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 534 THR OG1 : rot 180:sc= 0 USER MOD Set 1.2: A 538 ASN : amide:sc= -2.62! K(o=-2.6!,f=-1.5) USER MOD Set 2.1: A 529 LYS NZ :NH3+ -156:sc= -1.91! (180deg=-3.69!) USER MOD Set 2.2: A 536 TYR OH : rot 180:sc= 0 USER MOD Set 3.1: A 481 ASN : amide:sc= -0.351! C(o=-1.8!,f=-5.1!) USER MOD Set 3.2: A 527 CYS SG : rot 88:sc= -1.46! USER MOD Set 4.1: A 470 GLN : amide:sc= -2.14! K(o=-4.1!,f=-0.12) USER MOD Set 4.2: A 471 GLN : amide:sc= -1.98! K(o=-4.1!,f=0.27) USER MOD Single : A 459 SER OG : rot 180:sc= -0.408 USER MOD Single : A 463 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 464 ASN : amide:sc= -3.48! C(o=-3.5!,f=-3.3!) USER MOD Single : A 466 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 473 THR OG1 : rot 180:sc= 0 USER MOD Single : A 474 CYS SG : rot 57:sc= 0.00113 USER MOD Single : A 484 LYS NZ :NH3+ -161:sc= -0.028 (180deg=-0.409) USER MOD Single : A 486 ASN : amide:sc= -10.1! C(o=-10!,f=-10!) USER MOD Single : A 489 ASN : amide:sc= -9.56! K(o=-9.6!,f=-0.3) USER MOD Single : A 490 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 491 GLN : amide:sc= -5.13! K(o=-5.1!,f=-2.3) USER MOD Single : A 493 HIS : no HE2:sc= -1.24 K(o=-1.2,f=-4) USER MOD Single : A 501 GLN : amide:sc= 0 K(o=0,f=-1.4!) USER MOD Single : A 505 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 512 THR OG1 : rot -40:sc= 0.303 USER MOD Single : A 516 LYS NZ :NH3+ -136:sc= -3.75! (180deg=-7.76!) USER MOD Single : A 518 ASN : amide:sc= -0.691 K(o=-0.69,f=-0.0022) USER MOD Single : A 522 ASN : amide:sc= -2.27! K(o=-2.3!,f=-0.081) USER MOD Single : A 525 LYS NZ :NH3+ -124:sc= -0.0757 (180deg=-0.456) USER MOD Single : A 526 ASN : amide:sc= -1.58! X(o=-1.6!,f=-1.4) USER MOD Single : A 533 SER OG : rot 180:sc= 0 USER MOD Single : A 537 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 385 N ASP A 456 4.716 14.912 11.574 1.00 0.00 N ATOM 386 CA ASP A 456 3.268 14.911 11.442 1.00 0.00 C ATOM 387 C ASP A 456 2.843 13.876 10.410 1.00 0.00 C ATOM 388 O ASP A 456 1.696 13.442 10.385 1.00 0.00 O ATOM 389 CB ASP A 456 2.777 16.296 11.014 1.00 0.00 C ATOM 390 CG ASP A 456 3.527 16.754 9.768 1.00 0.00 C ATOM 391 OD1 ASP A 456 4.247 15.945 9.204 1.00 0.00 O ATOM 392 OD2 ASP A 456 3.377 17.905 9.399 1.00 0.00 O ATOM 0 HA ASP A 456 2.827 14.660 12.407 1.00 0.00 H new ATOM 0 HB2 ASP A 456 1.706 16.265 10.813 1.00 0.00 H new ATOM 0 HB3 ASP A 456 2.929 17.011 11.823 1.00 0.00 H new ATOM 397 N ASP A 457 3.787 13.477 9.567 1.00 0.00 N ATOM 398 CA ASP A 457 3.511 12.487 8.536 1.00 0.00 C ATOM 399 C ASP A 457 2.793 11.283 9.129 1.00 0.00 C ATOM 400 O ASP A 457 1.866 10.743 8.525 1.00 0.00 O ATOM 401 CB ASP A 457 4.824 12.032 7.896 1.00 0.00 C ATOM 402 CG ASP A 457 5.393 13.146 7.025 1.00 0.00 C ATOM 403 OD1 ASP A 457 4.698 14.128 6.822 1.00 0.00 O ATOM 404 OD2 ASP A 457 6.517 13.002 6.574 1.00 0.00 O ATOM 0 H ASP A 457 4.747 13.823 9.577 1.00 0.00 H new ATOM 0 HA ASP A 457 2.870 12.941 7.780 1.00 0.00 H new ATOM 0 HB2 ASP A 457 5.542 11.763 8.671 1.00 0.00 H new ATOM 0 HB3 ASP A 457 4.655 11.139 7.294 1.00 0.00 H new ATOM 409 N LEU A 458 3.222 10.865 10.313 1.00 0.00 N ATOM 410 CA LEU A 458 2.603 9.722 10.964 1.00 0.00 C ATOM 411 C LEU A 458 1.130 10.008 11.242 1.00 0.00 C ATOM 412 O LEU A 458 0.272 9.150 11.035 1.00 0.00 O ATOM 413 CB LEU A 458 3.330 9.411 12.279 1.00 0.00 C ATOM 414 CG LEU A 458 2.658 8.231 13.004 1.00 0.00 C ATOM 415 CD1 LEU A 458 2.634 6.990 12.099 1.00 0.00 C ATOM 416 CD2 LEU A 458 3.445 7.918 14.281 1.00 0.00 C ATOM 0 H LEU A 458 3.986 11.295 10.835 1.00 0.00 H new ATOM 0 HA LEU A 458 2.676 8.859 10.302 1.00 0.00 H new ATOM 0 HB2 LEU A 458 4.374 9.173 12.076 1.00 0.00 H new ATOM 0 HB3 LEU A 458 3.323 10.291 12.922 1.00 0.00 H new ATOM 0 HG LEU A 458 1.632 8.501 13.253 1.00 0.00 H new ATOM 0 HD11 LEU A 458 2.156 6.164 12.626 1.00 0.00 H new ATOM 0 HD12 LEU A 458 2.075 7.213 11.190 1.00 0.00 H new ATOM 0 HD13 LEU A 458 3.655 6.711 11.837 1.00 0.00 H new ATOM 0 HD21 LEU A 458 2.976 7.083 14.802 1.00 0.00 H new ATOM 0 HD22 LEU A 458 4.470 7.654 14.021 1.00 0.00 H new ATOM 0 HD23 LEU A 458 3.449 8.794 14.930 1.00 0.00 H new ATOM 428 N SER A 459 0.841 11.219 11.715 1.00 0.00 N ATOM 429 CA SER A 459 -0.535 11.601 12.020 1.00 0.00 C ATOM 430 C SER A 459 -1.400 11.568 10.763 1.00 0.00 C ATOM 431 O SER A 459 -2.526 11.075 10.790 1.00 0.00 O ATOM 432 CB SER A 459 -0.568 13.004 12.629 1.00 0.00 C ATOM 433 OG SER A 459 -1.905 13.484 12.620 1.00 0.00 O ATOM 0 H SER A 459 1.534 11.946 11.894 1.00 0.00 H new ATOM 0 HA SER A 459 -0.935 10.884 12.737 1.00 0.00 H new ATOM 0 HB2 SER A 459 -0.184 12.980 13.649 1.00 0.00 H new ATOM 0 HB3 SER A 459 0.076 13.675 12.061 1.00 0.00 H new ATOM 0 HG SER A 459 -1.933 14.382 13.011 1.00 0.00 H new ATOM 439 N LEU A 460 -0.873 12.099 9.664 1.00 0.00 N ATOM 440 CA LEU A 460 -1.617 12.129 8.406 1.00 0.00 C ATOM 441 C LEU A 460 -1.938 10.710 7.935 1.00 0.00 C ATOM 442 O LEU A 460 -3.054 10.438 7.490 1.00 0.00 O ATOM 443 CB LEU A 460 -0.790 12.872 7.336 1.00 0.00 C ATOM 444 CG LEU A 460 -1.062 14.392 7.391 1.00 0.00 C ATOM 445 CD1 LEU A 460 -2.466 14.717 6.838 1.00 0.00 C ATOM 446 CD2 LEU A 460 -0.944 14.896 8.839 1.00 0.00 C ATOM 0 H LEU A 460 0.059 12.512 9.617 1.00 0.00 H new ATOM 0 HA LEU A 460 -2.558 12.655 8.565 1.00 0.00 H new ATOM 0 HB2 LEU A 460 0.272 12.682 7.494 1.00 0.00 H new ATOM 0 HB3 LEU A 460 -1.039 12.489 6.346 1.00 0.00 H new ATOM 0 HG LEU A 460 -0.320 14.896 6.772 1.00 0.00 H new ATOM 0 HD11 LEU A 460 -2.636 15.793 6.886 1.00 0.00 H new ATOM 0 HD12 LEU A 460 -2.535 14.385 5.802 1.00 0.00 H new ATOM 0 HD13 LEU A 460 -3.220 14.203 7.435 1.00 0.00 H new ATOM 0 HD21 LEU A 460 -1.137 15.968 8.868 1.00 0.00 H new ATOM 0 HD22 LEU A 460 -1.672 14.379 9.465 1.00 0.00 H new ATOM 0 HD23 LEU A 460 0.061 14.698 9.212 1.00 0.00 H new ATOM 458 N ILE A 461 -0.969 9.810 8.037 1.00 0.00 N ATOM 459 CA ILE A 461 -1.181 8.429 7.617 1.00 0.00 C ATOM 460 C ILE A 461 -2.255 7.771 8.481 1.00 0.00 C ATOM 461 O ILE A 461 -3.126 7.065 7.972 1.00 0.00 O ATOM 462 CB ILE A 461 0.133 7.648 7.726 1.00 0.00 C ATOM 463 CG1 ILE A 461 1.126 8.187 6.693 1.00 0.00 C ATOM 464 CG2 ILE A 461 -0.123 6.164 7.452 1.00 0.00 C ATOM 465 CD1 ILE A 461 2.516 7.607 6.966 1.00 0.00 C ATOM 0 H ILE A 461 -0.037 10.007 8.403 1.00 0.00 H new ATOM 0 HA ILE A 461 -1.517 8.422 6.580 1.00 0.00 H new ATOM 0 HB ILE A 461 0.541 7.765 8.730 1.00 0.00 H new ATOM 0 HG12 ILE A 461 0.801 7.921 5.687 1.00 0.00 H new ATOM 0 HG13 ILE A 461 1.160 9.276 6.739 1.00 0.00 H new ATOM 0 HG21 ILE A 461 0.814 5.613 7.531 1.00 0.00 H new ATOM 0 HG22 ILE A 461 -0.834 5.777 8.182 1.00 0.00 H new ATOM 0 HG23 ILE A 461 -0.531 6.044 6.448 1.00 0.00 H new ATOM 0 HD11 ILE A 461 3.222 7.992 6.230 1.00 0.00 H new ATOM 0 HD12 ILE A 461 2.841 7.896 7.966 1.00 0.00 H new ATOM 0 HD13 ILE A 461 2.477 6.520 6.897 1.00 0.00 H new ATOM 477 N ARG A 462 -2.186 8.003 9.789 1.00 0.00 N ATOM 478 CA ARG A 462 -3.156 7.420 10.710 1.00 0.00 C ATOM 479 C ARG A 462 -4.557 7.964 10.438 1.00 0.00 C ATOM 480 O ARG A 462 -5.532 7.219 10.452 1.00 0.00 O ATOM 481 CB ARG A 462 -2.759 7.736 12.154 1.00 0.00 C ATOM 482 CG ARG A 462 -1.519 6.925 12.535 1.00 0.00 C ATOM 483 CD ARG A 462 -1.112 7.260 13.971 1.00 0.00 C ATOM 484 NE ARG A 462 -0.639 8.637 14.053 1.00 0.00 N ATOM 485 CZ ARG A 462 -0.223 9.155 15.204 1.00 0.00 C ATOM 486 NH1 ARG A 462 -0.233 8.428 16.288 1.00 0.00 N ATOM 487 NH2 ARG A 462 0.194 10.391 15.250 1.00 0.00 N ATOM 0 H ARG A 462 -1.475 8.585 10.232 1.00 0.00 H new ATOM 0 HA ARG A 462 -3.164 6.340 10.559 1.00 0.00 H new ATOM 0 HB2 ARG A 462 -2.556 8.802 12.261 1.00 0.00 H new ATOM 0 HB3 ARG A 462 -3.582 7.499 12.828 1.00 0.00 H new ATOM 0 HG2 ARG A 462 -1.727 5.859 12.444 1.00 0.00 H new ATOM 0 HG3 ARG A 462 -0.700 7.150 11.852 1.00 0.00 H new ATOM 0 HD2 ARG A 462 -1.961 7.119 14.640 1.00 0.00 H new ATOM 0 HD3 ARG A 462 -0.329 6.579 14.303 1.00 0.00 H new ATOM 0 HE ARG A 462 -0.627 9.213 13.211 1.00 0.00 H new ATOM 0 HH11 ARG A 462 -0.560 7.463 16.252 1.00 0.00 H new ATOM 0 HH12 ARG A 462 0.086 8.825 17.172 1.00 0.00 H new ATOM 0 HH21 ARG A 462 0.200 10.959 14.403 1.00 0.00 H new ATOM 0 HH22 ARG A 462 0.513 10.789 16.133 1.00 0.00 H new ATOM 501 N LYS A 463 -4.652 9.267 10.193 1.00 0.00 N ATOM 502 CA LYS A 463 -5.944 9.890 9.919 1.00 0.00 C ATOM 503 C LYS A 463 -6.546 9.377 8.614 1.00 0.00 C ATOM 504 O LYS A 463 -7.756 9.177 8.520 1.00 0.00 O ATOM 505 CB LYS A 463 -5.794 11.413 9.860 1.00 0.00 C ATOM 506 CG LYS A 463 -5.540 11.956 11.269 1.00 0.00 C ATOM 507 CD LYS A 463 -5.387 13.476 11.208 1.00 0.00 C ATOM 508 CE LYS A 463 -5.125 14.021 12.611 1.00 0.00 C ATOM 509 NZ LYS A 463 -4.964 15.502 12.541 1.00 0.00 N ATOM 0 H LYS A 463 -3.858 9.908 10.178 1.00 0.00 H new ATOM 0 HA LYS A 463 -6.620 9.624 10.731 1.00 0.00 H new ATOM 0 HB2 LYS A 463 -4.969 11.683 9.201 1.00 0.00 H new ATOM 0 HB3 LYS A 463 -6.695 11.862 9.443 1.00 0.00 H new ATOM 0 HG2 LYS A 463 -6.366 11.689 11.928 1.00 0.00 H new ATOM 0 HG3 LYS A 463 -4.640 11.505 11.687 1.00 0.00 H new ATOM 0 HD2 LYS A 463 -4.565 13.743 10.544 1.00 0.00 H new ATOM 0 HD3 LYS A 463 -6.289 13.926 10.795 1.00 0.00 H new ATOM 0 HE2 LYS A 463 -5.951 13.764 13.274 1.00 0.00 H new ATOM 0 HE3 LYS A 463 -4.228 13.565 13.029 1.00 0.00 H new ATOM 0 HZ1 LYS A 463 -4.785 15.877 13.494 1.00 0.00 H new ATOM 0 HZ2 LYS A 463 -4.162 15.735 11.921 1.00 0.00 H new ATOM 0 HZ3 LYS A 463 -5.832 15.928 12.158 1.00 0.00 H new ATOM 523 N ASN A 464 -5.699 9.181 7.604 1.00 0.00 N ATOM 524 CA ASN A 464 -6.167 8.709 6.301 1.00 0.00 C ATOM 525 C ASN A 