USER MOD reduce.3.24.130724 H: found=0, std=0, add=665, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 667 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: A1535 HIS : no HE2:sc= -5.16! C(o=-4!,f=-15!) USER MOD Set 1.2: A1549 SER OG : rot 161:sc= 1.21 USER MOD Single : A 760 SER OG : rot -24:sc= -0.0103 USER MOD Single : A 762 MET CE :methyl 138:sc= -0.283 (180deg=-1.68!) USER MOD Single : A 764 LYS NZ :NH3+ -160:sc= 0 (180deg=-0.232) USER MOD Single : A 766 THR OG1 : rot 180:sc= 0 USER MOD Single : A 771 SER OG : rot -88:sc= 0.223 USER MOD Single : A1503 TYR OH : rot -94:sc= 0.623 USER MOD Single : A1511 HIS : no HD1:sc= -5.26! C(o=-5.3!,f=-6.1!) USER MOD Single : A1515 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A1516 THR OG1 : rot 180:sc= 0 USER MOD Single : A1521 HIS : no HE2:sc= -0.0394 K(o=-0.039,f=-0.72) USER MOD Single : A1524 GLN : amide:sc= -8.38! C(o=-8.4!,f=-6.9!) USER MOD Single : A1525 GLN : amide:sc= -0.409 K(o=-0.41,f=-2.8!) USER MOD Single : A1528 ASN : amide:sc= -0.355 K(o=-0.35,f=-1.9!) USER MOD Single : A1533 THR OG1 : rot 170:sc= 0 USER MOD Single : A1537 HIS : no HD1:sc= 0 X(o=0,f=-0.007) USER MOD Single : A1539 THR OG1 : rot 75:sc= 0.794 USER MOD Single : A1540 ASN : amide:sc= -1.04 K(o=-1,f=-0.019) USER MOD Single : A1541 THR OG1 : rot 180:sc= 0 USER MOD Single : A1542 THR OG1 : rot -19:sc= 0.33 USER MOD Single : A1548 CYS SG : rot 180:sc= 0.177 USER MOD Single : A1552 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1553 THR OG1 : rot 180:sc=0.000217 USER MOD Single : A1554 THR OG1 : rot 180:sc= 0 USER MOD Single : A1557 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A1559 GLN : amide:sc= -0.33 X(o=-0.33,f=-0.063) USER MOD Single : A1560 SER OG : rot 180:sc= 0 USER MOD Single : A1561 TYR OH : rot 30:sc= -0.467 USER MOD ----------------------------------------------------------------- ATOM 389 N SER A 760 3.125 -0.085 11.254 1.00 0.00 N ATOM 390 CA SER A 760 4.155 -0.612 10.364 1.00 0.00 C ATOM 391 C SER A 760 4.817 0.520 9.580 1.00 0.00 C ATOM 392 O SER A 760 5.323 1.478 10.166 1.00 0.00 O ATOM 393 CB SER A 760 3.535 -1.621 9.395 1.00 0.00 C ATOM 394 OG SER A 760 2.492 -0.990 8.662 1.00 0.00 O ATOM 0 HA SER A 760 4.916 -1.109 10.966 1.00 0.00 H new ATOM 0 HB2 SER A 760 4.295 -2.002 8.713 1.00 0.00 H new ATOM 0 HB3 SER A 760 3.143 -2.476 9.945 1.00 0.00 H new ATOM 0 HG SER A 760 2.146 -0.229 9.174 1.00 0.00 H new ATOM 400 N LEU A 761 4.812 0.401 8.253 1.00 0.00 N ATOM 401 CA LEU A 761 5.416 1.414 7.387 1.00 0.00 C ATOM 402 C LEU A 761 4.455 1.804 6.272 1.00 0.00 C ATOM 403 O LEU A 761 3.807 0.951 5.666 1.00 0.00 O ATOM 404 CB LEU A 761 6.712 0.876 6.784 1.00 0.00 C ATOM 405 CG LEU A 761 7.698 0.485 7.915 1.00 0.00 C ATOM 406 CD1 LEU A 761 7.558 -1.003 8.260 1.00 0.00 C ATOM 407 CD2 LEU A 761 9.134 0.760 7.462 1.00 0.00 C ATOM 0 H LEU A 761 4.397 -0.386 7.754 1.00 0.00 H new ATOM 0 HA LEU A 761 5.635 2.298 7.987 1.00 0.00 H new ATOM 0 HB2 LEU A 761 6.500 0.009 6.159 1.00 0.00 H new ATOM 0 HB3 LEU A 761 7.164 1.630 6.140 1.00 0.00 H new ATOM 0 HG LEU A 761 7.465 1.079 8.799 1.00 0.00 H new ATOM 0 HD11 LEU A 761 8.258 -1.259 9.056 1.00 0.00 H new ATOM 0 HD12 LEU A 761 6.540 -1.205 8.593 1.00 0.00 H new ATOM 0 HD13 LEU A 761 7.777 -1.603 7.377 1.00 0.00 H new ATOM 0 HD21 LEU A 761 9.826 0.485 8.258 1.00 0.00 H new ATOM 0 HD22 LEU A 761 9.353 0.172 6.571 1.00 0.00 H new ATOM 0 HD23 LEU A 761 9.247 1.820 7.234 1.00 0.00 H new ATOM 419 N MET A 762 4.367 3.105 6.022 1.00 0.00 N ATOM 420 CA MET A 762 3.484 3.644 4.987 1.00 0.00 C ATOM 421 C MET A 762 4.268 4.553 4.054 1.00 0.00 C ATOM 422 O MET A 762 5.302 5.107 4.432 1.00 0.00 O ATOM 423 CB MET A 762 2.320 4.401 5.623 1.00 0.00 C ATOM 424 CG MET A 762 1.731 3.553 6.751 1.00 0.00 C ATOM 425 SD MET A 762 0.316 4.413 7.482 1.00 0.00 S ATOM 426 CE MET A 762 -0.765 4.374 6.029 1.00 0.00 C ATOM 0 H MET A 762 4.900 3.814 6.525 1.00 0.00 H new ATOM 0 HA MET A 762 3.077 2.817 4.405 1.00 0.00 H new ATOM 0 HB2 MET A 762 2.662 5.360 6.012 1.00 0.00 H new ATOM 0 HB3 MET A 762 1.557 4.615 4.875 1.00 0.00 H new ATOM 0 HG2 MET A 762 1.420 2.582 6.365 1.00 0.00 H new ATOM 0 HG3 MET A 762 2.488 3.366 7.512 1.00 0.00 H new ATOM 0 HE1 MET A 762 -1.782 4.132 6.338 1.00 0.00 H new ATOM 0 HE2 MET A 762 -0.756 5.349 5.542 1.00 0.00 H new ATOM 0 HE3 MET A 762 -0.409 3.617 5.331 1.00 0.00 H new ATOM 436 N VAL A 763 3.770 4.704 2.828 1.00 0.00 N ATOM 437 CA VAL A 763 4.428 5.555 1.835 1.00 0.00 C ATOM 438 C VAL A 763 3.693 6.886 1.689 1.00 0.00 C ATOM 439 O VAL A 763 2.507 6.905 1.373 1.00 0.00 O ATOM 440 CB VAL A 763 4.432 4.843 0.485 1.00 0.00 C ATOM 441 CG1 VAL A 763 5.106 5.741 -0.555 1.00 0.00 C ATOM 442 CG2 VAL A 763 5.218 3.536 0.622 1.00 0.00 C ATOM 0 H VAL A 763 2.918 4.251 2.498 1.00 0.00 H new ATOM 0 HA VAL A 763 5.448 5.749 2.167 1.00 0.00 H new ATOM 0 HB VAL A 763 3.411 4.629 0.169 1.00 0.00 H new ATOM 0 HG11 VAL A 763 5.112 5.237 -1.522 1.00 0.00 H new ATOM 0 HG12 VAL A 763 4.556 6.678 -0.638 1.00 0.00 H new ATOM 0 HG13 VAL A 763 6.131 5.948 -0.248 1.00 0.00 H new ATOM 0 HG21 VAL A 763 5.229 3.016 -0.336 1.00 0.00 H new ATOM 0 HG22 VAL A 763 6.241 3.757 0.927 1.00 0.00 H new ATOM 0 HG23 VAL A 763 4.744 2.903 1.373 1.00 0.00 H new ATOM 452 N LYS A 764 4.402 7.998 1.911 1.00 0.00 N ATOM 453 CA LYS A 764 3.795 9.334 1.791 1.00 0.00 C ATOM 454 C LYS A 764 4.637 10.195 0.860 1.00 0.00 C ATOM 455 O LYS A 764 5.836 10.378 1.072 1.00 0.00 O ATOM 456 CB LYS A 764 3.701 10.010 3.168 1.00 0.00 C ATOM 457 CG LYS A 764 4.963 9.679 3.978 1.00 0.00 C ATOM 458 CD LYS A 764 4.935 8.212 4.508 1.00 0.00 C ATOM 459 CE LYS A 764 5.347 8.173 5.984 1.00 0.00 C ATOM 460 NZ LYS A 764 6.718 8.736 6.117 1.00 0.00 N ATOM 0 H LYS A 764 5.388 8.004 2.173 1.00 0.00 H new ATOM 0 HA LYS A 764 2.790 9.225 1.384 1.00 0.00 H new ATOM 0 HB2 LYS A 764 3.602 11.089 3.051 1.00 0.00 H new ATOM 0 HB3 LYS A 764 2.813 9.664 3.697 1.00 0.00 H new ATOM 0 HG2 LYS A 764 5.845 9.825 3.355 1.00 0.00 H new ATOM 0 HG3 LYS A 764 5.049 10.369 4.818 1.00 0.00 H new ATOM 0 HD2 LYS A 764 3.935 7.795 4.391 1.00 0.00 H new ATOM 0 HD3 LYS A 764 5.610 7.592 3.918 1.00 0.00 H new ATOM 0 HE2 LYS A 764 4.644 8.747 6.587 1.00 0.00 H new ATOM 0 HE3 LYS A 764 5.323 7.148 6.355 1.00 0.00 H new ATOM 0 HZ1 LYS A 764 7.139 8.417 7.013 1.00 0.00 H new ATOM 0 HZ2 LYS A 764 7.306 8.410 5.323 1.00 0.00 H new ATOM 0 HZ3 LYS A 764 6.669 9.775 6.108 1.00 0.00 H new ATOM 474 N ILE A 765 3.998 10.721 -0.178 1.00 0.00 N ATOM 475 CA ILE A 765 4.688 11.570 -1.146 1.00 0.00 C ATOM 476 C ILE A 765 4.274 13.021 -0.961 1.00 0.00 C ATOM 477 O ILE A 765 3.104 13.361 -1.132 1.00 0.00 O ATOM 478 CB ILE A 765 4.337 11.121 -2.561 1.00 0.00 C ATOM 479 CG1 ILE A 765 4.786 9.663 -2.765 1.00 0.00 C ATOM 480 CG2 ILE A 765 5.053 12.030 -3.567 1.00 0.00 C ATOM 481 CD1 ILE A 765 4.020 9.041 -3.937 1.00 0.00 C ATOM 0 H ILE A 765 3.007 10.576 -0.372 1.00 0.00 H new ATOM 0 HA ILE A 765 5.763 11.483 -0.988 1.00 0.00 H new ATOM 0 HB ILE A 765 3.260 11.186 -2.712 1.00 0.00 H new ATOM 0 HG12 ILE A 765 5.858 9.627 -2.960 1.00 0.00 H new ATOM 0 HG13 ILE A 765 4.608 9.088 -1.856 1.00 0.00 H new ATOM 0 HG21 ILE A 765 4.807 11.715 -4.581 1.00 0.00 H new ATOM 0 HG22 ILE A 765 4.731 13.061 -3.419 1.00 0.00 H new ATOM 0 HG23 ILE A 765 6.130 11.961 -3.417 1.00 0.00 H new ATOM 0 HD11 ILE A 765 4.343 8.009 -4.076 1.00 0.00 H new ATOM 0 HD12 ILE A 765 2.951 9.062 -3.725 1.00 0.00 H new ATOM 0 HD13 ILE A 765 4.221 9.609 -4.845 1.00 0.00 H new ATOM 493 N THR A 766 5.245 13.870 -0.609 1.00 0.00 N ATOM 494 CA THR A 766 4.985 15.296 -0.402 1.00 0.00 C ATOM 495 C THR A 766 3.930 15.797 -1.372 1.00 0.00 C ATOM 496 O THR A 766 3.970 15.481 -2.561 1.00 0.00 O ATOM 497 CB THR A 766 6.267 16.094 -0.612 1.00 0.00 C ATOM 498 OG1 THR A 766 6.009 17.471 -0.376 1.00 0.00 O ATOM 499 CG2 THR A 766 6.755 15.905 -2.049 1.00 0.00 C ATOM 0 H THR A 766 6.216 13.594 -0.462 1.00 0.00 H new ATOM 0 HA THR A 766 4.625 15.430 0.618 1.00 0.00 H new ATOM 0 HB THR A 766 7.033 15.743 0.080 1.00 0.00 H new ATOM 0 HG1 THR A 766 6.832 17.986 -0.509 1.00 0.00 H new ATOM 0 HG21 THR A 766 7.672 16.475 -2.200 1.00 0.00 H new ATOM 0 HG22 THR A 766 6.951 14.848 -2.231 1.00 0.00 H new ATOM 0 HG23 THR A 766 5.991 16.257 -2.742 1.00 0.00 H new ATOM 507 N LEU A 767 2.975 16.556 -0.863 1.00 0.00 N