A 458 2.678 10.020 10.419 1.00 0.00 C ATOM 411 C LEU A 458 1.217 10.226 10.813 1.00 0.00 C ATOM 412 O LEU A 458 0.381 9.347 10.615 1.00 0.00 O ATOM 413 CB LEU A 458 3.533 9.685 11.665 1.00 0.00 C ATOM 414 CG LEU A 458 3.498 8.168 11.977 1.00 0.00 C ATOM 415 CD1 LEU A 458 2.049 7.707 12.223 1.00 0.00 C ATOM 416 CD2 LEU A 458 4.124 7.370 10.805 1.00 0.00 C ATOM 0 H LEU A 458 3.982 11.657 10.265 1.00 0.00 H new ATOM 0 HA LEU A 458 2.738 9.187 9.718 1.00 0.00 H new ATOM 0 HB2 LEU A 458 4.563 10.001 11.498 1.00 0.00 H new ATOM 0 HB3 LEU A 458 3.163 10.244 12.524 1.00 0.00 H new ATOM 0 HG LEU A 458 4.080 7.981 12.880 1.00 0.00 H new ATOM 0 HD11 LEU A 458 2.039 6.639 12.441 1.00 0.00 H new ATOM 0 HD12 LEU A 458 1.632 8.254 13.068 1.00 0.00 H new ATOM 0 HD13 LEU A 458 1.449 7.901 11.334 1.00 0.00 H new ATOM 0 HD21 LEU A 458 4.095 6.305 11.034 1.00 0.00 H new ATOM 0 HD22 LEU A 458 3.559 7.561 9.892 1.00 0.00 H new ATOM 0 HD23 LEU A 458 5.159 7.683 10.664 1.00 0.00 H new ATOM 428 N SER A 459 0.911 11.395 11.367 1.00 0.00 N ATOM 429 CA SER A 459 -0.457 11.689 11.771 1.00 0.00 C ATOM 430 C SER A 459 -1.386 11.646 10.563 1.00 0.00 C ATOM 431 O SER A 459 -2.526 11.197 10.662 1.00 0.00 O ATOM 432 CB SER A 459 -0.530 13.067 12.431 1.00 0.00 C ATOM 433 OG SER A 459 0.239 13.055 13.626 1.00 0.00 O ATOM 0 H SER A 459 1.581 12.143 11.544 1.00 0.00 H new ATOM 0 HA SER A 459 -0.775 10.934 12.490 1.00 0.00 H new ATOM 0 HB2 SER A 459 -0.153 13.830 11.750 1.00 0.00 H new ATOM 0 HB3 SER A 459 -1.566 13.322 12.654 1.00 0.00 H new ATOM 0 HG SER A 459 0.196 13.937 14.051 1.00 0.00 H new ATOM 439 N LEU A 460 -0.892 12.116 9.420 1.00 0.00 N ATOM 440 CA LEU A 460 -1.695 12.123 8.199 1.00 0.00 C ATOM 441 C LEU A 460 -2.073 10.694 7.792 1.00 0.00 C ATOM 442 O LEU A 460 -3.208 10.440 7.390 1.00 0.00 O ATOM 443 CB LEU A 460 -0.914 12.820 7.057 1.00 0.00 C ATOM 444 CG LEU A 460 -1.196 14.333 7.046 1.00 0.00 C ATOM 445 CD1 LEU A 460 -0.687 14.982 8.334 1.00 0.00 C ATOM 446 CD2 LEU A 460 -0.502 14.979 5.841 1.00 0.00 C ATOM 0 H LEU A 460 0.050 12.493 9.313 1.00 0.00 H new ATOM 0 HA LEU A 460 -2.614 12.677 8.389 1.00 0.00 H new ATOM 0 HB2 LEU A 460 0.155 12.646 7.182 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.198 12.386 6.098 1.00 0.00 H new ATOM 0 HG LEU A 460 -2.273 14.486 6.976 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -0.895 16.052 8.309 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -1.191 14.534 9.191 1.00 0.00 H new ATOM 0 HD13 LEU A 460 0.388 14.823 8.421 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -0.704 16.050 5.836 1.00 0.00 H new ATOM 0 HD22 LEU A 460 0.573 14.812 5.908 1.00 0.00 H new ATOM 0 HD23 LEU A 460 -0.881 14.534 4.921 1.00 0.00 H new ATOM 458 N ILE A 461 -1.121 9.771 7.895 1.00 0.00 N ATOM 459 CA ILE A 461 -1.379 8.379 7.530 1.00 0.00 C ATOM 460 C ILE A 461 -2.402 7.760 8.479 1.00 0.00 C ATOM 461 O ILE A 461 -3.334 7.082 8.046 1.00 0.00 O ATOM 462 CB ILE A 461 -0.074 7.572 7.579 1.00 0.00 C ATOM 463 CG1 ILE A 461 0.976 8.242 6.690 1.00 0.00 C ATOM 464 CG2 ILE A 461 -0.329 6.157 7.060 1.00 0.00 C ATOM 465 CD1 ILE A 461 2.346 7.594 6.931 1.00 0.00 C ATOM 0 H ILE A 461 -0.174 9.957 8.224 1.00 0.00 H new ATOM 0 HA ILE A 461 -1.779 8.355 6.516 1.00 0.00 H new ATOM 0 HB ILE A 461 0.283 7.531 8.608 1.00 0.00 H new ATOM 0 HG12 ILE A 461 0.695 8.143 5.641 1.00 0.00 H new ATOM 0 HG13 ILE A 461 1.024 9.309 6.908 1.00 0.00 H new ATOM 0 HG21 ILE A 461 0.598 5.584 7.095 1.00 0.00 H new ATOM 0 HG22 ILE A 461 -1.080 5.671 7.683 1.00 0.00 H new ATOM 0 HG23 ILE A 461 -0.687 6.206 6.032 1.00 0.00 H new ATOM 0 HD11 ILE A 461 3.092 8.073 6.297 1.00 0.00 H new ATOM 0 HD12 ILE A 461 2.627 7.716 7.977 1.00 0.00 H new ATOM 0 HD13 ILE A 461 2.294 6.532 6.691 1.00 0.00 H new ATOM 477 N ARG A 462 -2.216 7.999 9.775 1.00 0.00 N ATOM 478 CA ARG A 462 -3.122 7.456 10.783 1.00 0.00 C ATOM 479 C ARG A 462 -4.540 7.996 10.595 1.00 0.00 C ATOM 480 O ARG A 462 -5.509 7.245 10.663 1.00 0.00 O ATOM 481 CB ARG A 462 -2.612 7.817 12.181 1.00 0.00 C ATOM 482 CG ARG A 462 -3.501 7.159 13.240 1.00 0.00 C ATOM 483 CD ARG A 462 -2.956 7.474 14.634 1.00 0.00 C ATOM 484 NE ARG A 462 -1.667 6.823 14.832 1.00 0.00 N ATOM 485 CZ ARG A 462 -0.982 6.982 15.959 1.00 0.00 C ATOM 486 NH1 ARG A 462 -1.453 7.746 16.906 1.00 0.00 N ATOM 487 NH2 ARG A 462 0.163 6.378 16.117 1.00 0.00 N ATOM 0 H ARG A 462 -1.452 8.561 10.150 1.00 0.00 H new ATOM 0 HA ARG A 462 -3.151 6.372 10.671 1.00 0.00 H new ATOM 0 HB2 ARG A 462 -1.581 7.484 12.300 1.00 0.00 H new ATOM 0 HB3 ARG A 462 -2.614 8.899 12.311 1.00 0.00 H new ATOM 0 HG2 ARG A 462 -4.524 7.523 13.148 1.00 0.00 H new ATOM 0 HG3 ARG A 462 -3.531 6.080 13.085 1.00 0.00 H new ATOM 0 HD2 ARG A 462 -2.849 8.552 14.755 1.00 0.00 H new ATOM 0 HD3 ARG A 462 -3.662 7.136 15.393 1.00 0.00 H new ATOM 0 HE ARG A 462 -1.284 6.235 14.092 1.00 0.00 H new ATOM 0 HH11 ARG A 462 -2.347 8.221 16.781 1.00 0.00 H new ATOM 0 HH12 ARG A 462 -0.927 7.868 17.771 1.00 0.00 H new ATOM 0 HH21 ARG A 462 0.533 5.783 15.375 1.00 0.00 H new ATOM 0 HH22 ARG A 462 0.689 6.500 16.982 1.00 0.00 H new ATOM 501 N LYS A 463 -4.657 9.298 10.354 1.00 0.00 N ATOM 502 CA LYS A 463 -5.967 9.916 10.150 1.00 0.00 C ATOM 503 C LYS A 463 -6.628 9.389 8.879 1.00 0.00 C ATOM 504 O LYS A 463 -7.840 9.180 8.837 1.00 0.00 O ATOM 505 CB LYS A 463 -5.819 11.438 10.062 1.00 0.00 C ATOM 506 CG LYS A 463 -5.448 11.999 11.437 1.00 0.00 C ATOM 507 CD LYS A 463 -5.235 13.510 11.328 1.00 0.00 C ATOM 508 CE LYS A 463 -4.867 14.073 12.702 1.00 0.00 C ATOM 509 NZ LYS A 463 -4.678 15.549 12.601 1.00 0.00 N ATOM 0 H LYS A 463 -3.869 9.943 10.295 1.00 0.00 H new ATOM 0 HA LYS A 463 -6.600 9.660 11.000 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -5.051 11.697 9.333 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.751 11.885 9.715 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -6.239 11.783 12.156 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -4.542 11.518 11.806 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -4.443 13.726 10.611 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -6.141 13.990 10.957 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -5.652 13.845 13.422 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -3.954 13.603 13.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -4.428 15.932 13.535 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -3.914 15.756 11.926 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -5.560 15.990 12.271 1.00 0.00 H new ATOM 523 N ASN A 464 -5.820 9.182 7.845 1.00 0.00 N ATOM 524 CA ASN A 464 -6.328 8.685 6.568 1.00 0.00 C ATOM 525 C ASN A 464 -6.342 7.161 6.545 1.00 0.00 C ATOM 526 O ASN A 464 -6.596 6.550 5.508 1.00 0.00 O ATOM 527 CB ASN A 464 -5.449 9.203 5.429 1.00 0.00 C ATOM 528 CG ASN A 464 -5.668 10.700 5.244 1.00 0.00 C ATOM 529 OD1 ASN A 464 -6.676 11.241 5.700 1.00 0.00 O ATOM 530 ND2 ASN A 464 -4.779 11.407 4.601 1.00 0.00 N ATOM 0 H ASN A 464 -4.814 9.349 7.864 1.00 0.00 H new ATOM 0 HA ASN A 464 -7.349 9.044 6.441 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -4.400 9.005 5.649 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -5.687 8.675 4.506 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -4.918 12.410 4.475 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -3.945 10.957 4.224 1.00 0.00 H new ATOM 537 N ARG A 465 -6.070 6.549 7.692 1.00 0.00 N ATOM 538 CA ARG A 465 -6.062 5.093 7.770 1.00 0.00 C ATOM 539 C ARG A 465 -7.442 4.535 7.431 1.00 0.00 C ATOM 540 O ARG A 465 -7.561 3.565 6.681 1.00 0.00 O ATOM 541 CB ARG A 465 -5.631 4.636 9.177 1.00 0.00 C ATOM 542 CG ARG A 465 -6.795 4.761 10.176 1.00 0.00 C ATOM 543 CD ARG A 465 -6.301 4.486 11.597 1.00 0.00 C ATOM 544 NE ARG A 465 -7.421 4.534 12.531 1.00 0.00 N ATOM 545 CZ ARG A 465 -7.254 4.253 13.819 1.00 0.00 C ATOM 546 NH1 ARG A 465 -6.069 3.945 14.271 1.00 0.00 N ATOM 547 NH2 ARG A 465 -8.274 4.285 14.632 1.00 0.00 N ATOM 0 H ARG A 465 -5.856 7.028 8.567 1.00 0.00 H new ATOM 0 HA ARG A 465 -5.345 4.710 7.044 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -5.289 3.602 9.139 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -4.788 5.238 9.517 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -7.227 5.760 10.120 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -7.585 4.057 9.915 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -5.821 3.508 11.641 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -5.549 5.223 11.879 1.00 0.00 H new ATOM 0 HE ARG A 465 -8.348 4.788 12.189 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -5.271 3.920 13.636 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -5.940 3.729 15.260 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -9.200 4.526 14.279 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -8.145 4.069 15.621 1.00 0.00 H new ATOM 561 N MET A 466 -8.482 5.147 7.998 1.00 0.00 N ATOM 562 CA MET A 466 -9.848 4.690 7.755 1.00 0.00 C ATOM 563 C MET A 466 -10.229 4.867 6.290 1.00 0.00 C ATOM 564 O MET A 466 -10.867 3.996 5.697 1.00 0.00 O ATOM 565 CB MET A 466 -10.830 5.473 8.629 1.00 0.00 C ATOM 566 CG MET A 466 -10.727 5.005 10.082 1.00 0.00 C ATOM 567 SD MET A 466 -11.834 6.002 11.113 1.00 0.00 S ATOM 568 CE MET A 466 -13.400 5.415 10.417 1.00 0.00 C ATOM 0 H MET A 466 -8.406 5.951 8.621 1.00 0.00 H new ATOM 0 HA MET