464 -6.195 7.184 6.243 1.00 0.00 C ATOM 526 O ASN A 464 -6.455 6.600 5.190 1.00 0.00 O ATOM 527 CB ASN A 464 -5.247 9.241 5.203 1.00 0.00 C ATOM 528 CG ASN A 464 -5.405 10.753 5.079 1.00 0.00 C ATOM 529 OD1 ASN A 464 -6.443 11.299 5.450 1.00 0.00 O ATOM 530 ND2 ASN A 464 -4.429 11.464 4.585 1.00 0.00 N ATOM 0 H ASN A 464 -4.693 9.340 7.661 1.00 0.00 H new ATOM 0 HA ASN A 464 -7.182 9.078 6.150 1.00 0.00 H new ATOM 0 HB2 ASN A 464 -4.211 8.993 5.433 1.00 0.00 H new ATOM 0 HB3 ASN A 464 -5.486 8.763 4.253 1.00 0.00 H new ATOM 0 HD21 ASN A 464 -4.525 12.476 4.505 1.00 0.00 H new ATOM 0 HD22 ASN A 464 -3.570 11.008 4.278 1.00 0.00 H new ATOM 537 N ARG A 465 -5.925 6.541 7.374 1.00 0.00 N ATOM 538 CA ARG A 465 -5.929 5.081 7.421 1.00 0.00 C ATOM 539 C ARG A 465 -7.323 4.541 7.100 1.00 0.00 C ATOM 540 O ARG A 465 -7.474 3.595 6.327 1.00 0.00 O ATOM 541 CB ARG A 465 -5.477 4.602 8.818 1.00 0.00 C ATOM 542 CG ARG A 465 -6.639 4.677 9.823 1.00 0.00 C ATOM 543 CD ARG A 465 -6.123 4.400 11.238 1.00 0.00 C ATOM 544 NE ARG A 465 -7.227 4.484 12.191 1.00 0.00 N ATOM 545 CZ ARG A 465 -8.001 3.432 12.447 1.00 0.00 C ATOM 546 NH1 ARG A 465 -7.779 2.293 11.849 1.00 0.00 N ATOM 547 NH2 ARG A 465 -8.988 3.540 13.295 1.00 0.00 N ATOM 0 H ARG A 465 -5.704 6.998 8.259 1.00 0.00 H new ATOM 0 HA ARG A 465 -5.233 4.701 6.673 1.00 0.00 H new ATOM 0 HB2 ARG A 465 -5.110 3.578 8.755 1.00 0.00 H new ATOM 0 HB3 ARG A 465 -4.648 5.217 9.168 1.00 0.00 H new ATOM 0 HG2 ARG A 465 -7.103 5.662 9.782 1.00 0.00 H new ATOM 0 HG3 ARG A 465 -7.408 3.951 9.558 1.00 0.00 H new ATOM 0 HD2 ARG A 465 -5.667 3.411 11.282 1.00 0.00 H new ATOM 0 HD3 ARG A 465 -5.348 5.120 11.500 1.00 0.00 H new ATOM 0 HE ARG A 465 -7.408 5.366 12.670 1.00 0.00 H new ATOM 0 HH11 ARG A 465 -7.011 2.208 11.184 1.00 0.00 H new ATOM 0 HH12 ARG A 465 -8.374 1.488 12.047 1.00 0.00 H new ATOM 0 HH21 ARG A 465 -9.165 4.430 13.761 1.00 0.00 H new ATOM 0 HH22 ARG A 465 -9.582 2.734 13.492 1.00 0.00 H new ATOM 561 N MET A 466 -8.336 5.148 7.713 1.00 0.00 N ATOM 562 CA MET A 466 -9.711 4.713 7.498 1.00 0.00 C ATOM 563 C MET A 466 -10.144 4.964 6.057 1.00 0.00 C ATOM 564 O MET A 466 -10.756 4.101 5.435 1.00 0.00 O ATOM 565 CB MET A 466 -10.654 5.451 8.456 1.00 0.00 C ATOM 566 CG MET A 466 -12.062 4.849 8.371 1.00 0.00 C ATOM 567 SD MET A 466 -12.062 3.205 9.128 1.00 0.00 S ATOM 568 CE MET A 466 -13.828 3.133 9.519 1.00 0.00 C ATOM 0 H MET A 466 -8.232 5.934 8.355 1.00 0.00 H new ATOM 0 HA MET A 466 -9.761 3.642 7.694 1.00 0.00 H new ATOM 0 HB2 MET A 466 -10.279 5.378 9.477 1.00 0.00 H new ATOM 0 HB3 MET A 466 -10.687 6.511 8.203 1.00 0.00 H new ATOM 0 HG2 MET A 466 -12.777 5.495 8.880 1.00 0.00 H new ATOM 0 HG3 MET A 466 -12.378 4.782 7.330 1.00 0.00 H new ATOM 0 HE1 MET A 466 -14.055 2.183 10.003 1.00 0.00 H new ATOM 0 HE2 MET A 466 -14.086 3.952 10.190 1.00 0.00 H new ATOM 0 HE3 MET A 466 -14.408 3.220 8.600 1.00 0.00 H new ATOM 578 N ALA A 467 -9.827 6.148 5.537 1.00 0.00 N ATOM 579 CA ALA A 467 -10.199 6.498 4.172 1.00 0.00 C ATOM 580 C ALA A 467 -9.578 5.525 3.180 1.00 0.00 C ATOM 581 O ALA A 467 -10.238 5.069 2.246 1.00 0.00 O ATOM 582 CB ALA A 467 -9.731 7.918 3.852 1.00 0.00 C ATOM 0 H ALA A 467 -9.317 6.875 6.038 1.00 0.00 H new ATOM 0 HA ALA A 467 -11.284 6.443 4.087 1.00 0.00 H new ATOM 0 HB1 ALA A 467 -10.013 8.172 2.830 1.00 0.00 H new ATOM 0 HB2 ALA A 467 -10.199 8.620 4.543 1.00 0.00 H new ATOM 0 HB3 ALA A 467 -8.647 7.976 3.955 1.00 0.00 H new ATOM 588 N LEU A 468 -8.304 5.215 3.382 1.00 0.00 N ATOM 589 CA LEU A 468 -7.604 4.298 2.495 1.00 0.00 C ATOM 590 C LEU A 468 -8.204 2.895 2.591 1.00 0.00 C ATOM 591 O LEU A 468 -8.307 2.185 1.591 1.00 0.00 O ATOM 592 CB LEU A 468 -6.109 4.259 2.846 1.00 0.00 C ATOM 593 CG LEU A 468 -5.294 3.730 1.644 1.00 0.00 C ATOM 594 CD1 LEU A 468 -4.931 4.888 0.705 1.00 0.00 C ATOM 595 CD2 LEU A 468 -4.003 3.074 2.144 1.00 0.00 C ATOM 0 H LEU A 468 -7.738 5.583 4.147 1.00 0.00 H new ATOM 0 HA LEU A 468 -7.717 4.654 1.471 1.00 0.00 H new ATOM 0 HB2 LEU A 468 -5.765 5.257 3.117 1.00 0.00 H new ATOM 0 HB3 LEU A 468 -5.948 3.620 3.714 1.00 0.00 H new ATOM 0 HG LEU A 468 -5.897 2.999 1.106 1.00 0.00 H new ATOM 0 HD11 LEU A 468 -4.357 4.506 -0.139 1.00 0.00 H new ATOM 0 HD12 LEU A 468 -5.843 5.360 0.339 1.00 0.00 H new ATOM 0 HD13 LEU A 468 -4.335 5.622 1.247 1.00 0.00 H new ATOM 0 HD21 LEU A 468 -3.431 2.702 1.294 1.00 0.00 H new ATOM 0 HD22 LEU A 468 -3.409 3.808 2.688 1.00 0.00 H new ATOM 0 HD23 LEU A 468 -4.249 2.244 2.806 1.00 0.00 H new ATOM 607 N PHE A 469 -8.586 2.498 3.801 1.00 0.00 N ATOM 608 CA PHE A 469 -9.164 1.173 4.007 1.00 0.00 C ATOM 609 C PHE A 469 -10.421 0.987 3.156 1.00 0.00 C ATOM 610 O PHE A 469 -10.561 -0.014 2.454 1.00 0.00 O ATOM 611 CB PHE A 469 -9.500 0.991 5.496 1.00 0.00 C ATOM 612 CG PHE A 469 -10.347 -0.250 5.693 1.00 0.00 C ATOM 613 CD1 PHE A 469 -9.781 -1.520 5.528 1.00 0.00 C ATOM 614 CD2 PHE A 469 -11.698 -0.124 6.036 1.00 0.00 C ATOM 615 CE1 PHE A 469 -10.569 -2.665 5.702 1.00 0.00 C ATOM 616 CE2 PHE A 469 -12.487 -1.267 6.207 1.00 0.00 C ATOM 617 CZ PHE A 469 -11.922 -2.539 6.042 1.00 0.00 C ATOM 0 H PHE A 469 -8.508 3.066 4.645 1.00 0.00 H new ATOM 0 HA PHE A 469 -8.437 0.420 3.701 1.00 0.00 H new ATOM 0 HB2 PHE A 469 -8.581 0.909 6.076 1.00 0.00 H new ATOM 0 HB3 PHE A 469 -10.033 1.867 5.866 1.00 0.00 H new ATOM 0 HD1 PHE A 469 -8.738 -1.617 5.267 1.00 0.00 H new ATOM 0 HD2 PHE A 469 -12.132 0.856 6.169 1.00 0.00 H new ATOM 0 HE1 PHE A 469 -10.133 -3.645 5.574 1.00 0.00 H new ATOM 0 HE2 PHE A 469 -13.531 -1.169 6.466 1.00 0.00 H new ATOM 0 HZ PHE A 469 -12.530 -3.422 6.177 1.00 0.00 H new ATOM 627 N GLN A 470 -11.331 1.953 3.224 1.00 0.00 N ATOM 628 CA GLN A 470 -12.570 1.875 2.454 1.00 0.00 C ATOM 629 C GLN A 470 -12.297 2.068 0.962 1.00 0.00 C ATOM 630 O GLN A 470 -12.960 1.463 0.118 1.00 0.00 O ATOM 631 CB GLN A 470 -13.564 2.925 2.955 1.00 0.00 C ATOM 632 CG GLN A 470 -12.922 4.308 2.885 1.00 0.00 C ATOM 633 CD GLN A 470 -13.907 5.374 3.353 1.00 0.00 C ATOM 634 OE1 GLN A 470 -14.540 5.223 4.399 1.00 0.00 O ATOM 635 NE2 GLN A 470 -14.072 6.452 2.636 1.00 0.00 N ATOM 0 H GLN A 470 -11.237 2.791 3.798 1.00 0.00 H new ATOM 0 HA GLN A 470 -13.002 0.884 2.593 1.00 0.00 H new ATOM 0 HB2 GLN A 470 -14.470 2.902 2.349 1.00 0.00 H new ATOM 0 HB3 GLN A 470 -13.860 2.701 3.980 1.00 0.00 H new ATOM 0 HG2 GLN A 470 -12.027 4.333 3.506 1.00 0.00 H new ATOM 0 HG3 GLN A 470 -12.606 4.518 1.863 1.00 0.00 H new ATOM 0 HE21 GLN A 470 -13.546 6.574 1.770 1.00 0.00 H new ATOM 0 HE22 GLN A 470 -14.726 7.172 2.941 1.00 0.00 H new ATOM 644 N GLN A 471 -11.314 2.911 0.641 1.00 0.00 N ATOM 645 CA GLN A 471 -10.952 3.176 -0.757 1.00 0.00 C ATOM 646 C GLN A 471 -9.794 2.273 -1.184 1.00 0.00 C ATOM 647 O GLN A 471 -8.868 2.712 -1.864 1.00 0.00 O ATOM 648 CB GLN A 471 -10.548 4.649 -0.919 1.00 0.00 C ATOM 649 CG GLN A 471 -11.803 5.543 -0.951 1.00 0.00 C ATOM 650 CD GLN A 471 -11.463 6.948 -0.453 1.00 0.00 C ATOM 651 OE1 GLN A 471 -10.972 7.781 -1.215 1.00 0.00 O ATOM 652 NE2 GLN A 471 -11.700 7.257 0.795 1.00 0.00 N ATOM 0 H GLN A 471 -10.755 3.421 1.325 1.00 0.00 H new ATOM 0 HA GLN A 471 -11.815 2.966 -1.390 1.00 0.00 H new ATOM 0 HB2 GLN A 471 -9.900 4.949 -0.096 1.00 0.00 H new ATOM 0 HB3 GLN A 471 -9.977 4.778 -1.838 1.00 0.00 H new ATOM 0 HG2 GLN A 471 -12.196 5.594 -1.966 1.00 0.00 H new ATOM 0 HG3 GLN A 471 -12.585 5.108 -0.328 1.00 0.00 H new ATOM 0 HE21 GLN A 471 -12.107 6.564 1.423 1.00 0.00 H new ATOM 0 HE22 GLN A 471 -11.478 8.191 1.140 1.00 0.00 H new ATOM 661 N LEU A 472 -9.860 1.008 -0.773 1.00 0.00 N ATOM 662 CA LEU A 472 -8.816 0.045 -1.111 1.00 0.00 C ATOM 663 C LEU A 472 -8.937 -0.399 -2.569 1.00 0.00 C ATOM 664 O LEU A 472 -10.037 -0.629 -3.071 1.00 0.00 O ATOM 665 CB LEU A 472 -8.916 -1.170 -0.172 1.00 0.00 C ATOM 666 CG LEU A 472 -10.137 -2.059 -0.540 1.00 0.00 C ATOM 667 CD1 LEU A 472 -9.697 -3.243 -1.426 1.00 0.00 C ATOM 668 CD2 LEU A 472 -10.786 -2.612 0.740 1.00 0.00 C ATOM 0 H LEU A 472 -10.621 0.629 -0.209 1.00 0.00 H new ATOM 0 HA LEU A 472 -7.844 0.521 -0.984 1.00 0.00 H new ATOM 0 HB2 LEU A 472 -8.001 -1.759 -0.235 1.00 0.00 H new ATOM 0 HB3 LEU A 472 -9.007 -0.830 0.860 1.00 0.00 H new ATOM 0 HG LEU A 472 -10.854 -1.446 -1.087 1.00 0.00 H new ATOM 0 HD11 LEU A 472 -10.565 -3.854 -1.674 1.00 0.00 H new ATOM 0 HD12 LEU A 472 -9.247 -2.863 -2.343 1.00 0.00 H new ATOM 0 HD13 LEU A 472 -8.968 -3.849 -0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 472 -11.641 -3.234 0.475 1.00 0.00 H new ATOM 0 HD22 LEU A 472 -10.058 -3.210 1.288 1.00 0.00 H new ATOM 0 HD23 LEU A 472 -11.120 -1.784 1.366 1.00 0.00 H new ATOM 680 N THR A 473 -7.799 -0.524 -3.245 1.00 0.00 N ATOM 681 CA THR A 473 -7.799 -0.949 -4.644 1.00 0.00 C ATOM 682 C THR A 473 -6.432 -1.502 -5.039 1.00 0.00 C ATOM 683 O THR A 473 -6.332 -2.592 -5.602 1.00 0.00 O ATOM 684 CB THR A 473 -8.163 0.233 -5.560 1.00 0.00 C ATOM 685 OG1 THR A 473 -7.481 0.100 -6.800 1.00 0.00 O ATOM 686 CG2 THR A 473 -7.751 1.550 -4.897 1.00 0.00 C ATOM 0 H THR A 473 -6.875 -0.340 -2.854 1.00 0.00 H new ATOM 0 HA THR A 473 -8.544 -1.736 -4.760 1.00 0.00 H new ATOM 0 HB THR A 473 -9.240 0.234 -5.730 1.00 0.00 H new ATOM 0 HG1 THR A 473 -7.714 0.852 -7.384 1.00 0.00 H new ATOM 0 HG21 THR A 473 -8.011 2.383 -5.550 1.00 0.00 H new ATOM 0 HG22 THR A 473 -8.273 1.658 -3.946 1.00 0.00 H new ATOM 0 HG23 THR A 473 -6.675 1.548 -4.722 1.00 0.00 H new ATOM 694 N CYS A 474 -5.379 -0.741 -4.744 1.00 0.00 N ATOM 695 CA CYS A 474 -4.014 -1.157 -5.073 1.00 0.00 C ATOM 696 C CYS A 474 -3.320 -1.743 -3.848 1.00 0.00 C ATOM 697 