ATOM 508 CA LEU A 767 1.904 17.063 -1.708 1.00 0.00 C ATOM 509 C LEU A 767 2.389 18.249 -2.532 1.00 0.00 C ATOM 510 O LEU A 767 1.760 18.627 -3.518 1.00 0.00 O ATOM 511 CB LEU A 767 0.700 17.473 -0.829 1.00 0.00 C ATOM 512 CG LEU A 767 -0.626 17.025 -1.467 1.00 0.00 C ATOM 513 CD1 LEU A 767 -0.772 17.660 -2.860 1.00 0.00 C ATOM 514 CD2 LEU A 767 -0.687 15.475 -1.556 1.00 0.00 C ATOM 0 H LEU A 767 2.917 16.833 0.117 1.00 0.00 H new ATOM 0 HA LEU A 767 1.592 16.277 -2.396 1.00 0.00 H new ATOM 0 HB2 LEU A 767 0.800 17.028 0.161 1.00 0.00 H new ATOM 0 HB3 LEU A 767 0.696 18.555 -0.694 1.00 0.00 H new ATOM 0 HG LEU A 767 -1.455 17.359 -0.843 1.00 0.00 H new ATOM 0 HD11 LEU A 767 -1.712 17.340 -3.309 1.00 0.00 H new ATOM 0 HD12 LEU A 767 -0.765 18.746 -2.767 1.00 0.00 H new ATOM 0 HD13 LEU A 767 0.058 17.344 -3.493 1.00 0.00 H new ATOM 0 HD21 LEU A 767 -1.631 15.173 -2.010 1.00 0.00 H new ATOM 0 HD22 LEU A 767 0.141 15.113 -2.166 1.00 0.00 H new ATOM 0 HD23 LEU A 767 -0.613 15.050 -0.555 1.00 0.00 H new ATOM 526 N ASP A 768 3.497 18.834 -2.115 1.00 0.00 N ATOM 527 CA ASP A 768 4.039 19.982 -2.820 1.00 0.00 C ATOM 528 C ASP A 768 4.631 19.569 -4.161 1.00 0.00 C ATOM 529 O ASP A 768 4.243 20.089 -5.207 1.00 0.00 O ATOM 530 CB ASP A 768 5.118 20.643 -1.972 1.00 0.00 C ATOM 531 CG ASP A 768 4.565 20.977 -0.592 1.00 0.00 C ATOM 532 OD1 ASP A 768 3.492 21.557 -0.530 1.00 0.00 O ATOM 533 OD2 ASP A 768 5.218 20.646 0.382 1.00 0.00 O ATOM 0 H ASP A 768 4.035 18.538 -1.301 1.00 0.00 H new ATOM 0 HA ASP A 768 3.227 20.686 -3.001 1.00 0.00 H new ATOM 0 HB2 ASP A 768 5.976 19.978 -1.878 1.00 0.00 H new ATOM 0 HB3 ASP A 768 5.471 21.551 -2.461 1.00 0.00 H new ATOM 538 N LEU A 769 5.575 18.635 -4.123 1.00 0.00 N ATOM 539 CA LEU A 769 6.222 18.170 -5.343 1.00 0.00 C ATOM 540 C LEU A 769 5.382 17.110 -6.047 1.00 0.00 C ATOM 541 O LEU A 769 5.923 16.164 -6.622 1.00 0.00 O ATOM 542 CB LEU A 769 7.601 17.595 -5.015 1.00 0.00 C ATOM 543 CG LEU A 769 8.275 18.468 -3.956 1.00 0.00 C ATOM 544 CD1 LEU A 769 9.698 17.964 -3.712 1.00 0.00 C ATOM 545 CD2 LEU A 769 8.328 19.918 -4.448 1.00 0.00 C ATOM 0 H LEU A 769 5.907 18.188 -3.268 1.00 0.00 H new ATOM 0 HA LEU A 769 6.328 19.024 -6.013 1.00 0.00 H new ATOM 0 HB2 LEU A 769 7.504 16.572 -4.651 1.00 0.00 H new ATOM 0 HB3 LEU A 769 8.215 17.556 -5.915 1.00 0.00 H new ATOM 0 HG LEU A 769 7.705 18.418 -3.028 1.00 0.00 H new ATOM 0 HD11 LEU A 769 10.180 18.586 -2.957 1.00 0.00 H new ATOM 0 HD12 LEU A 769 9.664 16.932 -3.364 1.00 0.00 H new ATOM 0 HD13 LEU A 769 10.266 18.015 -4.641 1.00 0.00 H new ATOM 0 HD21 LEU A 769 8.808 20.541 -3.693 1.00 0.00 H new ATOM 0 HD22 LEU A 769 8.898 19.967 -5.376 1.00 0.00 H new ATOM 0 HD23 LEU A 769 7.315 20.279 -4.625 1.00 0.00 H new ATOM 557 N LEU A 770 4.058 17.280 -6.019 1.00 0.00 N ATOM 558 CA LEU A 770 3.152 16.343 -6.673 1.00 0.00 C ATOM 559 C LEU A 770 2.460 17.022 -7.851 1.00 0.00 C ATOM 560 O LEU A 770 2.474 16.499 -8.966 1.00 0.00 O ATOM 561 CB LEU A 770 2.120 15.822 -5.653 1.00 0.00 C ATOM 562 CG LEU A 770 1.968 14.307 -5.787 1.00 0.00 C ATOM 563 CD1 LEU A 770 1.083 13.804 -4.662 1.00 0.00 C ATOM 564 CD2 LEU A 770 1.337 13.975 -7.144 1.00 0.00 C ATOM 0 H LEU A 770 3.594 18.058 -5.550 1.00 0.00 H new ATOM 0 HA LEU A 770 3.720 15.495 -7.055 1.00 0.00 H new ATOM 0 HB2 LEU A 770 2.437 16.075 -4.641 1.00 0.00 H new ATOM 0 HB3 LEU A 770 1.158 16.308 -5.817 1.00 0.00 H new ATOM 0 HG LEU A 770 2.943 13.824 -5.726 1.00 0.00 H new ATOM 0 HD11 LEU A 770 0.966 12.724 -4.746 1.00 0.00 H new ATOM 0 HD12 LEU A 770 1.541 14.046 -3.703 1.00 0.00 H new ATOM 0 HD13 LEU A 770 0.105 14.281 -4.728 1.00 0.00 H new ATOM 0 HD21 LEU A 770 1.228 12.895 -7.240 1.00 0.00 H new ATOM 0 HD22 LEU A 770 0.357 14.446 -7.214 1.00 0.00 H new ATOM 0 HD23 LEU A 770 1.977 14.348 -7.944 1.00 0.00 H new ATOM 576 N SER A 771 1.861 18.188 -7.603 1.00 0.00 N ATOM 577 CA SER A 771 1.172 18.935 -8.657 1.00 0.00 C ATOM 578 C SER A 771 -0.255 18.431 -8.837 1.00 0.00 C ATOM 579 O SER A 771 -1.209 19.203 -8.751 1.00 0.00 O ATOM 580 CB SER A 771 1.924 18.821 -9.987 1.00 0.00 C ATOM 581 OG SER A 771 1.429 17.703 -10.710 1.00 0.00 O ATOM 0 H SER A 771 1.839 18.634 -6.686 1.00 0.00 H new ATOM 0 HA SER A 771 1.143 19.981 -8.353 1.00 0.00 H new ATOM 0 HB2 SER A 771 1.795 19.733 -10.571 1.00 0.00 H new ATOM 0 HB3 SER A 771 2.993 18.707 -9.805 1.00 0.00 H new ATOM 0 HG SER A 771 1.931 16.901 -10.456 1.00 0.00 H new ATOM 587 N ARG A 772 -0.390 17.131 -9.100 1.00 0.00 N ATOM 588 CA ARG A 772 -1.705 16.524 -9.304 1.00 0.00 C ATOM 589 C ARG A 772 -2.319 16.111 -7.972 1.00 0.00 C ATOM 590 O ARG A 772 -1.666 15.484 -7.141 1.00 0.00 O ATOM 591 CB ARG A 772 -1.572 15.292 -10.210 1.00 0.00 C ATOM 592 CG ARG A 772 -1.417 15.727 -11.673 1.00 0.00 C ATOM 593 CD ARG A 772 -1.512 14.503 -12.583 1.00 0.00 C ATOM 594 NE ARG A 772 -1.662 14.925 -13.973 1.00 0.00 N ATOM 595 CZ ARG A 772 -2.334 14.189 -14.855 1.00 0.00 C ATOM 596 NH1 ARG A 772 -2.882 13.061 -14.490 1.00 0.00 N ATOM 597 NH2 ARG A 772 -2.442 14.592 -16.092 1.00 0.00 N ATOM 0 H ARG A 772 0.392 16.480 -9.177 1.00 0.00 H new ATOM 0 HA ARG A 772 -2.356 17.260 -9.777 1.00 0.00 H new ATOM 0 HB2 ARG A 772 -0.710 14.699 -9.906 1.00 0.00 H new ATOM 0 HB3 ARG A 772 -2.451 14.656 -10.103 1.00 0.00 H new ATOM 0 HG2 ARG A 772 -2.192 16.447 -11.933 1.00 0.00 H new ATOM 0 HG3 ARG A 772 -0.458 16.225 -11.815 1.00 0.00 H new ATOM 0 HD2 ARG A 772 -0.618 13.889 -12.475 1.00 0.00 H new ATOM 0 HD3 ARG A 772 -2.360 13.885 -12.288 1.00 0.00 H new ATOM 0 HE ARG A 772 -1.242 15.804 -14.275 1.00 0.00 H new ATOM 0 HH11 ARG A 772 -2.796 12.741 -13.525 1.00 0.00 H new ATOM 0 HH12 ARG A 772 -3.396 12.500 -15.170 1.00 0.00 H new ATOM 0 HH21 ARG A 772 -2.012 15.470 -16.382 1.00 0.00 H new ATOM 0 HH22 ARG A 772 -2.957 14.029 -16.769 1.00 0.00 H new ATOM 611 N ILE A 773 -3.587 16.469 -7.780 1.00 0.00 N ATOM 612 CA ILE A 773 -4.298 16.138 -6.548 1.00 0.00 C ATOM 613 C ILE A 773 -5.638 15.464 -6.872 1.00 0.00 C ATOM 614 O ILE A 773 -6.622 16.144 -7.169 1.00 0.00 O ATOM 615 CB ILE A 773 -4.545 17.413 -5.733 1.00 0.00 C ATOM 616 CG1 ILE A 773 -3.221 18.217 -5.607 1.00 0.00 C ATOM 617 CG2 ILE A 773 -5.052 17.010 -4.343 1.00 0.00 C ATOM 618 CD1 ILE A 773 -3.130 19.270 -6.717 1.00 0.00 C ATOM 0 H ILE A 773 -4.142 16.987 -8.461 1.00 0.00 H new ATOM 0 HA ILE A 773 -3.688 15.448 -5.965 1.00 0.00 H new ATOM 0 HB ILE A 773 -5.286 18.040 -6.228 1.00 0.00 H new ATOM 0 HG12 ILE A 773 -3.173 18.702 -4.632 1.00 0.00 H new ATOM 0 HG13 ILE A 773 -2.369 17.540 -5.668 1.00 0.00 H new ATOM 0 HG21 ILE A 773 -5.233 17.905 -3.748 1.00 0.00 H new ATOM 0 HG22 ILE A 773 -5.980 16.447 -4.443 1.00 0.00 H new ATOM 0 HG23 ILE A 773 -4.304 16.391 -3.848 1.00 0.00 H new ATOM 0 HD11 ILE A 773 -2.198 19.825 -6.616 1.00 0.00 H new ATOM 0 HD12 ILE A 773 -3.156 18.777 -7.689 1.00 0.00 H new ATOM 0 HD13 ILE A 773 -3.972 19.957 -6.636 1.00 0.00 H new ATOM 630 N PRO A 774 -5.695 14.151 -6.837 1.00 0.00 N ATOM 631 CA PRO A 774 -6.943 13.393 -7.150 1.00 0.00 C ATOM 632 C PRO A 774 -8.169 13.980 -6.455 1.00 0.00 C ATOM 633 O PRO A 774 -8.122 14.320 -5.274 1.00 0.00 O ATOM 634 CB PRO A 774 -6.641 11.980 -6.638 1.00 0.00 C ATOM 635 CG PRO A 774 -5.157 11.846 -6.739 1.00 0.00 C ATOM 636 CD PRO A 774 -4.584 13.243 -6.497 1.00 0.00 C ATOM 0 HA PRO A 774 -7.187 13.425 -8.212 1.00 0.00 H new ATOM 0 HB2 PRO A 774 -6.981 11.851 -5.610 1.00 0.00 H new ATOM 0 HB3 PRO A 774 -7.148 11.225 -7.239 1.00 0.00 H new ATOM 0 HG2 PRO A 774 -4.779 11.137 -6.002 1.00 0.00 H new ATOM 0 HG3 PRO A 774 -4.866 11.471 -7.720 1.00 0.00 H new ATOM 0 HD2 PRO A 774 -4.268 13.370 -5.462 1.00 0.00 H new ATOM 0 HD3 PRO A 774 -3.711 13.430 -7.122 1.00 0.00 H new ATOM 940 N ALA A1502 9.629 -12.928 5.753 1.00 0.00 N ATOM 941 CA ALA A1502 10.784 -12.173 5.287 1.00 0.00 C ATOM 942 C ALA A1502 10.399 -11.287 4.110 1.00 0.00 C ATOM 943 O ALA A1502 10.899 -10.172 3.977 1.00 0.00 O ATOM 944 CB ALA A1502 11.903 -13.126 4.868 1.00 0.00 C ATOM 0 HA ALA A1502 11.137 -11.544 6.104 1.00 0.00 H new ATOM 0 HB1 ALA A1502 12.761 -12.550 4.522 1.00 0.00 H new ATOM 0 HB2 ALA A1502 12.197 -13.738 5.720 1.00 0.00 H new ATOM 0 HB3 ALA A1502 11.550 -13.770 4.063 1.00 0.00 H new ATOM 950 N TYR A1503 9.515 -11.792 3.253 1.00 0.00 N ATOM 951 CA TYR A1503 9.070 -11.037 2.081 1.00 0.00 C ATOM 952 C TYR A1503 8.880 -9.561 2.422 1.00 0.00 C ATOM 953 O TYR A1503 9.011 -8.689 1.562 1.00 0.00 O ATOM 954 CB TYR A1503 7.749 -11.613 1.565 1.00 0.00 C ATOM 955 CG TYR A1503 7.485 -11.105 0.167 1.00 0.00 C ATOM 956 CD1 TYR A1503 8.178 -11.657 -0.916 1.00 0.00 C ATOM 957 CD2 TYR A1503 6.552 -10.082 -0.047 1.00 0.00 C ATOM 958 CE1 TYR A1503 7.940 -11.187 -2.213 1.00 0.00 C ATOM 959 CE2 TYR A1503 6.314 -9.613 -1.344 1.00 0.00 C ATOM 960 CZ TYR A1503 7.008 -10.165 -2.426 1.00 0.00 C ATOM 961 OH TYR A1503 6.773 -9.702 -3.704 1.00 0.00 O ATOM 0 H TYR A1503 9.093 -12.716 3.346 1.00 0.00 H new ATOM 0 HA TYR A1503 9.836 -11.121 1.310 1.00 0.00 H new ATOM 0 HB2 TYR A1503 7.791 -12.702 1.565 1.00 0.00 H new ATOM 0 HB3 TYR A1503 6.932 -11.326 2.227 1.00 0.00 H new ATOM 0 HD1 TYR A1503 8.897 -12.446 -0.751 1.00 0.00 H new ATOM 0 HD2 TYR A1503 6.017 -9.656 0.788 1.00 0.00 H new ATOM 0 HE1 TYR A1503 8.475 -11.613 -3.049 1.00 0.00 H new ATOM 0 HE2 TYR A1503 5.594 -8.825 -1.510 1.00 0.00 H new ATOM 0 HH TYR A1503 7.339 -8.921 -3.878 1.00 0.00 H new ATOM 971 N LEU A1504 8.576 -9.292 3.689 1.00 0.00 N ATOM 972 CA LEU A1504 8.372 -7.921 4.149 1.00 0.00 C ATOM 973 C LEU A1504 9.574 -7.055 3.784 1.00 0.00 C ATOM 974 O LEU A1504 9.420 -5.884 3.439 1.00 0.00 O ATOM 975 CB LEU A1504 8.172 -7.905 5.666 1.00 0.00 C ATOM 976 CG LEU A1504 7.187 -9.006 6.075 1.00 0.00 C ATOM 977 CD1 LEU A1504 6.906 -8.907 7.576 1.00 0.00 C ATOM 978 CD2 LEU A1504 5.876 -8.842 5.296 1.00 0.00 C ATOM 0 H LEU A1504 8.466 -10.002 4.413 1.00 0.00 H new ATOM 0 HA LEU A1504 7.484 -7.519 3.662 1.00 0.00 H new ATOM 0 HB2 LEU A1504 9.127 -8.055 6.169 1.00 0.00 H new ATOM 0 HB3 LEU A1504 7.795 -6.932 5.981 1.00 0.00 H new ATOM 0 HG LEU A1504 7.620 -9.980 5.849 1.00 0.00 H new ATOM 0 HD11 LEU A1504 6.206 -9.690 7.867 1.00 0.00 H new ATOM 0 HD12 LEU A1504 7.837 -9.029 8.129 1.00 0.00 H new ATOM 0 HD13 LEU A1504 6.475 -7.932 7.802 1.00 0.00 H new ATOM 0 HD21 LEU A1504 5.178 -9.626 5.589 1.00 0.00 H new ATOM 0 HD22 LEU A1504 5.441 -7.868 5.517 1.00 0.00 H new ATOM 0 HD23 LEU A1504 6.076 -8.916 4.227 1.00 0.00 H new ATOM 990 N ASP A1505 10.767 -7.632 3.866 1.00 0.00 N ATOM 991 CA ASP A1505 11.981 -6.896 3.541 1.00 0.00 C ATOM 992 C ASP A1505 11.812 -6.133 2.230 1.00 0.00 C ATOM 993 O ASP A1505 12.142 -4.950 2.143 1.00 0.00 O ATOM 994 CB ASP A1505 13.163 -7.860 3.425 1.00 0.00 C ATOM 995 CG ASP A1505 12.909 -8.866 2.307 1.00 0.00 C ATOM 996 OD1 ASP A1505 11.753 -9.134 2.029 1.00 0.00 O ATOM 997 OD2 ASP A1505 13.877 -9.352 1.745 1.00 0.00 O ATOM 0 H ASP A1505 10.919 -8.599 4.152 1.00 0.00 H new ATOM 0 HA ASP A1505 12.174 -6.181 4.341 1.00 0.00 H new ATOM 0 HB2 ASP A1505 14.078 -7.303 3.223 1.00 0.00 H new ATOM 0 HB3 ASP A1505 13.310 -8.383 4.370 1.00 0.00 H new ATOM 1002 N GLU A1506 11.298 -6.821 1.214 1.00 0.00 N ATOM 1003 CA GLU A1506 11.091 -6.204 -0.092 1.00 0.00 C ATOM 1004 C GLU A1506 10.223 -4.958 0.035 1.00 0.00 C ATOM 1005 O GLU A1506 10.647 -3.855 -0.307 1.00 0.00 O ATOM 1006 CB GLU A1506 10.417 -7.200 -1.038 1.00 0.00 C ATOM 1007 CG GLU A1506 10.269 -6.567 -2.424 1.00 0.00 C ATOM 1008 CD GLU A1506 9.757 -7.601 -3.419 1.00 0.00 C ATOM 1009 OE1 GLU A1506 10.487 -8.538 -3.700 1.00 0.00 O ATOM 1010 OE2 GLU A1506 8.640 -7.443 -3.887 1.00 0.00 O ATOM 0 H GLU A1506 11.019 -7.800 1.269 1.00 0.00 H new ATOM 0 HA GLU A1506 12.062 -5.917 -0.495 1.00 0.00 H new ATOM 0 HB2 GLU A1506 11.009 -8.113 -1.105 1.00 0.00 H new ATOM 0 HB3 GLU A1506 9.439 -7.483 -0.649 1.00 0.00 H new ATOM 0 HG2 GLU A1506 9.579 -5.724 -2.376 1.00 0.00 H new ATOM 0 HG3 GLU A1506 11.229 -6.174 -2.758 1.00 0.00 H new ATOM 1017 N LEU A1507 9.002 -5.143 0.520 1.00 0.00 N ATOM 1018 CA LEU A1507 8.077 -4.029 0.681 1.00 0.00 C ATOM 1019 C LEU A1507 8.737 -2.883 1.446 1.00 0.00 C ATOM 1020 O LEU A1507 8.662 -1.726 1.036 1.00 0.00 O ATOM 1021 CB LEU A1507 6.829 -4.500 1.439 1.00 0.00 C ATOM 1022 CG LEU A1507 5.936 -5.361 0.515 1.00 0.00 C ATOM 1023 CD1 LEU A1507 5.127 -6.359 1.352 1.00 0.00 C ATOM 1024 CD2 LEU A1507 4.965 -4.462 -0.269 1.00 0.00 C ATOM 0 H LEU A1507 8.631 -6.049 0.807 1.00 0.00 H new ATOM 0 HA LEU A1507 7.793 -3.669 -0.308 1.00 0.00 H new ATOM 0 HB2 LEU A1507 7.123 -5.079 2.315 1.00 0.00 H new ATOM 0 HB3 LEU A1507 6.267 -3.639 1.800 1.00 0.00 H new ATOM 0 HG LEU A1507 6.576 -5.901 -0.183 1.00 0.00 H new ATOM 0 HD11 LEU A1507 4.501 -6.962 0.694 1.00 0.00 H new ATOM 0 HD12 LEU A1507 5.808 -7.009 1.901 1.00 0.00 H new ATOM 0 HD13 LEU A1507 4.497 -5.816 2.056 1.00 0.00 H new ATOM 0 HD21 LEU A1507 4.341 -5.078 -0.916 1.00 0.00 H new ATOM 0 HD22 LEU A1507 4.333 -3.913 0.429 1.00 0.00 H new ATOM 0 HD23 LEU A1507 5.532 -3.756 -0.876 1.00 0.00 H new ATOM 1036 N VAL A1508 9.390 -3.215 2.550 1.00 0.00 N ATOM 1037 CA VAL A1508 10.061 -2.206 3.360 1.00 0.00 C ATOM 1038 C VAL A1508 11.051 -1.409 2.507 1.00 0.00 C ATOM 1039 O VAL A1508 10.981 -0.174 2.424 1.00 0.00 O ATOM 1040 CB VAL A1508 10.802 -2.889 4.515 1.00 0.00 C ATOM 1041 CG1 VAL A1508 11.619 -1.850 5.286 1.00 0.00 C ATOM 1042 CG2 VAL A1508 9.789 -3.546 5.459 1.00 0.00 C ATOM 0 H VAL A1508 9.470 -4.168 2.905 1.00 0.00 H new ATOM 0 HA VAL A1508 9.315 -1.519 3.760 1.00 0.00 H new ATOM 0 HB VAL A1508 11.470 -3.651 4.114 1.00 0.00 H new ATOM 0 HG11 VAL A1508 12.145 -2.337 6.107 1.00 0.00 H new ATOM 0 HG12 VAL A1508 12.342 -1.386 4.616 1.00 0.00 H new ATOM 0 HG13 VAL A1508 10.952 -1.086 5.685 1.00 0.00 H new ATOM 0 HG21 VAL A1508 10.318 -4.031 6.280 1.00 0.00 H new ATOM 0 HG22 VAL A1508 9.118 -2.786 5.859 1.00 0.00 H new ATOM 0 HG23 VAL A1508 9.210 -4.289 4.911 1.00 0.00 H new ATOM 1052 N GLU A1509 11.971 -2.117 1.873 1.00 0.00 N ATOM 1053 CA GLU A1509 12.963 -1.462 1.036 1.00 0.00 C ATOM 1054 C GLU A1509 12.283 -0.569 0.006 1.00 0.00 C ATOM 1055 O GLU A1509 12.701 0.565 -0.220 1.00 0.00 O ATOM 1056 CB GLU A1509 13.820 -2.506 0.319 1.00 0.00 C ATOM 1057 CG GLU A1509 15.047 -1.828 -0.295 1.00 0.00 C ATOM 1058 CD GLU A1509 16.076 -1.526 0.789 1.00 0.00 C ATOM 1059 OE1 GLU A1509 15.800 -1.822 1.940 1.00 0.00 O ATOM 1060 OE2 GLU A1509 17.127 -1.008 0.453 1.00 0.00 O ATOM 0 H GLU A1509 12.052 -3.133 1.920 1.00 0.00 H new ATOM 0 HA GLU A1509 13.600 -0.849 1.674 1.00 0.00 H new ATOM 0 HB2 GLU A1509 14.132 -3.279 1.021 1.00 0.00 H new ATOM 0 HB3 GLU A1509 13.236 -2.998 -0.459 1.00 0.00 H new ATOM 0 HG2 GLU A1509 15.487 -2.474 -1.055 1.00 0.00 H new ATOM 0 HG3 GLU A1509 14.751 -0.905 -0.793 1.00 0.00 H new ATOM 1067 N LEU A1510 11.235 -1.094 -0.618 1.00 0.00 N ATOM 1068 CA LEU A1510 10.509 -0.333 -1.631 1.00 0.00 C ATOM 1069 C LEU A1510 10.205 1.070 -1.131 1.00 0.00 C ATOM 1070 O LEU A1510 10.645 2.060 -1.716 1.00 0.00 O ATOM 1071 CB LEU A1510 9.192 -1.042 -1.980 1.00 0.00 C ATOM 1072 CG LEU A1510 8.666 -0.527 -3.340 1.00 0.00 C ATOM 1073 CD1 LEU A1510 9.256 -1.356 -4.485 1.00 0.00 C ATOM 1074 CD2 LEU A1510 7.138 -0.638 -3.380 1.00 0.00 C ATOM 0 H LEU A1510 10.871 -2.031 -0.445 1.00 0.00 H new ATOM 0 HA LEU A1510 11.136 -0.266 -2.520 1.00 0.00 H new ATOM 0 HB2 LEU A1510 9.349 -2.120 -2.025 1.00 0.00 H new ATOM 0 HB3 LEU A1510 8.452 -0.860 -1.201 1.00 0.00 H new ATOM 0 HG LEU A1510 8.965 0.515 -3.456 1.00 0.00 H new ATOM 0 HD11 LEU A1510 8.878 -0.983 -5.437 1.00 0.00 H new ATOM 0 HD12 LEU A1510 10.343 -1.275 -4.470 1.00 0.00 H new ATOM 0 HD13 LEU A1510 8.968 -2.400 -4.364 1.00 0.00 H new ATOM 0 HD21 LEU A1510 6.772 -0.274 -4.340 1.00 0.00 H new ATOM 0 HD22 LEU A1510 6.845 -1.680 -3.251 1.00 0.00 H new ATOM 0 HD23 LEU A1510 6.709 -0.039 -2.577 1.00 0.00 H new ATOM 1086 N HIS A1511 9.430 1.142 -0.049 1.00 0.00 N ATOM 1087 CA HIS A1511 9.054 2.424 0.535 1.00 0.00 C ATOM 1088 C HIS A1511 10.222 3.401 0.492 1.00 0.00 C ATOM 1089 O HIS A1511 10.046 4.580 0.190 1.00 0.00 O ATOM 1090 CB HIS A1511 8.631 2.233 1.995 1.00 0.00 C ATOM 1091 CG HIS A1511 7.760 1.018 2.121 1.00 0.00 C ATOM 1092 ND1 HIS A1511 7.062 0.489 1.048 1.00 0.00 N ATOM 1093 CD2 HIS A1511 7.464 0.218 3.194 1.00 0.00 C ATOM 1094 CE1 HIS A1511 6.385 -0.585 1.498 1.00 0.00 C ATOM 1095 NE2 HIS A1511 6.595 -0.792 2.800 1.00 0.00 N ATOM 0 H HIS A1511 9.053 0.329 0.438 1.00 0.00 H new ATOM 0 HA HIS A1511 8.224 2.826 -0.046 1.00 0.00 H new ATOM 0 HB2 HIS A1511 9.513 2.126 2.627 1.00 0.00 H new ATOM 0 HB3 HIS A1511 8.093 3.114 2.345 1.00 0.00 H new ATOM 0 HD2 HIS A1511 7.848 0.352 4.194 1.00 0.00 H new ATOM 0 HE1 HIS A1511 5.750 -1.203 0.881 