A 466 -9.897 3.631 8.007 1.00 0.00 H new ATOM 0 HB2 MET A 466 -10.615 6.540 8.566 1.00 0.00 H new ATOM 0 HB3 MET A 466 -11.847 5.331 8.264 1.00 0.00 H new ATOM 0 HG2 MET A 466 -10.994 3.951 10.156 1.00 0.00 H new ATOM 0 HG3 MET A 466 -9.700 5.099 10.434 1.00 0.00 H new ATOM 0 HE1 MET A 466 -14.190 5.519 11.160 1.00 0.00 H new ATOM 0 HE2 MET A 466 -13.651 6.006 9.536 1.00 0.00 H new ATOM 0 HE3 MET A 466 -13.303 4.367 10.135 1.00 0.00 H new ATOM 578 N ALA A 467 -9.841 5.999 5.708 1.00 0.00 N ATOM 579 CA ALA A 467 -10.159 6.267 4.314 1.00 0.00 C ATOM 580 C ALA A 467 -9.558 5.187 3.429 1.00 0.00 C ATOM 581 O ALA A 467 -10.221 4.667 2.536 1.00 0.00 O ATOM 582 CB ALA A 467 -9.606 7.632 3.901 1.00 0.00 C ATOM 0 H ALA A 467 -9.312 6.735 6.176 1.00 0.00 H new ATOM 0 HA ALA A 467 -11.243 6.270 4.196 1.00 0.00 H new ATOM 0 HB1 ALA A 467 -9.850 7.822 2.856 1.00 0.00 H new ATOM 0 HB2 ALA A 467 -10.050 8.408 4.524 1.00 0.00 H new ATOM 0 HB3 ALA A 467 -8.523 7.640 4.028 1.00 0.00 H new ATOM 588 N LEU A 468 -8.298 4.852 3.686 1.00 0.00 N ATOM 589 CA LEU A 468 -7.621 3.826 2.906 1.00 0.00 C ATOM 590 C LEU A 468 -8.327 2.488 3.085 1.00 0.00 C ATOM 591 O LEU A 468 -8.567 1.770 2.115 1.00 0.00 O ATOM 592 CB LEU A 468 -6.166 3.712 3.368 1.00 0.00 C ATOM 593 CG LEU A 468 -5.390 4.988 2.994 1.00 0.00 C ATOM 594 CD1 LEU A 468 -4.062 5.009 3.753 1.00 0.00 C ATOM 595 CD2 LEU A 468 -5.106 5.023 1.479 1.00 0.00 C ATOM 0 H LEU A 468 -7.730 5.272 4.422 1.00 0.00 H new ATOM 0 HA LEU A 468 -7.645 4.100 1.851 1.00 0.00 H new ATOM 0 HB2 LEU A 468 -6.130 3.558 4.446 1.00 0.00 H new ATOM 0 HB3 LEU A 468 -5.697 2.843 2.906 1.00 0.00 H new ATOM 0 HG LEU A 468 -5.991 5.857 3.261 1.00 0.00 H new ATOM 0 HD11 LEU A 468 -3.508 5.911 3.492 1.00 0.00 H new ATOM 0 HD12 LEU A 468 -4.256 5.000 4.826 1.00 0.00 H new ATOM 0 HD13 LEU A 468 -3.475 4.131 3.483 1.00 0.00 H new ATOM 0 HD21 LEU A 468 -4.557 5.932 1.233 1.00 0.00 H new ATOM 0 HD22 LEU A 468 -4.512 4.153 1.200 1.00 0.00 H new ATOM 0 HD23 LEU A 468 -6.049 5.009 0.932 1.00 0.00 H new ATOM 607 N PHE A 469 -8.674 2.166 4.329 1.00 0.00 N ATOM 608 CA PHE A 469 -9.371 0.919 4.613 1.00 0.00 C ATOM 609 C PHE A 469 -10.729 0.911 3.919 1.00 0.00 C ATOM 610 O PHE A 469 -11.104 -0.067 3.272 1.00 0.00 O ATOM 611 CB PHE A 469 -9.546 0.752 6.127 1.00 0.00 C ATOM 612 CG PHE A 469 -10.434 -0.438 6.414 1.00 0.00 C ATOM 613 CD1 PHE A 469 -9.950 -1.737 6.231 1.00 0.00 C ATOM 614 CD2 PHE A 469 -11.747 -0.237 6.863 1.00 0.00 C ATOM 615 CE1 PHE A 469 -10.777 -2.836 6.494 1.00 0.00 C ATOM 616 CE2 PHE A 469 -12.573 -1.334 7.125 1.00 0.00 C ATOM 617 CZ PHE A 469 -12.088 -2.635 6.942 1.00 0.00 C ATOM 0 H PHE A 469 -8.486 2.746 5.147 1.00 0.00 H new ATOM 0 HA PHE A 469 -8.780 0.085 4.234 1.00 0.00 H new ATOM 0 HB2 PHE A 469 -8.574 0.614 6.601 1.00 0.00 H new ATOM 0 HB3 PHE A 469 -9.984 1.655 6.553 1.00 0.00 H new ATOM 0 HD1 PHE A 469 -8.938 -1.893 5.887 1.00 0.00 H new ATOM 0 HD2 PHE A 469 -12.121 0.766 7.007 1.00 0.00 H new ATOM 0 HE1 PHE A 469 -10.403 -3.839 6.351 1.00 0.00 H new ATOM 0 HE2 PHE A 469 -13.585 -1.178 7.468 1.00 0.00 H new ATOM 0 HZ PHE A 469 -12.725 -3.483 7.146 1.00 0.00 H new ATOM 627 N GLN A 470 -11.459 2.012 4.065 1.00 0.00 N ATOM 628 CA GLN A 470 -12.778 2.139 3.457 1.00 0.00 C ATOM 629 C GLN A 470 -12.665 2.211 1.939 1.00 0.00 C ATOM 630 O GLN A 470 -13.501 1.668 1.217 1.00 0.00 O ATOM 631 CB GLN A 470 -13.469 3.401 3.983 1.00 0.00 C ATOM 632 CG GLN A 470 -14.868 3.525 3.373 1.00 0.00 C ATOM 633 CD GLN A 470 -15.572 4.751 3.941 1.00 0.00 C ATOM 634 OE1 GLN A 470 -15.706 4.886 5.157 1.00 0.00 O ATOM 635 NE2 GLN A 470 -16.022 5.666 3.127 1.00 0.00 N ATOM 0 H GLN A 470 -11.160 2.828 4.599 1.00 0.00 H new ATOM 0 HA GLN A 470 -13.369 1.262 3.721 1.00 0.00 H new ATOM 0 HB2 GLN A 470 -13.540 3.361 5.070 1.00 0.00 H new ATOM 0 HB3 GLN A 470 -12.876 4.281 3.734 1.00 0.00 H new ATOM 0 HG2 GLN A 470 -14.796 3.606 2.288 1.00 0.00 H new ATOM 0 HG3 GLN A 470 -15.449 2.628 3.588 1.00 0.00 H new ATOM 0 HE21 GLN A 470 -15.910 5.552 2.120 1.00 0.00 H new ATOM 0 HE22 GLN A 470 -16.486 6.495 3.498 1.00 0.00 H new ATOM 644 N GLN A 471 -11.635 2.905 1.459 1.00 0.00 N ATOM 645 CA GLN A 471 -11.420 3.074 0.021 1.00 0.00 C ATOM 646 C GLN A 471 -10.176 2.319 -0.432 1.00 0.00 C ATOM 647 O GLN A 471 -9.236 2.913 -0.960 1.00 0.00 O ATOM 648 CB GLN A 471 -11.255 4.564 -0.293 1.00 0.00 C ATOM 649 CG GLN A 471 -12.503 5.338 0.171 1.00 0.00 C ATOM 650 CD GLN A 471 -12.152 6.803 0.425 1.00 0.00 C ATOM 651 OE1 GLN A 471 -11.556 7.459 -0.428 1.00 0.00 O ATOM 652 NE2 GLN A 471 -12.486 7.350 1.563 1.00 0.00 N ATOM 0 H GLN A 471 -10.935 3.360 2.045 1.00 0.00 H new ATOM 0 HA GLN A 471 -12.282 2.672 -0.512 1.00 0.00 H new ATOM 0 HB2 GLN A 471 -10.368 4.954 0.206 1.00 0.00 H new ATOM 0 HB3 GLN A 471 -11.106 4.705 -1.364 1.00 0.00 H new ATOM 0 HG2 GLN A 471 -13.284 5.270 -0.586 1.00 0.00 H new ATOM 0 HG3 GLN A 471 -12.901 4.889 1.081 1.00 0.00 H new ATOM 0 HE21 GLN A 471 -12.980 6.802 2.267 1.00 0.00 H new ATOM 0 HE22 GLN A 471 -12.253 8.326 1.748 1.00 0.00 H new ATOM 661 N LEU A 472 -10.180 1.006 -0.224 1.00 0.00 N ATOM 662 CA LEU A 472 -9.050 0.172 -0.616 1.00 0.00 C ATOM 663 C LEU A 472 -9.152 -0.199 -2.093 1.00 0.00 C ATOM 664 O LEU A 472 -10.245 -0.436 -2.607 1.00 0.00 O ATOM 665 CB LEU A 472 -9.025 -1.102 0.241 1.00 0.00 C ATOM 666 CG LEU A 472 -10.249 -2.006 -0.093 1.00 0.00 C ATOM 667 CD1 LEU A 472 -9.826 -3.155 -1.022 1.00 0.00 C ATOM 668 CD2 LEU A 472 -10.837 -2.599 1.196 1.00 0.00 C ATOM 0 H LEU A 472 -10.950 0.499 0.212 1.00 0.00 H new ATOM 0 HA LEU A 472 -8.128 0.731 -0.459 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.100 -1.650 0.062 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -9.038 -0.837 1.298 1.00 0.00 H new ATOM 0 HG LEU A 472 -11.000 -1.393 -0.591 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -10.691 -3.778 -1.247 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -9.424 -2.745 -1.948 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -9.062 -3.758 -0.531 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -11.692 -3.229 0.950 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -10.078 -3.198 1.700 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -11.159 -1.792 1.854 1.00 0.00 H new ATOM 680 N THR A 473 -8.009 -0.251 -2.769 1.00 0.00 N ATOM 681 CA THR A 473 -7.983 -0.599 -4.188 1.00 0.00 C ATOM 682 C THR A 473 -6.603 -1.107 -4.592 1.00 0.00 C ATOM 683 O THR A 473 -6.474 -2.165 -5.209 1.00 0.00 O ATOM 684 CB THR A 473 -8.342 0.626 -5.031 1.00 0.00 C ATOM 685 OG1 THR A 473 -9.551 1.195 -4.549 1.00 0.00 O ATOM 686 CG2 THR A 473 -8.515 0.213 -6.495 1.00 0.00 C ATOM 0 H THR A 473 -7.094 -0.058 -2.362 1.00 0.00 H new ATOM 0 HA THR A 473 -8.713 -1.389 -4.362 1.00 0.00 H new ATOM 0 HB THR A 473 -7.541 1.362 -4.959 1.00 0.00 H new ATOM 0 HG1 THR A 473 -10.087 0.502 -4.110 1.00 0.00 H new ATOM 0 HG21 THR A 473 -8.771 1.088 -7.092 1.00 0.00 H new ATOM 0 HG22 THR A 473 -7.584 -0.219 -6.864 1.00 0.00 H new ATOM 0 HG23 THR A 473 -9.313 -0.525 -6.573 1.00 0.00 H new ATOM 694 N CYS A 474 -5.573 -0.336 -4.246 1.00 0.00 N ATOM 695 CA CYS A 474 -4.195 -0.696 -4.577 1.00 0.00 C ATOM 696 C CYS A 474 -3.529 -1.385 -3.390 1.00 0.00 C ATOM 697 O CYS A 474 -2.629 -0.827 -2.760 1.00 0.00 O ATOM 698 CB CYS A 474 -3.414 0.571 -4.947 1.00 0.00 C ATOM 699 SG CYS A 474 -3.917 1.924 -3.854 1.00 0.00 S ATOM 0 H CYS A 474 -5.667 0.542 -3.736 1.00 0.00 H new ATOM 0 HA CYS A 474 -4.199 -1.384 -5.423 1.00 0.00 H new ATOM 0 HB2 CYS A 474 -2.343 0.392 -4.854 1.00 0.00 H new ATOM 0 HB3 CYS A 474 -3.603 0.838 -5.987 1.00 0.00 H new ATOM 0 HG CYS A 474 -3.678 1.596 -2.619 1.00 0.00 H new ATOM 705 N VAL A 475 -3.971 -2.603 -3.095 1.00 0.00 N ATOM 706 CA VAL A 475 -3.410 -3.374 -1.987 1.00 0.00 C ATOM 707 C VAL A 475 -2.367 -4.367 -2.493 1.00 0.00 C ATOM 708 O VAL A 475 -1.399 -4.671 -1.796 1.00 0.00 O ATOM 709 CB VAL A 475 -4.530 -4.112 -1.249 1.00 0.00 C ATOM 710 CG1 VAL A 475 -3.942 -4.895 -0.075 1.00 0.00 C ATOM 711 CG2 VAL A 475 -5.536 -3.089 -0.716 1.00 0.00 C ATOM 0 H VAL A 475 -4.715 -3.079 -3.606 1.00 0.00 H new ATOM 0 HA VAL A 475 -2.919 -2.687 -1.297 1.00 0.00 H new ATOM 0 HB VAL A 475 -5.025 -4.801 -1.933 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -4.741 -5.420 0.449 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -3.216 -5.618 -0.447 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -3.449 -4.206 0.611 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -6.337 -3.607 -0.189 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -5.033 -2.407 -0.031 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -5.956 -2.524 -1.548 1.00 0.00 H new ATOM 721 N LEU A 476 -2.551 -4.866 -3.710 1.00 0.00 N ATOM 722 CA LEU A 476 -1.587 -5.809 -4.268 1.00 0.00 C ATOM 723 C LEU A 476 -0.251 -5.101 -4.558 1.00 0.00 C ATOM 724 O LEU A 476 0.762 -5.468 -3.961 1.00 0.00 O ATOM 725 CB LEU A 476 -2.173 -6.537 -5.495 1.00 0.00 C ATOM 726 CG LEU A 476 -3.641 -6.883 -5.200 1.00 0.00 C ATOM 727 CD1 LEU A 476 -4.222 -7.777 -6.299 1.00 0.00 C ATOM 728 CD2 LEU A 476 -3.736 -7.622 -3.857 1.00 0.00 C ATOM 0 H LEU A 476 -3.339 -4.641 -4.318 1.00 0.00 H new ATOM 0 HA LEU A 476 -1.376 -6.585 -3.532 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -2.103 -5.905 -6.380 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -1.605 -7.443 -5.705 1.00 0.00 H new ATOM 0 HG LEU A 476 -4.210 -5.954 -5.161 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -5.262 -8.008 -6.068 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -4.170 -7.258 -7.256 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -3.649 -8.702 -6.356 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -4.778 -7.867 -3.649 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -3.150 -8.540 -3.905 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -3.348 -6.985 -3.063 1.00 0.00 H new ATOM 740 N PRO A 477 -0.215 -4.078 -5.401 1.00 0.00 N ATOM 741 CA PRO A 477 1.045 -3.298 -5.694 1.00 0.00 C ATOM 742 C PRO A 477 1.779 -2.805 -4.437 1.00 0.00 C ATOM 743 O PRO A 477 3.004 -2.875 -4.346 1.00 0.00 O ATOM 744 CB PRO A 477 0.518 -2.057 -6.478 1.00 0.00 C ATOM 745 CG PRO A 477 -0.958 -2.059 -6.247 1.00 0.00 C ATOM 746 CD PRO A 477 -1.320 -3.520 -6.197 1.00 0.00 C ATOM 0 HA PRO A 477 1.766 -3.921 -6.223 1.00 0.00 H new ATOM 0 HB2 PRO A 477 0.974 -1.136 -6.114 1.00 0.00 H new ATOM 0 HB3 PRO A 477 0.752 -2.131 -7.540 1.00 0.00 H new ATOM 0 HG2 PRO A 477 -1.217 -1.552 -5.317 1.00 0.00 H new ATOM 0 HG3 PRO A 477 -1.488 -1.544 -7.049 1.00 0.00 H new ATOM 0 HD2 PRO A 477 -2.288 -3.685 -5.724 1.00 0.00 H new ATOM 0 HD3 PRO A 477 -1.371 -3.963 -7.192 1.00 0.00 H new ATOM 754 N ILE A 478 1.016 -2.220 -3.522 1.00 0.00 N ATOM 755 CA ILE A 478 1.590 -1.629 -2.317 1.00 0.00 C ATOM 756 C ILE A 478 2.135 -2.718 -1.388 1.00 0.00 C ATOM 757 O ILE A 478 3.211 -2.575 -0.811 1.00 0.00 O ATOM 758 CB ILE A 478 0.508 -0.755 -1.609 1.00 0.00 C ATOM 759 CG1 ILE A 478 1.171 0.431 -0.867 1.00 0.00 C ATOM 760 CG2 ILE A 478 -0.295 -1.600 -0.602 1.00 0.00 C ATOM 761 CD1 ILE A 478 2.259 -0.076 0.085 1.00 0.00 C ATOM 0 H ILE A 478 0.001 -2.142 -3.590 1.00 0.00 H new ATOM 0 HA ILE A 478 2.430 -0.990 -2.587 1.00 0.00 H new ATOM 0 HB ILE A 478 -0.167 -0.370 -2.373 1.00 0.00 H new ATOM 0 HG12 ILE A 478 1.604 1.123 -1.589 1.00 0.00 H new ATOM 0 HG13 ILE A 478 0.418 0.985 -0.307 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -1.045 -0.974 -0.118 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -0.789 -2.418 -1.126 1.00 0.00 H new ATOM 0 HG23 ILE A 478 0.380 -2.006 0.152 1.00 0.00 H new ATOM 0 HD11 ILE A 478 2.716 0.770 0.599 1.00 0.00 H new ATOM 0 HD12 ILE A 478 1.816 -0.750 0.818 1.00 0.00 H new ATOM 0 HD13 ILE A 478 3.021 -0.609 -0.484 1.00 0.00 H new ATOM 773 N LEU A 479 1.392 -3.808 -1.255 1.00 0.00 N ATOM 774 CA LEU A 479 1.824 -4.902 -0.404 1.00 0.00 C ATOM 775 C LEU A 479 3.106 -5.494 -0.968 1.00 0.00 C ATOM 776 O LEU A 479 4.021 -5.853 -0.225 1.00 0.00 O ATOM 777 CB LEU A 479 0.734 -5.978 -0.325 1.00 0.00 C ATOM 778 CG LEU A 479 1.191 -7.145 0.561 1.00 0.00 C ATOM 779 CD1 LEU A 479 1.479 -6.656 1.991 1.00 0.00 C ATOM 780 CD2 LEU A 479 0.079 -8.201 0.596 1.00 0.00 C ATOM 0 H LEU A 479 0.497 -3.956 -1.721 1.00 0.00 H new ATOM 0 HA LEU A 479 2.008 -4.527 0.603 1.00 0.00 H new ATOM 0 HB2 LEU A 479 -0.183 -5.546 0.077 1.00 0.00 H new ATOM 0 HB3 LEU A 479 0.502 -6.343 -1.326 1.00 0.00 H new ATOM 0 HG LEU A 479 2.106 -7.572 0.150 1.00 0.00 H new ATOM 0 HD11 LEU A 479 1.802 -7.497 2.605 1.00 0.00 H new ATOM 0 HD12 LEU A 479 2.266 -5.902 1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 479 0.574 -6.222 2.416 1.00 0.00 H new ATOM 0 HD21 LEU A 479 0.391 -9.037 1.223 1.00 0.00 H new ATOM 0 HD22 LEU A 479 -0.829 -7.759 1.006 1.00 0.00 H new ATOM 0 HD23 LEU A 479 -0.115 -8.558 -0.415 1.00 0.00 H new ATOM 792 N ASP A 480 3.160 -5.599 -2.291 1.00 0.00 N ATOM 793 CA ASP A 480 4.331 -6.153 -2.950 1.00 0.00 C ATOM 794 C ASP A 480 5.562 -5.306 -2.652 1.00 0.00 C ATOM 795 O ASP A 480 6.663 -5.835 -2.499 1.00 0.00 O ATOM 796 CB ASP A 480 4.118 -6.210 -4.465 1.00 0.00 C ATOM 797 CG ASP A 480 5.328 -6.864 -5.126 1.00 0.00 C ATOM 798 OD1 ASP A 480 5.569 -8.028 -4.852 1.00 0.00 O ATOM 799 OD2 ASP A 480 5.995 -6.191 -5.894 1.00 0.00 O ATOM 0 H ASP A 480 2.412 -5.310 -2.922 1.00 0.00 H new ATOM 0 HA ASP A 480 4.485 -7.162 -2.568 1.00 0.00 H new ATOM 0 HB2 ASP A 480 3.215 -6.776 -4.695 1.00 0.00 H new ATOM 0 HB3 ASP A 480 3.974 -5.205 -4.861 1.00 0.00 H new ATOM 804 N ASN A 481 5.373 -3.989 -2.583 1.00 0.00 N ATOM 805 CA ASN A 481 6.487 -3.085 -2.317 1.00 0.00 C ATOM 806 C ASN A 481 7.109 -3.381 -0.959 1.00 0.00 C ATOM 807 O ASN A 481 8.331 -3.473 -0.839 1.00 0.00 O ATOM 808 CB ASN A 481 5.997 -1.636 -2.344 1.00 0.00 C ATOM 809 CG ASN A 481 5.669 -1.218 -3.774 1.00 0.00 C ATOM 810 OD1 ASN A 481 6.108 -1.862 -4.727 1.00 0.00 O ATOM 811 ND2 ASN A 481 4.917 -0.173 -3.979 1.00 0.00 N ATOM 0 H ASN A 481 4.470 -3.530 -2.706 1.00 0.00 H new ATOM 0 HA ASN A 481 7.241 -3.234 -3.090 1.00 0.00 H new ATOM 0 HB2 ASN A 481 5.113 -1.531 -1.715 1.00 0.00 H new ATOM 0 HB3 ASN A 481 6.762 -0.978 -1.931 1.00 0.00 H new ATOM 0 HD21 ASN A 481 4.691 0.113 -4.931 1.00 0.00 H new ATOM 0 HD22 ASN A 481 4.555 0.358 -3.187 1.00 0.00 H new ATOM 818 N LEU A 482 6.267 -3.533 0.060 1.00 0.00 N ATOM 819 CA LEU A 482 6.760 -3.826 1.404 1.00 0.00 C ATOM 820 C LEU A 482 7.422 -5.202 1.435 1.00 0.00 C ATOM 821 O LEU A 482 8.439 -5.395 2.095 1.00 0.00 O ATOM 822 CB LEU A 482 5.609 -3.784 2.428 1.00 0.00 C ATOM 823 CG LEU A 482 5.315 -2.337 2.862 1.00 0.00 C ATOM 824 CD1 LEU A 482 4.572 -1.599 1.745 1.00 0.00 C ATOM 825 CD2 LEU A 482 4.446 -2.355 4.126 1.00 0.00 C ATOM 0 H LEU A 482 5.253 -3.459 -0.016 1.00 0.00 H new ATOM 0 HA LEU A 482 7.495 -3.066 1.669 1.00 0.00 H new ATOM 0 HB2 LEU A 482 4.713 -4.227 1.993 1.00 0.00 H new ATOM 0 HB3 LEU A 482 5.870 -4.384 3.300 1.00 0.00 H new ATOM 0 HG LEU A 482 6.255 -1.824 3.067 1.00 0.00 H new ATOM 0 HD11 LEU A 482 4.367 -0.575 2.059 1.00 0.00 H new ATOM 0 HD12 LEU A 482 5.187 -1.586 0.845 1.00 0.00 H new ATOM 0 HD13 LEU A 482 3.632 -2.109 1.535 1.00 0.00 H new ATOM 0 HD21 LEU A 482 4.235 -1.332 4.437 1.00 0.00 H new ATOM 0 HD22 LEU A 482 3.509 -2.871 3.916 1.00 0.00 H new ATOM 0 HD23 LEU A 482 4.976 -2.875 4.924 1.00 0.00 H new ATOM 837 N LEU A 483 6.825 -6.152 0.724 1.00 0.00 N ATOM 838 CA LEU A 483 7.347 -7.515 0.701 1.00 0.00 C ATOM 839 C LEU A 483 8.841 -7.494 0.359 1.00 0.00 C ATOM 840 O LEU A 483 9.625 -8.269 0.905 1.00 0.00 O ATOM 841 CB LEU A 483 6.571 -8.363 -0.339 1.00 0.00 C ATOM 842 CG LEU A 483 6.515 -9.839 0.108 1.00 0.00 C ATOM 843 CD1 LEU A 483 5.783 -10.677 -0.945 1.00 0.00 C ATOM 844 CD2 LEU A 483 7.940 -10.385 0.299 1.00 0.00 C ATOM 0 H LEU A 483 5.987 -6.007 0.161 1.00 0.00 H new ATOM 0 HA LEU A 483 7.216 -7.964 1.686 1.00 0.00 H new ATOM 0 HB2 LEU A 483 5.560 -7.973 -0.455 1.00 0.00 H new ATOM 0 HB3 LEU A 483 7.055 -8.289 -1.313 1.00 0.00 H new ATOM 0 HG LEU A 483 5.977 -9.899 1.054 1.00 0.00 H new ATOM 0 HD11 LEU A 483 5.748 -11.717 -0.622 1.00 0.00 H new ATOM 0 HD12 LEU A 483 4.767 -10.301 -1.068 1.00 0.00 H new ATOM 0 HD13 LEU A 483 6.312 -10.610 -1.896 1.00 0.00 H new ATOM 0 HD21 LEU A 483 7.891 -11.427 0.614 1.00 0.00 H new ATOM 0 HD22 LEU A 483 8.485 -10.316 -0.642 1.00 0.00 H new ATOM 0 HD23 LEU A 483 8.455 -9.799 1.060 1.00 0.00 H new ATOM 856 N LYS A 484 9.227 -6.607 -0.548 1.00 0.00 N ATOM 857 CA LYS A 484 10.624 -6.507 -0.952 1.00 0.00 C ATOM 858 C LYS A 484 11.511 -6.240 0.261 1.00 0.00 C ATOM 859 O LYS A 484 12.607 -6.789 0.370 1.00 0.00 O ATOM 860 CB LYS A 484 10.789 -5.378 -1.971 1.00 0.00 C ATOM 861 CG LYS A 484 12.227 -5.364 -2.492 1.00 0.00 C ATOM 862 CD LYS A 484 12.375 -4.274 -3.555 1.00 0.00 C ATOM 863 CE LYS A 484 13.804 -4.281 -4.100 1.00 0.00 C ATOM 864 NZ LYS A 484 14.759 -3.984 -2.994 1.00 0.00 N ATOM 0 H LYS A 484 8.600 -5.952 -1.015 1.00 0.00 H new ATOM 0 HA LYS A 484 10.925 -7.451 -1.406 1.00 0.00 H new ATOM 0 HB2 LYS A 484 10.093 -5.516 -2.798 1.00 0.00 H new ATOM 0 HB3 LYS A 484 10.549 -4.420 -1.510 1.00 0.00 H new ATOM 0 HG2 LYS A 484 12.921 -5.182 -1.671 1.00 0.00 H new ATOM 0 HG3 LYS A 484 12.481 -6.336 -2.915 1.00 0.00 H new ATOM 0 HD2 LYS A 484 11.665 -4.443 -4.365 1.00 0.00 H new ATOM 0 HD3 LYS A 484 12.143 -3.299 -3.126 1.00 0.00 H new ATOM 0 HE2 LYS A 484 14.032 -5.252 -4.541 1.00 0.00 H new ATOM 0 HE3 LYS A 484 13.906 -3.539 -4.892 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 15.667 -3.673 -3.394 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 14.369 -3.231 -2.