O CYS A 474 -2.362 -1.167 -3.334 1.00 0.00 O ATOM 698 CB CYS A 474 -3.218 0.047 -5.574 1.00 0.00 C ATOM 699 SG CYS A 474 -3.457 1.436 -4.439 1.00 0.00 S ATOM 0 H CYS A 474 -5.443 0.165 -4.279 1.00 0.00 H new ATOM 0 HA CYS A 474 -4.063 -1.920 -5.850 1.00 0.00 H new ATOM 0 HB2 CYS A 474 -2.160 -0.205 -5.641 1.00 0.00 H new ATOM 0 HB3 CYS A 474 -3.545 0.322 -6.577 1.00 0.00 H new ATOM 0 HG CYS A 474 -3.101 1.083 -3.240 1.00 0.00 H new ATOM 705 N VAL A 475 -3.812 -2.887 -3.378 1.00 0.00 N ATOM 706 CA VAL A 475 -3.230 -3.540 -2.202 1.00 0.00 C ATOM 707 C VAL A 475 -2.194 -4.582 -2.619 1.00 0.00 C ATOM 708 O VAL A 475 -1.468 -5.121 -1.783 1.00 0.00 O ATOM 709 CB VAL A 475 -4.335 -4.205 -1.376 1.00 0.00 C ATOM 710 CG1 VAL A 475 -3.749 -4.753 -0.072 1.00 0.00 C ATOM 711 CG2 VAL A 475 -5.410 -3.167 -1.050 1.00 0.00 C ATOM 0 H VAL A 475 -4.606 -3.380 -3.788 1.00 0.00 H new ATOM 0 HA VAL A 475 -2.733 -2.782 -1.597 1.00 0.00 H new ATOM 0 HB VAL A 475 -4.771 -5.025 -1.947 1.00 0.00 H new ATOM 0 HG11 VAL A 475 -4.539 -5.225 0.512 1.00 0.00 H new ATOM 0 HG12 VAL A 475 -2.978 -5.489 -0.301 1.00 0.00 H new ATOM 0 HG13 VAL A 475 -3.312 -3.936 0.502 1.00 0.00 H new ATOM 0 HG21 VAL A 475 -6.200 -3.634 -0.462 1.00 0.00 H new ATOM 0 HG22 VAL A 475 -4.967 -2.351 -0.479 1.00 0.00 H new ATOM 0 HG23 VAL A 475 -5.830 -2.775 -1.976 1.00 0.00 H new ATOM 721 N LEU A 476 -2.129 -4.859 -3.918 1.00 0.00 N ATOM 722 CA LEU A 476 -1.177 -5.837 -4.443 1.00 0.00 C ATOM 723 C LEU A 476 0.219 -5.222 -4.627 1.00 0.00 C ATOM 724 O LEU A 476 1.177 -5.669 -3.997 1.00 0.00 O ATOM 725 CB LEU A 476 -1.699 -6.402 -5.786 1.00 0.00 C ATOM 726 CG LEU A 476 -2.540 -7.677 -5.552 1.00 0.00 C ATOM 727 CD1 LEU A 476 -3.519 -7.872 -6.715 1.00 0.00 C ATOM 728 CD2 LEU A 476 -1.615 -8.899 -5.469 1.00 0.00 C ATOM 0 H LEU A 476 -2.721 -4.423 -4.625 1.00 0.00 H new ATOM 0 HA LEU A 476 -1.085 -6.647 -3.720 1.00 0.00 H new ATOM 0 HB2 LEU A 476 -2.303 -5.650 -6.292 1.00 0.00 H new ATOM 0 HB3 LEU A 476 -0.859 -6.630 -6.442 1.00 0.00 H new ATOM 0 HG LEU A 476 -3.094 -7.570 -4.619 1.00 0.00 H new ATOM 0 HD11 LEU A 476 -4.110 -8.772 -6.546 1.00 0.00 H new ATOM 0 HD12 LEU A 476 -4.182 -7.009 -6.781 1.00 0.00 H new ATOM 0 HD13 LEU A 476 -2.962 -7.973 -7.646 1.00 0.00 H new ATOM 0 HD21 LEU A 476 -2.211 -9.796 -5.304 1.00 0.00 H new ATOM 0 HD22 LEU A 476 -1.060 -8.999 -6.402 1.00 0.00 H new ATOM 0 HD23 LEU A 476 -0.916 -8.771 -4.642 1.00 0.00 H new ATOM 740 N PRO A 477 0.372 -4.234 -5.478 1.00 0.00 N ATOM 741 CA PRO A 477 1.705 -3.599 -5.728 1.00 0.00 C ATOM 742 C PRO A 477 2.332 -3.040 -4.448 1.00 0.00 C ATOM 743 O PRO A 477 3.544 -3.138 -4.250 1.00 0.00 O ATOM 744 CB PRO A 477 1.391 -2.475 -6.741 1.00 0.00 C ATOM 745 CG PRO A 477 -0.074 -2.231 -6.590 1.00 0.00 C ATOM 746 CD PRO A 477 -0.678 -3.595 -6.294 1.00 0.00 C ATOM 0 HA PRO A 477 2.438 -4.315 -6.100 1.00 0.00 H new ATOM 0 HB2 PRO A 477 1.967 -1.575 -6.526 1.00 0.00 H new ATOM 0 HB3 PRO A 477 1.640 -2.777 -7.758 1.00 0.00 H new ATOM 0 HG2 PRO A 477 -0.275 -1.528 -5.782 1.00 0.00 H new ATOM 0 HG3 PRO A 477 -0.497 -1.802 -7.498 1.00 0.00 H new ATOM 0 HD2 PRO A 477 -1.620 -3.513 -5.753 1.00 0.00 H new ATOM 0 HD3 PRO A 477 -0.882 -4.156 -7.206 1.00 0.00 H new ATOM 754 N ILE A 478 1.508 -2.455 -3.587 1.00 0.00 N ATOM 755 CA ILE A 478 2.012 -1.887 -2.342 1.00 0.00 C ATOM 756 C ILE A 478 2.474 -2.991 -1.395 1.00 0.00 C ATOM 757 O ILE A 478 3.513 -2.869 -0.746 1.00 0.00 O ATOM 758 CB ILE A 478 0.925 -1.042 -1.670 1.00 0.00 C ATOM 759 CG1 ILE A 478 1.545 -0.224 -0.528 1.00 0.00 C ATOM 760 CG2 ILE A 478 -0.165 -1.954 -1.108 1.00 0.00 C ATOM 761 CD1 ILE A 478 0.531 0.800 0.002 1.00 0.00 C ATOM 0 H ILE A 478 0.502 -2.362 -3.724 1.00 0.00 H new ATOM 0 HA ILE A 478 2.865 -1.250 -2.575 1.00 0.00 H new ATOM 0 HB ILE A 478 0.487 -0.368 -2.406 1.00 0.00 H new ATOM 0 HG12 ILE A 478 1.857 -0.889 0.278 1.00 0.00 H new ATOM 0 HG13 ILE A 478 2.439 0.289 -0.882 1.00 0.00 H new ATOM 0 HG21 ILE A 478 -0.936 -1.349 -0.631 1.00 0.00 H new ATOM 0 HG22 ILE A 478 -0.608 -2.533 -1.918 1.00 0.00 H new ATOM 0 HG23 ILE A 478 0.270 -2.631 -0.373 1.00 0.00 H new ATOM 0 HD11 ILE A 478 0.982 1.374 0.811 1.00 0.00 H new ATOM 0 HD12 ILE A 478 0.241 1.475 -0.803 1.00 0.00 H new ATOM 0 HD13 ILE A 478 -0.351 0.279 0.375 1.00 0.00 H new ATOM 773 N LEU A 479 1.701 -4.071 -1.324 1.00 0.00 N ATOM 774 CA LEU A 479 2.054 -5.187 -0.454 1.00 0.00 C ATOM 775 C LEU A 479 3.379 -5.790 -0.899 1.00 0.00 C ATOM 776 O LEU A 479 4.228 -6.125 -0.073 1.00 0.00 O ATOM 777 CB LEU A 479 0.950 -6.254 -0.486 1.00 0.00 C ATOM 778 CG LEU A 479 1.342 -7.460 0.383 1.00 0.00 C ATOM 779 CD1 LEU A 479 1.602 -7.014 1.831 1.00 0.00 C ATOM 780 CD2 LEU A 479 0.203 -8.488 0.361 1.00 0.00 C ATOM 0 H LEU A 479 0.837 -4.196 -1.851 1.00 0.00 H new ATOM 0 HA LEU A 479 2.156 -4.821 0.568 1.00 0.00 H new ATOM 0 HB2 LEU A 479 0.014 -5.828 -0.126 1.00 0.00 H new ATOM 0 HB3 LEU A 479 0.779 -6.578 -1.513 1.00 0.00 H new ATOM 0 HG LEU A 479 2.253 -7.905 -0.016 1.00 0.00 H new ATOM 0 HD11 LEU A 479 1.878 -7.879 2.434 1.00 0.00 H new ATOM 0 HD12 LEU A 479 2.413 -6.286 1.847 1.00 0.00 H new ATOM 0 HD13 LEU A 479 0.699 -6.560 2.240 1.00 0.00 H new ATOM 0 HD21 LEU A 479 0.475 -9.346 0.976 1.00 0.00 H new ATOM 0 HD22 LEU A 479 -0.706 -8.033 0.755 1.00 0.00 H new ATOM 0 HD23 LEU A 479 0.029 -8.816 -0.664 1.00 0.00 H new ATOM 792 N ASP A 480 3.549 -5.925 -2.211 1.00 0.00 N ATOM 793 CA ASP A 480 4.777 -6.489 -2.753 1.00 0.00 C ATOM 794 C ASP A 480 5.974 -5.609 -2.399 1.00 0.00 C ATOM 795 O ASP A 480 7.065 -6.110 -2.127 1.00 0.00 O ATOM 796 CB ASP A 480 4.676 -6.618 -4.276 1.00 0.00 C ATOM 797 CG ASP A 480 5.949 -7.252 -4.828 1.00 0.00 C ATOM 798 OD1 ASP A 480 6.871 -7.448 -4.056 1.00 0.00 O ATOM 799 OD2 ASP A 480 5.982 -7.533 -6.016 1.00 0.00 O ATOM 0 H ASP A 480 2.858 -5.654 -2.911 1.00 0.00 H new ATOM 0 HA ASP A 480 4.918 -7.477 -2.315 1.00 0.00 H new ATOM 0 HB2 ASP A 480 3.811 -7.226 -4.542 1.00 0.00 H new ATOM 0 HB3 ASP A 480 4.525 -5.636 -4.724 1.00 0.00 H new ATOM 804 N ASN A 481 5.768 -4.294 -2.409 1.00 0.00 N ATOM 805 CA ASN A 481 6.849 -3.365 -2.097 1.00 0.00 C ATOM 806 C ASN A 481 7.363 -3.594 -0.677 1.00 0.00 C ATOM 807 O ASN A 481 8.571 -3.643 -0.448 1.00 0.00 O ATOM 808 CB ASN A 481 6.344 -1.924 -2.223 1.00 0.00 C ATOM 809 CG ASN A 481 6.192 -1.545 -3.693 1.00 0.00 C ATOM 810 OD1 ASN A 481 6.782 -2.183 -4.566 1.00 0.00 O ATOM 811 ND2 ASN A 481 5.425 -0.541 -4.018 1.00 0.00 N ATOM 0 H ASN A 481 4.874 -3.853 -2.627 1.00 0.00 H new ATOM 0 HA ASN A 481 7.664 -3.536 -2.800 1.00 0.00 H new ATOM 0 HB2 ASN A 481 5.386 -1.821 -1.713 1.00 0.00 H new ATOM 0 HB3 ASN A 481 7.041 -1.243 -1.735 1.00 0.00 H new ATOM 0 HD21 ASN A 481 5.312 -0.282 -4.998 1.00 0.00 H new ATOM 0 HD22 ASN A 481 4.938 -0.015 -3.292 1.00 0.00 H new ATOM 818 N LEU A 482 6.442 -3.741 0.270 1.00 0.00 N ATOM 819 CA LEU A 482 6.827 -3.972 1.658 1.00 0.00 C ATOM 820 C LEU A 482 7.483 -5.341 1.810 1.00 0.00 C ATOM 821 O LEU A 482 8.436 -5.504 2.573 1.00 0.00 O ATOM 822 CB LEU A 482 5.599 -3.859 2.581 1.00 0.00 C ATOM 823 CG LEU A 482 5.297 -2.375 2.885 1.00 0.00 C ATOM 824 CD1 LEU A 482 3.815 -2.206 3.234 1.00 0.00 C ATOM 825 CD2 LEU A 482 6.142 -1.902 4.079 1.00 0.00 C ATOM 0 H LEU A 482 5.436 -3.705 0.105 1.00 0.00 H new ATOM 0 HA LEU A 482 7.550 -3.209 1.947 1.00 0.00 H new ATOM 0 HB2 LEU A 482 4.735 -4.324 2.107 1.00 0.00 H new ATOM 0 HB3 LEU A 482 5.782 -4.398 3.510 1.00 0.00 H new ATOM 0 HG LEU A 482 5.540 -1.782 2.003 1.00 0.00 H new ATOM 0 HD11 LEU A 482 3.609 -1.157 3.447 1.00 0.00 H new ATOM 0 HD12 LEU A 482 3.204 -2.532 2.393 1.00 0.00 H new ATOM 0 HD13 LEU A 482 3.577 -2.808 4.111 1.00 0.00 H new ATOM 0 HD21 LEU A 482 5.923 -0.855 4.287 1.00 0.00 H new ATOM 0 HD22 LEU A 482 5.902 -2.504 4.956 1.00 0.00 H new ATOM 0 HD23 LEU A 482 7.200 -2.012 3.842 1.00 0.00 H new ATOM 837 N LEU A 483 6.961 -6.324 1.086 1.00 0.00 N ATOM 838 CA LEU A 483 7.496 -7.678 1.153 1.00 0.00 C ATOM 839 C LEU A 483 8.995 -7.671 0.856 1.00 0.00 C ATOM 840 O LEU A 483 9.722 -8.576 1.267 1.00 0.00 O ATOM 841 CB LEU A 483 6.769 -8.578 0.146 1.00 0.00 C ATOM 842 CG LEU A 483 7.204 -10.041 0.323 1.00 0.00 C ATOM 843 CD1 LEU A 483 6.793 -10.565 1.712 1.00 0.00 C ATOM 844 CD2 LEU A 483 6.544 -10.892 -0.768 1.00 0.00 C ATOM 0 H LEU A 483 6.172 -6.210 0.449 1.00 0.00 H new ATOM 0 HA LEU A 483 7.339 -8.067 2.159 1.00 0.00 H new ATOM 0 HB2 LEU A 483 5.691 -8.493 0.285 1.00 0.00 H new ATOM 0 HB3 LEU A 483 6.987 -8.248 -0.870 1.00 0.00 H new ATOM 0 HG LEU A 483 8.289 -10.104 0.240 1.00 0.00 H new ATOM 0 HD11 LEU A 483 7.110 -11.603 1.818 1.00 0.00 H new ATOM 0 HD12 LEU A 483 7.268 -9.960 2.484 1.00 0.00 H new ATOM 0 HD13 LEU A 483 5.710 -10.504 1.818 1.00 0.00 H new ATOM 0 HD21 LEU A 483 6.847 -11.933 -0.651 1.00 0.00 H new ATOM 0 HD22 LEU A 483 5.460 -10.818 -0.682 1.00 0.00 H new ATOM 0 HD23 LEU A 483 6.855 -10.532 -1.749 1.00 0.00 H new ATOM 856 N LYS A 484 9.449 -6.647 0.142 1.00 0.00 N ATOM 857 CA LYS A 484 10.861 -6.533 -0.204 1.00 0.00 C ATOM 858 C LYS A 484 11.725 -6.495 1.056 1.00 0.00 C ATOM 859 O LYS A 484 12.751 -7.169 1.135 1.00 0.00 O ATOM 860 CB LYS A 484 11.092 -5.260 -1.021 1.00 0.00 C ATOM 861 CG LYS A 484 12.546 -5.205 -1.488 1.00 0.00 C ATOM 862 CD LYS A 484 12.762 -3.946 -2.328 1.00 0.00 C ATOM 863 CE LYS A 484 14.209 -3.908 -2.819 1.00 0.00 C ATOM 864 NZ LYS A 484 15.124 -3.731 -1.655 1.00 0.00 N ATOM 0 H LYS A 484 8.864 -5.888 -0.207 1.00 0.00 H new ATOM 0 HA LYS A 484 11.143 -7.405 -0.795 1.00 0.00 H new ATOM 0 HB2 LYS A 484 10.423 -5.242 -1.881 1.00 0.00 H new ATOM 0 HB3 LYS A 484 10.860 -4.382 -0.418 1.00 0.00 H new ATOM 0 HG2 LYS A 484 13.216 -5.201 -0.628 1.00 0.00 H new ATOM 0 HG3 LYS A 484 12.785 -6.092 -2.074 1.00 0.00 H new ATOM 0 HD2 LYS A 484 12.078 -3.939 -3.176 1.00 0.00 H new ATOM 0 HD3 LYS A 484 12.544 -3.058 -1.735 1.00 0.00 H new ATOM 0 HE2 LYS A 484 14.449 -4.831 -3.347 1.00 0.00 H new ATOM 0 HE3 LYS A 484 14.342 -3.091 -3.528 1.00 0.00 H new ATOM 0 HZ1 LYS A 484 16.047 -3.387 -1.