1.00 0.00 H new ATOM 0 HE2 HIS A1511 6.202 -1.533 3.381 1.00 0.00 H new ATOM 1104 N ARG A1512 11.418 2.905 0.787 1.00 0.00 N ATOM 1105 CA ARG A1512 12.597 3.764 0.781 1.00 0.00 C ATOM 1106 C ARG A1512 12.897 4.290 -0.622 1.00 0.00 C ATOM 1107 O ARG A1512 12.728 5.476 -0.898 1.00 0.00 O ATOM 1108 CB ARG A1512 13.803 3.000 1.313 1.00 0.00 C ATOM 1109 CG ARG A1512 13.411 2.266 2.597 1.00 0.00 C ATOM 1110 CD ARG A1512 14.673 1.853 3.358 1.00 0.00 C ATOM 1111 NE ARG A1512 15.729 1.493 2.421 1.00 0.00 N ATOM 1112 CZ ARG A1512 16.907 1.055 2.849 1.00 0.00 C ATOM 1113 NH1 ARG A1512 17.131 0.939 4.128 1.00 0.00 N ATOM 1114 NH2 ARG A1512 17.838 0.740 1.991 1.00 0.00 N ATOM 0 H ARG A1512 11.596 1.930 1.029 1.00 0.00 H new ATOM 0 HA ARG A1512 12.391 4.617 1.427 1.00 0.00 H new ATOM 0 HB2 ARG A1512 14.155 2.288 0.567 1.00 0.00 H new ATOM 0 HB3 ARG A1512 14.625 3.688 1.510 1.00 0.00 H new ATOM 0 HG2 ARG A1512 12.792 2.910 3.222 1.00 0.00 H new ATOM 0 HG3 ARG A1512 12.814 1.386 2.357 1.00 0.00 H new ATOM 0 HD2 ARG A1512 15.006 2.671 3.996 1.00 0.00 H new ATOM 0 HD3 ARG A1512 14.453 1.009 4.011 1.00 0.00 H new ATOM 0 HE ARG A1512 15.560 1.579 1.419 1.00 0.00 H new ATOM 0 HH11 ARG A1512 16.402 1.185 4.798 1.00 0.00 H new ATOM 0 HH12 ARG A1512 18.035 0.603 4.459 1.00 0.00 H new ATOM 0 HH21 ARG A1512 17.661 0.830 0.991 1.00 0.00 H new ATOM 0 HH22 ARG A1512 18.743 0.404 2.321 1.00 0.00 H new ATOM 1128 N ARG A1513 13.350 3.398 -1.499 1.00 0.00 N ATOM 1129 CA ARG A1513 13.679 3.780 -2.871 1.00 0.00 C ATOM 1130 C ARG A1513 12.639 4.747 -3.430 1.00 0.00 C ATOM 1131 O ARG A1513 12.929 5.536 -4.330 1.00 0.00 O ATOM 1132 CB ARG A1513 13.743 2.532 -3.754 1.00 0.00 C ATOM 1133 CG ARG A1513 14.205 2.923 -5.158 1.00 0.00 C ATOM 1134 CD ARG A1513 14.413 1.662 -5.998 1.00 0.00 C ATOM 1135 NE ARG A1513 15.137 1.985 -7.222 1.00 0.00 N ATOM 1136 CZ ARG A1513 15.735 1.039 -7.936 1.00 0.00 C ATOM 1137 NH1 ARG A1513 15.680 -0.206 -7.548 1.00 0.00 N ATOM 1138 NH2 ARG A1513 16.376 1.353 -9.028 1.00 0.00 N ATOM 0 H ARG A1513 13.497 2.411 -1.287 1.00 0.00 H new ATOM 0 HA ARG A1513 14.649 4.277 -2.866 1.00 0.00 H new ATOM 0 HB2 ARG A1513 14.430 1.804 -3.323 1.00 0.00 H new ATOM 0 HB3 ARG A1513 12.763 2.057 -3.801 1.00 0.00 H new ATOM 0 HG2 ARG A1513 13.464 3.568 -5.629 1.00 0.00 H new ATOM 0 HG3 ARG A1513 15.133 3.492 -5.101 1.00 0.00 H new ATOM 0 HD2 ARG A1513 14.969 0.921 -5.423 1.00 0.00 H new ATOM 0 HD3 ARG A1513 13.449 1.217 -6.244 1.00 0.00 H new ATOM 0 HE ARG A1513 15.185 2.955 -7.535 1.00 0.00 H new ATOM 0 HH11 ARG A1513 15.177 -0.453 -6.696 1.00 0.00 H new ATOM 0 HH12 ARG A1513 16.140 -0.932 -8.097 1.00 0.00 H new ATOM 0 HH21 ARG A1513 16.418 2.325 -9.333 1.00 0.00 H new ATOM 0 HH22 ARG A1513 16.835 0.626 -9.577 1.00 0.00 H new ATOM 1152 N LEU A1514 11.427 4.676 -2.894 1.00 0.00 N ATOM 1153 CA LEU A1514 10.347 5.544 -3.351 1.00 0.00 C ATOM 1154 C LEU A1514 10.542 6.962 -2.815 1.00 0.00 C ATOM 1155 O LEU A1514 10.255 7.942 -3.502 1.00 0.00 O ATOM 1156 CB LEU A1514 8.994 4.976 -2.876 1.00 0.00 C ATOM 1157 CG LEU A1514 8.406 4.020 -3.937 1.00 0.00 C ATOM 1158 CD1 LEU A1514 7.475 3.007 -3.263 1.00 0.00 C ATOM 1159 CD2 LEU A1514 7.613 4.826 -4.976 1.00 0.00 C ATOM 0 H LEU A1514 11.167 4.031 -2.147 1.00 0.00 H new ATOM 0 HA LEU A1514 10.358 5.584 -4.440 1.00 0.00 H new ATOM 0 HB2 LEU A1514 9.127 4.445 -1.933 1.00 0.00 H new ATOM 0 HB3 LEU A1514 8.297 5.792 -2.687 1.00 0.00 H new ATOM 0 HG LEU A1514 9.221 3.491 -4.431 1.00 0.00 H new ATOM 0 HD11 LEU A1514 7.063 2.335 -4.016 1.00 0.00 H new ATOM 0 HD12 LEU A1514 8.036 2.429 -2.529 1.00 0.00 H new ATOM 0 HD13 LEU A1514 6.662 3.535 -2.764 1.00 0.00 H new ATOM 0 HD21 LEU A1514 7.199 4.149 -5.723 1.00 0.00 H new ATOM 0 HD22 LEU A1514 6.802 5.359 -4.481 1.00 0.00 H new ATOM 0 HD23 LEU A1514 8.274 5.543 -5.463 1.00 0.00 H new ATOM 1171 N MET A1515 11.037 7.060 -1.590 1.00 0.00 N ATOM 1172 CA MET A1515 11.266 8.366 -0.986 1.00 0.00 C ATOM 1173 C MET A1515 12.353 9.124 -1.742 1.00 0.00 C ATOM 1174 O MET A1515 12.335 10.354 -1.803 1.00 0.00 O ATOM 1175 CB MET A1515 11.686 8.206 0.477 1.00 0.00 C ATOM 1176 CG MET A1515 10.596 7.457 1.264 1.00 0.00 C ATOM 1177 SD MET A1515 10.571 8.039 2.976 1.00 0.00 S ATOM 1178 CE MET A1515 9.440 9.426 2.717 1.00 0.00 C ATOM 0 H MET A1515 11.285 6.265 -1.001 1.00 0.00 H new ATOM 0 HA MET A1515 10.335 8.931 -1.037 1.00 0.00 H new ATOM 0 HB2 MET A1515 12.627 7.659 0.535 1.00 0.00 H new ATOM 0 HB3 MET A1515 11.858 9.186 0.923 1.00 0.00 H new ATOM 0 HG2 MET A1515 9.623 7.619 0.800 1.00 0.00 H new ATOM 0 HG3 MET A1515 10.787 6.384 1.237 1.00 0.00 H new ATOM 0 HE1 MET A1515 9.276 9.943 3.662 1.00 0.00 H new ATOM 0 HE2 MET A1515 9.873 10.119 1.995 1.00 0.00 H new ATOM 0 HE3 MET A1515 8.489 9.054 2.337 1.00 0.00 H new ATOM 1188 N THR A1516 13.301 8.386 -2.314 1.00 0.00 N ATOM 1189 CA THR A1516 14.399 9.001 -3.060 1.00 0.00 C ATOM 1190 C THR A1516 14.044 9.121 -4.534 1.00 0.00 C ATOM 1191 O THR A1516 14.843 8.772 -5.403 1.00 0.00 O ATOM 1192 CB THR A1516 15.670 8.158 -2.913 1.00 0.00 C ATOM 1193 OG1 THR A1516 15.775 7.694 -1.577 1.00 0.00 O ATOM 1194 CG2 THR A1516 16.896 9.008 -3.262 1.00 0.00 C ATOM 0 H THR A1516 13.333 7.367 -2.277 1.00 0.00 H new ATOM 0 HA THR A1516 14.572 9.998 -2.654 1.00 0.00 H new ATOM 0 HB THR A1516 15.621 7.306 -3.591 1.00 0.00 H new ATOM 0 HG1 THR A1516 16.587 7.153 -1.481 1.00 0.00 H new ATOM 0 HG21 THR A1516 17.798 8.406 -3.156 1.00 0.00 H new ATOM 0 HG22 THR A1516 16.813 9.361 -4.290 1.00 0.00 H new ATOM 0 HG23 THR A1516 16.950 9.863 -2.588 1.00 0.00 H new ATOM 1202 N LEU A1517 12.840 9.614 -4.813 1.00 0.00 N ATOM 1203 CA LEU A1517 12.377 9.779 -6.193 1.00 0.00 C ATOM 1204 C LEU A1517 12.132 11.250 -6.501 1.00 0.00 C ATOM 1205 O LEU A1517 11.461 11.954 -5.744 1.00 0.00 O ATOM 1206 CB LEU A1517 11.077 8.979 -6.409 1.00 0.00 C ATOM 1207 CG LEU A1517 10.922 8.610 -7.903 1.00 0.00 C ATOM 1208 CD1 LEU A1517 11.652 7.295 -8.194 1.00 0.00 C ATOM 1209 CD2 LEU A1517 9.436 8.447 -8.249 1.00 0.00 C ATOM 0 H LEU A1517 12.167 9.906 -4.105 1.00 0.00 H new ATOM 0 HA LEU A1517 13.149 9.404 -6.865 1.00 0.00 H new ATOM 0 HB2 LEU A1517 11.093 8.073 -5.803 1.00 0.00 H new ATOM 0 HB3 LEU A1517 10.220 9.567 -6.081 1.00 0.00 H new ATOM 0 HG LEU A1517 11.352 9.408 -8.508 1.00 0.00 H new ATOM 0 HD11 LEU A1517 11.539 7.041 -9.248 1.00 0.00 H new ATOM 0 HD12 LEU A1517 12.711 7.407 -7.960 1.00 0.00 H new ATOM 0 HD13 LEU A1517 11.227 6.500 -7.582 1.00 0.00 H new ATOM 0 HD21 LEU A1517 9.334 8.187 -9.303 1.00 0.00 H new ATOM 0 HD22 LEU A1517 9.005 7.655 -7.637 1.00 0.00 H new ATOM 0 HD23 LEU A1517 8.912 9.383 -8.054 1.00 0.00 H new ATOM 1221 N ARG A1518 12.679 11.706 -7.622 1.00 0.00 N ATOM 1222 CA ARG A1518 12.519 13.096 -8.031 1.00 0.00 C ATOM 1223 C ARG A1518 12.654 13.229 -9.545 1.00 0.00 C ATOM 1224 O ARG A1518 13.611 13.823 -10.040 1.00 0.00 O ATOM 1225 CB ARG A1518 13.573 13.962 -7.348 1.00 0.00 C ATOM 1226 CG ARG A1518 13.213 15.436 -7.532 1.00 0.00 C ATOM 1227 CD ARG A1518 14.239 16.305 -6.806 1.00 0.00 C ATOM 1228 NE ARG A1518 15.496 16.324 -7.543 1.00 0.00 N ATOM 1229 CZ ARG A1518 15.651 17.089 -8.618 1.00 0.00 C ATOM 1230 NH1 ARG A1518 14.666 17.840 -9.032 1.00 0.00 N ATOM 1231 NH2 ARG A1518 16.786 17.090 -9.262 1.00 0.00 N ATOM 0 H ARG A1518 13.234 11.137 -8.261 1.00 0.00 H new ATOM 0 HA ARG A1518 11.524 13.430 -7.736 1.00 0.00 H new ATOM 0 HB2 ARG A1518 13.628 13.719 -6.287 1.00 0.00 H new ATOM 0 HB3 ARG A1518 14.557 13.760 -7.772 1.00 0.00 H new ATOM 0 HG2 ARG A1518 13.193 15.687 -8.593 1.00 0.00 H new ATOM 0 HG3 ARG A1518 12.214 15.629 -7.140 1.00 0.00 H new ATOM 0 HD2 ARG A1518 13.856 17.320 -6.700 1.00 0.00 H new ATOM 0 HD3 ARG A1518 14.405 15.920 -5.800 1.00 0.00 H new ATOM 0 HE ARG A1518 16.270 15.740 -7.228 1.00 0.00 H new ATOM 0 HH11 ARG A1518 13.778 17.839 -8.530 1.00 0.00 H new ATOM 0 HH12 ARG A1518 14.785 18.428 -9.857 1.00 0.00 H new ATOM 0 HH21 ARG A1518 17.556 16.503 -8.940 1.00 0.00 H new ATOM 0 HH22 ARG A1518 16.904 17.678 -10.087 1.00 0.00 H new ATOM 1245 N GLU A1519 11.686 12.675 -10.272 1.00 0.00 N ATOM 1246 CA GLU A1519 11.694 12.735 -11.737 1.00 0.00 C ATOM 1247 C GLU A1519 10.322 13.142 -12.266 1.00 0.00 C ATOM 1248 O GLU A1519 10.150 13.359 -13.466 1.00 0.00 O ATOM 1249 CB GLU A1519 12.079 11.370 -12.310 1.00 0.00 C ATOM 1250 CG GLU A1519 13.402 10.912 -11.696 