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 14.907 -4.841 -2.424 1.00 0.00 H new ATOM 878 N ALA A 485 11.029 -5.401 1.173 1.00 0.00 N ATOM 879 CA ALA A 485 11.788 -5.077 2.382 1.00 0.00 C ATOM 880 C ALA A 485 10.846 -4.674 3.514 1.00 0.00 C ATOM 881 O ALA A 485 10.421 -3.521 3.600 1.00 0.00 O ATOM 882 CB ALA A 485 12.763 -3.935 2.094 1.00 0.00 C ATOM 0 H ALA A 485 10.124 -4.935 1.102 1.00 0.00 H new ATOM 0 HA ALA A 485 12.346 -5.962 2.688 1.00 0.00 H new ATOM 0 HB1 ALA A 485 13.324 -3.699 2.998 1.00 0.00 H new ATOM 0 HB2 ALA A 485 13.454 -4.236 1.306 1.00 0.00 H new ATOM 0 HB3 ALA A 485 12.207 -3.054 1.772 1.00 0.00 H new ATOM 888 N ASN A 486 10.522 -5.633 4.380 1.00 0.00 N ATOM 889 CA ASN A 486 9.629 -5.366 5.504 1.00 0.00 C ATOM 890 C ASN A 486 9.781 -6.437 6.582 1.00 0.00 C ATOM 891 O ASN A 486 10.707 -7.249 6.539 1.00 0.00 O ATOM 892 CB ASN A 486 8.178 -5.322 5.022 1.00 0.00 C ATOM 893 CG ASN A 486 7.829 -6.612 4.287 1.00 0.00 C ATOM 894 OD1 ASN A 486 6.793 -6.687 3.625 1.00 0.00 O ATOM 895 ND2 ASN A 486 8.635 -7.635 4.363 1.00 0.00 N ATOM 0 H ASN A 486 10.861 -6.593 4.325 1.00 0.00 H new ATOM 0 HA ASN A 486 9.897 -4.400 5.932 1.00 0.00 H new ATOM 0 HB2 ASN A 486 7.509 -5.186 5.872 1.00 0.00 H new ATOM 0 HB3 ASN A 486 8.032 -4.467 4.361 1.00 0.00 H new ATOM 0 HD21 ASN A 486 8.408 -8.501 3.873 1.00 0.00 H new ATOM 0 HD22 ASN A 486 9.492 -7.569 4.912 1.00 0.00 H new ATOM 902 N VAL A 487 8.871 -6.429 7.552 1.00 0.00 N ATOM 903 CA VAL A 487 8.916 -7.403 8.639 1.00 0.00 C ATOM 904 C VAL A 487 8.387 -8.754 8.165 1.00 0.00 C ATOM 905 O VAL A 487 8.847 -9.804 8.614 1.00 0.00 O ATOM 906 CB VAL A 487 8.076 -6.909 9.818 1.00 0.00 C ATOM 907 CG1 VAL A 487 6.606 -6.815 9.400 1.00 0.00 C ATOM 908 CG2 VAL A 487 8.212 -7.892 10.985 1.00 0.00 C ATOM 0 H VAL A 487 8.099 -5.765 7.608 1.00 0.00 H new ATOM 0 HA VAL A 487 9.952 -7.520 8.957 1.00 0.00 H new ATOM 0 HB VAL A 487 8.427 -5.924 10.125 1.00 0.00 H new ATOM 0 HG11 VAL A 487 6.010 -6.463 10.242 1.00 0.00 H new ATOM 0 HG12 VAL A 487 6.508 -6.117 8.569 1.00 0.00 H new ATOM 0 HG13 VAL A 487 6.252 -7.799 9.091 1.00 0.00 H new ATOM 0 HG21 VAL A 487 7.614 -7.542 11.827 1.00 0.00 H new ATOM 0 HG22 VAL A 487 7.861 -8.876 10.675 1.00 0.00 H new ATOM 0 HG23 VAL A 487 9.258 -7.958 11.285 1.00 0.00 H new ATOM 918 N ILE A 488 7.423 -8.720 7.250 1.00 0.00 N ATOM 919 CA ILE A 488 6.844 -9.948 6.713 1.00 0.00 C ATOM 920 C ILE A 488 7.743 -10.514 5.622 1.00 0.00 C ATOM 921 O ILE A 488 8.733 -9.895 5.234 1.00 0.00 O ATOM 922 CB ILE A 488 5.440 -9.668 6.149 1.00 0.00 C ATOM 923 CG1 ILE A 488 5.520 -8.621 5.029 1.00 0.00 C ATOM 924 CG2 ILE A 488 4.533 -9.138 7.268 1.00 0.00 C ATOM 925 CD1 ILE A 488 4.176 -8.549 4.305 1.00 0.00 C ATOM 0 H ILE A 488 7.028 -7.861 6.866 1.00 0.00 H new ATOM 0 HA ILE A 488 6.760 -10.680 7.516 1.00 0.00 H new ATOM 0 HB ILE A 488 5.030 -10.595 5.748 1.00 0.00 H new ATOM 0 HG12 ILE A 488 5.774 -7.646 5.445 1.00 0.00 H new ATOM 0 HG13 ILE A 488 6.311 -8.884 4.326 1.00 0.00 H new ATOM 0 HG21 ILE A 488 3.539 -8.940 6.867 1.00 0.00 H new ATOM 0 HG22 ILE A 488 4.463 -9.881 8.062 1.00 0.00 H new ATOM 0 HG23 ILE A 488 4.952 -8.216 7.670 1.00 0.00 H new ATOM 0 HD11 ILE A 488 4.231 -7.806 3.509 1.00 0.00 H new ATOM 0 HD12 ILE A 488 3.941 -9.523 3.876 1.00 0.00 H new ATOM 0 HD13 ILE A 488 3.396 -8.266 5.012 1.00 0.00 H new ATOM 937 N ASN A 489 7.389 -11.693 5.126 1.00 0.00 N ATOM 938 CA ASN A 489 8.167 -12.341 4.076 1.00 0.00 C ATOM 939 C ASN A 489 7.259 -13.189 3.201 1.00 0.00 C ATOM 940 O ASN A 489 6.040 -13.165 3.350 1.00 0.00 O ATOM 941 CB ASN A 489 9.260 -13.221 4.693 1.00 0.00 C ATOM 942 CG ASN A 489 8.656 -14.170 5.723 1.00 0.00 C ATOM 943 OD1 ASN A 489 8.972 -15.359 5.729 1.00 0.00 O ATOM 944 ND2 ASN A 489 7.802 -13.716 6.601 1.00 0.00 N ATOM 0 H ASN A 489 6.571 -12.219 5.432 1.00 0.00 H new ATOM 0 HA ASN A 489 8.635 -11.570 3.464 1.00 0.00 H new ATOM 0 HB2 ASN A 489 9.761 -13.792 3.911 1.00 0.00 H new ATOM 0 HB3 ASN A 489 10.017 -12.595 5.165 1.00 0.00 H new ATOM 0 HD21 ASN A 489 7.397 -14.347 7.292 1.00 0.00 H new ATOM 0 HD22 ASN A 489 7.540 -12.730 6.596 1.00 0.00 H new ATOM 951 N LYS A 490 7.857 -13.939 2.291 1.00 0.00 N ATOM 952 CA LYS A 490 7.087 -14.789 1.400 1.00 0.00 C ATOM 953 C LYS A 490 6.223 -15.752 2.207 1.00 0.00 C ATOM 954 O LYS A 490 5.156 -16.169 1.758 1.00 0.00 O ATOM 955 CB LYS A 490 8.032 -15.579 0.492 1.00 0.00 C ATOM 956 CG LYS A 490 7.220 -16.372 -0.535 1.00 0.00 C ATOM 957 CD LYS A 490 8.169 -17.106 -1.486 1.00 0.00 C ATOM 958 CE LYS A 490 7.348 -17.874 -2.524 1.00 0.00 C ATOM 959 NZ LYS A 490 8.265 -18.628 -3.424 1.00 0.00 N ATOM 0 H LYS A 490 8.867 -13.977 2.150 1.00 0.00 H new ATOM 0 HA LYS A 490 6.439 -14.162 0.788 1.00 0.00 H new ATOM 0 HB2 LYS A 490 8.715 -14.899 -0.017 1.00 0.00 H new ATOM 0 HB3 LYS A 490 8.643 -16.257 1.089 1.00 0.00 H new ATOM 0 HG2 LYS A 490 6.573 -17.087 -0.028 1.00 0.00 H new ATOM 0 HG3 LYS A 490 6.572 -15.700 -1.098 1.00 0.00 H new ATOM 0 HD2 LYS A 490 8.829 -16.394 -1.981 1.00 0.00 H new ATOM 0 HD3 LYS A 490 8.804 -17.793 -0.927 1.00 0.00 H new ATOM 0 HE2 LYS A 490 6.664 -18.561 -2.026 1.00 0.00 H new ATOM 0 HE3 LYS A 490 6.738 -17.182 -3.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 7.707 -19.150 -4.130 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 8.901 -17.963 -3.909 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 8.828 -19.299 -2.863 1.00 0.00 H new ATOM 973 N GLN A 491 6.695 -16.107 3.398 1.00 0.00 N ATOM 974 CA GLN A 491 5.958 -17.031 4.252 1.00 0.00 C ATOM 975 C GLN A 491 4.766 -16.336 4.907 1.00 0.00 C ATOM 976 O GLN A 491 3.625 -16.772 4.751 1.00 0.00 O ATOM 977 CB GLN A 491 6.885 -17.588 5.336 1.00 0.00 C ATOM 978 CG GLN A 491 6.182 -18.712 6.105 1.00 0.00 C ATOM 979 CD GLN A 491 5.936 -19.905 5.184 1.00 0.00 C ATOM 980 OE1 GLN A 491 6.801 -20.258 4.384 1.00 0.00 O ATOM 981 NE2 GLN A 491 4.802 -20.546 5.251 1.00 0.00 N ATOM 0 H GLN A 491 7.575 -15.773 3.790 1.00 0.00 H new ATOM 0 HA GLN A 491 5.586 -17.847 3.632 1.00 0.00 H new ATOM 0 HB2 GLN A 491 7.802 -17.965 4.883 1.00 0.00 H new ATOM 0 HB3 GLN A 491 7.173 -16.792 6.023 1.00 0.00 H new ATOM 0 HG2 GLN A 491 6.792 -19.019 6.955 1.00 0.00 H new ATOM 0 HG3 GLN A 491 5.235 -18.351 6.506 1.00 0.00 H new ATOM 0 HE21 GLN A 491 4.087 -20.250 5.916 1.00 0.00 H new ATOM 0 HE22 GLN A 491 4.630 -21.343 4.639 1.00 0.00 H new ATOM 990 N GLU A 492 5.037 -15.263 5.649 1.00 0.00 N ATOM 991 CA GLU A 492 3.974 -14.532 6.328 1.00 0.00 C ATOM 992 C GLU A 492 3.078 -13.826 5.318 1.00 0.00 C ATOM 993 O GLU A 492 1.865 -13.739 5.504 1.00 0.00 O ATOM 994 CB GLU A 492 4.578 -13.511 7.294 1.00 0.00 C ATOM 995 CG GLU A 492 3.467 -12.879 8.133 1.00 0.00 C ATOM 996 CD GLU A 492 4.070 -11.987 9.211 1.00 0.00 C ATOM 997 OE1 GLU A 492 5.268 -11.767 9.169 1.00 0.00 O ATOM 998 OE2 GLU A 492 3.323 -11.539 10.067 1.00 0.00 O ATOM 0 H GLU A 492 5.974 -14.886 5.793 1.00 0.00 H new ATOM 0 HA GLU A 492 3.368 -15.243 6.890 1.00 0.00 H new ATOM 0 HB2 GLU A 492 5.307 -13.996 7.943 1.00 0.00 H new ATOM 0 HB3 GLU A 492 5.111 -12.740 6.738 1.00 0.00 H new ATOM 0 HG2 GLU A 492 2.805 -12.294 7.494 1.00 0.00 H new ATOM 0 HG3 GLU A 492 2.859 -13.658 8.593 1.00 0.00 H new ATOM 1005 N HIS A 493 3.683 -13.331 4.245 1.00 0.00 N ATOM 1006 CA HIS A 493 2.930 -12.640 3.207 1.00 0.00 C ATOM 1007 C HIS A 493 1.867 -13.563 2.623 1.00 0.00 C ATOM 1008 O HIS A 493 0.736 -13.148 2.374 1.00 0.00 O ATOM 1009 CB HIS A 493 3.884 -12.175 2.100 1.00 0.00 C ATOM 1010 CG HIS A 493 3.113 -11.448 1.032 1.00 0.00 C ATOM 1011 ND1 HIS A 493 2.607 -12.099 -0.082 1.00 0.00 N ATOM 1012 CD2 HIS A 493 2.762 -10.129 0.887 1.00 0.00 C ATOM 1013 CE1 HIS A 493 1.985 -11.180 -0.841 1.00 0.00 C ATOM 1014 NE2 HIS A 493 2.048 -9.964 -0.296 1.00 0.00 N ATOM 0 H HIS A 493 4.686 -13.395 4.072 1.00 0.00 H new ATOM 0 HA HIS A 493 2.437 -11.772 3.645 1.00 0.00 H new ATOM 0 HB2 HIS A 493 4.649 -11.520 2.518 1.00 0.00 H new ATOM 0 HB3 HIS A 493 4.400 -13.033 1.668 1.00 0.00 H new ATOM 0 HD1 HIS A 493 2.691 -13.094 -0.288 1.00 0.00 H new ATOM 0 HD2 HIS A 493 3.003 -9.340 1.584 1.00 0.00 H new ATOM 0 HE1 HIS A 493 1.494 -11.399 -1.778 1.00 0.00 H new ATOM 1022 N ASP A 494 2.241 -14.821 2.410 1.00 0.00 N ATOM 1023 CA ASP A 494 1.321 -15.805 1.854 1.00 0.00 C ATOM 1024 C ASP A 494 0.140 -16.065 2.790 1.00 0.00 C ATOM 1025 O ASP A 494 -0.985 -16.264 2.332 1.00 0.00 O ATOM 1026 CB ASP A 494 2.058 -17.123 1.601 1.00 0.00 C ATOM 1027 CG ASP A 494 1.131 -18.108 0.899 1.00 0.00 C ATOM 1028 OD1 ASP A 494 -0.041 -17.796 0.767 1.00 0.00 O ATOM 1029 OD2 ASP A 494 1.607 -19.159 0.501 1.00 0.00 O ATOM 0 H ASP A 494 3.173 -15.182 2.614 1.00 0.00 H new ATOM 0 HA ASP A 494 0.936 -15.403 0.917 1.00 0.00 H new ATOM 0 HB2 ASP A 494 2.943 -16.944 0.990 1.00 0.00 H new ATOM 0 HB3 ASP A 494 2.403 -17.544 2.545 1.00 0.00 H new ATOM 1034 N ILE A 495 0.402 -16.081 4.096 1.00 0.00 N ATOM 1035 CA ILE A 495 -0.656 -16.344 5.072 1.00 0.00 C ATOM 1036 C ILE A 495 -1.734 -15.264 5.004 1.00 0.00 C ATOM 1037 O ILE A 495 -2.927 -15.568 5.031 1.00 0.00 O ATOM 1038 CB ILE A 495 -0.066 -16.392 6.488 1.00 0.00 C ATOM 1039 CG1 ILE A 495 0.844 -17.622 6.618 1.00 0.00 C ATOM 1040 CG2 ILE A 495 -1.200 -16.486 7.519 1.00 0.00 C ATOM 1041 CD1 ILE A 495 1.599 -17.576 7.952 1.00 0.00 C ATOM 0 H ILE A 495 1.324 -15.917 4.500 1.00 0.00 H new ATOM 0 HA ILE A 495 -1.108 -17.307 4.834 1.00 0.00 H new ATOM 0 HB ILE A 495 0.512 -15.486 6.670 1.00 0.00 H new ATOM 0 HG12 ILE A 495 0.249 -18.533 6.559 1.00 0.00 H new ATOM 0 HG13 ILE A 495 1.553 -17.650 5.790 1.00 0.00 H new ATOM 0 HG21 ILE A 495 -0.777 -16.520 8.523 1.00 0.00 H new ATOM 0 HG22 ILE A 495 -1.848 -15.614 7.427 1.00 0.00 H new ATOM 0 HG23 ILE A 495 -1.781 -17.391 7.339 1.00 0.00 H new ATOM 0 HD11 ILE A 495 2.242 -18.452 8.036 1.00 0.00 H new ATOM 0 HD12 ILE A 495 2.208 -16.673 7.994 1.00 0.00 H new ATOM 0 HD13 ILE A 495 0.884 -17.570 8.775 1.00 0.00 H new ATOM 1147 N GLN A 501 -8.601 -12.164 2.966 1.00 0.00 N ATOM 1148 CA GLN A 501 -8.997 -11.789 1.605 1.00 0.00 C ATOM 1149 C GLN A 501 -8.510 -10.377 1.287 1.00 0.00 C ATOM 1150 O GLN A 501 -7.692 -9.815 2.014 1.00 0.00 O ATOM 1151 CB GLN A 501 -10.521 -11.826 1.480 1.00 0.00 C ATOM 1152 CG GLN A 501 -11.035 -13.258 1.636 1.00 0.00 C ATOM 1153 CD GLN A 501 -12.557 -13.258 1.560 1.00 0.00 C ATOM 1154 OE1 GLN A 501 -13.163 -12.225 1.271 1.00 0.00 O ATOM 1155 NE2 GLN A 501 -13.219 -14.356 1.805 1.00 0.00 N