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 484 14.715 -3.040 -0.994 1.00 0.00 H new ATOM 0 HZ3 LYS A 484 15.249 -4.642 -1.170 1.00 0.00 H new ATOM 878 N ALA A 485 11.301 -5.704 2.040 1.00 0.00 N ATOM 879 CA ALA A 485 12.047 -5.587 3.292 1.00 0.00 C ATOM 880 C ALA A 485 11.115 -5.197 4.435 1.00 0.00 C ATOM 881 O ALA A 485 10.784 -4.025 4.608 1.00 0.00 O ATOM 882 CB ALA A 485 13.150 -4.537 3.148 1.00 0.00 C ATOM 0 H ALA A 485 10.453 -5.139 1.996 1.00 0.00 H new ATOM 0 HA ALA A 485 12.496 -6.554 3.518 1.00 0.00 H new ATOM 0 HB1 ALA A 485 13.700 -4.457 4.085 1.00 0.00 H new ATOM 0 HB2 ALA A 485 13.832 -4.833 2.351 1.00 0.00 H new ATOM 0 HB3 ALA A 485 12.705 -3.572 2.905 1.00 0.00 H new ATOM 888 N ASN A 486 10.695 -6.192 5.210 1.00 0.00 N ATOM 889 CA ASN A 486 9.798 -5.951 6.334 1.00 0.00 C ATOM 890 C ASN A 486 9.884 -7.092 7.346 1.00 0.00 C ATOM 891 O ASN A 486 10.737 -7.971 7.230 1.00 0.00 O ATOM 892 CB ASN A 486 8.361 -5.811 5.832 1.00 0.00 C ATOM 893 CG ASN A 486 7.987 -7.013 4.976 1.00 0.00 C ATOM 894 OD1 ASN A 486 8.702 -8.015 4.964 1.00 0.00 O ATOM 895 ND2 ASN A 486 6.901 -6.974 4.255 1.00 0.00 N ATOM 0 H ASN A 486 10.960 -7.168 5.081 1.00 0.00 H new ATOM 0 HA ASN A 486 10.101 -5.027 6.826 1.00 0.00 H new ATOM 0 HB2 ASN A 486 7.678 -5.730 6.678 1.00 0.00 H new ATOM 0 HB3 ASN A 486 8.258 -4.895 5.251 1.00 0.00 H new ATOM 0 HD21 ASN A 486 6.642 -7.775 3.679 1.00 0.00 H new ATOM 0 HD22 ASN A 486 6.310 -6.142 4.267 1.00 0.00 H new ATOM 902 N VAL A 487 9.001 -7.065 8.342 1.00 0.00 N ATOM 903 CA VAL A 487 8.994 -8.099 9.373 1.00 0.00 C ATOM 904 C VAL A 487 8.354 -9.380 8.847 1.00 0.00 C ATOM 905 O VAL A 487 8.725 -10.481 9.253 1.00 0.00 O ATOM 906 CB VAL A 487 8.219 -7.606 10.597 1.00 0.00 C ATOM 907 CG1 VAL A 487 8.834 -6.297 11.097 1.00 0.00 C ATOM 908 CG2 VAL A 487 6.757 -7.366 10.212 1.00 0.00 C ATOM 0 H VAL A 487 8.287 -6.345 8.456 1.00 0.00 H new ATOM 0 HA VAL A 487 10.025 -8.312 9.654 1.00 0.00 H new ATOM 0 HB VAL A 487 8.270 -8.357 11.385 1.00 0.00 H new ATOM 0 HG11 VAL A 487 8.282 -5.945 11.969 1.00 0.00 H new ATOM 0 HG12 VAL A 487 9.876 -6.465 11.370 1.00 0.00 H new ATOM 0 HG13 VAL A 487 8.783 -5.546 10.308 1.00 0.00 H new ATOM 0 HG21 VAL A 487 6.204 -7.015 11.083 1.00 0.00 H new ATOM 0 HG22 VAL A 487 6.707 -6.615 9.424 1.00 0.00 H new ATOM 0 HG23 VAL A 487 6.317 -8.297 9.855 1.00 0.00 H new ATOM 918 N ILE A 488 7.399 -9.230 7.936 1.00 0.00 N ATOM 919 CA ILE A 488 6.721 -10.383 7.353 1.00 0.00 C ATOM 920 C ILE A 488 7.593 -11.012 6.270 1.00 0.00 C ATOM 921 O ILE A 488 8.565 -10.409 5.815 1.00 0.00 O ATOM 922 CB ILE A 488 5.373 -9.960 6.761 1.00 0.00 C ATOM 923 CG1 ILE A 488 5.584 -8.853 5.726 1.00 0.00 C ATOM 924 CG2 ILE A 488 4.469 -9.435 7.874 1.00 0.00 C ATOM 925 CD1 ILE A 488 4.261 -8.558 5.016 1.00 0.00 C ATOM 0 H ILE A 488 7.078 -8.327 7.586 1.00 0.00 H new ATOM 0 HA ILE A 488 6.545 -11.119 8.137 1.00 0.00 H new ATOM 0 HB ILE A 488 4.909 -10.822 6.283 1.00 0.00 H new ATOM 0 HG12 ILE A 488 5.956 -7.952 6.213 1.00 0.00 H new ATOM 0 HG13 ILE A 488 6.338 -9.158 5.000 1.00 0.00 H new ATOM 0 HG21 ILE A 488 3.510 -9.134 7.452 1.00 0.00 H new ATOM 0 HG22 ILE A 488 4.310 -10.219 8.614 1.00 0.00 H new ATOM 0 HG23 ILE A 488 4.941 -8.576 8.351 1.00 0.00 H new ATOM 0 HD11 ILE A 488 4.412 -7.769 4.279 1.00 0.00 H new ATOM 0 HD12 ILE A 488 3.908 -9.460 4.516 1.00 0.00 H new ATOM 0 HD13 ILE A 488 3.520 -8.235 5.747 1.00 0.00 H new ATOM 937 N ASN A 489 7.245 -12.231 5.868 1.00 0.00 N ATOM 938 CA ASN A 489 8.007 -12.941 4.840 1.00 0.00 C ATOM 939 C ASN A 489 7.077 -13.802 3.995 1.00 0.00 C ATOM 940 O ASN A 489 5.869 -13.841 4.228 1.00 0.00 O ATOM 941 CB ASN A 489 9.070 -13.827 5.491 1.00 0.00 C ATOM 942 CG ASN A 489 8.449 -14.658 6.607 1.00 0.00 C ATOM 943 OD1 ASN A 489 9.156 -15.377 7.312 1.00 0.00 O ATOM 944 ND2 ASN A 489 7.161 -14.604 6.812 1.00 0.00 N ATOM 0 H ASN A 489 6.445 -12.747 6.235 1.00 0.00 H new ATOM 0 HA ASN A 489 8.494 -12.205 4.200 1.00 0.00 H new ATOM 0 HB2 ASN A 489 9.515 -14.483 4.743 1.00 0.00 H new ATOM 0 HB3 ASN A 489 9.874 -13.209 5.892 1.00 0.00 H new ATOM 0 HD21 ASN A 489 6.740 -15.158 7.557 1.00 0.00 H new ATOM 0 HD22 ASN A 489 6.576 -14.008 6.227 1.00 0.00 H new ATOM 951 N LYS A 490 7.648 -14.488 3.011 1.00 0.00 N ATOM 952 CA LYS A 490 6.861 -15.342 2.134 1.00 0.00 C ATOM 953 C LYS A 490 5.922 -16.221 2.951 1.00 0.00 C ATOM 954 O LYS A 490 4.970 -16.781 2.419 1.00 0.00 O ATOM 955 CB LYS A 490 7.787 -16.224 1.295 1.00 0.00 C ATOM 956 CG LYS A 490 8.553 -15.357 0.293 1.00 0.00 C ATOM 957 CD LYS A 490 9.594 -16.211 -0.446 1.00 0.00 C ATOM 958 CE LYS A 490 8.904 -17.099 -1.491 1.00 0.00 C ATOM 959 NZ LYS A 490 9.926 -17.681 -2.407 1.00 0.00 N ATOM 0 H LYS A 490 8.646 -14.469 2.803 1.00 0.00 H new ATOM 0 HA LYS A 490 6.268 -14.708 1.474 1.00 0.00 H new ATOM 0 HB2 LYS A 490 8.486 -16.754 1.942 1.00 0.00 H new ATOM 0 HB3 LYS A 490 7.206 -16.980 0.767 1.00 0.00 H new ATOM 0 HG2 LYS A 490 7.860 -14.913 -0.422 1.00 0.00 H new ATOM 0 HG3 LYS A 490 9.046 -14.535 0.812 1.00 0.00 H new ATOM 0 HD2 LYS A 490 10.326 -15.566 -0.932 1.00 0.00 H new ATOM 0 HD3 LYS A 490 10.139 -16.831 0.266 1.00 0.00 H new ATOM 0 HE2 LYS A 490 8.349 -17.896 -0.996 1.00 0.00 H new ATOM 0 HE3 LYS A 490 8.182 -16.514 -2.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 490 9.456 -18.282 -3.114 1.00 0.00 H new ATOM 0 HZ2 LYS A 490 10.437 -16.914 -2.889 1.00 0.00 H new ATOM 0 HZ3 LYS A 490 10.599 -18.253 -1.858 1.00 0.00 H new ATOM 973 N GLN A 491 6.198 -16.338 4.245 1.00 0.00 N ATOM 974 CA GLN A 491 5.365 -17.155 5.124 1.00 0.00 C ATOM 975 C GLN A 491 4.112 -16.386 5.546 1.00 0.00 C ATOM 976 O GLN A 491 2.996 -16.751 5.176 1.00 0.00 O ATOM 977 CB GLN A 491 6.182 -17.574 6.360 1.00 0.00 C ATOM 978 CG GLN A 491 5.627 -18.874 6.965 1.00 0.00 C ATOM 979 CD GLN A 491 4.278 -18.609 7.618 1.00 0.00 C ATOM 980 OE1 GLN A 491 4.143 -17.668 8.399 1.00 0.00 O ATOM 981 NE2 GLN A 491 3.267 -19.390 7.346 1.00 0.00 N ATOM 0 H GLN A 491 6.985 -15.882 4.707 1.00 0.00 H new ATOM 0 HA GLN A 491 5.047 -18.047 4.585 1.00 0.00 H new ATOM 0 HB2 GLN A 491 7.226 -17.714 6.081 1.00 0.00 H new ATOM 0 HB3 GLN A 491 6.155 -16.780 7.106 1.00 0.00 H new ATOM 0 HG2 GLN A 491 5.522 -19.631 6.188 1.00 0.00 H new ATOM 0 HG3 GLN A 491 6.326 -19.269 7.702 1.00 0.00 H new ATOM 0 HE21 GLN A 491 3.384 -20.169 6.698 1.00 0.00 H new ATOM 0 HE22 GLN A 491 2.360 -19.221 7.782 1.00 0.00 H new ATOM 990 N GLU A 492 4.301 -15.318 6.316 1.00 0.00 N ATOM 991 CA GLU A 492 3.173 -14.508 6.773 1.00 0.00 C ATOM 992 C GLU A 492 2.484 -13.835 5.589 1.00 0.00 C ATOM 993 O GLU A 492 1.263 -13.677 5.577 1.00 0.00 O ATOM 994 CB GLU A 492 3.656 -13.448 7.768 1.00 0.00 C ATOM 995 CG GLU A 492 4.156 -14.130 9.047 1.00 0.00 C ATOM 996 CD GLU A 492 2.990 -14.794 9.775 1.00 0.00 C ATOM 997 OE1 GLU A 492 1.862 -14.408 9.519 1.00 0.00 O ATOM 998 OE2 GLU A 492 3.244 -15.680 10.575 1.00 0.00 O ATOM 0 H GLU A 492 5.214 -14.995 6.635 1.00 0.00 H new ATOM 0 HA GLU A 492 2.455 -15.162 7.269 1.00 0.00 H new ATOM 0 HB2 GLU A 492 4.456 -12.856 7.324 1.00 0.00 H new ATOM 0 HB3 GLU A 492 2.844 -12.760 8.005 1.00 0.00 H new ATOM 0 HG2 GLU A 492 4.913 -14.875 8.800 1.00 0.00 H new ATOM 0 HG3 GLU A 492 4.632 -13.396 9.698 1.00 0.00 H new ATOM 1005 N HIS A 493 3.272 -13.452 4.595 1.00 0.00 N ATOM 1006 CA HIS A 493 2.725 -12.809 3.405 1.00 0.00 C ATOM 1007 C HIS A 493 1.735 -13.738 2.709 1.00 0.00 C ATOM 1008 O HIS A 493 0.669 -13.306 2.269 1.00 0.00 O ATOM 1009 CB HIS A 493 3.867 -12.446 2.454 1.00 0.00 C ATOM 1010 CG HIS A 493 3.318 -11.769 1.228 1.00 0.00 C ATOM 1011 ND1 HIS A 493 2.872 -12.485 0.129 1.00 0.00 N ATOM 1012 CD2 HIS A 493 3.140 -10.444 0.911 1.00 0.00 C ATOM 1013 CE1 HIS A 493 2.448 -11.600 -0.789 1.00 0.00 C ATOM 1014 NE2 HIS A 493 2.587 -10.340 -0.364 1.00 0.00 N ATOM 0 H HIS A 493 4.285 -13.573 4.586 1.00 0.00 H new ATOM 0 HA HIS A 493 2.197 -11.901 3.698 1.00 0.00 H new ATOM 0 HB2 HIS A 493 4.575 -11.788 2.957 1.00 0.00 H new ATOM 0 HB3 HIS A 493 4.414 -13.345 2.169 1.00 0.00 H new ATOM 0 HD1 HIS A 493 2.866 -13.501 0.034 1.00 0.00 H new ATOM 0 HD2 HIS A 493 3.390 -9.611 1.551 1.00 0.00 H new ATOM 0 HE1 HIS A 493 2.044 -11.873 -1.753 1.00 0.00 H new ATOM 1022 N ASP A 494 2.088 -15.017 2.611 1.00 0.00 N ATOM 1023 CA ASP A 494 1.217 -15.998 1.967 1.00 0.00 C ATOM 1024 C ASP A 494 -0.065 -16.213 2.769 1.00 0.00 C ATOM 1025 O ASP A 494 -1.130 -16.432 2.197 1.00 0.00 O ATOM 1026 CB ASP A 494 1.945 -17.334 1.808 1.00 0.00 C ATOM 1027 CG ASP A 494 1.164 -18.243 0.864 1.00 0.00 C ATOM 1028 OD1 ASP A 494 0.371 -17.727 0.095 1.00 0.00 O ATOM 1029 OD2 ASP A 494 1.370 -19.444 0.925 1.00 0.00 O ATOM 0 H ASP A 494 2.965 -15.397 2.967 1.00 0.00 H new ATOM 0 HA ASP A 494 0.952 -15.607 0.985 1.00 0.00 H new ATOM 0 HB2 ASP A 494 2.949 -17.167 1.418 1.00 0.00 H new ATOM 0 HB3 ASP A 494 2.057 -17.815 2.780 1.00 0.00 H new ATOM 1034 N ILE A 495 0.042 -16.163 4.092 1.00 0.00 N ATOM 1035 CA ILE A 495 -1.124 -16.377 4.944 1.00 0.00 C ATOM 1036 C ILE A 495 -2.184 -15.308 4.692 1.00 0.00 C ATOM 1037 O ILE A 495 -3.370 -15.617 4.584 1.00 0.00 O ATOM 1038 CB ILE A 495 -0.706 -16.347 6.419 1.00 0.00 C ATOM 1039 CG1 ILE A 495 0.164 -17.573 6.723 