1.00 0.00 C ATOM 1251 CD GLU A1519 13.954 9.721 -12.474 1.00 0.00 C ATOM 1252 OE1 GLU A1519 14.306 9.905 -13.627 1.00 0.00 O ATOM 1253 OE2 GLU A1519 14.016 8.645 -11.904 1.00 0.00 O ATOM 0 H GLU A1519 10.887 12.180 -9.875 1.00 0.00 H new ATOM 0 HA GLU A1519 12.425 13.481 -12.048 1.00 0.00 H new ATOM 0 HB2 GLU A1519 11.296 10.641 -12.098 1.00 0.00 H new ATOM 0 HB3 GLU A1519 12.172 11.432 -13.394 1.00 0.00 H new ATOM 0 HG2 GLU A1519 14.121 11.731 -11.710 1.00 0.00 H new ATOM 0 HG3 GLU A1519 13.252 10.637 -10.652 1.00 0.00 H new ATOM 1260 N ARG A1520 9.350 13.245 -11.366 1.00 0.00 N ATOM 1261 CA ARG A1520 7.999 13.627 -11.757 1.00 0.00 C ATOM 1262 C ARG A1520 7.542 12.797 -12.947 1.00 0.00 C ATOM 1263 O ARG A1520 8.274 11.929 -13.421 1.00 0.00 O ATOM 1264 CB ARG A1520 7.958 15.113 -12.121 1.00 0.00 C ATOM 1265 CG ARG A1520 8.112 15.954 -10.852 1.00 0.00 C ATOM 1266 CD ARG A1520 7.921 17.431 -11.195 1.00 0.00 C ATOM 1267 NE ARG A1520 8.601 17.753 -12.444 1.00 0.00 N ATOM 1268 CZ ARG A1520 8.409 18.920 -13.049 1.00 0.00 C ATOM 1269 NH1 ARG A1520 7.601 19.801 -12.527 1.00 0.00 N ATOM 1270 NH2 ARG A1520 9.029 19.185 -14.166 1.00 0.00 N ATOM 0 H ARG A1520 9.471 13.071 -10.368 1.00 0.00 H new ATOM 0 HA ARG A1520 7.329 13.445 -10.917 1.00 0.00 H new ATOM 0 HB2 ARG A1520 8.756 15.348 -12.825 1.00 0.00 H new ATOM 0 HB3 ARG A1520 7.016 15.351 -12.616 1.00 0.00 H new ATOM 0 HG2 ARG A1520 7.379 15.645 -10.107 1.00 0.00 H new ATOM 0 HG3 ARG A1520 9.098 15.795 -10.415 1.00 0.00 H new ATOM 0 HD2 ARG A1520 6.858 17.656 -11.283 1.00 0.00 H new ATOM 0 HD3 ARG A1520 8.313 18.052 -10.389 1.00 0.00 H new ATOM 0 HE ARG A1520 9.235 17.071 -12.860 1.00 0.00 H new ATOM 0 HH11 ARG A1520 7.116 19.594 -11.654 1.00 0.00 H new ATOM 0 HH12 ARG A1520 7.454 20.697 -12.992 1.00 0.00 H new ATOM 0 HH21 ARG A1520 9.661 18.496 -14.574 1.00 0.00 H new ATOM 0 HH22 ARG A1520 8.882 20.081 -14.631 1.00 0.00 H new ATOM 1284 N HIS A1521 6.330 13.069 -13.424 1.00 0.00 N ATOM 1285 CA HIS A1521 5.776 12.345 -14.565 1.00 0.00 C ATOM 1286 C HIS A1521 5.380 10.924 -14.168 1.00 0.00 C ATOM 1287 O HIS A1521 4.413 10.370 -14.692 1.00 0.00 O ATOM 1288 CB HIS A1521 6.807 12.298 -15.707 1.00 0.00 C ATOM 1289 CG HIS A1521 6.106 12.090 -17.021 1.00 0.00 C ATOM 1290 ND1 HIS A1521 5.516 10.883 -17.357 1.00 0.00 N ATOM 1291 CD2 HIS A1521 5.895 12.924 -18.090 1.00 0.00 C ATOM 1292 CE1 HIS A1521 4.983 11.022 -18.584 1.00 0.00 C ATOM 1293 NE2 HIS A1521 5.185 12.248 -19.075 1.00 0.00 N ATOM 0 H HIS A1521 5.713 13.784 -13.039 1.00 0.00 H new ATOM 0 HA HIS A1521 4.883 12.871 -14.903 1.00 0.00 H new ATOM 0 HB2 HIS A1521 7.377 13.227 -15.732 1.00 0.00 H new ATOM 0 HB3 HIS A1521 7.519 11.491 -15.533 1.00 0.00 H new ATOM 0 HD1 HIS A1521 5.490 10.043 -16.780 1.00 0.00 H new ATOM 0 HD2 HIS A1521 6.229 13.949 -18.156 1.00 0.00 H new ATOM 0 HE1 HIS A1521 4.456 10.238 -19.108 1.00 0.00 H new ATOM 1302 N ILE A1522 6.137 10.343 -13.243 1.00 0.00 N ATOM 1303 CA ILE A1522 5.862 8.984 -12.782 1.00 0.00 C ATOM 1304 C ILE A1522 4.809 9.003 -11.680 1.00 0.00 C ATOM 1305 O ILE A1522 3.919 8.157 -11.647 1.00 0.00 O ATOM 1306 CB ILE A1522 7.149 8.341 -12.257 1.00 0.00 C ATOM 1307 CG1 ILE A1522 8.259 8.495 -13.305 1.00 0.00 C ATOM 1308 CG2 ILE A1522 6.910 6.850 -11.995 1.00 0.00 C ATOM 1309 CD1 ILE A1522 9.588 8.019 -12.715 1.00 0.00 C ATOM 0 H ILE A1522 6.941 10.787 -12.799 1.00 0.00 H new ATOM 0 HA ILE A1522 5.484 8.400 -13.621 1.00 0.00 H new ATOM 0 HB ILE A1522 7.445 8.832 -11.330 1.00 0.00 H new ATOM 0 HG12 ILE A1522 8.016 7.915 -14.195 1.00 0.00 H new ATOM 0 HG13 ILE A1522 8.339 9.537 -13.615 1.00 0.00 H new ATOM 0 HG21 ILE A1522 7.827 6.395 -11.622 1.00 0.00 H new ATOM 0 HG22 ILE A1522 6.119 6.733 -11.254 1.00 0.00 H new ATOM 0 HG23 ILE A1522 6.614 6.361 -12.923 1.00 0.00 H new ATOM 0 HD11 ILE A1522 10.377 8.128 -13.460 1.00 0.00 H new ATOM 0 HD12 ILE A1522 9.832 8.618 -11.838 1.00 0.00 H new ATOM 0 HD13 ILE A1522 9.504 6.971 -12.427 1.00 0.00 H new ATOM 1321 N LEU A1523 4.923 9.967 -10.776 1.00 0.00 N ATOM 1322 CA LEU A1523 3.976 10.082 -9.673 1.00 0.00 C ATOM 1323 C LEU A1523 2.544 9.933 -10.179 1.00 0.00 C ATOM 1324 O LEU A1523 1.684 9.389 -9.489 1.00 0.00 O ATOM 1325 CB LEU A1523 4.138 11.440 -8.987 1.00 0.00 C ATOM 1326 CG LEU A1523 5.595 11.631 -8.543 1.00 0.00 C ATOM 1327 CD1 LEU A1523 5.789 13.066 -8.048 1.00 0.00 C ATOM 1328 CD2 LEU A1523 5.943 10.640 -7.418 1.00 0.00 C ATOM 0 H LEU A1523 5.656 10.676 -10.783 1.00 0.00 H new ATOM 0 HA LEU A1523 4.181 9.286 -8.957 1.00 0.00 H new ATOM 0 HB2 LEU A1523 3.849 12.239 -9.670 1.00 0.00 H new ATOM 0 HB3 LEU A1523 3.475 11.503 -8.124 1.00 0.00 H new ATOM 0 HG LEU A1523 6.255 11.443 -9.390 1.00 0.00 H new ATOM 0 HD11 LEU A1523 6.823 13.205 -7.732 1.00 0.00 H new ATOM 0 HD12 LEU A1523 5.559 13.763 -8.854 1.00 0.00 H new ATOM 0 HD13 LEU A1523 5.124 13.253 -7.205 1.00 0.00 H new ATOM 0 HD21 LEU A1523 6.979 10.786 -7.112 1.00 0.00 H new ATOM 0 HD22 LEU A1523 5.285 10.812 -6.566 1.00 0.00 H new ATOM 0 HD23 LEU A1523 5.811 9.620 -7.778 1.00 0.00 H new ATOM 1340 N GLN A1524 2.299 10.418 -11.390 1.00 0.00 N ATOM 1341 CA GLN A1524 0.969 10.331 -11.985 1.00 0.00 C ATOM 1342 C GLN A1524 0.601 8.879 -12.272 1.00 0.00 C ATOM 1343 O GLN A1524 -0.577 8.528 -12.329 1.00 0.00 O ATOM 1344 CB GLN A1524 0.936 11.129 -13.288 1.00 0.00 C ATOM 1345 CG GLN A1524 -0.495 11.172 -13.824 1.00 0.00 C ATOM 1346 CD GLN A1524 -0.541 11.965 -15.123 1.00 0.00 C ATOM 1347 OE1 GLN A1524 -1.200 11.556 -16.078 1.00 0.00 O ATOM 1348 NE2 GLN A1524 0.123 13.084 -15.217 1.00 0.00 N ATOM 0 H GLN A1524 2.998 10.873 -11.977 1.00 0.00 H new ATOM 0 HA GLN A1524 0.247 10.743 -11.280 1.00 0.00 H new ATOM 0 HB2 GLN A1524 1.302 12.141 -13.116 1.00 0.00 H new ATOM 0 HB3 GLN A1524 1.598 10.672 -14.024 1.00 0.00 H new ATOM 0 HG2 GLN A1524 -0.859 10.159 -13.994 1.00 0.00 H new ATOM 0 HG3 GLN A1524 -1.155 11.628 -13.086 1.00 0.00 H new ATOM 0 HE21 GLN A1524 0.669 13.421 -14.424 1.00 0.00 H new ATOM 0 HE22 GLN A1524 0.096 13.622 -16.083 1.00 0.00 H new ATOM 1357 N GLN A1525 1.612 8.038 -12.458 1.00 0.00 N ATOM 1358 CA GLN A1525 1.388 6.622 -12.744 1.00 0.00 C ATOM 1359 C GLN A1525 1.325 5.811 -11.454 1.00 0.00 C ATOM 1360 O GLN A1525 1.055 4.610 -11.481 1.00 0.00 O ATOM 1361 CB GLN A1525 2.515 6.082 -13.624 1.00 0.00 C ATOM 1362 CG GLN A1525 2.651 6.956 -14.871 1.00 0.00 C ATOM 1363 CD GLN A1525 1.406 6.820 -15.739 1.00 0.00 C ATOM 1364 OE1 GLN A1525 0.606 5.906 -15.540 1.00 0.00 O ATOM 1365 NE2 GLN A1525 1.192 7.679 -16.697 1.00 0.00 N ATOM 0 H GLN A1525 2.594 8.310 -12.416 1.00 0.00 H new ATOM 0 HA GLN A1525 0.436 6.528 -13.266 1.00 0.00 H new ATOM 0 HB2 GLN A1525 3.453 6.074 -13.068 1.00 0.00 H new ATOM 0 HB3 GLN A1525 2.305 5.051 -13.910 1.00 0.00 H new ATOM 0 HG2 GLN A1525 2.791 7.998 -14.582 1.00 0.00 H new ATOM 0 HG3 GLN A1525 3.534 6.661 -15.438 1.00 0.00 H new ATOM 0 HE21 GLN A1525 1.856 8.436 -16.861 1.00 0.00 H new ATOM 0 HE22 GLN A1525 0.361 7.594 -17.282 1.00 0.00 H new ATOM 1374 N ILE A1526 1.571 6.471 -10.323 1.00 0.00 N ATOM 1375 CA ILE A1526 1.536 5.802 -9.021 1.00 0.00 C ATOM 1376 C ILE A1526 0.269 6.183 -8.259 1.00 0.00 C ATOM 1377 O ILE A1526 -0.203 5.431 -7.406 1.00 0.00 O ATOM 1378 CB ILE A1526 2.761 6.204 -8.198 1.00 0.00 C ATOM 1379 CG1 ILE A1526 4.026 5.722 -8.915 1.00 0.00 C ATOM 1380 CG2 ILE A1526 2.673 5.561 -6.810 1.00 0.00 C ATOM 1381 CD1 ILE A1526 5.265 6.284 -8.214 1.00 0.00 C ATOM 0 H ILE A1526 1.796 7.465 -10.281 1.00 0.00 H new ATOM 0 HA ILE A1526 1.542 4.724 -9.185 1.00 0.00 H new ATOM 0 HB ILE A1526 2.796 7.288 -8.089 1.00 0.00 H new ATOM 0 HG12 ILE A1526 4.061 4.633 -8.917 1.00 0.00 H new ATOM 0 HG13 ILE A1526 4.009 6.043 -9.957 1.00 0.00 H new ATOM 0 HG21 ILE A1526 3.545 5.846 -6.221 1.00 0.00 H new ATOM 0 HG22 ILE A1526 1.768 5.903 -6.307 1.00 0.00 H new ATOM 0 HG23 ILE A1526 2.643 4.476 -6.913 1.00 0.00 H new ATOM 0 HD11 ILE A1526 6.162 5.938 -8.728 1.00 0.00 H new ATOM 0 HD12 ILE A1526 5.232 7.373 -8.235 1.00 0.00 H new ATOM 0 HD13 ILE A1526 5.285 5.941 -7.179 1.00 0.00 H new ATOM 1393 N VAL A1527 -0.279 7.358 -8.570 1.00 0.00 N ATOM 1394 CA VAL A1527 -1.494 7.833 -7.902 1.00 0.00 C ATOM 1395 C VAL A1527 -2.735 7.389 -8.671 1.00 0.00 C ATOM 1396 O VAL A1527 -3.687 6.876 -8.087 1.00 0.00 O ATOM 1397 CB VAL A1527 -1.474 9.364 -7.802 1.00 0.00 C ATOM 1398 CG1 VAL A1527 -2.718 9.847 -7.039 1.00 0.00 C ATOM 1399 CG2 VAL A1527 -0.213 9.814 -7.058 1.00 0.00 C ATOM 0 H VAL A1527 0.094 7.995 -9.274 1.00 0.00 H new ATOM 0 HA VAL A1527 -1.526 7.404 -6.900 1.00 0.00 H new ATOM 0 HB VAL A1527 -1.475 9.790 -8.805 1.00 0.00 H new ATOM 0 HG11 VAL A1527 -2.702 10.935 -6.969 1.00 0.00 H new ATOM 0 HG12 VAL A1527 -3.616 9.531 -7.570 1.00 0.00 H new ATOM 0 HG13 VAL A1527 -2.719 9.419 -6.037 1.00 0.00 H new ATOM 0 HG21 VAL A1527 -0.201 10.902 -6.988 1.00 0.00 H new ATOM 0 HG22 VAL A1527 -0.210 9.386 -6.056 1.00 0.00 H new ATOM 0 HG23 VAL A1527 0.670 9.475 -7.600 1.00 0.00 H new ATOM 1409 N ASN A1528 -2.717 7.594 -9.982 1.00 0.00 N ATOM 1410 CA ASN A1528 -3.851 7.211 -10.816 1.00 0.00 C ATOM 1411 C ASN A1528 -4.056 5.702 -10.781 1.00 0.00 C ATOM 1412 O ASN A1528 -5.187 5.217 -10.681 1.00 0.00 O ATOM 1413 CB ASN A1528 -3.613 7.661 -12.258 1.00 0.00 C ATOM 1414 CG ASN A1528 -4.884 7.473 -13.080 1.00 0.00 C ATOM 1415 OD1 ASN A1528 -5.329 6.345 -13.289 1.00 0.00 O ATOM 1416 ND2 ASN A1528 -5.496 8.520 -13.563 1.00 0.00 N ATOM 0 H ASN A1528 -1.939 8.019 -10.487 1.00 0.00 H new ATOM 0 HA ASN A1528 -4.745 7.697 -10.426 1.00 0.00 H new ATOM 0 HB2 ASN A1528 -3.310 8.708 -12.276 1.00 0.00 H new ATOM 0 HB3 ASN A1528 -2.798 7.086 -12.697 1.00 0.00 H new ATOM 0 HD21 ASN A1528 -6.346 8.404 -14.115 1.00 0.00 H new ATOM 0 HD22 ASN A1528 -5.125 9.454 -13.388 1.00 0.00 H new ATOM 1423 N LEU A1529 -2.957 4.962 -10.875 1.00 0.00 N ATOM 1424 CA LEU A1529 -3.028 3.507 -10.866 1.00 0.00 C ATOM 1425 C LEU A1529 -3.841 3.016 -9.673 1.00 0.00 C ATOM 1426 O LEU A1529 -4.748 2.198 -9.825 1.00 0.00 O ATOM 1427 CB LEU A1529 -1.617 2.907 -10.812 1.00 0.00 C ATOM 1428 CG LEU A1529 -1.678 1.389 -11.063 1.00 0.00 C ATOM 1429 CD1 LEU A1529 -2.123 1.093 -12.513 1.00 0.00 C ATOM 1430 CD2 LEU A1529 -0.288 0.783 -10.812 1.00 0.00 C ATOM 0 H LEU A1529 -2.014 5.342 -10.958 1.00 0.00 H new ATOM 0 HA LEU A1529 -3.520 3.184 -11.783 1.00 0.00 H new ATOM 0 HB2 LEU A1529 -0.982 3.382 -11.560 1.00 0.00 H new ATOM 0 HB3 LEU A1529 -1.166 3.105 -9.840 1.00 0.00 H new ATOM 0 HG LEU A1529 -2.406 0.945 -10.384 1.00 0.00 H new ATOM 0 HD11 LEU A1529 -2.160 0.015 -12.669 1.00 0.00 H new ATOM 0 HD12 LEU A1529 -3.112 1.518 -12.684 1.00 0.00 H new ATOM 0 HD13 LEU A1529 -1.412 1.537 -13.210 1.00 0.00 H new ATOM 0 HD21 LEU A1529 -0.323 -0.292 -10.988 1.00 0.00 H new ATOM 0 HD22 LEU A1529 0.435 1.238 -11.489 1.00 0.00 H new ATOM 0 HD23 LEU A1529 0.011 0.973 -9.781 1.00 0.00 H new ATOM 1442 N ILE A1530 -3.511 3.518 -8.485 1.00 0.00 N ATOM 1443 CA ILE A1530 -4.222 3.118 -7.274 1.00 0.00 C ATOM 1444 C ILE A1530 -5.597 3.773 -7.231 1.00 0.00 C ATOM 1445 O ILE A1530 -6.564 3.157 -6.801 1.00 0.00 O ATOM 1446 CB ILE A1530 -3.396 3.507 -6.030 1.00 0.00 C ATOM 1447 CG1 ILE A1530 -2.286 2.474 -5.802 1.00 0.00 C ATOM 1448 CG2 ILE A1530 -4.286 3.561 -4.781 1.00 0.00 C ATOM 1449 CD1 ILE A1530 -1.491 2.283 -7.089 1.00 0.00 C ATOM 0 H ILE A1530 -2.763 4.196 -8.336 1.00 0.00 H new ATOM 0 HA ILE A1530 -4.358 2.036 -7.280 1.00 0.00 H new ATOM 0 HB ILE A1530 -2.963 4.492 -6.203 1.00 0.00 H new ATOM 0 HG12 ILE A1530 -1.626 2.806 -5.001 1.00 0.00 H new ATOM 0 HG13 ILE A1530 -2.718 1.525 -5.486 1.00 0.00 H new ATOM 0 HG21 ILE A1530 -3.683 3.837 -3.916 1.00 0.00 H new ATOM 0 HG22 ILE A1530 -5.072 4.302 -4.926 1.00 0.00 H new ATOM 0 HG23 ILE A1530 -4.736 2.583 -4.612 1.00 0.00 H new ATOM 0 HD11 ILE A1530 -0.703 1.548 -6.924 1.00 0.00 H new ATOM 0 HD12 ILE A1530 -2.155 1.931 -7.878 1.00 0.00 H new ATOM 0 HD13 ILE A1530 -1.046 3.233 -7.386 1.00 0.00 H new ATOM 1461 N GLU A1531 -5.679 5.020 -7.671 1.00 0.00 N ATOM 1462 CA GLU A1531 -6.949 5.734 -7.679 1.00 0.00 C ATOM 1463 C GLU A1531 -8.083 4.820 -8.134 1.00 0.00 C ATOM 1464 O GLU A1531 -9.139 4.770 -7.508 1.00 0.00 O ATOM 1465 CB GLU A1531 -6.857 6.926 -8.628 1.00 0.00 C ATOM 1466 CG GLU A1531 -8.057 7.847 -8.409 1.00 0.00 C ATOM 1467 CD GLU A1531 -7.879 8.634 -7.116 1.00 0.00 C ATOM 1468 OE1 GLU A1531 -6.817 8.533 -6.524 1.00 0.00 O ATOM 1469 OE2 GLU A1531 -8.811 9.324 -6.734 1.00 0.00 O ATOM 0 H GLU A1531 -4.887 5.556 -8.025 1.00 0.00 H new ATOM 0 HA GLU A1531 -7.158 6.076 -6.665 1.00 0.00 H new ATOM 0 HB2 GLU A1531 -5.930 7.472 -8.454 1.00 0.00 H new ATOM 0 HB3 GLU A1531 -6.834 6.580 -9.662 1.00 0.00 H new ATOM 0 HG2 GLU A1531 -8.159 8.532 -9.251 1.00 0.00 H new ATOM 0 HG3 GLU A1531 -8.974 7.259 -8.364 1.00 0.00 H new ATOM 1476 N GLU A1532 -7.855 4.101 -9.231 1.00 0.00 N ATOM 1477 CA GLU A1532 -8.872 3.199 -9.760 1.00 0.00 C ATOM 1478 C GLU A1532 -9.352 2.238 -8.676 1.00 0.00 C ATOM 1479 O GLU A1532 -10.455 1.698 -8.753 1.00 0.00 O ATOM 1480 CB GLU A1532 -8.317 2.414 -10.953 1.00 0.00 C ATOM 1481 CG GLU A1532 -9.472 1.867 -11.792 1.00 0.00 C ATOM 1482 CD GLU A1532 -10.157 3.011 -12.530 1.00 0.00 C ATOM 1483 OE1 GLU A1532 -9.667 3.392 -13.579 1.00 0.00 O ATOM 1484 OE2 GLU A1532 -11.162 3.493 -12.033 1.00 0.00 O ATOM 0 H GLU A1532 -6.986 4.125 -9.764 1.00 0.00 H new ATOM 0 HA GLU A1532 -9.720 3.795 -10.095 1.00 0.00 H new ATOM 0 HB2 GLU A1532 -7.685 3.059 -11.563 1.00 0.00 H new ATOM 0 HB3 GLU A1532 -7.690 1.595 -10.602 1.00 0.00 H new ATOM 0 HG2 GLU A1532 -9.100 1.132 -12.506 1.00 0.00 H new ATOM 0 HG3 GLU A1532 -10.189 1.354 -11.151 1.00 0.00 H new ATOM 1491 N THR A1533 -8.523 2.053 -7.660 1.00 0.00 N ATOM 1492 CA THR A1533 -8.859 1.184 -6.539 1.00 0.00 C ATOM 1493 C THR A1533 -8.638 1.939 -5.238 1.00 0.00 C ATOM 1494 O THR A1533 -7.500 2.164 -4.832 1.00 0.00 O ATOM 1495 CB THR A1533 -8.011 -0.103 -6.571 1.00 0.00 C ATOM 1496 OG1 THR A1533 -7.994 -0.697 -5.280 1.00 0.00 O ATOM 1497 CG2 THR A1533 -6.575 0.223 -7.004 1.00 0.00 C ATOM 0 H THR A1533 -7.607 2.495 -7.588 1.00 0.00 H new ATOM 0 HA THR A1533 -9.907 0.892 -6.614 1.00 0.00 H new ATOM 0 HB THR A1533 -8.450 -0.799 -7.286 1.00 0.00 H new ATOM 0 HG1 THR A1533 -7.595 -1.590 -5.336 1.00 0.00 H new ATOM 0 HG21 THR A1533 -5.984 -0.693 -7.023 1.00 0.00 H new ATOM 0 HG22 THR A1533 -6.587 0.668 -7.999 1.00 0.00 H new ATOM 0 HG23 THR A1533 -6.133 0.925 -6.298 1.00 0.00 H new ATOM 1505 N GLY A1534 -9.743 2.325 -4.587 1.00 0.00 N ATOM 1506 CA GLY A1534 -9.665 3.044 -3.318 1.00 0.00 C ATOM 1507 C GLY A1534 -8.683 2.340 -2.397 1.00 0.00 C ATOM 1508 O GLY A1534 -8.145 1.306 -2.783 1.00 0.00 O ATOM 0 H GLY A1534 -10.692 2.151 -4.918 1.00 0.00 H new ATOM 0 HA2 GLY A1534 -9.346 4.072 -3.489 1.00 0.00 H new ATOM 0 HA3 GLY A1534 -10.649 3.089 -2.852 1.00 0.00 H new ATOM 1512 N HIS A1535 -8.467 2.906 -1.195 1.00 0.00 N ATOM 1513 CA HIS A1535 -7.542 2.347 -0.184 1.00 0.00 C ATOM 1514 C HIS A1535 -6.316 3.250 -0.012 1.00 0.00 C ATOM 1515 O HIS A1535 -5.229 2.779 0.327 1.00 0.00 O ATOM 1516 CB HIS A1535 -7.072 0.931 -0.552 1.00 0.00 C ATOM 1517 CG HIS A1535 -6.403 0.287 0.610 1.00 0.00 C ATOM 1518 ND1 HIS A1535 -7.125 -0.257 1.654 1.00 0.00 N ATOM 1519 CD2 HIS A1535 -5.090 0.045 0.883 1.00 0.00 C ATOM 1520 CE1 HIS A1535 -6.245 -0.804 2.504 1.00 0.00 C ATOM 1521 NE2 HIS A1535 -4.987 -0.648 2.081 1.00 0.00 N ATOM 0 H HIS A1535 -8.928 3.765 -0.894 1.00 0.00 H new ATOM 0 HA HIS A1535 -8.098 2.294 0.752 1.00 0.00 H new ATOM 0 HB2 HIS A1535 -7.924 0.329 -0.868 1.00 0.00 H new ATOM 0 HB3 HIS A1535 -6.384 0.977 -1.396 1.00 0.00 H new ATOM 0 HD1 HIS A1535 -8.140 -0.245 1.759 1.00 0.00 H new ATOM 0 HD2 HIS A1535 -4.258 0.346 0.263 1.00 0.00 H new ATOM 0 HE1 HIS A1535 -6.519 -1.309 3.419 1.00 0.00 H new ATOM 1530 N PHE A1536 -6.503 4.551 -0.232 1.00 0.00 N ATOM 1531 CA PHE A1536 -5.414 5.522 -0.089 1.00 0.00 C ATOM 1532 C PHE A1536 -5.936 6.785 0.568 1.00 0.00 C ATOM 1533 O PHE A1536 -7.005 7.279 0.216 1.00 0.00 O ATOM 1534 CB PHE A1536 -4.824 5.864 -1.462 1.00 0.00 C ATOM 1535 CG PHE A1536 -5.867 6.509 -2.339 1.00 0.00 C ATOM 1536 CD1 PHE A1536 -6.673 5.717 -3.164 1.00 0.00 C ATOM 1537 CD2 PHE A1536 -6.012 7.905 -2.344 1.00 0.00 C ATOM 1538 CE1 PHE A1536 -7.624 6.319 -3.994 1.00 0.00 C ATOM 1539 CE2 PHE A1536 -6.965 8.500 -3.172 1.00 0.00 C ATOM 1540 CZ PHE A1536 -7.769 7.708 -3.997 1.00 0.00 C ATOM 0 H PHE A1536 -7.396 4.958 -0.510 1.00 0.00 H new ATOM 0 HA PHE A1536 -4.633 5.084 0.533 1.00 0.00 H new ATOM 0 HB2 PHE A1536 -3.975 6.537 -1.342 1.00 0.00 H new ATOM 0 HB3 PHE A1536 -4.449 4.959 -1.939 1.00 0.00 H new ATOM 0 HD1 PHE A1536 -6.561 4.643 -3.160 1.00 0.00 H new ATOM 0 HD2 PHE A1536 -5.388 8.517 -1.709 