ATOM 0 HA GLN A 501 -8.550 -12.496 0.905 1.00 0.00 H new ATOM 0 HB2 GLN A 501 -10.970 -11.187 2.240 1.00 0.00 H new ATOM 0 HB3 GLN A 501 -10.822 -11.428 0.511 1.00 0.00 H new ATOM 0 HG2 GLN A 501 -10.620 -13.893 0.853 1.00 0.00 H new ATOM 0 HG3 GLN A 501 -10.707 -13.672 2.589 1.00 0.00 H new ATOM 0 HE21 GLN A 501 -12.717 -15.211 2.044 1.00 0.00 H new ATOM 0 HE22 GLN A 501 -14.238 -14.359 1.757 1.00 0.00 H new ATOM 1164 N ILE A 502 -9.031 -9.795 0.211 1.00 0.00 N ATOM 1165 CA ILE A 502 -8.637 -8.437 -0.147 1.00 0.00 C ATOM 1166 C ILE A 502 -8.941 -7.479 1.018 1.00 0.00 C ATOM 1167 O ILE A 502 -8.009 -6.899 1.572 1.00 0.00 O ATOM 1168 CB ILE A 502 -9.287 -8.020 -1.489 1.00 0.00 C ATOM 1169 CG1 ILE A 502 -8.739 -8.927 -2.615 1.00 0.00 C ATOM 1170 CG2 ILE A 502 -8.986 -6.560 -1.831 1.00 0.00 C ATOM 1171 CD1 ILE A 502 -7.209 -8.807 -2.754 1.00 0.00 C ATOM 0 H ILE A 502 -9.710 -10.229 -0.414 1.00 0.00 H new ATOM 0 HA ILE A 502 -7.561 -8.390 -0.312 1.00 0.00 H new ATOM 0 HB ILE A 502 -10.367 -8.130 -1.394 1.00 0.00 H new ATOM 0 HG12 ILE A 502 -9.005 -9.964 -2.408 1.00 0.00 H new ATOM 0 HG13 ILE A 502 -9.212 -8.659 -3.560 1.00 0.00 H new ATOM 0 HG21 ILE A 502 -9.458 -6.304 -2.779 1.00 0.00 H new ATOM 0 HG22 ILE A 502 -9.377 -5.914 -1.045 1.00 0.00 H new ATOM 0 HG23 ILE A 502 -7.908 -6.420 -1.913 1.00 0.00 H new ATOM 0 HD11 ILE A 502 -6.864 -9.460 -3.556 1.00 0.00 H new ATOM 0 HD12 ILE A 502 -6.945 -7.776 -2.987 1.00 0.00 H new ATOM 0 HD13 ILE A 502 -6.734 -9.100 -1.818 1.00 0.00 H new ATOM 1183 N PRO A 503 -10.184 -7.343 1.449 1.00 0.00 N ATOM 1184 CA PRO A 503 -10.557 -6.471 2.623 1.00 0.00 C ATOM 1185 C PRO A 503 -9.623 -6.634 3.830 1.00 0.00 C ATOM 1186 O PRO A 503 -9.132 -5.650 4.384 1.00 0.00 O ATOM 1187 CB PRO A 503 -11.990 -6.967 2.989 1.00 0.00 C ATOM 1188 CG PRO A 503 -12.171 -8.218 2.196 1.00 0.00 C ATOM 1189 CD PRO A 503 -11.402 -7.965 0.923 1.00 0.00 C ATOM 0 HA PRO A 503 -10.491 -5.414 2.366 1.00 0.00 H new ATOM 0 HB2 PRO A 503 -12.082 -7.159 4.058 1.00 0.00 H new ATOM 0 HB3 PRO A 503 -12.744 -6.223 2.733 1.00 0.00 H new ATOM 0 HG2 PRO A 503 -11.784 -9.087 2.729 1.00 0.00 H new ATOM 0 HG3 PRO A 503 -13.224 -8.412 1.993 1.00 0.00 H new ATOM 0 HD2 PRO A 503 -11.192 -8.886 0.378 1.00 0.00 H new ATOM 0 HD3 PRO A 503 -11.940 -7.306 0.241 1.00 0.00 H new ATOM 1197 N LEU A 504 -9.444 -7.878 4.264 1.00 0.00 N ATOM 1198 CA LEU A 504 -8.619 -8.166 5.435 1.00 0.00 C ATOM 1199 C LEU A 504 -7.150 -7.873 5.157 1.00 0.00 C ATOM 1200 O LEU A 504 -6.432 -7.398 6.036 1.00 0.00 O ATOM 1201 CB LEU A 504 -8.795 -9.629 5.867 1.00 0.00 C ATOM 1202 CG LEU A 504 -10.050 -9.810 6.738 1.00 0.00 C ATOM 1203 CD1 LEU A 504 -9.859 -9.166 8.122 1.00 0.00 C ATOM 1204 CD2 LEU A 504 -11.268 -9.195 6.039 1.00 0.00 C ATOM 0 H LEU A 504 -9.857 -8.701 3.825 1.00 0.00 H new ATOM 0 HA LEU A 504 -8.948 -7.516 6.246 1.00 0.00 H new ATOM 0 HB2 LEU A 504 -8.868 -10.264 4.984 1.00 0.00 H new ATOM 0 HB3 LEU A 504 -7.915 -9.954 6.422 1.00 0.00 H new ATOM 0 HG LEU A 504 -10.216 -10.878 6.878 1.00 0.00 H new ATOM 0 HD11 LEU A 504 -10.761 -9.309 8.717 1.00 0.00 H new ATOM 0 HD12 LEU A 504 -9.013 -9.633 8.627 1.00 0.00 H new ATOM 0 HD13 LEU A 504 -9.667 -8.100 8.004 1.00 0.00 H new ATOM 0 HD21 LEU A 504 -12.152 -9.328 6.663 1.00 0.00 H new ATOM 0 HD22 LEU A 504 -11.096 -8.131 5.876 1.00 0.00 H new ATOM 0 HD23 LEU A 504 -11.424 -9.688 5.079 1.00 0.00 H new ATOM 1216 N GLN A 505 -6.701 -8.163 3.942 1.00 0.00 N ATOM 1217 CA GLN A 505 -5.308 -7.922 3.600 1.00 0.00 C ATOM 1218 C GLN A 505 -4.947 -6.484 3.937 1.00 0.00 C ATOM 1219 O GLN A 505 -3.873 -6.213 4.475 1.00 0.00 O ATOM 1220 CB GLN A 505 -5.062 -8.197 2.108 1.00 0.00 C ATOM 1221 CG GLN A 505 -3.611 -7.852 1.739 1.00 0.00 C ATOM 1222 CD GLN A 505 -2.644 -8.632 2.623 1.00 0.00 C ATOM 1223 OE1 GLN A 505 -1.762 -8.041 3.245 1.00 0.00 O ATOM 1224 NE2 GLN A 505 -2.763 -9.927 2.719 1.00 0.00 N ATOM 0 H GLN A 505 -7.269 -8.557 3.192 1.00 0.00 H new ATOM 0 HA GLN A 505 -4.678 -8.598 4.178 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -5.262 -9.245 1.886 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -5.750 -7.606 1.503 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -3.428 -8.088 0.691 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -3.442 -6.782 1.858 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -3.496 -10.412 2.201 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -2.123 -10.455 3.312 1.00 0.00 H new ATOM 1233 N ALA A 506 -5.854 -5.567 3.625 1.00 0.00 N ATOM 1234 CA ALA A 506 -5.624 -4.161 3.908 1.00 0.00 C ATOM 1235 C ALA A 506 -5.562 -3.921 5.413 1.00 0.00 C ATOM 1236 O ALA A 506 -4.747 -3.133 5.890 1.00 0.00 O ATOM 1237 CB ALA A 506 -6.748 -3.317 3.303 1.00 0.00 C ATOM 0 H ALA A 506 -6.748 -5.772 3.179 1.00 0.00 H new ATOM 0 HA ALA A 506 -4.671 -3.871 3.465 1.00 0.00 H new ATOM 0 HB1 ALA A 506 -6.569 -2.264 3.519 1.00 0.00 H new ATOM 0 HB2 ALA A 506 -6.775 -3.466 2.224 1.00 0.00 H new ATOM 0 HB3 ALA A 506 -7.702 -3.619 3.735 1.00 0.00 H new ATOM 1243 N ARG A 507 -6.433 -4.601 6.159 1.00 0.00 N ATOM 1244 CA ARG A 507 -6.468 -4.441 7.611 1.00 0.00 C ATOM 1245 C ARG A 507 -5.147 -4.849 8.232 1.00 0.00 C ATOM 1246 O ARG A 507 -4.606 -4.142 9.083 1.00 0.00 O ATOM 1247 CB ARG A 507 -7.601 -5.289 8.215 1.00 0.00 C ATOM 1248 CG ARG A 507 -7.680 -5.071 9.755 1.00 0.00 C ATOM 1249 CD ARG A 507 -7.031 -6.252 10.495 1.00 0.00 C ATOM 1250 NE ARG A 507 -7.860 -7.444 10.365 1.00 0.00 N ATOM 1251 CZ ARG A 507 -7.544 -8.573 10.992 1.00 0.00 C ATOM 1252 NH1 ARG A 507 -6.481 -8.625 11.747 1.00 0.00 N ATOM 1253 NH2 ARG A 507 -8.300 -9.628 10.856 1.00 0.00 N ATOM 0 H ARG A 507 -7.116 -5.260 5.786 1.00 0.00 H new ATOM 0 HA ARG A 507 -6.648 -3.388 7.828 1.00 0.00 H new ATOM 0 HB2 ARG A 507 -8.551 -5.019 7.754 1.00 0.00 H new ATOM 0 HB3 ARG A 507 -7.430 -6.344 7.999 1.00 0.00 H new ATOM 0 HG2 ARG A 507 -7.176 -4.143 10.024 1.00 0.00 H new ATOM 0 HG3 ARG A 507 -8.721 -4.969 10.062 1.00 0.00 H new ATOM 0 HD2 ARG A 507 -6.038 -6.444 10.088 1.00 0.00 H new ATOM 0 HD3 ARG A 507 -6.901 -6.004 11.548 1.00 0.00 H new ATOM 0 HE ARG A 507 -8.697 -7.411 9.783 1.00 0.00 H new ATOM 0 HH11 ARG A 507 -5.892 -7.799 11.856 1.00 0.00 H new ATOM 0 HH12 ARG A 507 -6.239 -9.491 12.228 1.00 0.00 H new ATOM 0 HH21 ARG A 507 -9.133 -9.586 10.269 1.00 0.00 H new ATOM 0 HH22 ARG A 507 -8.058 -10.494 11.337 1.00 0.00 H new ATOM 1267 N GLU A 508 -4.630 -5.987 7.808 1.00 0.00 N ATOM 1268 CA GLU A 508 -3.363 -6.459 8.343 1.00 0.00 C ATOM 1269 C GLU A 508 -2.236 -5.534 7.901 1.00 0.00 C ATOM 1270 O GLU A 508 -1.303 -5.271 8.657 1.00 0.00 O ATOM 1271 CB GLU A 508 -3.086 -7.886 7.870 1.00 0.00 C ATOM 1272 CG GLU A 508 -1.866 -8.440 8.614 1.00 0.00 C ATOM 1273 CD GLU A 508 -2.202 -8.659 10.084 1.00 0.00 C ATOM 1274 OE1 GLU A 508 -3.379 -8.741 10.397 1.00 0.00 O ATOM 1275 OE2 GLU A 508 -1.279 -8.744 10.876 1.00 0.00 O ATOM 0 H GLU A 508 -5.057 -6.593 7.108 1.00 0.00 H new ATOM 0 HA GLU A 508 -3.419 -6.457 9.432 1.00 0.00 H new ATOM 0 HB2 GLU A 508 -3.955 -8.517 8.054 1.00 0.00 H new ATOM 0 HB3 GLU A 508 -2.906 -7.896 6.795 1.00 0.00 H new ATOM 0 HG2 GLU A 508 -1.551 -9.380 8.161 1.00 0.00 H new ATOM 0 HG3 GLU A 508 -1.030 -7.747 8.524 1.00 0.00 H new ATOM 1282 N LEU A 509 -2.332 -5.042 6.671 1.00 0.00 N ATOM 1283 CA LEU A 509 -1.316 -4.144 6.134 1.00 0.00 C ATOM 1284 C LEU A 509 -1.244 -2.857 6.945 1.00 0.00 C ATOM 1285 O LEU A 509 -0.167 -2.372 7.238 1.00 0.00 O ATOM 1286 CB LEU A 509 -1.645 -3.808 4.672 1.00 0.00 C ATOM 1287 CG LEU A 509 -0.657 -2.765 4.124 1.00 0.00 C ATOM 1288 CD1 LEU A 509 0.785 -3.273 4.271 1.00 0.00 C ATOM 1289 CD2 LEU A 509 -0.966 -2.515 2.643 1.00 0.00 C ATOM 0 H LEU A 509 -3.098 -5.248 6.030 1.00 0.00 H new ATOM 0 HA LEU A 509 -0.350 -4.645 6.191 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -1.601 -4.713 4.066 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -2.663 -3.426 4.601 1.00 0.00 H new ATOM 0 HG LEU A 509 -0.761 -1.838 4.687 1.00 0.00 H new ATOM 0 HD11 LEU A 509 1.476 -2.526 3.880 1.00 0.00 H new ATOM 0 HD12 LEU A 509 1.002 -3.452 5.324 1.00 0.00 H new ATOM 0 HD13 LEU A 509 0.902 -4.202 3.714 1.00 0.00 H new ATOM 0 HD21 LEU A 509 -0.270 -1.776 2.246 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -0.862 -3.447 2.087 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -1.986 -2.144 2.542 1.00 0.00 H new ATOM 1301 N ILE A 510 -2.395 -2.305 7.289 1.00 0.00 N ATOM 1302 CA ILE A 510 -2.436 -1.066 8.057 1.00 0.00 C ATOM 1303 C ILE A 510 -1.790 -1.259 9.424 1.00 0.00 C ATOM 1304 O ILE A 510 -1.057 -0.393 9.901 1.00 0.00 O ATOM 1305 CB ILE A 510 -3.888 -0.591 8.218 1.00 0.00 C ATOM 1306 CG1 ILE A 510 -4.423 -0.136 6.858 1.00 0.00 C ATOM 1307 CG2 ILE A 510 -3.948 0.582 9.208 1.00 0.00 C ATOM 1308 CD1 ILE A 510 -5.938 0.043 6.941 1.00 0.00 C ATOM 0 H ILE A 510 -3.309 -2.690 7.052 1.00 0.00 H new ATOM 0 HA ILE A 510 -1.874 -0.305 7.515 1.00 0.00 H new ATOM 0 HB ILE A 510 -4.496 -1.412 8.599 1.00 0.00 H new ATOM 0 HG12 ILE A 510 -3.951 0.802 6.565 1.00 0.00 H new ATOM 0 HG13 ILE A 510 -4.174 -0.871 6.093 1.00 0.00 H new ATOM 0 HG21 ILE A 510 -4.981 0.914 9.317 1.00 0.00 H new ATOM 0 HG22 ILE A 510 -3.566 0.260 10.177 1.00 0.00 H new ATOM 0 HG23 ILE A 510 -3.340 1.406 8.833 1.00 0.00 H new ATOM 0 HD11 ILE A 510 -6.320 0.367 5.973 1.00 0.00 H new ATOM 0 HD12 ILE A 510 -6.402 -0.904 