1.00 0.00 C ATOM 1040 CG2 ILE A 495 -1.947 -16.368 7.318 1.00 0.00 C ATOM 1041 CD1 ILE A 495 0.809 -17.450 8.116 1.00 0.00 C ATOM 0 H ILE A 495 0.911 -15.979 4.593 1.00 0.00 H new ATOM 0 HA ILE A 495 -1.548 -17.352 4.704 1.00 0.00 H new ATOM 0 HB ILE A 495 -0.142 -15.435 6.613 1.00 0.00 H new ATOM 0 HG12 ILE A 495 -0.443 -18.477 6.676 1.00 0.00 H new ATOM 0 HG13 ILE A 495 0.941 -17.671 5.964 1.00 0.00 H new ATOM 0 HG21 ILE A 495 -1.639 -16.346 8.363 1.00 0.00 H new ATOM 0 HG22 ILE A 495 -2.566 -15.497 7.104 1.00 0.00 H new ATOM 0 HG23 ILE A 495 -2.519 -17.276 7.127 1.00 0.00 H new ATOM 0 HD11 ILE A 495 1.422 -18.330 8.312 1.00 0.00 H new ATOM 0 HD12 ILE A 495 1.434 -16.557 8.150 1.00 0.00 H new ATOM 0 HD13 ILE A 495 0.028 -17.376 8.873 1.00 0.00 H new ATOM 1147 N GLN A 501 -8.792 -12.473 2.570 1.00 0.00 N ATOM 1148 CA GLN A 501 -9.192 -11.828 1.326 1.00 0.00 C ATOM 1149 C GLN A 501 -8.397 -10.530 1.121 1.00 0.00 C ATOM 1150 O GLN A 501 -7.287 -10.399 1.634 1.00 0.00 O ATOM 1151 CB GLN A 501 -10.695 -11.543 1.371 1.00 0.00 C ATOM 1152 CG GLN A 501 -11.474 -12.854 1.265 1.00 0.00 C ATOM 1153 CD GLN A 501 -12.968 -12.575 1.385 1.00 0.00 C ATOM 1154 OE1 GLN A 501 -13.377 -11.419 1.495 1.00 0.00 O ATOM 1155 NE2 GLN A 501 -13.813 -13.570 1.368 1.00 0.00 N ATOM 0 HA GLN A 501 -8.979 -12.488 0.485 1.00 0.00 H new ATOM 0 HB2 GLN A 501 -10.950 -11.032 2.299 1.00 0.00 H new ATOM 0 HB3 GLN A 501 -10.973 -10.877 0.554 1.00 0.00 H new ATOM 0 HG2 GLN A 501 -11.260 -13.339 0.313 1.00 0.00 H new ATOM 0 HG3 GLN A 501 -11.158 -13.540 2.051 1.00 0.00 H new ATOM 0 HE21 GLN A 501 -13.472 -14.527 1.277 1.00 0.00 H new ATOM 0 HE22 GLN A 501 -14.814 -13.390 1.446 1.00 0.00 H new ATOM 1164 N ILE A 502 -8.952 -9.576 0.362 1.00 0.00 N ATOM 1165 CA ILE A 502 -8.250 -8.309 0.102 1.00 0.00 C ATOM 1166 C ILE A 502 -8.566 -7.255 1.172 1.00 0.00 C ATOM 1167 O ILE A 502 -7.674 -6.521 1.599 1.00 0.00 O ATOM 1168 CB ILE A 502 -8.622 -7.766 -1.301 1.00 0.00 C ATOM 1169 CG1 ILE A 502 -8.955 -8.947 -2.226 1.00 0.00 C ATOM 1170 CG2 ILE A 502 -7.456 -6.956 -1.889 1.00 0.00 C ATOM 1171 CD1 ILE A 502 -9.098 -8.456 -3.669 1.00 0.00 C ATOM 0 H ILE A 502 -9.869 -9.653 -0.077 1.00 0.00 H new ATOM 0 HA ILE A 502 -7.180 -8.513 0.139 1.00 0.00 H new ATOM 0 HB ILE A 502 -9.488 -7.110 -1.213 1.00 0.00 H new ATOM 0 HG12 ILE A 502 -8.169 -9.700 -2.165 1.00 0.00 H new ATOM 0 HG13 ILE A 502 -9.880 -9.424 -1.902 1.00 0.00 H new ATOM 0 HG21 ILE A 502 -7.733 -6.582 -2.874 1.00 0.00 H new ATOM 0 HG22 ILE A 502 -7.229 -6.116 -1.233 1.00 0.00 H new ATOM 0 HG23 ILE A 502 -6.577 -7.595 -1.978 1.00 0.00 H new ATOM 0 HD11 ILE A 502 -9.334 -9.299 -4.318 1.00 0.00 H new ATOM 0 HD12 ILE A 502 -9.899 -7.719 -3.725 1.00 0.00 H new ATOM 0 HD13 ILE A 502 -8.162 -8.000 -3.992 1.00 0.00 H new ATOM 1183 N PRO A 503 -9.799 -7.147 1.604 1.00 0.00 N ATOM 1184 CA PRO A 503 -10.198 -6.133 2.634 1.00 0.00 C ATOM 1185 C PRO A 503 -9.407 -6.283 3.936 1.00 0.00 C ATOM 1186 O PRO A 503 -8.758 -5.341 4.392 1.00 0.00 O ATOM 1187 CB PRO A 503 -11.699 -6.411 2.850 1.00 0.00 C ATOM 1188 CG PRO A 503 -12.135 -7.114 1.609 1.00 0.00 C ATOM 1189 CD PRO A 503 -10.945 -7.967 1.193 1.00 0.00 C ATOM 0 HA PRO A 503 -9.994 -5.113 2.309 1.00 0.00 H new ATOM 0 HB2 PRO A 503 -11.865 -7.027 3.734 1.00 0.00 H new ATOM 0 HB3 PRO A 503 -12.256 -5.486 2.998 1.00 0.00 H new ATOM 0 HG2 PRO A 503 -13.015 -7.730 1.794 1.00 0.00 H new ATOM 0 HG3 PRO A 503 -12.402 -6.403 0.827 1.00 0.00 H new ATOM 0 HD2 PRO A 503 -10.948 -8.937 1.691 1.00 0.00 H new ATOM 0 HD3 PRO A 503 -10.941 -8.160 0.120 1.00 0.00 H new ATOM 1197 N LEU A 504 -9.468 -7.476 4.518 1.00 0.00 N ATOM 1198 CA LEU A 504 -8.757 -7.755 5.761 1.00 0.00 C ATOM 1199 C LEU A 504 -7.249 -7.658 5.552 1.00 0.00 C ATOM 1200 O LEU A 504 -6.533 -7.141 6.410 1.00 0.00 O ATOM 1201 CB LEU A 504 -9.134 -9.159 6.267 1.00 0.00 C ATOM 1202 CG LEU A 504 -10.471 -9.093 7.013 1.00 0.00 C ATOM 1203 CD1 LEU A 504 -11.559 -8.563 6.072 1.00 0.00 C ATOM 1204 CD2 LEU A 504 -10.853 -10.492 7.497 1.00 0.00 C ATOM 0 H LEU A 504 -10.001 -8.264 4.150 1.00 0.00 H new ATOM 0 HA LEU A 504 -9.046 -7.014 6.506 1.00 0.00 H new ATOM 0 HB2 LEU A 504 -9.207 -9.852 5.428 1.00 0.00 H new ATOM 0 HB3 LEU A 504 -8.355 -9.540 6.928 1.00 0.00 H new ATOM 0 HG LEU A 504 -10.376 -8.425 7.869 1.00 0.00 H new ATOM 0 HD11 LEU A 504 -12.509 -8.517 6.604 1.00 0.00 H new ATOM 0 HD12 LEU A 504 -11.287 -7.565 5.727 1.00 0.00 H new ATOM 0 HD13 LEU A 504 -11.655 -9.230 5.215 1.00 0.00 H new ATOM 0 HD21 LEU A 504 -11.804 -10.446 8.028 1.00 0.00 H new ATOM 0 HD22 LEU A 504 -10.947 -11.160 6.641 1.00 0.00 H new ATOM 0 HD23 LEU A 504 -10.081 -10.868 8.168 1.00 0.00 H new ATOM 1216 N GLN A 505 -6.775 -8.154 4.414 1.00 0.00 N ATOM 1217 CA GLN A 505 -5.352 -8.105 4.117 1.00 0.00 C ATOM 1218 C GLN A 505 -4.859 -6.670 4.173 1.00 0.00 C ATOM 1219 O GLN A 505 -3.779 -6.394 4.693 1.00 0.00 O ATOM 1220 CB GLN A 505 -5.084 -8.696 2.732 1.00 0.00 C ATOM 1221 CG GLN A 505 -3.607 -8.528 2.375 1.00 0.00 C ATOM 1222 CD GLN A 505 -3.273 -9.383 1.158 1.00 0.00 C ATOM 1223 OE1 GLN A 505 -3.233 -8.883 0.034 1.00 0.00 O ATOM 1224 NE2 GLN A 505 -3.031 -10.653 1.322 1.00 0.00 N ATOM 0 H GLN A 505 -7.349 -8.589 3.692 1.00 0.00 H new ATOM 0 HA GLN A 505 -4.816 -8.693 4.862 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -5.353 -9.752 2.719 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -5.706 -8.199 1.988 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -3.390 -7.480 2.166 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -2.983 -8.821 3.220 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -3.065 -11.062 2.256 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -2.807 -11.238 0.517 1.00 0.00 H new ATOM 1233 N ALA A 506 -5.665 -5.755 3.643 1.00 0.00 N ATOM 1234 CA ALA A 506 -5.301 -4.351 3.657 1.00 0.00 C ATOM 1235 C ALA A 506 -5.236 -3.853 5.092 1.00 0.00 C ATOM 1236 O ALA A 506 -4.345 -3.084 5.452 1.00 0.00 O ATOM 1237 CB ALA A 506 -6.324 -3.528 2.873 1.00 0.00 C ATOM 0 H ALA A 506 -6.563 -5.961 3.205 1.00 0.00 H new ATOM 0 HA ALA A 506 -4.324 -4.237 3.187 1.00 0.00 H new ATOM 0 HB1 ALA A 506 -6.037 -2.477 2.893 1.00 0.00 H new ATOM 0 HB2 ALA A 506 -6.357 -3.876 1.841 1.00 0.00 H new ATOM 0 HB3 ALA A 506 -7.309 -3.644 3.326 1.00 0.00 H new ATOM 1243 N ARG A 507 -6.181 -4.302 5.914 1.00 0.00 N ATOM 1244 CA ARG A 507 -6.214 -3.899 7.312 1.00 0.00 C ATOM 1245 C ARG A 507 -4.983 -4.411 8.040 1.00 0.00 C ATOM 1246 O ARG A 507 -4.367 -3.688 8.822 1.00 0.00 O ATOM 1247 CB ARG A 507 -7.478 -4.437 7.988 1.00 0.00 C ATOM 1248 CG ARG A 507 -7.541 -3.939 9.435 1.00 0.00 C ATOM 1249 CD ARG A 507 -8.847 -4.409 10.076 1.00 0.00 C ATOM 1250 NE ARG A 507 -9.984 -3.773 9.423 1.00 0.00 N ATOM 1251 CZ ARG A 507 -11.232 -4.112 9.731 1.00 0.00 C ATOM 1252 NH1 ARG A 507 -11.455 -5.021 10.642 1.00 0.00 N ATOM 1253 NH2 ARG A 507 -12.233 -3.536 9.123 1.00 0.00 N ATOM 0 H ARG A 507 -6.927 -4.940 5.637 1.00 0.00 H new ATOM 0 HA ARG A 507 -6.222 -2.810 7.357 1.00 0.00 H new ATOM 0 HB2 ARG A 507 -8.362 -4.109 7.441 1.00 0.00 H new ATOM 0 HB3 ARG A 507 -7.477 -5.527 7.968 1.00 0.00 H new ATOM 0 HG2 ARG A 507 -6.689 -4.318 9.999 1.00 0.00 H new ATOM 0 HG3 ARG A 507 -7.481 -2.851 9.460 1.00 0.00 H new ATOM 0 HD2 ARG A 507 -8.931 -5.493 9.995 1.00 0.00 H new ATOM 0 HD3 ARG A 507 -8.847 -4.168 11.139 1.00 0.00 H new ATOM 0 HE ARG A 507 -9.819 -3.055 8.717 1.00 0.00 H new ATOM 0 HH11 ARG A 507 -10.672 -5.470 11.117 1.00 0.00 H new ATOM 0 HH12 ARG A 507 -12.412 -5.282 10.879 1.00 0.00 H new ATOM 0 HH21 ARG A 507 -12.058 -2.826 8.412 1.00 0.00 H new ATOM 0 HH22 ARG A 507 -13.191 -3.796 9.359 1.00 0.00 H new ATOM 1267 N GLU A 508 -4.626 -5.660 7.778 1.00 0.00 N ATOM 1268 CA GLU A 508 -3.459 -6.246 8.421 1.00 0.00 C ATOM 1269 C GLU A 508 -2.202 -5.483 8.009 1.00 0.00 C ATOM 1270 O GLU A 508 -1.326 -5.227 8.830 1.00 0.00 O ATOM 1271 CB GLU A 508 -3.330 -7.723 8.031 1.00 0.00 C ATOM 1272 CG GLU A 508 -2.194 -8.380 8.823 1.00 0.00 C ATOM 1273 CD GLU A 508 -2.570 -8.481 10.299 1.00 0.00 C ATOM 1274 OE1 GLU A 508 -3.716 -8.216 10.620 1.00 0.00 O ATOM 1275 OE2 GLU A 508 -1.705 -8.830 11.085 1.00 0.00 O ATOM 0 H GLU A 508 -5.119 -6.279 7.135 1.00 0.00 H new ATOM 0 HA GLU A 508 -3.577 -6.177 9.502 1.00 0.00 H new ATOM 0 HB2 GLU A 508 -4.268 -8.242 8.227 1.00 0.00 H new ATOM 0 HB3 GLU A 508 -3.136 -7.809 6.962 1.00 0.00 H new ATOM 0 HG2 GLU A 508 -1.990 -9.373 8.424 1.00 0.00 H new ATOM 0 HG3 GLU A 508 -1.279 -7.797 8.712 1.00 0.00 H new ATOM 1282 N LEU A 509 -2.124 -5.121 6.732 1.00 0.00 N ATOM 1283 CA LEU A 509 -0.970 -4.382 6.222 1.00 0.00 C ATOM 1284 C LEU A 509 -0.871 -3.016 6.895 1.00 0.00 C ATOM 1285 O LEU A 509 0.211 -2.574 7.242 1.00 0.00 O ATOM 1286 CB LEU A 509 -1.096 -4.204 4.703 1.00 0.00 C ATOM 1287 CG LEU A 509 0.184 -3.570 4.137 1.00 0.00 C ATOM 1288 CD1 LEU A 509 1.381 -4.527 4.321 1.00 0.00 C ATOM 1289 CD2 LEU A 509 -0.026 -3.266 2.648 1.00 0.00 C ATOM 0 H LEU A 509 -2.840 -5.325 6.034 1.00 0.00 H new ATOM 0 HA LEU A 509 -0.066 -4.949 6.446 1.00 0.00 H new ATOM 0 HB2 LEU A 509 -1.273 -5.170 4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 509 -1.955 -3.574 4.473 1.00 0.00 H new ATOM 0 HG LEU A 509 0.400 -2.645 4.672 1.00 0.00 H new ATOM 0 HD11 LEU A 509 2.281 -4.065 3.916 1.00 0.00 H new ATOM 0 HD12 LEU A 509 1.524 -4.731 5.382 1.00 0.00 H new ATOM 0 HD13 LEU A 509 1.184 -5.461 3.795 1.00 0.00 H new ATOM 0 HD21 LEU A 509 0.878 -2.816 2.238 1.00 0.00 H new ATOM 0 HD22 LEU A 509 -0.244 -4.191 2.115 1.00 0.00 H new ATOM 0 HD23 LEU A 509 -0.861 -2.575 2.532 1.00 0.00 H new ATOM 1301 N ILE