1.00 0.00 H new ATOM 0 HE1 PHE A1536 -8.246 5.710 -4.633 1.00 0.00 H new ATOM 0 HE2 PHE A1536 -7.081 9.574 -3.175 1.00 0.00 H new ATOM 0 HZ PHE A1536 -8.504 8.171 -4.638 1.00 0.00 H new ATOM 1550 N HIS A1537 -5.192 7.298 1.547 1.00 0.00 N ATOM 1551 CA HIS A1537 -5.618 8.495 2.260 1.00 0.00 C ATOM 1552 C HIS A1537 -5.088 9.715 1.541 1.00 0.00 C ATOM 1553 O HIS A1537 -3.888 9.820 1.280 1.00 0.00 O ATOM 1554 CB HIS A1537 -5.064 8.466 3.688 1.00 0.00 C ATOM 1555 CG HIS A1537 -5.855 7.502 4.527 1.00 0.00 C ATOM 1556 ND1 HIS A1537 -5.324 6.302 4.972 1.00 0.00 N ATOM 1557 CD2 HIS A1537 -7.137 7.548 5.011 1.00 0.00 C ATOM 1558 CE1 HIS A1537 -6.277 5.679 5.689 1.00 0.00 C ATOM 1559 NE2 HIS A1537 -7.402 6.395 5.743 1.00 0.00 N ATOM 0 H HIS A1537 -4.303 6.908 1.860 1.00 0.00 H new ATOM 0 HA HIS A1537 -6.707 8.531 2.296 1.00 0.00 H new ATOM 0 HB2 HIS A1537 -4.014 8.172 3.674 1.00 0.00 H new ATOM 0 HB3 HIS A1537 -5.110 9.464 4.125 1.00 0.00 H new ATOM 0 HD2 HIS A1537 -7.835 8.356 4.849 1.00 0.00 H new ATOM 0 HE1 HIS A1537 -6.147 4.717 6.163 1.00 0.00 H new ATOM 0 HE2 HIS A1537 -8.270 6.149 6.219 1.00 0.00 H new ATOM 1568 N ILE A1538 -5.994 10.630 1.204 1.00 0.00 N ATOM 1569 CA ILE A1538 -5.625 11.843 0.486 1.00 0.00 C ATOM 1570 C ILE A1538 -5.721 13.067 1.391 1.00 0.00 C ATOM 1571 O ILE A1538 -6.561 13.126 2.289 1.00 0.00 O ATOM 1572 CB ILE A1538 -6.548 12.015 -0.741 1.00 0.00 C ATOM 1573 CG1 ILE A1538 -5.847 12.885 -1.812 1.00 0.00 C ATOM 1574 CG2 ILE A1538 -7.877 12.676 -0.322 1.00 0.00 C ATOM 1575 CD1 ILE A1538 -4.986 12.009 -2.728 1.00 0.00 C ATOM 0 H ILE A1538 -6.988 10.553 1.418 1.00 0.00 H new ATOM 0 HA ILE A1538 -4.590 11.751 0.155 1.00 0.00 H new ATOM 0 HB ILE A1538 -6.759 11.031 -1.159 1.00 0.00 H new ATOM 0 HG12 ILE A1538 -6.592 13.418 -2.402 1.00 0.00 H new ATOM 0 HG13 ILE A1538 -5.225 13.638 -1.328 1.00 0.00 H new ATOM 0 HG21 ILE A1538 -8.518 12.791 -1.196 1.00 0.00 H new ATOM 0 HG22 ILE A1538 -8.379 12.049 0.415 1.00 0.00 H new ATOM 0 HG23 ILE A1538 -7.675 13.656 0.112 1.00 0.00 H new ATOM 0 HD11 ILE A1538 -4.499 12.634 -3.476 1.00 0.00 H new ATOM 0 HD12 ILE A1538 -4.229 11.496 -2.135 1.00 0.00 H new ATOM 0 HD13 ILE A1538 -5.617 11.272 -3.225 1.00 0.00 H new ATOM 1587 N THR A1539 -4.873 14.052 1.137 1.00 0.00 N ATOM 1588 CA THR A1539 -4.892 15.279 1.922 1.00 0.00 C ATOM 1589 C THR A1539 -4.325 16.433 1.101 1.00 0.00 C ATOM 1590 O THR A1539 -3.420 16.243 0.287 1.00 0.00 O ATOM 1591 CB THR A1539 -4.089 15.091 3.228 1.00 0.00 C ATOM 1592 OG1 THR A1539 -3.906 13.703 3.466 1.00 0.00 O ATOM 1593 CG2 THR A1539 -4.841 15.710 4.414 1.00 0.00 C ATOM 0 H THR A1539 -4.168 14.028 0.400 1.00 0.00 H new ATOM 0 HA THR A1539 -5.923 15.516 2.186 1.00 0.00 H new ATOM 0 HB THR A1539 -3.124 15.587 3.124 1.00 0.00 H new ATOM 0 HG1 THR A1539 -3.223 13.354 2.856 1.00 0.00 H new ATOM 0 HG21 THR A1539 -4.261 15.569 5.326 1.00 0.00 H new ATOM 0 HG22 THR A1539 -4.985 16.776 4.237 1.00 0.00 H new ATOM 0 HG23 THR A1539 -5.812 15.226 4.522 1.00 0.00 H new ATOM 1601 N ASN A1540 -4.861 17.623 1.319 1.00 0.00 N ATOM 1602 CA ASN A1540 -4.401 18.797 0.597 1.00 0.00 C ATOM 1603 C ASN A1540 -3.000 19.183 1.041 1.00 0.00 C ATOM 1604 O ASN A1540 -2.460 20.194 0.596 1.00 0.00 O ATOM 1605 CB ASN A1540 -5.352 19.968 0.843 1.00 0.00 C ATOM 1606 CG ASN A1540 -6.670 19.729 0.119 1.00 0.00 C ATOM 1607 OD1 ASN A1540 -7.032 20.489 -0.781 1.00 0.00 O ATOM 1608 ND2 ASN A1540 -7.413 18.714 0.459 1.00 0.00 N ATOM 0 H ASN A1540 -5.611 17.801 1.987 1.00 0.00 H new ATOM 0 HA ASN A1540 -4.382 18.559 -0.467 1.00 0.00 H new ATOM 0 HB2 ASN A1540 -5.531 20.084 1.912 1.00 0.00 H new ATOM 0 HB3 ASN A1540 -4.898 20.895 0.493 1.00 0.00 H new ATOM 0 HD21 ASN A1540 -8.298 18.546 -0.020 1.00 0.00 H new ATOM 0 HD22 ASN A1540 -7.110 18.087 1.204 1.00 0.00 H new ATOM 1615 N THR A1541 -2.404 18.378 1.924 1.00 0.00 N ATOM 1616 CA THR A1541 -1.056 18.652 2.417 1.00 0.00 C ATOM 1617 C THR A1541 -0.245 17.354 2.505 1.00 0.00 C ATOM 1618 O THR A1541 0.946 17.380 2.809 1.00 0.00 O ATOM 1619 CB THR A1541 -1.137 19.291 3.807 1.00 0.00 C ATOM 1620 OG1 THR A1541 -1.825 18.414 4.688 1.00 0.00 O ATOM 1621 CG2 THR A1541 -1.890 20.618 3.712 1.00 0.00 C ATOM 0 H THR A1541 -2.832 17.536 2.309 1.00 0.00 H new ATOM 0 HA THR A1541 -0.563 19.334 1.724 1.00 0.00 H new ATOM 0 HB THR A1541 -0.132 19.472 4.187 1.00 0.00 H new ATOM 0 HG1 THR A1541 -1.877 18.819 5.579 1.00 0.00 H new ATOM 0 HG21 THR A1541 -1.949 21.074 4.700 1.00 0.00 H new ATOM 0 HG22 THR A1541 -1.362 21.288 3.034 1.00 0.00 H new ATOM 0 HG23 THR A1541 -2.897 20.439 3.335 1.00 0.00 H new ATOM 1629 N THR A1542 -0.900 16.221 2.236 1.00 0.00 N ATOM 1630 CA THR A1542 -0.231 14.929 2.291 1.00 0.00 C ATOM 1631 C THR A1542 -1.109 13.845 1.672 1.00 0.00 C ATOM 1632 O THR A1542 -2.331 13.985 1.605 1.00 0.00 O ATOM 1633 CB THR A1542 0.081 14.561 3.743 1.00 0.00 C ATOM 1634 OG1 THR A1542 0.908 15.562 4.319 1.00 0.00 O ATOM 1635 CG2 THR A1542 0.800 13.214 3.785 1.00 0.00 C ATOM 0 H THR A1542 -1.886 16.177 1.980 1.00 0.00 H new ATOM 0 HA THR A1542 0.698 15.000 1.726 1.00 0.00 H new ATOM 0 HB THR A1542 -0.849 14.492 4.308 1.00 0.00 H new ATOM 0 HG1 THR A1542 1.339 16.080 3.607 1.00 0.00 H new ATOM 0 HG21 THR A1542 1.022 12.952 4.820 1.00 0.00 H new ATOM 0 HG22 THR A1542 0.162 12.447 3.346 1.00 0.00 H new ATOM 0 HG23 THR A1542 1.730 13.280 3.220 1.00 0.00 H new ATOM 1643 N PHE A1543 -0.481 12.770 1.222 1.00 0.00 N ATOM 1644 CA PHE A1543 -1.211 11.670 0.612 1.00 0.00 C ATOM 1645 C PHE A1543 -0.347 10.408 0.649 1.00 0.00 C ATOM 1646 O PHE A1543 0.792 10.410 0.167 1.00 0.00 O ATOM 1647 CB PHE A1543 -1.603 12.045 -0.846 1.00 0.00 C ATOM 1648 CG PHE A1543 -1.328 10.889 -1.783 1.00 0.00 C ATOM 1649 CD1 PHE A1543 -2.173 9.772 -1.797 1.00 0.00 C ATOM 1650 CD2 PHE A1543 -0.201 10.926 -2.611 1.00 0.00 C ATOM 1651 CE1 PHE A1543 -1.887 8.692 -2.638 1.00 0.00 C ATOM 1652 CE2 PHE A1543 0.080 9.851 -3.453 1.00 0.00 C ATOM 1653 CZ PHE A1543 -0.759 8.731 -3.466 1.00 0.00 C ATOM 0 H PHE A1543 0.529 12.636 1.267 1.00 0.00 H new ATOM 0 HA PHE A1543 -2.128 11.476 1.168 1.00 0.00 H new ATOM 0 HB2 PHE A1543 -2.659 12.311 -0.888 1.00 0.00 H new ATOM 0 HB3 PHE A1543 -1.040 12.922 -1.166 1.00 0.00 H new ATOM 0 HD1 PHE A1543 -3.044 9.745 -1.159 1.00 0.00 H new ATOM 0 HD2 PHE A1543 0.451 11.787 -2.598 1.00 0.00 H new ATOM 0 HE1 PHE A1543 -2.536 7.829 -2.649 1.00 0.00 H new ATOM 0 HE2 PHE A1543 0.947 9.883 -4.096 1.00 0.00 H new ATOM 0 HZ PHE A1543 -0.536 7.897 -4.115 1.00 0.00 H new ATOM 1663 N ASP A1544 -0.902 9.332 1.211 1.00 0.00 N ATOM 1664 CA ASP A1544 -0.193 8.056 1.296 1.00 0.00 C ATOM 1665 C ASP A1544 -1.121 6.909 0.902 1.00 0.00 C ATOM 1666 O ASP A1544 -2.254 7.132 0.469 1.00 0.00 O ATOM 1667 CB ASP A1544 0.346 7.829 2.702 1.00 0.00 C ATOM 1668 CG ASP A1544 -0.721 8.177 3.729 1.00 0.00 C ATOM 1669 OD1 ASP A1544 -1.776 8.632 3.323 1.00 0.00 O ATOM 1670 OD2 ASP A1544 -0.467 7.982 4.904 1.00 0.00 O ATOM 0 H ASP A1544 -1.839 9.320 1.613 1.00 0.00 H new ATOM 0 HA ASP A1544 0.649 8.087 0.604 1.00 0.00 H new ATOM 0 HB2 ASP A1544 0.651 6.789 2.820 1.00 0.00 H new ATOM 0 HB3 ASP A1544 1.233 8.442 2.864 1.00 0.00 H new ATOM 1675 N PHE A1545 -0.647 5.691 1.120 1.00 0.00 N ATOM 1676 CA PHE A1545 -1.440 4.506 0.828 1.00 0.00 C ATOM 1677 C PHE A1545 -0.714 3.253 1.301 1.00 0.00 C ATOM 1678 O PHE A1545 0.433 3.325 1.741 1.00 0.00 O ATOM 1679 CB PHE A1545 -1.715 4.418 -0.676 1.00 0.00 C ATOM 1680 CG PHE A1545 -0.439 4.106 -1.431 1.00 0.00 C ATOM 1681 CD1 PHE A1545 0.661 4.980 -1.366 1.00 0.00 C ATOM 1682 CD2 PHE A1545 -0.366 2.951 -2.215 1.00 0.00 C ATOM 1683 CE1 PHE A1545 1.827 4.687 -2.077 1.00 0.00 C ATOM 1684 CE2 PHE A1545 0.797 2.662 -2.925 1.00 0.00 C ATOM 1685 CZ PHE A1545 1.896 3.529 -2.857 1.00 0.00 C ATOM 0 H PHE A1545 0.281 5.498 1.497 1.00 0.00 H new ATOM 0 HA PHE A1545 -2.389 4.580 1.359 1.00 0.00 H new ATOM 0 HB2 PHE A1545 -2.458 3.645 -0.871 1.00 0.00 H new ATOM 0 HB3 PHE A1545 -2.134 5.360 -1.031 1.00 0.00 H new ATOM 0 HD1 PHE A1545 0.604 5.877 -0.767 1.00 0.00 H new ATOM 0 HD2 PHE A1545 -1.212 2.282 -2.270 1.00 0.00 H new ATOM 0 HE1 PHE A1545 2.674 5.354 -2.024 1.00 0.00 H new ATOM 0 HE2 PHE A1545 0.852 1.768 -3.529 1.00 0.00 H new ATOM 0 HZ PHE A1545 2.797 3.302 -3.408 1.00 0.00 H new ATOM 1695 N ASP A1546 -1.387 2.104 1.215 1.00 0.00 N ATOM 1696 CA ASP A1546 -0.795 0.832 1.646 