7.215 1.00 0.00 H new ATOM 0 HD13 ILE A 510 -6.175 0.794 7.694 1.00 0.00 H new ATOM 1320 N ASP A 511 -2.078 -2.391 10.053 1.00 0.00 N ATOM 1321 CA ASP A 511 -1.525 -2.678 11.369 1.00 0.00 C ATOM 1322 C ASP A 511 0.006 -2.710 11.323 1.00 0.00 C ATOM 1323 O ASP A 511 0.669 -2.259 12.257 1.00 0.00 O ATOM 1324 CB ASP A 511 -2.048 -4.025 11.869 1.00 0.00 C ATOM 1325 CG ASP A 511 -1.679 -4.221 13.335 1.00 0.00 C ATOM 1326 OD1 ASP A 511 -0.837 -3.481 13.817 1.00 0.00 O ATOM 1327 OD2 ASP A 511 -2.241 -5.108 13.955 1.00 0.00 O ATOM 0 H ASP A 511 -2.686 -3.119 9.677 1.00 0.00 H new ATOM 0 HA ASP A 511 -1.837 -1.887 12.051 1.00 0.00 H new ATOM 0 HB2 ASP A 511 -3.131 -4.070 11.750 1.00 0.00 H new ATOM 0 HB3 ASP A 511 -1.627 -4.832 11.269 1.00 0.00 H new ATOM 1332 N THR A 512 0.560 -3.240 10.230 1.00 0.00 N ATOM 1333 CA THR A 512 2.015 -3.319 10.080 1.00 0.00 C ATOM 1334 C THR A 512 2.623 -1.914 10.065 1.00 0.00 C ATOM 1335 O THR A 512 3.706 -1.690 10.606 1.00 0.00 O ATOM 1336 CB THR A 512 2.372 -4.062 8.781 1.00 0.00 C ATOM 1337 OG1 THR A 512 1.791 -3.395 7.681 1.00 0.00 O ATOM 1338 CG2 THR A 512 1.849 -5.504 8.842 1.00 0.00 C ATOM 0 H THR A 512 0.030 -3.617 9.444 1.00 0.00 H new ATOM 0 HA THR A 512 2.425 -3.869 10.927 1.00 0.00 H new ATOM 0 HB THR A 512 3.456 -4.080 8.666 1.00 0.00 H new ATOM 0 HG1 THR A 512 0.963 -2.955 7.965 1.00 0.00 H new ATOM 0 HG21 THR A 512 2.106 -6.023 7.919 1.00 0.00 H new ATOM 0 HG22 THR A 512 2.304 -6.020 9.687 1.00 0.00 H new ATOM 0 HG23 THR A 512 0.766 -5.493 8.963 1.00 0.00 H new ATOM 1346 N ILE A 513 1.915 -0.969 9.443 1.00 0.00 N ATOM 1347 CA ILE A 513 2.380 0.416 9.369 1.00 0.00 C ATOM 1348 C ILE A 513 2.451 1.027 10.765 1.00 0.00 C ATOM 1349 O ILE A 513 3.399 1.738 11.096 1.00 0.00 O ATOM 1350 CB ILE A 513 1.440 1.259 8.498 1.00 0.00 C ATOM 1351 CG1 ILE A 513 1.292 0.618 7.110 1.00 0.00 C ATOM 1352 CG2 ILE A 513 1.991 2.682 8.351 1.00 0.00 C ATOM 1353 CD1 ILE A 513 2.662 0.470 6.424 1.00 0.00 C ATOM 0 H ILE A 513 1.020 -1.138 8.984 1.00 0.00 H new ATOM 0 HA ILE A 513 3.374 0.412 8.922 1.00 0.00 H new ATOM 0 HB ILE A 513 0.463 1.302 8.980 1.00 0.00 H new ATOM 0 HG12 ILE A 513 0.821 -0.360 7.205 1.00 0.00 H new ATOM 0 HG13 ILE A 513 0.635 1.229 6.491 1.00 0.00 H new ATOM 0 HG21 ILE A 513 1.316 3.271 7.731 1.00 0.00 H new ATOM 0 HG22 ILE A 513 2.075 3.143 9.335 1.00 0.00 H new ATOM 0 HG23 ILE A 513 2.974 2.645 7.882 1.00 0.00 H new ATOM 0 HD11 ILE A 513 2.530 0.014 5.443 1.00 0.00 H new ATOM 0 HD12 ILE A 513 3.119 1.453 6.309 1.00 0.00 H new ATOM 0 HD13 ILE A 513 3.308 -0.161 7.034 1.00 0.00 H new ATOM 1365 N LEU A 514 1.432 0.758 11.576 1.00 0.00 N ATOM 1366 CA LEU A 514 1.389 1.303 12.928 1.00 0.00 C ATOM 1367 C LEU A 514 2.577 0.803 13.745 1.00 0.00 C ATOM 1368 O LEU A 514 3.211 1.571 14.467 1.00 0.00 O ATOM 1369 CB LEU A 514 0.083 0.883 13.617 1.00 0.00 C ATOM 1370 CG LEU A 514 -0.005 1.493 15.027 1.00 0.00 C ATOM 1371 CD1 LEU A 514 0.046 3.031 14.954 1.00 0.00 C ATOM 1372 CD2 LEU A 514 -1.324 1.056 15.677 1.00 0.00 C ATOM 0 H LEU A 514 0.635 0.174 11.325 1.00 0.00 H new ATOM 0 HA LEU A 514 1.437 2.390 12.864 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -0.770 1.207 13.021 1.00 0.00 H new ATOM 0 HB3 LEU A 514 0.032 -0.204 13.681 1.00 0.00 H new ATOM 0 HG LEU A 514 0.840 1.145 15.620 1.00 0.00 H new ATOM 0 HD11 LEU A 514 -0.017 3.445 15.960 1.00 0.00 H new ATOM 0 HD12 LEU A 514 0.983 3.342 14.492 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -0.791 3.395 14.358 1.00 0.00 H new ATOM 0 HD21 LEU A 514 -1.396 1.483 16.677 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -2.161 1.405 15.072 1.00 0.00 H new ATOM 0 HD23 LEU A 514 -1.354 -0.032 15.744 1.00 0.00 H new ATOM 1384 N VAL A 515 2.873 -0.490 13.633 1.00 0.00 N ATOM 1385 CA VAL A 515 3.985 -1.070 14.375 1.00 0.00 C ATOM 1386 C VAL A 515 5.309 -0.458 13.924 1.00 0.00 C ATOM 1387 O VAL A 515 6.122 -0.037 14.747 1.00 0.00 O ATOM 1388 CB VAL A 515 4.020 -2.589 14.158 1.00 0.00 C ATOM 1389 CG1 VAL A 515 5.268 -3.184 14.821 1.00 0.00 C ATOM 1390 CG2 VAL A 515 2.769 -3.220 14.772 1.00 0.00 C ATOM 0 H VAL A 515 2.364 -1.148 13.042 1.00 0.00 H new ATOM 0 HA VAL A 515 3.843 -0.856 15.434 1.00 0.00 H new ATOM 0 HB VAL A 515 4.049 -2.796 13.088 1.00 0.00 H new ATOM 0 HG11 VAL A 515 5.285 -4.262 14.662 1.00 0.00 H new ATOM 0 HG12 VAL A 515 6.161 -2.738 14.382 1.00 0.00 H new ATOM 0 HG13 VAL A 515 5.247 -2.975 15.891 1.00 0.00 H new ATOM 0 HG21 VAL A 515 2.793 -4.299 14.618 1.00 0.00 H new ATOM 0 HG22 VAL A 515 2.741 -3.006 15.840 1.00 0.00 H new ATOM 0 HG23 VAL A 515 1.881 -2.805 14.295 1.00 0.00 H new ATOM 1400 N LYS A 516 5.516 -0.412 12.612 1.00 0.00 N ATOM 1401 CA LYS A 516 6.743 0.150 12.060 1.00 0.00 C ATOM 1402 C LYS A 516 6.834 1.646 12.344 1.00 0.00 C ATOM 1403 O LYS A 516 7.882 2.149 12.746 1.00 0.00 O ATOM 1404 CB LYS A 516 6.787 -0.098 10.553 1.00 0.00 C ATOM 1405 CG LYS A 516 7.013 -1.587 10.282 1.00 0.00 C ATOM 1406 CD LYS A 516 7.001 -1.838 8.773 1.00 0.00 C ATOM 1407 CE LYS A 516 7.182 -3.332 8.501 1.00 0.00 C ATOM 1408 NZ LYS A 516 8.557 -3.745 8.899 1.00 0.00 N ATOM 0 H LYS A 516 4.855 -0.755 11.915 1.00 0.00 H new ATOM 0 HA LYS A 516 7.593 -0.339 12.536 1.00 0.00 H new ATOM 0 HB2 LYS A 516 5.854 0.228 10.094 1.00 0.00 H new ATOM 0 HB3 LYS A 516 7.586 0.489 10.101 1.00 0.00 H new ATOM 0 HG2 LYS A 516 7.965 -1.904 10.707 1.00 0.00 H new ATOM 0 HG3 LYS A 516 6.235 -2.178 10.766 1.00 0.00 H new ATOM 0 HD2 LYS A 516 6.061 -1.491 8.344 1.00 0.00 H new ATOM 0 HD3 LYS A 516 7.799 -1.271 8.293 1.00 0.00 H new ATOM 0 HE2 LYS A 516 6.442 -3.906 9.059 1.00 0.00 H new ATOM 0 HE3 LYS A 516 7.019 -3.543 7.444 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 8.928 -4.428 8.208 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 9.176 -2.910 8.927 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 8.528 -4.186 9.840 1.00 0.00 H new ATOM 1422 N GLY A 517 5.726 2.351 12.136 1.00 0.00 N ATOM 1423 CA GLY A 517 5.688 3.789 12.374 1.00 0.00 C ATOM 1424 C GLY A 517 6.384 4.569 11.263 1.00 0.00 C ATOM 1425 O GLY A 517 6.426 4.129 10.115 1.00 0.00 O ATOM 0 H GLY A 517 4.847 1.952 11.805 1.00 0.00 H new ATOM 0 HA2 GLY A 517 4.651 4.116 12.453 1.00 0.00 H new ATOM 0 HA3 GLY A 517 6.166 4.012 13.328 1.00 0.00 H new ATOM 1429 N ASN A 518 6.918 5.738 11.612 1.00 0.00 N ATOM 1430 CA ASN A 518 7.604 6.581 10.638 1.00 0.00 C ATOM 1431 C ASN A 518 8.572 5.758 9.793 1.00 0.00 C ATOM 1432 O ASN A 518 8.925 6.144 8.679 1.00 0.00 O ATOM 1433 CB ASN A 518 8.371 7.691 11.357 1.00 0.00 C ATOM 1434 CG ASN A 518 8.804 8.754 10.356 1.00 0.00 C ATOM 1435 OD1 ASN A 518 8.832 8.497 9.153 1.00 0.00 O ATOM 1436 ND2 ASN A 518 9.149 9.938 10.784 1.00 0.00 N ATOM 0 H ASN A 518 6.889 6.120 12.557 1.00 0.00 H new ATOM 0 HA ASN A 518 6.854 7.021 9.981 1.00 0.00 H new ATOM 0 HB2 ASN A 518 7.743 8.139 12.127 1.00 0.00 H new ATOM 0 HB3 ASN A 518 9.244 7.275 11.859 1.00 0.00 H new ATOM 0 HD21 ASN A 518 9.443 10.654 10.120 1.00 0.00 H new ATOM 0 HD22 ASN A 518 9.124 10.147 11.782 1.00 0.00 H new ATOM 1443 N ALA A 519 8.991 4.618 10.325 1.00 0.00 N ATOM 1444 CA ALA A 519 9.910 3.746 9.604 1.00 0.00 C ATOM 1445 C ALA A 519 9.276 3.259 8.306 1.00 0.00 C ATOM 1446 O ALA A 519 9.963 3.078 7.300 1.00 0.00 O ATOM 1447 CB ALA A 519 10.281 2.544 10.476 1.00 0.00 C ATOM 0 H ALA A 519 8.713 4.277 11.245 1.00 0.00 H new ATOM 0 HA ALA A 519 10.810 4.313 9.366 1.00 0.00 H new ATOM 0 HB1 ALA A 519 10.968 1.897 9.930 1.00 0.00 H new ATOM 0 HB2 ALA A 519 10.760 2.892 11.391 1.00 0.00 H new ATOM 0 HB3 ALA A 519 9.380 1.985 10.728 1.00 0.00 H new ATOM 1453 N ALA A 520 7.961 3.046 8.330 1.00 0.00 N ATOM 1454 CA ALA A 520 7.245 2.578 7.142 1.00 0.00 C ATOM 1455 C ALA A 520 6.599 3.739 6.405 1.00 0.00 C ATOM 1456 O ALA A 520 6.103 3.577 5.291 1.00 0.00 O ATOM 1457 CB ALA A 520 6.170 1.574 7.542 1.00 0.00 C ATOM 0 H ALA A 520 7.373 3.188 9.151 1.00 0.00 H new ATOM 0 HA ALA A 520 7.966 2.100 6.480 1.00 0.00 H new ATOM 0 HB1 ALA A 520 5.643 1.231 6.652 1.00 0.00 H new ATOM 0 HB2 ALA A 520 6.634 0.722 8.039 1.00 0.00 H new ATOM 0 HB3 ALA A 520 5.463 2.049 8.222 1.00 0.00 H new ATOM 1463 N ALA A 521 6.600 4.911 7.024 1.00 0.00 N ATOM 1464 CA ALA A 521 6.005 6.079 6.396 1.00 0.00 C ATOM 1465 C ALA A 521 6.729 6.389 5.096 1.00 0.00 C ATOM 1466 O ALA A 521 6.111 6.772 4.106 1.00 0.00 O ATOM 1467 CB ALA A 521 6.088 7.284 7.333 1.00 0.00 C ATOM 0 H ALA A 521 7.000 5.076 7.947 1.00 0.00 H new ATOM 0 HA ALA A 521 4.957 5.869 6.184 1.00 0.00 H new ATOM 0 HB1 ALA A 521 5.639 8.152 6.850 1.00 0.00 H new ATOM 0 HB2 ALA A 521 5.552 7.064 8.256 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.132 7.496 7.561 1.00 0.00 H new ATOM 1473 N ASN A 522 8.044 6.212 5.104 1.00 0.00 N ATOM 1474 CA ASN A 522 8.840 6.469 3.915 1.00 0.00 C ATOM 1475 C ASN A 522 8.482 5.480 2.810 1.00 0.00 C ATOM 1476 O ASN A 522 8.278 5.870 1.664 1.00 0.00 O ATOM 1477 CB ASN A 522 10.329 6.360 4.255 1.00 0.00 C ATOM 1478 CG ASN A 522 10.616 5.020 4.920 1.00 0.00 C ATOM 1479 OD1 ASN A 522 9.693 4.270 5.234 1.00 0.00 O ATOM 1480 ND2 ASN A 522 11.849 4.675 5.166 1.00 0.00 N ATOM 0 H ASN A 522 8.576 5.894 5.914 1.00 0.00 H new ATOM 0 HA ASN A 522 8.626 7.477 3.560 1.00 0.00 H new ATOM 0 HB2 ASN A 522 10.926 6.460 3.348 1.00 0.00 H new ATOM 0 HB3 ASN A 522 10.619 7.174 4.919 1.00 0.00 H new ATOM 0 HD21 ASN A 522 