A 510 -2.003 -2.355 7.081 1.00 0.00 N ATOM 1302 CA ILE A 510 -2.010 -1.042 7.721 1.00 0.00 C ATOM 1303 C ILE A 510 -1.484 -1.151 9.148 1.00 0.00 C ATOM 1304 O ILE A 510 -0.719 -0.299 9.603 1.00 0.00 O ATOM 1305 CB ILE A 510 -3.432 -0.463 7.715 1.00 0.00 C ATOM 1306 CG1 ILE A 510 -3.817 -0.090 6.282 1.00 0.00 C ATOM 1307 CG2 ILE A 510 -3.505 0.784 8.600 1.00 0.00 C ATOM 1308 CD1 ILE A 510 -5.318 0.192 6.206 1.00 0.00 C ATOM 0 H ILE A 510 -2.922 -2.699 6.802 1.00 0.00 H new ATOM 0 HA ILE A 510 -1.358 -0.371 7.162 1.00 0.00 H new ATOM 0 HB ILE A 510 -4.121 -1.212 8.105 1.00 0.00 H new ATOM 0 HG12 ILE A 510 -3.256 0.788 5.962 1.00 0.00 H new ATOM 0 HG13 ILE A 510 -3.555 -0.901 5.602 1.00 0.00 H new ATOM 0 HG21 ILE A 510 -4.520 1.182 8.585 1.00 0.00 H new ATOM 0 HG22 ILE A 510 -3.234 0.521 9.622 1.00 0.00 H new ATOM 0 HG23 ILE A 510 -2.814 1.538 8.224 1.00 0.00 H new ATOM 0 HD11 ILE A 510 -5.587 0.457 5.184 1.00 0.00 H new ATOM 0 HD12 ILE A 510 -5.871 -0.697 6.508 1.00 0.00 H new ATOM 0 HD13 ILE A 510 -5.567 1.018 6.873 1.00 0.00 H new ATOM 1320 N ASP A 511 -1.900 -2.195 9.849 1.00 0.00 N ATOM 1321 CA ASP A 511 -1.466 -2.398 11.222 1.00 0.00 C ATOM 1322 C ASP A 511 0.058 -2.503 11.299 1.00 0.00 C ATOM 1323 O ASP A 511 0.668 -2.018 12.252 1.00 0.00 O ATOM 1324 CB ASP A 511 -2.098 -3.673 11.784 1.00 0.00 C ATOM 1325 CG ASP A 511 -1.831 -3.771 13.283 1.00 0.00 C ATOM 1326 OD1 ASP A 511 -1.018 -3.004 13.771 1.00 0.00 O ATOM 1327 OD2 ASP A 511 -2.444 -4.611 13.919 1.00 0.00 O ATOM 0 H ASP A 511 -2.534 -2.910 9.492 1.00 0.00 H new ATOM 0 HA ASP A 511 -1.786 -1.541 11.814 1.00 0.00 H new ATOM 0 HB2 ASP A 511 -3.172 -3.669 11.597 1.00 0.00 H new ATOM 0 HB3 ASP A 511 -1.689 -4.546 11.276 1.00 0.00 H new ATOM 1332 N THR A 512 0.671 -3.131 10.293 1.00 0.00 N ATOM 1333 CA THR A 512 2.125 -3.277 10.275 1.00 0.00 C ATOM 1334 C THR A 512 2.792 -1.903 10.167 1.00 0.00 C ATOM 1335 O THR A 512 3.868 -1.680 10.723 1.00 0.00 O ATOM 1336 CB THR A 512 2.556 -4.166 9.097 1.00 0.00 C ATOM 1337 OG1 THR A 512 2.137 -3.585 7.880 1.00 0.00 O ATOM 1338 CG2 THR A 512 1.930 -5.555 9.247 1.00 0.00 C ATOM 0 H THR A 512 0.190 -3.541 9.492 1.00 0.00 H new ATOM 0 HA THR A 512 2.440 -3.750 11.205 1.00 0.00 H new ATOM 0 HB THR A 512 3.642 -4.257 9.094 1.00 0.00 H new ATOM 0 HG1 THR A 512 1.237 -3.213 7.988 1.00 0.00 H new ATOM 0 HG21 THR A 512 2.236 -6.184 8.411 1.00 0.00 H new ATOM 0 HG22 THR A 512 2.264 -6.005 10.182 1.00 0.00 H new ATOM 0 HG23 THR A 512 0.844 -5.466 9.255 1.00 0.00 H new ATOM 1346 N ILE A 513 2.137 -0.982 9.459 1.00 0.00 N ATOM 1347 CA ILE A 513 2.668 0.373 9.296 1.00 0.00 C ATOM 1348 C ILE A 513 2.715 1.087 10.639 1.00 0.00 C ATOM 1349 O ILE A 513 3.689 1.769 10.955 1.00 0.00 O ATOM 1350 CB ILE A 513 1.800 1.180 8.321 1.00 0.00 C ATOM 1351 CG1 ILE A 513 1.670 0.424 6.993 1.00 0.00 C ATOM 1352 CG2 ILE A 513 2.435 2.550 8.068 1.00 0.00 C ATOM 1353 CD1 ILE A 513 3.051 0.104 6.411 1.00 0.00 C ATOM 0 H ILE A 513 1.245 -1.147 8.992 1.00 0.00 H new ATOM 0 HA ILE A 513 3.678 0.295 8.893 1.00 0.00 H new ATOM 0 HB ILE A 513 0.811 1.317 8.758 1.00 0.00 H new ATOM 0 HG12 ILE A 513 1.113 -0.500 7.148 1.00 0.00 H new ATOM 0 HG13 ILE A 513 1.101 1.023 6.282 1.00 0.00 H new ATOM 0 HG21 ILE A 513 1.813 3.117 7.375 1.00 0.00 H new ATOM 0 HG22 ILE A 513 2.516 3.093 9.010 1.00 0.00 H new ATOM 0 HG23 ILE A 513 3.428 2.417 7.639 1.00 0.00 H new ATOM 0 HD11 ILE A 513 2.934 -0.432 5.469 1.00 0.00 H new ATOM 0 HD12 ILE A 513 3.595 1.032 6.235 1.00 0.00 H new ATOM 0 HD13 ILE A 513 3.608 -0.515 7.114 1.00 0.00 H new ATOM 1365 N LEU A 514 1.658 0.932 11.422 1.00 0.00 N ATOM 1366 CA LEU A 514 1.599 1.579 12.724 1.00 0.00 C ATOM 1367 C LEU A 514 2.759 1.113 13.599 1.00 0.00 C ATOM 1368 O LEU A 514 3.399 1.919 14.274 1.00 0.00 O ATOM 1369 CB LEU A 514 0.269 1.242 13.415 1.00 0.00 C ATOM 1370 CG LEU A 514 0.172 1.977 14.786 1.00 0.00 C ATOM 1371 CD1 LEU A 514 -1.238 2.540 14.983 1.00 0.00 C ATOM 1372 CD2 LEU A 514 0.480 1.003 15.932 1.00 0.00 C ATOM 0 H LEU A 514 0.840 0.372 11.183 1.00 0.00 H new ATOM 0 HA LEU A 514 1.671 2.657 12.581 1.00 0.00 H new ATOM 0 HB2 LEU A 514 -0.565 1.535 12.777 1.00 0.00 H new ATOM 0 HB3 LEU A 514 0.192 0.165 13.565 1.00 0.00 H new ATOM 0 HG LEU A 514 0.897 2.791 14.791 1.00 0.00 H new ATOM 0 HD11 LEU A 514 -1.295 3.051 15.944 1.00 0.00 H new ATOM 0 HD12 LEU A 514 -1.463 3.245 14.183 1.00 0.00 H new ATOM 0 HD13 LEU A 514 -1.961 1.725 14.963 1.00 0.00 H new ATOM 0 HD21 LEU A 514 0.409 1.528 16.885 1.00 0.00 H new ATOM 0 HD22 LEU A 514 -0.238 0.183 15.915 1.00 0.00 H new ATOM 0 HD23 LEU A 514 1.488 0.606 15.811 1.00 0.00 H new ATOM 1384 N VAL A 515 3.030 -0.189 13.579 1.00 0.00 N ATOM 1385 CA VAL A 515 4.121 -0.739 14.376 1.00 0.00 C ATOM 1386 C VAL A 515 5.461 -0.159 13.925 1.00 0.00 C ATOM 1387 O VAL A 515 6.267 0.275 14.749 1.00 0.00 O ATOM 1388 CB VAL A 515 4.149 -2.267 14.240 1.00 0.00 C ATOM 1389 CG1 VAL A 515 5.404 -2.826 14.921 1.00 0.00 C ATOM 1390 CG2 VAL A 515 2.903 -2.861 14.903 1.00 0.00 C ATOM 0 H VAL A 515 2.516 -0.875 13.027 1.00 0.00 H new ATOM 0 HA VAL A 515 3.956 -0.471 15.419 1.00 0.00 H new ATOM 0 HB VAL A 515 4.164 -2.533 13.183 1.00 0.00 H new ATOM 0 HG11 VAL A 515 5.419 -3.911 14.822 1.00 0.00 H new ATOM 0 HG12 VAL A 515 6.292 -2.406 14.449 1.00 0.00 H new ATOM 0 HG13 VAL A 515 5.394 -2.559 15.978 1.00 0.00 H new ATOM 0 HG21 VAL A 515 2.922 -3.947 14.807 1.00 0.00 H new ATOM 0 HG22 VAL A 515 2.889 -2.590 15.959 1.00 0.00 H new ATOM 0 HG23 VAL A 515 2.010 -2.469 14.416 1.00 0.00 H new ATOM 1400 N LYS A 516 5.693 -0.156 12.614 1.00 0.00 N ATOM 1401 CA LYS A 516 6.941 0.370 12.066 1.00 0.00 C ATOM 1402 C LYS A 516 7.051 1.872 12.308 1.00 0.00 C ATOM 1403 O LYS A 516 8.097 2.367 12.731 1.00 0.00 O ATOM 1404 CB LYS A 516 7.004 0.091 10.567 1.00 0.00 C ATOM 1405 CG LYS A 516 7.128 -1.417 10.338 1.00 0.00 C ATOM 1406 CD LYS A 516 7.181 -1.702 8.837 1.00 0.00 C ATOM 1407 CE LYS A 516 7.315 -3.205 8.604 1.00 0.00 C ATOM 1408 NZ LYS A 516 7.385 -3.469 7.141 1.00 0.00 N ATOM 0 H LYS A 516 5.038 -0.509 11.916 1.00 0.00 H new ATOM 0 HA LYS A 516 7.772 -0.125 12.569 1.00 0.00 H new ATOM 0 HB2 LYS A 516 6.108 0.472 10.076 1.00 0.00 H new ATOM 0 HB3 LYS A 516 7.855 0.609 10.124 1.00 0.00 H new ATOM 0 HG2 LYS A 516 8.027 -1.797 10.823 1.00 0.00 H new ATOM 0 HG3 LYS A 516 6.281 -1.935 10.788 1.00 0.00 H new ATOM 0 HD2 LYS A 516 6.278 -1.328 8.354 1.00 0.00 H new ATOM 0 HD3 LYS A 516 8.024 -1.178 8.387 1.00 0.00 H new ATOM 0 HE2 LYS A 516 8.210 -3.583 9.097 1.00 0.00 H new ATOM 0 HE3 LYS A 516 6.465 -3.730 9.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 516 6.777 -4.279 6.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 516 7.060 -2.629 6.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 516 8.367 -3.684 6.874 1.00 0.00 H new ATOM 1422 N GLY A 517 5.964 2.592 12.044 1.00 0.00 N ATOM 1423 CA GLY A 517 5.947 4.039 12.243 1.00 0.00 C ATOM 1424 C GLY A 517 6.456 4.783 11.016 1.00 0.00 C ATOM 1425 O GLY A 517 6.479 4.241 9.912 1.00 0.00 O ATOM 0 H GLY A 517 5.089 2.201 11.694 1.00 0.00 H new ATOM 0 HA2 GLY A 517 4.931 4.363 12.470 1.00 0.00 H new ATOM 0 HA3 GLY A 517 6.563 4.295 13.105 1.00 0.00 H new ATOM 1429 N ASN A 518 6.858 6.038 11.221 1.00 0.00 N ATOM 1430 CA ASN A 518 7.359 6.857 10.128 1.00 0.00 C ATOM 1431 C ASN A 518 8.452 6.118 9.367 1.00 0.00 C ATOM 1432 O ASN A 518 8.830 6.506 8.263 1.00 0.00 O ATOM 1433 CB ASN A 518 7.915 8.166 10.680 1.00 0.00 C ATOM 1434 CG ASN A 518 8.856 7.871 11.842 1.00 0.00 C ATOM 1435 OD1 ASN A 518 10.051 7.659 11.638 1.00 0.00 O ATOM 1436 ND2 ASN A 518 8.383 7.842 13.057 1.00 0.00 N ATOM 0 H ASN A 518 6.845 6.503 12.129 1.00 0.00 H new ATOM 0 HA ASN A 518 6.537 7.069 9.444 1.00 0.00 H new ATOM 0 HB2 ASN A 518 8.446 8.706 9.897 1.00 0.00 H new ATOM 0 HB3 ASN A 518 7.099 8.808 11.013 1.00 0.00 H new ATOM 0 HD21 ASN A 518 9.004 7.643 13.841 1.00 0.00 H new ATOM 0 HD22 ASN A 518 7.392 8.018 13.223 1.00 0.00 H new ATOM 1443 N ALA A 519 8.952 5.044 9.958 1.00 0.00 N ATOM 1444 CA ALA A 519 9.990 4.254 9.315 1.00 0.00 C ATOM 1445 C ALA A 519 9.440 3.617 8.045 1.00 0.00 C ATOM 1446 O ALA A 519 10.154 3.471 7.054 1.00 0.00 O ATOM 1447 CB ALA A 519 10.497 3.166 10.264 1.00 0.00 C ATOM 0 H ALA A 519 8.659 4.702 10.873 1.00 0.00 H new ATOM 0 HA ALA A 519 10.822 4.910 9.059 1.00 0.00 H new ATOM 0 HB1 ALA A 519 11.273 2.583 9.768 1.00 0.00 H new ATOM 0 HB2 ALA A 519 10.908 3.629 11.161 1.00 0.00 H new ATOM 0 HB3 ALA A 519 9.671 2.510 10.540 1.00 0.00 H new ATOM 1453 N ALA A 520 8.163 3.236 8.086 1.00 0.00 N ATOM 1454 CA ALA A 520 7.519 2.616 6.928 1.00 0.00 C ATOM 1455 C ALA A 520 6.804 3.664 6.092 1.00 0.00 C ATOM 1456 O ALA A 520 6.382 3.392 4.967 1.00 0.00 O ATOM 1457 CB ALA A 520 6.514 1.568 7.389 1.00 0.00 C ATOM 0 H ALA A 520 7.559 3.344 8.901 1.00 0.00 H new ATOM 0 HA ALA A 520 8.289 2.141 6.321 1.00 0.00 H new ATOM 0 HB1 ALA A 520 6.040 1.112 6.520 1.00 0.00 H new ATOM 0 HB2 ALA A 520 7.028 0.800 7.967 1.00 0.00 H new ATOM 0 HB3 ALA A 520 5.754 2.041 8.011 1.00 0.00 H new ATOM 1463 N ALA A 521 6.673 4.864 6.641 1.00 0.00 N ATOM 1464 CA ALA A 521 6.008 5.936 5.919 1.00 0.00 C ATOM 1465 C ALA A 521 6.728 6.190 4.604 1.00 0.00 C ATOM 1466 O ALA A 521 6.102 6.508 3.604 1.00 0.00 O ATOM 1467 CB ALA A 521 5.997 7.221 6.750 1.00 0.00 C ATOM 0 H ALA A 521 7.013 5.116 7.569 1.00 0.00 H new ATOM 0 HA ALA A 521 4.978 5.636 5.724 1.00 0.00 H new ATOM 0 HB1 ALA A 521 5.495 8.011 6.192 1.00 0.00 H new ATOM 0 HB2 ALA A 521 5.467 7.045 7.686 1.00 0.00 H new ATOM 0 HB3 ALA A 521 7.022 7.524 6.965 1.00 0.00 H new ATOM 1473 N ASN A 522 8.049 6.048 4.610 1.00 0.00 N ATOM 1474 CA ASN A 522 8.818 6.277 3.397 1.00 0.00 C ATOM 1475 C ASN A 522 8.383 5.310 2.308 1.00 0.00 C ATOM 1476 O ASN A 522 8.058 5.723 1.204 1.00 0.00 O ATOM 1477 CB ASN A 522 10.310 6.063 3.670 1.00 0.00 C ATOM 1478 CG ASN A 522 10.870 7.243 4.440 1.00 0.00 C ATOM 1479 OD1 ASN A 522 12.041 7.590 4.287 1.00 0.00 O ATOM 1480 ND2 ASN A 522 10.100 7.881 5.269 1.00 0.00 N ATOM 0 H ASN A 522 8.599 5.780 5.426 1.00 0.00 H new ATOM 0 HA ASN A 522 8.643 7.303 3.072 1.00 0.00 H new ATOM 0 HB2 ASN A 522 10.456 5.145 4.239 1.00 0.00 H new ATOM 0 HB3 ASN A 522 10.847 5.944 2.729 1.00 0.00 H new ATOM 0 HD21 ASN A 522 10.465 8.674 5.797 1.00 0.00 H new ATOM 0 HD22 ASN A 522 9.130 7.589 5.392 1.00 0.00 H new ATOM 1487 N ILE A 523 8.371 4.024 2.625 1.00 0.00 N ATOM 1488 CA ILE A 523 7.967 3.028 1.646 1.00 0.00 C ATOM 1489 C ILE A 523 6.505 3.219 1.278 1.00 0.00 C ATOM 1490 O ILE A 523 6.133 3.162 0.106 1.00 0.00 O ATOM 1491 CB ILE A 523 8.188 1.618 2.204 1.00 0.00 C ATOM 1492 CG1 ILE A 523 9.691 1.364 2.359 1.00 0.00 C ATOM 1493 CG2 ILE A 523 7.593 0.582 1.244 1.00 0.00 C ATOM 1494 CD1 ILE A 523 9.910 0.091 3.178 1.00 0.00 C ATOM 0 H ILE A 523 8.632 3.650 3.537 1.00 0.00 H new ATOM 0 HA ILE A 523 8.575 3.151 0.750 1.00 0.00 H new ATOM 0 HB ILE A 523 7.699 1.533 3.174 1.00 0.00 H new ATOM 0 HG12 ILE A 523 10.157 1.263 1.379 1.00 0.00 H new ATOM 0 HG13 ILE A 523 10.165 2.213 2.852 1.00 0.00 H new ATOM 0 HG21 ILE A 523 7.752 -0.419 1.645 1.00 0.00 H new ATOM 0 HG22 ILE A 523 6.524 0.762 1.132 1.00 0.00 H new ATOM 0 HG23 ILE A 523 8.079 0.665 0.272 1.00 0.00 H new ATOM 0 HD11 ILE A 523 10.979 -0.091 3.289 1.00 0.00 H new ATOM 0 HD12 ILE A 523 9.458 0.210 4.163 1.00 0.00 H new ATOM 0 HD13 ILE A 523 9.449 -0.754 2.667 1.00 0.00 H new ATOM 1506 N PHE A 524 5.678 3.444 2.287 1.00 0.00 N ATOM 1507 CA PHE A 524 4.256 3.638 2.048 1.00 0.00 C ATOM 1508 C PHE A 524 4.042 4.882 1.181 1.00 0.00 C ATOM 1509 O PHE A 524 3.306 4.845 0.199 1.00 0.00 O ATOM 1510 CB PHE A 524 3.517 3.780 3.390 1.00 0.00 C ATOM 1511 CG PHE A 524 2.078 3.341 3.237 1.00 0.00 C ATOM 1512 CD1 PHE A 524 1.780 1.975 3.181 1.00 0.00 C ATOM 1513 CD2 PHE A 524 1.059 4.287 3.146 1.00 0.00 C ATOM 1514 CE1 PHE A 524 0.456 1.554 3.037 1.00 0.00 C ATOM 1515 CE2 PHE A 524 -0.270 3.866 3.004 1.00 0.00 C ATOM 1516 CZ PHE A 524 -0.569 2.499 2.948 1.00 0.00 C ATOM 0 H PHE A 524 5.961 3.496 3.266 1.00 0.00 H new ATOM 0 HA PHE A 524 3.855 2.773 1.520 1.00 0.00 H new ATOM 0 HB2 PHE A 524 4.011 3.177 4.152 1.00 0.00 H new ATOM 0 HB3 PHE A 524 3.556 4.815 3.728 1.00 0.00 H new ATOM 0 HD1 PHE A 524 2.574 1.246 3.249 1.00 0.00 H new ATOM 0 HD2 PHE A 524 1.293 5.341 3.185 1.00 0.00 H new ATOM 0 HE1 PHE A 524 0.225 0.500 2.995 1.00 0.00 H new ATOM 0 HE2 PHE A 524 -1.064 4.596 2.938 1.00 0.00 H new ATOM 0 HZ PHE A 524 -1.593 2.175 2.836 1.00 0.00 H new ATOM 1526 N LYS A 525 4.700 5.975 1.552 1.00 0.00 N ATOM 1527 CA LYS A 525 4.588 7.227 0.807 1.00 0.00 C ATOM 1528 C LYS A 525 5.188 7.100 -0.589 1.00 0.00 C ATOM 1529 O LYS A 525 4.598 7.547 -1.567 1.00 0.00 O ATOM 1530 CB LYS A 525 5.303 8.347 1.565 1.00 0.00 C ATOM 1531 CG LYS A 525 4.493 8.719 2.809 1.00 0.00 C ATOM 1532 CD LYS A 525 5.329 9.620 3.723 1.00 0.00 C ATOM 1533 CE LYS A 525 5.642 10.937 3.011 1.00 0.00 C ATOM 1534 NZ LYS A 525 6.069 11.952 4.016 1.00 0.00 N ATOM 0 H LYS A 525 5.316 6.021 2.363 1.00 0.00 H new ATOM 0 HA LYS A 525 3.528 7.462 0.706 1.00 0.00 H new ATOM 0 HB2 LYS A 525 6.304 8.025 1.853 1.00 0.00 H new ATOM 0 HB3 LYS A 525 5.421 9.218 0.921 1.00 0.00 H new ATOM 0 HG2 LYS A 525 3.576 9.232 2.517 1.00 0.00 H new ATOM 0 HG3 LYS A 525 4.197 7.817 3.344 1.00 0.00 H new ATOM 0 HD2 LYS A 525 4.788 9.817 4.648 1.00 0.00 H new ATOM 0 HD3 LYS A 525 6.256 9.115 3.997 1.00 0.00 H new ATOM 0 HE2 LYS A 525 6.429 10.786 2.273 1.00 0.00 H new ATOM 0 HE3 LYS A 525 4.763 11.290 2.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 525 5.459 12.791 3.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 525 5.990 11.549 4.972 1.00 0.00 H new ATOM 0 HZ3 LYS A 525 7.056 12.225 3.836 1.00 0.00 H new ATOM 1548 N ASN A 526 6.367 6.497 -0.673 1.00 0.00 N ATOM 1549 CA ASN A 526 7.041 6.333 -1.952 1.00 0.00 C ATOM 1550 C ASN A 526 6.218 5.449 -2.890 1.00 0.00 C ATOM 1551 O ASN A 526 6.118 5.726 -4.082 1.00 0.00 O ATOM 1552 CB ASN A 526 8.438 5.731 -1.723 1.00 0.00 C ATOM 1553 CG ASN A 526 9.417 6.821 -1.259 1.00 0.00 C ATOM 1554 OD1 ASN A 526 9.840 7.648 -2.066 1.00 0.00 O ATOM 1555 ND2 ASN A 526 9.808 6.875 -0.007 1.00 0.00 N ATOM 0 H ASN A 526 6.873 6.115 0.126 1.00 0.00 H new ATOM 0 HA ASN A 526 7.147 7.309 -2.425 1.00 0.00 H new ATOM 0 HB2 ASN A 526 8.383 4.940 -0.975 1.00 0.00 H new ATOM 0 HB3 ASN A 526 8.801 5.275 -2.644 1.00 0.00 H new ATOM 0 HD21 ASN A 526 10.460 7.600 0.293 1.00 0.00 H new ATOM 0 HD22 ASN A 526 9.460 6.192 0.666 1.00 0.00 H new ATOM 1562 N CYS A 527 5.628 4.393 -2.345 1.00 0.00 N ATOM 1563 CA CYS A 527 4.817 3.483 -3.145 1.00 0.00 C ATOM 1564 C CYS A 527 3.577 4.195 -3.681 1.00 0.00 C ATOM 1565 O CYS A 527 3.203 4.020 -4.841 1.00 0.00 O ATOM 1566 CB CYS A 527 4.394 2.287 -2.293 1.00 0.00 C ATOM 1567 SG CYS A 527 5.856 1.317 -1.848 1.00 0.00 S ATOM 0 H CYS A 527 5.695 4.146 -1.358 1.00 0.00 H new ATOM 0 HA CYS A 527 5.413 3.139 -3.990 1.00 0.00 H new ATOM 0 HB2 CYS A 527 3.884 2.630 -1.393 1.00 0.00 H new ATOM 0 HB3 CYS A 527 3.686 1.667 -2.843 1.00 0.00 H new ATOM 0 HG CYS A 527 6.366 1.781 -0.746 1.00 0.00 H new ATOM 1573 N LEU A 528 2.947 5.003 -2.832 1.00 0.00 N ATOM 1574 CA LEU A 528 1.755 5.743 -3.233 1.00 0.00 C ATOM 1575 C LEU A 528 2.091 6.741 -4.335 1.00 0.00 C ATOM 1576 O LEU A 528 1.311 6.932 -5.268 1.00 0.00 O ATOM 1577 CB LEU A 528 1.150 6.476 -2.033 1.00 0.00 C ATOM 1578 CG LEU A 528 0.524 5.463 -1.060 1.00 0.00 C ATOM 1579 CD1 LEU A 528 0.161 6.180 0.244 1.00 0.00 C ATOM 1580 CD2 LEU A 528 -0.742 4.826 -1.678 1.00 0.00 C ATOM 0 H LEU A 528 3.240 5.161 -1.868 1.00 0.00 H new ATOM 0 HA LEU A 528 1.024 5.030 -3.615 1.00 0.00 H new ATOM 0 HB2 LEU A 528 1.921 7.054 -1.523 1.00 0.00 H new ATOM 0 HB3 LEU A 528 0.393 7.183 -2.372 1.00 0.00 H new ATOM 0 HG LEU A 528 1.244 4.670 -0.859 1.00 0.00 H new ATOM 0 HD11 LEU A 528 -0.284 5.468 0.939 1.00 0.00 H new ATOM 0 HD12 LEU A 528 1.061 6.606 0.687 1.00 0.00 H new ATOM 0 HD13 LEU A 528 -0.553 6.977 0.035 1.00 0.00 H new ATOM 0 HD21 LEU A 528 -1.171 4.112 -0.975 1.00 0.00 H new ATOM 0 HD22 LEU A 528 -1.473 5.605 -1.895 1.00 0.00 H new ATOM 0 HD23 LEU A 528 -0.477 4.311 -2.601 1.00 0.00 H new ATOM 1592 N LYS A 529 3.252 7.378 -4.228 1.00 0.00 N ATOM 1593 CA LYS A 529 3.664 8.349 -5.231 1.00 0.00 C ATOM 1594 C LYS A 529 3.777 7.687 -6.599 1.00 0.00 C ATOM 1595 O LYS A 529 3.316 8.235 -7.600 1.00 0.00 O ATOM 1596 CB LYS A 529 5.014 8.957 -4.844 1.00 0.00 C ATOM 1597 CG LYS A 529 4.829 9.941 -3.685 1.00 0.00 C ATOM 1598 CD LYS A 529 6.198 10.439 -3.221 1.00 0.00 C ATOM 1599 CE LYS A 529 6.017 11.499 -2.134 1.00 0.00 C ATOM 1600 NZ LYS A 529 5.479 12.745 -2.746 1.00 0.00 N ATOM 0 H LYS A 529 3.916 7.241 -3.466 1.00 0.00 H new ATOM 0 HA LYS A 529 2.912 9.136 -5.281 1.00 0.00 H new ATOM 0 HB2 LYS A 529 5.709 8.168 -4.556 1.00 0.00 H new ATOM 0 HB3 LYS A 529 5.451 9.469 -5.701 1.00 0.00 H new ATOM 0 HG2 LYS A 529 4.212 10.782 -4.002 1.00 0.00 H new ATOM 0 HG3 LYS A 529 4.307 9.455 -2.860 1.00 0.00 H new ATOM 0 HD2 LYS A 529 6.788 9.607 -2.837 1.00 0.00 H new ATOM 0 HD3 LYS A 529 6.749 10.858 -4.063 1.00 0.00 H new ATOM 0 HE2 LYS A 529 5.336 11.135 -1.365 1.00 0.00 H new ATOM 0 HE3 LYS A 529 6.970 11.702 -1.646 1.00 0.00 H new ATOM 0 HZ1 LYS A 529 5.727 13.560 -2.149 1.00 0.00 H new ATOM 0 HZ2 LYS A 529 5.890 12.872 -3.693 1.00 0.00 H new ATOM 0 HZ3 LYS A 529 4.444 12.675 -2.824 1.00 0.00 H new ATOM 1614 N GLU A 530 4.388 6.506 -6.640 1.00 0.00 N ATOM 1615 CA GLU A 530 4.541 5.791 -7.905 1.00 0.00 C ATOM 1616 C GLU A 530 3.209 5.172 -8.337 1.00 0.00 C ATOM 1617 O GLU A 530 2.796 5.309 -9.488 1.00 0.00 O ATOM 1618 CB GLU A 530 5.622 4.695 -7.764 1.00 0.00 C ATOM 1619 CG GLU A 530 6.998 5.241 -8.174 1.00 0.00 C ATOM 1620 CD GLU A 530 7.414 6.373 -7.242 1.00 0.00 C ATOM 1621 OE1 GLU A 530 6.827 6.484 -6.181 1.00 0.00 O ATOM 1622 OE2 GLU A 530 8.312 7.116 -7.605 1.00 0.00 O ATOM 0 H GLU A 530 4.779 6.030 -5.827 1.00 0.00 H new ATOM 0 HA GLU A 530 4.854 6.500 -8.672 1.00 0.00 H new ATOM 0 HB2 GLU A 530 5.657 4.341 -6.734 1.00 0.00 H new ATOM 0 HB3 GLU A 530 5.364 3.839 -8.387 1.00 0.00 H new ATOM 0 HG2 GLU A 530 7.739 4.442 -8.141 1.00 0.00 H new ATOM 0 HG3 GLU A 530 6.963 5.601 -9.202 1.00 0.00 H new ATOM 1629 N ILE A 531 2.548 4.483 -7.410 1.00 0.00 N ATOM 1630 CA ILE A 531 1.274 3.844 -7.721 1.00 0.00 C ATOM 1631 C ILE A 531 0.213 4.886 -8.073 1.00 0.00 C ATOM 1632 O ILE A 531 -0.529 4.725 -9.041 1.00 0.00 O ATOM 1633 CB ILE A 531 0.812 3.010 -6.521 1.00 0.00 C ATOM 1634 CG1 ILE A 531 1.760 1.822 -6.338 1.00 0.00 C ATOM 1635 CG2 ILE A 531 -0.607 2.491 -6.768 1.00 0.00 C ATOM 1636 CD1 ILE A 531 1.502 1.164 -4.981 1.00 0.00 C ATOM 0 H ILE A 531 2.868 4.354 -6.450 1.00 0.00 H new ATOM 0 HA ILE A 531 1.412 3.194 -8.585 1.00 0.00 H new ATOM 0 HB ILE A 531 0.819 3.630 -5.625 1.00 0.00 H new ATOM 0 HG12 ILE A 531 1.611 1.098 -7.139 1.00 0.00 H new ATOM 0 HG13 ILE A 531 2.795 2.157 -6.400 1.00 0.00 H new ATOM 0 HG21 ILE A 531 -0.932 1.899 -5.913 1.00 0.00 H new ATOM 0 HG22 ILE A 531 -1.284 3.334 -6.904 1.00 0.00 H new ATOM 0 HG23 ILE A 531 -0.617 1.870 -7.664 1.00 0.00 H new ATOM 0 HD11 ILE A 531 2.178 0.318 -4.852 1.00 0.00 H new ATOM 0 HD12 ILE A 531 1.674 1.890 -4.186 1.00 0.00 H new