12.048 3.783 5.619 1.00 0.00 H new ATOM 0 HD22 ASN A 522 12.614 5.297 4.906 1.00 0.00 H new ATOM 1487 N ILE A 523 8.397 4.198 3.161 1.00 0.00 N ATOM 1488 CA ILE A 523 8.053 3.177 2.179 1.00 0.00 C ATOM 1489 C ILE A 523 6.623 3.381 1.687 1.00 0.00 C ATOM 1490 O ILE A 523 6.352 3.303 0.490 1.00 0.00 O ATOM 1491 CB ILE A 523 8.192 1.780 2.801 1.00 0.00 C ATOM 1492 CG1 ILE A 523 9.673 1.496 3.074 1.00 0.00 C ATOM 1493 CG2 ILE A 523 7.642 0.720 1.836 1.00 0.00 C ATOM 1494 CD1 ILE A 523 9.801 0.230 3.924 1.00 0.00 C ATOM 0 H ILE A 523 8.559 3.847 4.105 1.00 0.00 H new ATOM 0 HA ILE A 523 8.736 3.262 1.333 1.00 0.00 H new ATOM 0 HB ILE A 523 7.628 1.743 3.733 1.00 0.00 H new ATOM 0 HG12 ILE A 523 10.210 1.371 2.134 1.00 0.00 H new ATOM 0 HG13 ILE A 523 10.127 2.341 3.591 1.00 0.00 H new ATOM 0 HG21 ILE A 523 7.744 -0.268 2.284 1.00 0.00 H new ATOM 0 HG22 ILE A 523 6.589 0.921 1.636 1.00 0.00 H new ATOM 0 HG23 ILE A 523 8.201 0.754 0.901 1.00 0.00 H new ATOM 0 HD11 ILE A 523 10.854 0.027 4.119 1.00 0.00 H new ATOM 0 HD12 ILE A 523 9.278 0.372 4.870 1.00 0.00 H new ATOM 0 HD13 ILE A 523 9.362 -0.613 3.390 1.00 0.00 H new ATOM 1506 N PHE A 524 5.714 3.646 2.621 1.00 0.00 N ATOM 1507 CA PHE A 524 4.317 3.857 2.269 1.00 0.00 C ATOM 1508 C PHE A 524 4.189 5.069 1.352 1.00 0.00 C ATOM 1509 O PHE A 524 3.531 5.010 0.314 1.00 0.00 O ATOM 1510 CB PHE A 524 3.480 4.072 3.540 1.00 0.00 C ATOM 1511 CG PHE A 524 2.021 3.774 3.252 1.00 0.00 C ATOM 1512 CD1 PHE A 524 1.616 2.462 2.984 1.00 0.00 C ATOM 1513 CD2 PHE A 524 1.077 4.809 3.255 1.00 0.00 C ATOM 1514 CE1 PHE A 524 0.269 2.185 2.720 1.00 0.00 C ATOM 1515 CE2 PHE A 524 -0.269 4.534 2.993 1.00 0.00 C ATOM 1516 CZ PHE A 524 -0.672 3.221 2.724 1.00 0.00 C ATOM 0 H PHE A 524 5.919 3.719 3.618 1.00 0.00 H new ATOM 0 HA PHE A 524 3.947 2.975 1.747 1.00 0.00 H new ATOM 0 HB2 PHE A 524 3.842 3.424 4.339 1.00 0.00 H new ATOM 0 HB3 PHE A 524 3.589 5.099 3.889 1.00 0.00 H new ATOM 0 HD1 PHE A 524 2.342 1.663 2.981 1.00 0.00 H new ATOM 0 HD2 PHE A 524 1.390 5.822 3.460 1.00 0.00 H new ATOM 0 HE1 PHE A 524 -0.044 1.172 2.513 1.00 0.00 H new ATOM 0 HE2 PHE A 524 -0.996 5.333 2.998 1.00 0.00 H new ATOM 0 HZ PHE A 524 -1.711 3.007 2.519 1.00 0.00 H new ATOM 1526 N LYS A 525 4.835 6.162 1.743 1.00 0.00 N ATOM 1527 CA LYS A 525 4.803 7.385 0.952 1.00 0.00 C ATOM 1528 C LYS A 525 5.464 7.165 -0.407 1.00 0.00 C ATOM 1529 O LYS A 525 4.967 7.628 -1.430 1.00 0.00 O ATOM 1530 CB LYS A 525 5.527 8.508 1.701 1.00 0.00 C ATOM 1531 CG LYS A 525 4.658 8.992 2.867 1.00 0.00 C ATOM 1532 CD LYS A 525 5.462 9.966 3.739 1.00 0.00 C ATOM 1533 CE LYS A 525 5.915 11.173 2.900 1.00 0.00 C ATOM 1534 NZ LYS A 525 7.206 10.851 2.230 1.00 0.00 N ATOM 0 H LYS A 525 5.385 6.226 2.600 1.00 0.00 H new ATOM 0 HA LYS A 525 3.762 7.666 0.793 1.00 0.00 H new ATOM 0 HB2 LYS A 525 6.487 8.150 2.074 1.00 0.00 H new ATOM 0 HB3 LYS A 525 5.737 9.335 1.023 1.00 0.00 H new ATOM 0 HG2 LYS A 525 3.762 9.483 2.487 1.00 0.00 H new ATOM 0 HG3 LYS A 525 4.327 8.142 3.464 1.00 0.00 H new ATOM 0 HD2 LYS A 525 4.853 10.304 4.578 1.00 0.00 H new ATOM 0 HD3 LYS A 525 6.330 9.459 4.160 1.00 0.00 H new ATOM 0 HE2 LYS A 525 5.157 11.418 2.156 1.00 0.00 H new ATOM 0 HE3 LYS A 525 6.032 12.050 3.537 1.00 0.00 H new ATOM 0 HZ1 LYS A 525 7.912 11.576 2.470 1.00 0.00 H new ATOM 0 HZ2 LYS A 525 7.541 9.921 2.552 1.00 0.00 H new ATOM 0 HZ3 LYS A 525 7.067 10.832 1.200 1.00 0.00 H new ATOM 1548 N ASN A 526 6.591 6.459 -0.408 1.00 0.00 N ATOM 1549 CA ASN A 526 7.316 6.194 -1.644 1.00 0.00 C ATOM 1550 C ASN A 526 6.464 5.373 -2.608 1.00 0.00 C ATOM 1551 O ASN A 526 6.459 5.621 -3.815 1.00 0.00 O ATOM 1552 CB ASN A 526 8.604 5.432 -1.324 1.00 0.00 C ATOM 1553 CG ASN A 526 9.575 6.336 -0.571 1.00 0.00 C ATOM 1554 OD1 ASN A 526 9.542 7.557 -0.734 1.00 0.00 O ATOM 1555 ND2 ASN A 526 10.440 5.808 0.255 1.00 0.00 N ATOM 0 H ASN A 526 7.019 6.063 0.429 1.00 0.00 H new ATOM 0 HA ASN A 526 7.555 7.146 -2.118 1.00 0.00 H new ATOM 0 HB2 ASN A 526 8.375 4.551 -0.724 1.00 0.00 H new ATOM 0 HB3 ASN A 526 9.065 5.078 -2.246 1.00 0.00 H new ATOM 0 HD21 ASN A 526 11.089 6.407 0.766 1.00 0.00 H new ATOM 0 HD22 ASN A 526 10.466 4.797 0.389 1.00 0.00 H new ATOM 1562 N CYS A 527 5.746 4.396 -2.072 1.00 0.00 N ATOM 1563 CA CYS A 527 4.897 3.545 -2.893 1.00 0.00 C ATOM 1564 C CYS A 527 3.759 4.349 -3.512 1.00 0.00 C ATOM 1565 O CYS A 527 3.542 4.306 -4.718 1.00 0.00 O ATOM 1566 CB CYS A 527 4.315 2.420 -2.037 1.00 0.00 C ATOM 1567 SG CYS A 527 5.663 1.437 -1.335 1.00 0.00 S ATOM 0 H CYS A 527 5.734 4.174 -1.077 1.00 0.00 H new ATOM 0 HA CYS A 527 5.504 3.125 -3.695 1.00 0.00 H new ATOM 0 HB2 CYS A 527 3.701 2.837 -1.239 1.00 0.00 H new ATOM 0 HB3 CYS A 527 3.666 1.787 -2.642 1.00 0.00 H new ATOM 0 HG CYS A 527 6.231 2.103 -0.374 1.00 0.00 H new ATOM 1573 N LEU A 528 3.042 5.091 -2.684 1.00 0.00 N ATOM 1574 CA LEU A 528 1.923 5.889 -3.167 1.00 0.00 C ATOM 1575 C LEU A 528 2.367 6.802 -4.302 1.00 0.00 C ATOM 1576 O LEU A 528 1.637 6.987 -5.276 1.00 0.00 O ATOM 1577 CB LEU A 528 1.353 6.738 -2.030 1.00 0.00 C ATOM 1578 CG LEU A 528 0.700 5.833 -0.973 1.00 0.00 C ATOM 1579 CD1 LEU A 528 0.310 6.682 0.247 1.00 0.00 C ATOM 1580 CD2 LEU A 528 -0.553 5.142 -1.552 1.00 0.00 C ATOM 0 H LEU A 528 3.212 5.159 -1.680 1.00 0.00 H new ATOM 0 HA LEU A 528 1.154 5.210 -3.536 1.00 0.00 H new ATOM 0 HB2 LEU A 528 2.147 7.329 -1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 528 0.618 7.440 -2.423 1.00 0.00 H new ATOM 0 HG LEU A 528 1.411 5.063 -0.675 1.00 0.00 H new ATOM 0 HD11 LEU A 528 -0.154 6.045 1.000 1.00 0.00 H new ATOM 0 HD12 LEU A 528 1.202 7.149 0.666 1.00 0.00 H new ATOM 0 HD13 LEU A 528 -0.395 7.455 -0.058 1.00 0.00 H new ATOM 0 HD21 LEU A 528 -1.002 4.505 -0.790 1.00 0.00 H new ATOM 0 HD22 LEU A 528 -1.274 5.898 -1.864 1.00 0.00 H new ATOM 0 HD23 LEU A 528 -0.269 4.534 -2.411 1.00 0.00 H new ATOM 1592 N LYS A 529 3.561 7.366 -4.176 1.00 0.00 N ATOM 1593 CA LYS A 529 4.081 8.248 -5.208 1.00 0.00 C ATOM 1594 C LYS A 529 4.236 7.503 -6.529 1.00 0.00 C ATOM 1595 O LYS A 529 3.910 8.031 -7.591 1.00 0.00 O ATOM 1596 CB LYS A 529 5.440 8.805 -4.778 1.00 0.00 C ATOM 1597 CG LYS A 529 5.250 9.859 -3.687 1.00 0.00 C ATOM 1598 CD LYS A 529 6.622 10.329 -3.195 1.00 0.00 C ATOM 1599 CE LYS A 529 6.442 11.457 -2.178 1.00 0.00 C ATOM 1600 NZ LYS A 529 7.778 11.902 -1.693 1.00 0.00 N ATOM 0 H LYS A 529 4.181 7.230 -3.378 1.00 0.00 H new ATOM 0 HA LYS A 529 3.374 9.066 -5.347 1.00 0.00 H new ATOM 0 HB2 LYS A 529 6.073 7.998 -4.409 1.00 0.00 H new ATOM 0 HB3 LYS A 529 5.950 9.244 -5.635 1.00 0.00 H new ATOM 0 HG2 LYS A 529 4.681 10.704 -4.076 1.00 0.00 H new ATOM 0 HG3 LYS A 529 4.677 9.443 -2.859 1.00 0.00 H new ATOM 0 HD2 LYS A 529 7.161 9.498 -2.740 1.00 0.00 H new ATOM 0 HD3 LYS A 529 7.222 10.676 -4.036 1.00 0.00 H new ATOM 0 HE2 LYS A 529 5.912 12.293 -2.635 1.00 0.00 H new ATOM 0 HE3 LYS A 529 5.835 11.113 -1.341 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 7.658 12.669 -1.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 8.268 11.103 -1.242 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 8.342 12.245 -2.496 1.00 0.00 H new ATOM 1614 N GLU A 530 4.740 6.272 -6.457 1.00 0.00 N ATOM 1615 CA GLU A 530 4.936 5.470 -7.663 1.00 0.00 C ATOM 1616 C GLU A 530 3.625 4.849 -8.135 1.00 0.00 C ATOM 1617 O GLU A 530 3.262 4.959 -9.306 1.00 0.00 O ATOM 1618 CB GLU A 530 5.956 4.360 -7.390 1.00 0.00 C ATOM 1619 CG GLU A 530 6.254 3.596 -8.686 1.00 0.00 C ATOM 1620 CD GLU A 530 7.263 2.484 -8.421 1.00 0.00 C ATOM 1621 OE1 GLU A 530 7.088 1.774 -7.444 1.00 0.00 O ATOM 1622 OE2 GLU A 530 8.194 2.358 -9.199 1.00 0.00 O ATOM 0 H GLU A 530 5.017 5.813 -5.589 1.00 0.00 H new ATOM 0 HA GLU A 530 5.307 6.129 -8.448 1.00 0.00 H new ATOM 0 HB2 GLU A 530 6.875 4.789 -6.991 1.00 0.00 H new ATOM 0 HB3 GLU A 530 5.569 3.676 -6.635 1.00 0.00 H new ATOM 0 HG2 GLU A 530 5.333 3.173 -9.088 1.00 0.00 H new ATOM 0 HG3 GLU A 530 6.645 4.280 -9.439 1.00 0.00 H new ATOM 1629 N ILE A 531 2.924 4.187 -7.221 1.00 0.00 N ATOM 1630 CA ILE A 531 1.660 3.545 -7.559 1.00 0.00 C ATOM 1631 C ILE A 531 0.630 4.580 -7.999 1.00 0.00 C ATOM 1632 O ILE A 531 -0.069 4.387 -8.993 1.00 0.00 O ATOM 1633 CB ILE A 531 1.138 2.754 -6.352 1.00 0.00 C ATOM 1634 CG1 ILE A 531 2.197 1.732 -5.886 1.00 0.00 C ATOM 1635 CG2 ILE A 531 -0.166 2.036 -6.712 1.00 0.00 C ATOM 1636 CD1 ILE A 531 2.585 0.785 -7.033 1.00 0.00 C ATOM 0 H ILE A 531 3.207 4.081 -6.247 1.00 0.00 H new ATOM 0 HA ILE A 531 1.829 2.859 -8.389 1.00 0.00 H new ATOM 0 HB ILE A 531 0.940 3.451 -5.537 1.00 0.00 H new ATOM 0 HG12 ILE A 531 3.082 2.257 -5.527 1.00 0.00 H new ATOM 0 HG13 ILE A 531 1.807 1.154 -5.048 1.00 0.00 H new ATOM 0 HG21 ILE A 531 -0.525 1.479 -5.847 1.00 0.00 H new ATOM 0 HG22 ILE A 531 -0.916 2.770 -7.008 1.00 0.00 H new ATOM 0 HG23 ILE A 531 0.014 1.348 -7.538 1.00 0.00 H new ATOM 0 HD11 ILE A 531 3.332 0.074 -6.681 1.00 0.00 H new ATOM 0 HD12 ILE A 531 1.702 0.244 -7.373 1.00 0.00 H new ATOM 0 HD13 ILE A 531 2.997 1.364 -7.860 1.00 0.00 H new ATOM 1648 N ASP A 532 0.542 5.679 -7.252 1.00 0.00 N ATOM 1649 CA ASP A 532 -0.411 6.745 -7.572 1.00 0.00 C ATOM 1650 C ASP A 532 0.168 8.113 -7.227 1.00 0.00 C ATOM 1651 O ASP A 532 -0.088 8.652 -6.151 1.00 0.00 O ATOM 1652 CB ASP A 532 -1.710 6.522 -6.797 1.00 0.00 C ATOM 1653 CG ASP A 532 -2.816 7.399 -7.373 1.00 0.00 C ATOM 1654 OD1 ASP A 532 -2.492 8.411 -7.970 1.00 0.00 O ATOM 1655 OD2 ASP A 532 -3.972 7.043 -7.211 1.00 0.00 O ATOM 0 H ASP A 532 1.114 5.856 -6.426 1.00 0.00 H new ATOM 0 HA ASP A 532 -0.614 6.718 -8.643 1.00 0.00 H new ATOM 0 HB2 ASP A 532 -2.001 5.473 -6.852 1.00 0.00 H new ATOM 0 HB3 ASP A 532 -1.560 6.757 -5.743 1.00 0.00 H new ATOM 1660 N SER A 533 0.946 8.671 -8.154 1.00 0.00 N ATOM 1661 CA SER A 533 1.548 9.984 -7.942 1.00 0.00 C ATOM 1662 C SER A 533 0.459 11.041 -7.802 1.00 0.00 C ATOM 1663 O SER A 533 0.606 12.007 -7.053 1.00 0.00 O ATOM 1664 CB SER A 533 2.464 10.339 -9.115 1.00 0.00 C ATOM 1665 OG SER A 533 1.683 10.519 -10.287 1.00 0.00 O ATOM 0 H SER A 533 1.172 8.239 -9.050 1.00 0.00 H new ATOM 0 HA SER A 533 2.138 9.955 -7.026 1.00 0.00 H new ATOM 0 HB2 SER A 533 3.021 11.249 -8.893 1.00 0.00 H new ATOM 0 HB3 SER A 533 3.196 9.547 -9.271 1.00 0.00 H new ATOM 0 HG SER A 533 2.269 10.748 -11.038 1.00 0.00 H new ATOM 1671 N THR A 534 -0.636 10.842 -8.525 1.00 0.00 N ATOM 1672 CA THR A 534 -1.755 11.775 -8.478 1.00 0.00 C ATOM 1673 C THR A 534 -2.327 11.851 -7.066 1.00 0.00 C ATOM 1674 O THR A 534 -2.642 12.935 -6.574 1.00 0.00 O ATOM 1675 CB THR A 534 -2.848 11.332 -9.453 1.00 0.00 C ATOM 1676 OG1 THR A 534 -2.269 11.065 -10.722 1.00 0.00 O ATOM 1677 CG2 THR A 534 -3.892 12.441 -9.588 1.00 0.00 C ATOM 0 H THR A 534 -0.773 10.046 -9.148 1.00 0.00 H new ATOM 0 HA THR A 534 -1.394 12.762 -8.766 1.00 0.00 H new ATOM 0 HB THR A 534 -3.328 10.429 -9.076 1.00 0.00 H new ATOM 0 HG1 THR A 534 -2.968 10.779 -11.347 1.00 0.00 H new ATOM 0 HG21 THR A 534 -4.670 12.125 -10.283 1.00 0.00 H new ATOM 0 HG22 THR A 534 -4.336 12.644 -8.613 1.00 0.00 H new ATOM 0 HG23 THR A 534 -3.415 13.346 -9.965 1.00 0.00 H new ATOM 1685 N LEU A 535 -2.471 10.697 -6.424 1.00 0.00 N ATOM 1686 CA LEU A 535 -3.020 10.657 -5.074 1.00 0.00 C ATOM 1687 C LEU A 535 -2.131 11.445 -4.119 1.00 0.00 C ATOM 1688 O LEU A 535 -2.622 12.211 -3.296 1.00 0.00 O ATOM 1689 CB LEU A 535 -3.131 9.202 -4.593 1.00 0.00 C ATOM 1690 CG LEU A 535 -3.749 9.144 -3.186 1.00 0.00 C ATOM 1691 CD1 LEU A 535 -5.197 9.665 -3.213 1.00 0.00 C ATOM 1692 CD2 LEU A 535 -3.735 7.694 -2.691 1.00 0.00 C ATOM 0 H LEU A 535 -2.219 9.787 -6.811 1.00 0.00 H new ATOM 0 HA LEU A 535 -4.013 11.107 -5.089 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -3.743 8.629 -5.289 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -2.144 8.740 -4.582 1.00 0.00 H new ATOM 0 HG LEU A 535 -3.165 9.773 -2.514 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -5.620 9.617 -2.209 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -5.206 10.698 -3.562 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -5.793 9.050 -3.887 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -4.172 7.646 -1.694 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -4.315 7.071 -3.372 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -2.708 7.332 -2.655 1.00 0.00 H new ATOM 1704 N TYR A 536 -0.822 11.252 -4.232 1.00 0.00 N ATOM 1705 CA TYR A 536 0.119 11.954 -3.370 1.00 0.00 C ATOM 1706 C TYR A 536 0.052 13.461 -3.609 1.00 0.00 C ATOM 1707 O TYR A 536 0.221 14.256 -2.683 1.00 0.00 O ATOM 1708 CB TYR A 536 1.542 11.461 -3.633 1.00 0.00 C ATOM 1709 CG TYR A 536 2.506 12.232 -2.764 1.00 0.00 C ATOM 1710 CD1 TYR A 536 2.812 11.770 -1.480 1.00 0.00 C ATOM 1711 CD2 TYR A 536 3.090 13.411 -3.241 1.00 0.00 C ATOM 1712 CE1 TYR A 536 3.703 12.486 -0.672 1.00 0.00 C ATOM 1713 CE2 TYR A 536 3.981 14.127 -2.435 1.00 0.00 C ATOM 1714 CZ TYR A 536 4.288 13.666 -1.148 1.00 0.00 C ATOM 1715 OH TYR A 536 5.168 14.370 -0.353 1.00 0.00 O ATOM 0 H TYR A 536 -0.391 10.620 -4.907 1.00 0.00 H new ATOM 0 HA TYR A 536 -0.152 11.749 -2.334 1.00 0.00 H new ATOM 0 HB2 TYR A 536 1.615 10.395 -3.419 1.00 0.00 H new ATOM 0 HB3 TYR A 536 1.797 11.594 -4.685 1.00 0.00 H new ATOM 0 HD1 TYR A 536 2.361 10.861 -1.112 1.00 0.00 H new ATOM 0 HD2 TYR A 536 2.852 13.768 -4.232 1.00 0.00 H new ATOM 0 HE1 TYR A 536 3.939 12.128 0.319 1.00 0.00 H new ATOM 0 HE2 TYR A 536 4.433 15.036 -2.805 1.00 0.00 H new ATOM 0 HH TYR A 536 5.482 15.163 -0.836 1.00 0.00 H new ATOM 1725 N LYS A 537 -0.174 13.846 -4.860 1.00 0.00 N ATOM 1726 CA LYS A 537 -0.241 15.259 -5.217 1.00 0.00 C ATOM 1727 C LYS A 537 -1.479 15.928 -4.614 1.00 0.00 C ATOM 1728 O LYS A 537 -1.566 17.152 -4.564 1.00 0.00 O ATOM 1729 CB LYS A 537 -0.258 15.409 -6.743 1.00 0.00 C ATOM 1730 CG LYS A 537 -0.148 16.889 -7.123 1.00 0.00 C ATOM 1731 CD LYS A 537 -0.035 17.026 -8.642 1.00 0.00 C ATOM 1732 CE LYS A 537 0.098 18.503 -9.013 1.00 0.00 C ATOM 1733 NZ LYS A 537 0.220 18.634 -10.494 1.00 0.00 N ATOM 0 H LYS A 537 -0.313 13.204 -5.640 1.00 0.00 H new ATOM 0 HA LYS A 537 0.641 15.753 -4.810 1.00 0.00 H new ATOM 0 HB2 LYS A 537 0.569 14.850 -7.181 1.00 0.00 H new ATOM 0 HB3 LYS A 537 -1.178 14.988 -7.148 1.00 0.00 H new ATOM 0 HG2 LYS A 537 -1.022 17.432 -6.764 1.00 0.00 H new ATOM 0 HG3 LYS A 537 0.724 17.334 -6.643 1.00 0.00 H new ATOM 0 HD2 LYS A 537 0.830 16.470 -9.004 1.00 0.00 H new ATOM 0 HD3 LYS A 537 -0.914 16.597 -9.123 1.00 0.00 H new ATOM 0 HE2 LYS A 537 -0.771 19.058 -8.658 1.00 0.00 H new ATOM 0 HE3 LYS A 537 0.972 18.934 -8.526 1.00 0.00 H new ATOM 0 HZ1 LYS A 537 0.311 19.639 -10.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 537 1.062 18.117 -10.820 1.00 0.00 H new ATOM 0 HZ3 LYS A 537 -0.627 18.237 -10.949 1.00 0.00 H new ATOM 1747 N ASN A 538 -2.441 15.122 -4.156 1.00 0.00 N ATOM 1748 CA ASN A 538 -3.672 15.662 -3.557 1.00 0.00 C ATOM 1749 C ASN A 538 -3.833 15.190 -2.113 1.00 0.00 C ATOM 1750 O ASN A 538 -4.786 15.569 -1.432 1.00 0.00 O ATOM 1751 CB ASN A 538 -4.885 15.219 -4.382 1.00 0.00 C ATOM 1752 CG ASN A 538 -5.019 13.701 -4.355 1.00 0.00 C ATOM 1753 OD1 ASN A 538 -4.824 13.079 -3.311 1.00 0.00 O ATOM 1754 ND2 ASN A 538 -5.339 13.063 -5.448 1.00 0.00 N ATOM 0 H ASN A 538 -2.396 14.103 -4.186 1.00 0.00 H new ATOM 0 HA ASN A 538 -3.604 16.750 -3.557 1.00 0.00 H new ATOM 0 HB2 ASN A 538 -5.790 15.678 -3.985 1.00 0.00 H new ATOM 0 HB3 ASN A 538 -4.779 15.563 -5.411 1.00 0.00 H new ATOM 0 HD21 ASN A 538 -5.428 12.047 -5.438 1.00 0.00 H new ATOM 0 HD22 ASN A 538 -5.500 13.581 -6.312 1.00 0.00 H new ATOM 1761 N LEU A 539 -2.905 14.352 -1.653 1.00 0.00 N ATOM 1762 CA LEU A 539 -2.961 13.827 -0.288 1.00 0.00 C ATOM 1763 C LEU A 539 -2.205 14.729 0.687 1.00 0.00 C ATOM 1764 O LEU A 539 -2.744 15.126 1.720 1.00 0.00 O ATOM 1765 CB LEU A 539 -2.356 12.418 -0.252 1.00 0.00 C ATOM 1766 CG LEU A 539 -2.533 11.779 1.139 1.00 0.00 C ATOM 1767 CD1 LEU A 539 -4.029 11.634 1.480 1.00 0.00 C ATOM 1768 CD2 LEU A 539 -1.871 10.393 1.140 1.00 0.00 C ATOM 0 H LEU A 539 -2.110 14.023 -2.201 1.00 0.00 H new ATOM 0 HA LEU A 539 -4.007 13.793 0.018 1.00 0.00 H new ATOM 0 HB2 LEU A 539 -2.834 11.793 -1.007 1.00 0.00 H new ATOM 0 HB3 LEU A 539 -1.296 12.466 -0.502 1.00 0.00 H new ATOM 0 HG LEU A 539 -2.066 12.419 1.888 1.00 0.00 H new ATOM 0 HD11 LEU A 539 -4.135 11.181 2.466 1.00 0.00 H new ATOM 0 HD12 LEU A 539 -4.499 12.617 1.480 1.00 0.00 H new ATOM 0 HD13 LEU A 539 -4.512 11.001 0.736 1.00 0.00 H new ATOM 0 HD21 LEU A 539 -1.991 9.933 2.121 1.00 0.00 H new ATOM 0 HD22 LEU A 539 -2.342 9.764 0.384 1.00 0.00 H new ATOM 0 HD23 LEU A 539 -0.809 10.497 0.916 1.00 0.00 H new ATOM 1780 N PHE A 540 -0.946 15.038 0.357 1.00 0.00 N ATOM 1781 CA PHE A 540 -0.109 15.883 1.218 1.00 0.00 C ATOM 1782 C PHE A 540 -0.084 17.333 0.739 1.00 0.00 C ATOM 1783 O PHE A 540 -0.221 18.258 1.539 1.00 0.00 O ATOM 1784 CB PHE A 540 1.322 15.339 1.235 1.00 0.00 C ATOM 1785 CG PHE A 540 1.362 14.038 2.003 1.00 0.00 C ATOM 1786 CD1 PHE A 540 1.500 14.055 3.396 1.00 0.00 C ATOM 1787 CD2 PHE A 540 1.256 12.818 1.325 1.00 0.00 C ATOM 1788 CE1 PHE A 540 1.538 12.852 4.112 1.00 0.00 C ATOM 1789 CE2 PHE A 540 1.292 11.614 2.042 1.00 0.00 C ATOM 1790 CZ PHE A 540 1.431 11.632 3.435 1.00 0.00 C ATOM 0 H PHE A 540 -0.486 14.718 -0.495 1.00 0.00 H new ATOM 0 HA PHE A 540 -0.538 15.862 2.220 1.00 0.00 H new ATOM 0 HB2 PHE A 540 1.674 15.182 0.215 1.00 0.00 H new ATOM 0 HB3 PHE A 540 1.992 16.065 1.695 1.00 0.00 H new ATOM 0 HD1 PHE A 540 1.577 14.997 3.919 1.00 0.00 H new ATOM 0 HD2 PHE A 540 1.147 12.804 0.251 1.00 0.00 H new ATOM 0 HE1 PHE A 540 1.650 12.866 5.186 1.00 0.00 H new ATOM 0 HE2 PHE A 540 1.212 10.672 1.520 1.00 0.00 H new ATOM 0 HZ PHE A 540 1.456 10.704 3.987 1.00 0.00 H new ATOM 1800 N VAL A 541 0.116 17.531 -0.560 1.00 0.00 N ATOM 1801 CA VAL A 541 0.179 18.879 -1.117 1.00 0.00 C ATOM 1802 C VAL A 541 -1.171 19.587 -1.017 1.00 0.00 C ATOM 1803 O VAL A 541 -1.454 20.269 -0.031 1.00 0.00 O ATOM 1804 CB VAL A 541 0.619 18.814 -2.581 1.00 0.00 C ATOM 1805 CG1 VAL A 541 0.661 20.222 -3.177 1.00 0.00 C ATOM 1806 CG2 VAL A 541 2.009 18.181 -2.671 1.00 0.00 C ATOM 0 H VAL A 541 0.236 16.783 -1.242 1.00 0.00 H new ATOM 0 HA VAL A 541 0.905 19.450 -0.538 1.00 0.00 H new ATOM 0 HB VAL A 541 -0.095 18.209 -3.141 1.00 0.00 H new ATOM 0 HG11 VAL A 541 0.975 20.167 -4.219 1.00 0.00 H new ATOM 0 HG12 VAL A 541 -0.331 20.671 -3.120 1.00 0.00 H new ATOM 0 HG13 VAL A 541 1.369 20.833 -2.617 1.00 0.00 H new ATOM 0 HG21 VAL A 541 2.321 18.135 -3.714 1.00 0.00 H new ATOM 0 HG22 VAL A 541 2.720 18.783 -2.105 1.00 0.00 H new ATOM 0 HG23 VAL A 541 1.977 17.173 -2.257 1.00 0.00 H new