ATOM 0 HD13 ILE A 531 0.471 0.814 -4.936 1.00 0.00 H new ATOM 1648 N ASP A 532 0.150 5.952 -7.279 1.00 0.00 N ATOM 1649 CA ASP A 532 -0.823 7.022 -7.506 1.00 0.00 C ATOM 1650 C ASP A 532 -0.222 8.377 -7.153 1.00 0.00 C ATOM 1651 O ASP A 532 -0.425 8.890 -6.052 1.00 0.00 O ATOM 1652 CB ASP A 532 -2.074 6.775 -6.655 1.00 0.00 C ATOM 1653 CG ASP A 532 -2.910 5.647 -7.258 1.00 0.00 C ATOM 1654 OD1 ASP A 532 -2.713 5.342 -8.422 1.00 0.00 O ATOM 1655 OD2 ASP A 532 -3.736 5.103 -6.544 1.00 0.00 O ATOM 0 H ASP A 532 0.759 6.100 -6.474 1.00 0.00 H new ATOM 0 HA ASP A 532 -1.095 7.025 -8.561 1.00 0.00 H new ATOM 0 HB2 ASP A 532 -1.784 6.518 -5.636 1.00 0.00 H new ATOM 0 HB3 ASP A 532 -2.669 7.687 -6.597 1.00 0.00 H new ATOM 1660 N SER A 533 0.517 8.952 -8.096 1.00 0.00 N ATOM 1661 CA SER A 533 1.137 10.250 -7.876 1.00 0.00 C ATOM 1662 C SER A 533 0.071 11.310 -7.623 1.00 0.00 C ATOM 1663 O SER A 533 0.285 12.248 -6.854 1.00 0.00 O ATOM 1664 CB SER A 533 1.974 10.645 -9.094 1.00 0.00 C ATOM 1665 OG SER A 533 1.136 10.694 -10.242 1.00 0.00 O ATOM 0 H SER A 533 0.699 8.542 -9.012 1.00 0.00 H new ATOM 0 HA SER A 533 1.784 10.181 -7.002 1.00 0.00 H new ATOM 0 HB2 SER A 533 2.442 11.615 -8.929 1.00 0.00 H new ATOM 0 HB3 SER A 533 2.778 9.925 -9.247 1.00 0.00 H new ATOM 0 HG SER A 533 1.668 10.948 -11.025 1.00 0.00 H new ATOM 1671 N THR A 534 -1.079 11.152 -8.274 1.00 0.00 N ATOM 1672 CA THR A 534 -2.175 12.101 -8.116 1.00 0.00 C ATOM 1673 C THR A 534 -2.693 12.090 -6.679 1.00 0.00 C ATOM 1674 O THR A 534 -3.054 13.133 -6.134 1.00 0.00 O ATOM 1675 CB THR A 534 -3.317 11.745 -9.073 1.00 0.00 C ATOM 1676 OG1 THR A 534 -4.290 12.780 -9.048 1.00 0.00 O ATOM 1677 CG2 THR A 534 -3.963 10.427 -8.639 1.00 0.00 C ATOM 0 H THR A 534 -1.274 10.380 -8.912 1.00 0.00 H new ATOM 0 HA THR A 534 -1.802 13.098 -8.349 1.00 0.00 H new ATOM 0 HB THR A 534 -2.923 11.636 -10.083 1.00 0.00 H new ATOM 0 HG1 THR A 534 -5.022 12.556 -9.660 1.00 0.00 H new ATOM 0 HG21 THR A 534 -4.775 10.177 -9.322 1.00 0.00 H new ATOM 0 HG22 THR A 534 -3.217 9.633 -8.657 1.00 0.00 H new ATOM 0 HG23 THR A 534 -4.358 10.531 -7.629 1.00 0.00 H new ATOM 1685 N LEU A 535 -2.729 10.907 -6.073 1.00 0.00 N ATOM 1686 CA LEU A 535 -3.207 10.779 -4.702 1.00 0.00 C ATOM 1687 C LEU A 535 -2.327 11.585 -3.759 1.00 0.00 C ATOM 1688 O LEU A 535 -2.825 12.260 -2.863 1.00 0.00 O ATOM 1689 CB LEU A 535 -3.208 9.302 -4.282 1.00 0.00 C ATOM 1690 CG LEU A 535 -3.648 9.156 -2.816 1.00 0.00 C ATOM 1691 CD1 LEU A 535 -5.026 9.802 -2.602 1.00 0.00 C ATOM 1692 CD2 LEU A 535 -3.726 7.665 -2.470 1.00 0.00 C ATOM 0 H LEU A 535 -2.436 10.031 -6.506 1.00 0.00 H new ATOM 0 HA LEU A 535 -4.225 11.166 -4.649 1.00 0.00 H new ATOM 0 HB2 LEU A 535 -3.880 8.735 -4.927 1.00 0.00 H new ATOM 0 HB3 LEU A 535 -2.211 8.881 -4.412 1.00 0.00 H new ATOM 0 HG LEU A 535 -2.925 9.656 -2.172 1.00 0.00 H new ATOM 0 HD11 LEU A 535 -5.322 9.690 -1.559 1.00 0.00 H new ATOM 0 HD12 LEU A 535 -4.974 10.862 -2.852 1.00 0.00 H new ATOM 0 HD13 LEU A 535 -5.760 9.313 -3.243 1.00 0.00 H new ATOM 0 HD21 LEU A 535 -4.037 7.548 -1.432 1.00 0.00 H new ATOM 0 HD22 LEU A 535 -4.450 7.177 -3.123 1.00 0.00 H new ATOM 0 HD23 LEU A 535 -2.746 7.208 -2.609 1.00 0.00 H new ATOM 1704 N TYR A 536 -1.018 11.512 -3.968 1.00 0.00 N ATOM 1705 CA TYR A 536 -0.087 12.250 -3.126 1.00 0.00 C ATOM 1706 C TYR A 536 -0.375 13.742 -3.222 1.00 0.00 C ATOM 1707 O TYR A 536 -0.415 14.445 -2.213 1.00 0.00 O ATOM 1708 CB TYR A 536 1.353 11.972 -3.561 1.00 0.00 C ATOM 1709 CG TYR A 536 2.299 12.815 -2.736 1.00 0.00 C ATOM 1710 CD1 TYR A 536 2.627 14.110 -3.154 1.00 0.00 C ATOM 1711 CD2 TYR A 536 2.840 12.303 -1.550 1.00 0.00 C ATOM 1712 CE1 TYR A 536 3.499 14.891 -2.388 1.00 0.00 C ATOM 1713 CE2 TYR A 536 3.711 13.086 -0.783 1.00 0.00 C ATOM 1714 CZ TYR A 536 4.042 14.380 -1.203 1.00 0.00 C ATOM 1715 OH TYR A 536 4.902 15.152 -0.448 1.00 0.00 O ATOM 0 H TYR A 536 -0.582 10.956 -4.704 1.00 0.00 H new ATOM 0 HA TYR A 536 -0.213 11.925 -2.093 1.00 0.00 H new ATOM 0 HB2 TYR A 536 1.585 10.915 -3.433 1.00 0.00 H new ATOM 0 HB3 TYR A 536 1.475 12.200 -4.620 1.00 0.00 H new ATOM 0 HD1 TYR A 536 2.207 14.506 -4.067 1.00 0.00 H new ATOM 0 HD2 TYR A 536 2.585 11.304 -1.227 1.00 0.00 H new ATOM 0 HE1 TYR A 536 3.754 15.890 -2.711 1.00 0.00 H new ATOM 0 HE2 TYR A 536 4.127 12.692 0.132 1.00 0.00 H new ATOM 0 HH TYR A 536 5.186 14.647 0.343 1.00 0.00 H new ATOM 1725 N LYS A 537 -0.580 14.219 -4.446 1.00 0.00 N ATOM 1726 CA LYS A 537 -0.868 15.631 -4.666 1.00 0.00 C ATOM 1727 C LYS A 537 -2.201 16.012 -4.025 1.00 0.00 C ATOM 1728 O LYS A 537 -2.586 17.180 -4.028 1.00 0.00 O ATOM 1729 CB LYS A 537 -0.913 15.934 -6.171 1.00 0.00 C ATOM 1730 CG LYS A 537 -0.750 17.441 -6.403 1.00 0.00 C ATOM 1731 CD LYS A 537 -0.600 17.725 -7.903 1.00 0.00 C ATOM 1732 CE LYS A 537 -1.935 17.499 -8.623 1.00 0.00 C ATOM 1733 NZ LYS A 537 -1.885 18.127 -9.974 1.00 0.00 N ATOM 0 H LYS A 537 -0.552 13.653 -5.294 1.00 0.00 H new ATOM 0 HA LYS A 537 -0.074 16.219 -4.205 1.00 0.00 H new ATOM 0 HB2 LYS A 537 -0.120 15.390 -6.685 1.00 0.00 H new ATOM 0 HB3 LYS A 537 -1.859 15.592 -6.592 1.00 0.00 H new ATOM 0 HG2 LYS A 537 -1.615 17.974 -6.008 1.00 0.00 H new ATOM 0 HG3 LYS A 537 0.124 17.808 -5.865 1.00 0.00 H new ATOM 0 HD2 LYS A 537 -0.267 18.752 -8.054 1.00 0.00 H new ATOM 0 HD3 LYS A 537 0.165 17.076 -8.328 1.00 0.00 H new ATOM 0 HE2 LYS A 537 -2.135 16.431 -8.714 1.00 0.00 H new ATOM 0 HE3 LYS A 537 -2.751 17.928 -8.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 537 -2.791 17.973 -10.462 1.00 0.00 H new ATOM 0 HZ2 LYS A 537 -1.713 19.148 -9.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 537 -1.116 17.698 -10.528 1.00 0.00 H new ATOM 1747 N ASN A 538 -2.909 15.016 -3.485 1.00 0.00 N ATOM 1748 CA ASN A 538 -4.207 15.256 -2.841 1.00 0.00 C ATOM 1749 C ASN A 538 -4.168 14.830 -1.376 1.00 0.00 C ATOM 1750 O ASN A 538 -5.095 15.100 -0.616 1.00 0.00 O ATOM 1751 CB ASN A 538 -5.303 14.481 -3.575 1.00 0.00 C ATOM 1752 CG ASN A 538 -5.382 14.938 -5.026 1.00 0.00 C ATOM 1753 OD1 ASN A 538 -5.530 16.130 -5.295 1.00 0.00 O ATOM 1754 ND2 ASN A 538 -5.285 14.056 -5.984 1.00 0.00 N ATOM 0 H ASN A 538 -2.609 14.041 -3.480 1.00 0.00 H new ATOM 0 HA ASN A 538 -4.424 16.323 -2.888 1.00 0.00 H new ATOM 0 HB2 ASN A 538 -5.094 13.412 -3.533 1.00 0.00 H new ATOM 0 HB3 ASN A 538 -6.263 14.638 -3.083 1.00 0.00 H new ATOM 0 HD21 ASN A 538 -5.332 14.354 -6.958 1.00 0.00 H new ATOM 0 HD22 ASN A 538 -5.162 13.069 -5.758 1.00 0.00 H new ATOM 1761 N LEU A 539 -3.090 14.154 -0.981 1.00 0.00 N ATOM 1762 CA LEU A 539 -2.946 13.698 0.402 1.00 0.00 C ATOM 1763 C LEU A 539 -2.217 14.749 1.242 1.00 0.00 C ATOM 1764 O LEU A 539 -2.831 15.451 2.043 1.00 0.00 O ATOM 1765 CB LEU A 539 -2.174 12.370 0.435 1.00 0.00 C ATOM 1766 CG LEU A 539 -2.431 11.631 1.764 1.00 0.00 C ATOM 1767 CD1 LEU A 539 -3.835 10.993 1.768 1.00 0.00 C ATOM 1768 CD2 LEU A 539 -1.371 10.535 1.939 1.00 0.00 C ATOM 0 H LEU A 539 -2.310 13.911 -1.592 1.00 0.00 H new ATOM 0 HA LEU A 539 -3.939 13.547 0.825 1.00 0.00 H new ATOM 0 HB2 LEU A 539 -2.481 11.743 -0.402 1.00 0.00 H new ATOM 0 HB3 LEU A 539 -1.107 12.559 0.317 1.00 0.00 H new ATOM 0 HG LEU A 539 -2.373 12.346 2.585 1.00 0.00 H new ATOM 0 HD11 LEU A 539 -3.997 10.476 2.714 1.00 0.00 H new ATOM 0 HD12 LEU A 539 -4.589 11.771 1.646 1.00 0.00 H new ATOM 0 HD13 LEU A 539 -3.913 10.280 0.947 1.00 0.00 H new ATOM 0 HD21 LEU A 539 -1.545 10.007 2.877 1.00 0.00 H new ATOM 0 HD22 LEU A 539 -1.435 9.831 1.109 1.00 0.00 H new ATOM 0 HD23 LEU A 539 -0.379 10.987 1.956 1.00 0.00 H new ATOM 1780 N PHE A 540 -0.902 14.838 1.061 1.00 0.00 N ATOM 1781 CA PHE A 540 -0.082 15.788 1.812 1.00 0.00 C ATOM 1782 C PHE A 540 -0.337 17.235 1.388 1.00 0.00 C ATOM 1783 O PHE A 540 -0.368 18.136 2.226 1.00 0.00 O ATOM 1784 CB PHE A 540 1.399 15.461 1.614 1.00 0.00 C ATOM 1785 CG PHE A 540 1.736 14.171 2.323 1.00 0.00 C ATOM 1786 CD1 PHE A 540 2.058 14.190 3.681 1.00 0.00 C ATOM 1787 CD2 PHE A 540 1.722 12.960 1.622 1.00 0.00 C ATOM 1788 CE1 PHE A 540 2.371 12.998 4.343 1.00 0.00 C ATOM 1789 CE2 PHE A 540 2.035 11.766 2.284 1.00 0.00 C ATOM 1790 CZ PHE A 540 2.359 11.784 3.645 1.00 0.00 C ATOM 0 H PHE A 540 -0.379 14.263 0.400 1.00 0.00 H new ATOM 0 HA PHE A 540 -0.357 15.693 2.863 1.00 0.00 H new ATOM 0 HB2 PHE A 540 1.622 15.372 0.551 1.00 0.00 H new ATOM 0 HB3 PHE A 540 2.015 16.272 2.002 1.00 0.00 H new ATOM 0 HD1 PHE A 540 2.066 15.125 4.221 1.00 0.00 H new ATOM 0 HD2 PHE A 540 1.470 12.946 0.572 1.00 0.00 H new ATOM 0 HE1 PHE A 540 2.622 13.014 5.393 1.00 0.00 H new ATOM 0 HE2 PHE A 540 2.026 10.831 1.744 1.00 0.00 H new ATOM 0 HZ PHE A 540 2.599 10.864 4.156 1.00 0.00 H new ATOM 1800 N VAL A 541 -0.486 17.456 0.089 1.00 0.00 N ATOM 1801 CA VAL A 541 -0.703 18.804 -0.429 1.00 0.00 C ATOM 1802 C VAL A 541 -2.080 19.344 -0.042 1.00 0.00 C ATOM 1803 O VAL A 541 -2.189 20.265 0.767 1.00 0.00 O ATOM 1804 CB VAL A 541 -0.563 18.798 -1.952 1.00 0.00 C ATOM 1805 CG1 VAL A 541 -0.883 20.189 -2.507 1.00 0.00 C ATOM 1806 CG2 VAL A 541 0.869 18.414 -2.334 1.00 0.00 C ATOM 0 H VAL A 541 -0.461 16.726 -0.623 1.00 0.00 H new ATOM 0 HA VAL A 541 0.049 19.457 0.013 1.00 0.00 H new ATOM 0 HB VAL A 541 -1.259 18.073 -2.373 1.00 0.00 H new ATOM 0 HG11 VAL A 541 -0.782 20.180 -3.592 1.00 0.00 H new ATOM 0 HG12 VAL A 541 -1.904 20.461 -2.240 1.00 0.00 H new ATOM 0 HG13 VAL A 541 -0.191 20.917 -2.084 1.00 0.00 H new ATOM 0 HG21 VAL A 541 0.967 18.410 -3.420 1.00 0.00 H new ATOM 0 HG22 VAL A 541 1.565 19.137 -1.909 1.00 0.00 H new ATOM 0 HG23 VAL A 541 1.095 17.421 -1.946 1.00 0.00 H new