1.00 0.00 C ATOM 1697 C ASP A1546 -0.598 -0.111 0.462 1.00 0.00 C ATOM 1698 O ASP A1546 -1.561 -0.484 -0.209 1.00 0.00 O ATOM 1699 CB ASP A1546 -1.708 0.162 2.669 1.00 0.00 C ATOM 1700 CG ASP A1546 -1.791 1.021 3.924 1.00 0.00 C ATOM 1701 OD1 ASP A1546 -0.766 1.205 4.559 1.00 0.00 O ATOM 1702 OD2 ASP A1546 -2.876 1.485 4.230 1.00 0.00 O ATOM 0 H ASP A1546 -2.337 2.026 0.853 1.00 0.00 H new ATOM 0 HA ASP A1546 0.177 1.044 2.091 1.00 0.00 H new ATOM 0 HB2 ASP A1546 -2.703 0.022 2.246 1.00 0.00 H new ATOM 0 HB3 ASP A1546 -1.326 -0.828 2.919 1.00 0.00 H new ATOM 1707 N LEU A1547 0.656 -0.482 0.202 1.00 0.00 N ATOM 1708 CA LEU A1547 0.964 -1.376 -0.917 1.00 0.00 C ATOM 1709 C LEU A1547 0.869 -2.835 -0.474 1.00 0.00 C ATOM 1710 O LEU A1547 0.903 -3.749 -1.298 1.00 0.00 O ATOM 1711 CB LEU A1547 2.365 -1.081 -1.468 1.00 0.00 C ATOM 1712 CG LEU A1547 2.722 0.403 -1.225 1.00 0.00 C ATOM 1713 CD1 LEU A1547 3.450 0.591 0.126 1.00 0.00 C ATOM 1714 CD2 LEU A1547 3.610 0.878 -2.366 1.00 0.00 C ATOM 0 H LEU A1547 1.467 -0.182 0.743 1.00 0.00 H new ATOM 0 HA LEU A1547 0.234 -1.202 -1.708 1.00 0.00 H new ATOM 0 HB2 LEU A1547 3.099 -1.725 -0.984 1.00 0.00 H new ATOM 0 HB3 LEU A1547 2.400 -1.303 -2.535 1.00 0.00 H new ATOM 0 HG LEU A1547 1.804 0.990 -1.188 1.00 0.00 H new ATOM 0 HD11 LEU A1547 3.688 1.645 0.268 1.00 0.00 H new ATOM 0 HD12 LEU A1547 2.805 0.252 0.937 1.00 0.00 H new ATOM 0 HD13 LEU A1547 4.371 0.008 0.127 1.00 0.00 H new ATOM 0 HD21 LEU A1547 3.872 1.925 -2.211 1.00 0.00 H new ATOM 0 HD22 LEU A1547 4.519 0.277 -2.395 1.00 0.00 H new ATOM 0 HD23 LEU A1547 3.076 0.774 -3.310 1.00 0.00 H new ATOM 1726 N CYS A1548 0.747 -3.042 0.833 1.00 0.00 N ATOM 1727 CA CYS A1548 0.650 -4.392 1.386 1.00 0.00 C ATOM 1728 C CYS A1548 -0.808 -4.816 1.516 1.00 0.00 C ATOM 1729 O CYS A1548 -1.109 -5.861 2.091 1.00 0.00 O ATOM 1730 CB CYS A1548 1.323 -4.439 2.758 1.00 0.00 C ATOM 1731 SG CYS A1548 0.658 -3.123 3.806 1.00 0.00 S ATOM 0 H CYS A1548 0.713 -2.297 1.528 1.00 0.00 H new ATOM 0 HA CYS A1548 1.155 -5.081 0.708 1.00 0.00 H new ATOM 0 HB2 CYS A1548 1.153 -5.410 3.224 1.00 0.00 H new ATOM 0 HB3 CYS A1548 2.401 -4.321 2.650 1.00 0.00 H new ATOM 0 HG CYS A1548 1.230 -3.166 4.973 1.00 0.00 H new ATOM 1737 N SER A1549 -1.711 -4.000 0.976 1.00 0.00 N ATOM 1738 CA SER A1549 -3.146 -4.297 1.031 1.00 0.00 C ATOM 1739 C SER A1549 -3.652 -4.741 -0.337 1.00 0.00 C ATOM 1740 O SER A1549 -4.290 -5.787 -0.465 1.00 0.00 O ATOM 1741 CB SER A1549 -3.914 -3.056 1.482 1.00 0.00 C ATOM 1742 OG SER A1549 -3.454 -2.664 2.769 1.00 0.00 O ATOM 0 H SER A1549 -1.478 -3.130 0.496 1.00 0.00 H new ATOM 0 HA SER A1549 -3.307 -5.105 1.745 1.00 0.00 H new ATOM 0 HB2 SER A1549 -3.770 -2.245 0.768 1.00 0.00 H new ATOM 0 HB3 SER A1549 -4.983 -3.267 1.513 1.00 0.00 H new ATOM 0 HG SER A1549 -3.705 -1.732 2.936 1.00 0.00 H new ATOM 1748 N LEU A1550 -3.363 -3.942 -1.359 1.00 0.00 N ATOM 1749 CA LEU A1550 -3.796 -4.265 -2.714 1.00 0.00 C ATOM 1750 C LEU A1550 -3.084 -5.516 -3.220 1.00 0.00 C ATOM 1751 O LEU A1550 -2.099 -5.963 -2.635 1.00 0.00 O ATOM 1752 CB LEU A1550 -3.501 -3.090 -3.651 1.00 0.00 C ATOM 1753 CG LEU A1550 -4.033 -1.791 -3.032 1.00 0.00 C ATOM 1754 CD1 LEU A1550 -3.675 -0.612 -3.941 1.00 0.00 C ATOM 1755 CD2 LEU A1550 -5.560 -1.877 -2.874 1.00 0.00 C ATOM 0 H LEU A1550 -2.835 -3.073 -1.277 1.00 0.00 H new ATOM 0 HA LEU A1550 -4.869 -4.454 -2.698 1.00 0.00 H new ATOM 0 HB2 LEU A1550 -2.428 -3.010 -3.823 1.00 0.00 H new ATOM 0 HB3 LEU A1550 -3.967 -3.260 -4.621 1.00 0.00 H new ATOM 0 HG LEU A1550 -3.581 -1.646 -2.051 1.00 0.00 H new ATOM 0 HD11 LEU A1550 -4.052 0.312 -3.503 1.00 0.00 H new ATOM 0 HD12 LEU A1550 -2.592 -0.549 -4.045 1.00 0.00 H new ATOM 0 HD13 LEU A1550 -4.126 -0.759 -4.922 1.00 0.00 H new ATOM 0 HD21 LEU A1550 -5.933 -0.952 -2.434 1.00 0.00 H new ATOM 0 HD22 LEU A1550 -6.019 -2.025 -3.851 1.00 0.00 H new ATOM 0 HD23 LEU A1550 -5.812 -2.715 -2.224 1.00 0.00 H new ATOM 1767 N ASP A1551 -3.597 -6.077 -4.310 1.00 0.00 N ATOM 1768 CA ASP A1551 -3.008 -7.279 -4.889 1.00 0.00 C ATOM 1769 C ASP A1551 -1.494 -7.141 -4.981 1.00 0.00 C ATOM 1770 O ASP A1551 -0.964 -6.032 -5.045 1.00 0.00 O ATOM 1771 CB ASP A1551 -3.581 -7.526 -6.284 1.00 0.00 C ATOM 1772 CG ASP A1551 -5.039 -7.960 -6.180 1.00 0.00 C ATOM 1773 OD1 ASP A1551 -5.609 -7.798 -5.114 1.00 0.00 O ATOM 1774 OD2 ASP A1551 -5.564 -8.445 -7.169 1.00 0.00 O ATOM 0 H ASP A1551 -4.414 -5.722 -4.807 1.00 0.00 H new ATOM 0 HA ASP A1551 -3.249 -8.123 -4.243 1.00 0.00 H new ATOM 0 HB2 ASP A1551 -3.505 -6.619 -6.883 1.00 0.00 H new ATOM 0 HB3 ASP A1551 -3.000 -8.294 -6.794 1.00 0.00 H new ATOM 1779 N LYS A1552 -0.804 -8.276 -4.987 1.00 0.00 N ATOM 1780 CA LYS A1552 0.651 -8.271 -5.072 1.00 0.00 C ATOM 1781 C LYS A1552 1.108 -7.843 -6.465 1.00 0.00 C ATOM 1782 O LYS A1552 2.266 -7.480 -6.670 1.00 0.00 O ATOM 1783 CB LYS A1552 1.198 -9.677 -4.751 1.00 0.00 C ATOM 1784 CG LYS A1552 2.589 -9.567 -4.093 1.00 0.00 C ATOM 1785 CD LYS A1552 2.440 -9.361 -2.570 1.00 0.00 C ATOM 1786 CE LYS A1552 2.348 -10.718 -1.868 1.00 0.00 C ATOM 1787 NZ LYS A1552 1.833 -10.532 -0.484 1.00 0.00 N ATOM 0 H LYS A1552 -1.225 -9.204 -4.934 1.00 0.00 H new ATOM 0 HA LYS A1552 1.039 -7.557 -4.345 1.00 0.00 H new ATOM 0 HB2 LYS A1552 0.512 -10.199 -4.084 1.00 0.00 H new ATOM 0 HB3 LYS A1552 1.265 -10.267 -5.665 1.00 0.00 H new ATOM 0 HG2 LYS A1552 3.166 -10.470 -4.291 1.00 0.00 H new ATOM 0 HG3 LYS A1552 3.141 -8.734 -4.528 1.00 0.00 H new ATOM 0 HD2 LYS A1552 3.291 -8.799 -2.185 1.00 0.00 H new ATOM 0 HD3 LYS A1552 1.548 -8.771 -2.359 1.00 0.00 H new ATOM 0 HE2 LYS A1552 1.688 -11.383 -2.426 1.00 0.00 H new ATOM 0 HE3 LYS A1552 3.329 -11.192 -1.841 1.00 0.00 H new ATOM 0 HZ1 LYS A1552 1.772 -11.455 -0.009 1.00 0.00 H new ATOM 0 HZ2 LYS A1552 2.478 -9.912 0.046 1.00 0.00 H new ATOM 0 HZ3 LYS A1552 0.889 -10.098 -0.520 1.00 0.00 H new ATOM 1801 N THR A1553 0.191 -7.885 -7.419 1.00 0.00 N ATOM 1802 CA THR A1553 0.519 -7.503 -8.782 1.00 0.00 C ATOM 1803 C THR A1553 0.832 -6.013 -8.863 1.00 0.00 C ATOM 1804 O THR A1553 1.775 -5.603 -9.541 1.00 0.00 O ATOM 1805 CB THR A1553 -0.650 -7.839 -9.708 1.00 0.00 C ATOM 1806 OG1 THR A1553 -1.834 -7.234 -9.206 1.00 0.00 O ATOM 1807 CG2 THR A1553 -0.835 -9.356 -9.767 1.00 0.00 C ATOM 0 H THR A1553 -0.776 -8.177 -7.277 1.00 0.00 H new ATOM 0 HA THR A1553 1.402 -8.059 -9.096 1.00 0.00 H new ATOM 0 HB THR A1553 -0.444 -7.462 -10.710 1.00 0.00 H new ATOM 0 HG1 THR A1553 -2.586 -7.446 -9.798 1.00 0.00 H new ATOM 0 HG21 THR A1553 -1.669 -9.595 -10.427 1.00 0.00 H new ATOM 0 HG22 THR A1553 0.075 -9.819 -10.149 1.00 0.00 H new ATOM 0 HG23 THR A1553 -1.043 -9.736 -8.767 1.00 0.00 H new ATOM 1815 N THR A1554 0.039 -5.207 -8.167 1.00 0.00 N ATOM 1816 CA THR A1554 0.245 -3.765 -8.168 1.00 0.00 C ATOM 1817 C THR A1554 1.656 -3.426 -7.700 1.00 0.00 C ATOM 1818 O THR A1554 2.268 -2.474 -8.185 1.00 0.00 O ATOM 1819 CB THR A1554 -0.776 -3.095 -7.250 1.00 0.00 C ATOM 1820 OG1 THR A1554 -2.080 -3.548 -7.583 1.00 0.00 O ATOM 1821 CG2 THR A1554 -0.703 -1.577 -7.417 1.00 0.00 C ATOM 0 H THR A1554 -0.746 -5.525 -7.599 1.00 0.00 H new ATOM 0 HA THR A1554 0.115 -3.396 -9.186 1.00 0.00 H new ATOM 0 HB THR A1554 -0.554 -3.353 -6.214 1.00 0.00 H new ATOM 0 HG1 THR A1554 -2.735 -3.120 -6.993 1.00 0.00 H new ATOM 0 HG21 THR A1554 -1.433 -1.103 -6.761 1.00 0.00 H new ATOM 0 HG22 THR A1554 0.297 -1.230 -7.158 1.00 0.00 H new ATOM 0 HG23 THR A1554 -0.921 -1.314 -8.452 1.00 0.00 H new ATOM 1829 N VAL A1555 2.164 -4.207 -6.751 1.00 0.00 N ATOM 1830 CA VAL A1555 3.504 -3.975 -6.221 1.00 0.00 C ATOM 1831 C VAL A1555 4.562 -4.340 -7.250 1.00 0.00 C ATOM 1832 O VAL A1555 5.583 -3.665 -7.370 1.00 0.00 O ATOM 1833 CB VAL A1555 3.720 -4.803 -4.952 1.00 0.00 C ATOM 1834 CG1 VAL A1555 5.095 -4.475 -4.353 1.00 0.00 C ATOM 1835 CG2 VAL A1555 2.625 -4.462 -3.937 1.00 0.00 C ATOM 0 H VAL A1555 1.673 -4.999 -6.336 1.00 0.00 H new ATOM 0 HA VAL A1555 3.595 -2.915 -5.983 1.00 0.00 H new ATOM 0 HB VAL A1555 3.677 -5.865 -5.195 1.00 0.00 H new ATOM 0 HG11 VAL A1555 5.248 -5.065 -3.449 1.00 0.00 H new ATOM 0 HG12 VAL A1555 5.874 -4.713 -5.078 1.00 0.00 H new ATOM 0 HG13 VAL A1555 5.141 -3.414 -4.106 1.00 0.00 H new ATOM 0 HG21 VAL A1555 2.774 -5.049 -3.031 1.00 0.00 H new ATOM 0 HG22 VAL A1555 2.672 -3.401 -3.694 1.00 0.00 H new ATOM 0 HG23 VAL A1555 1.649 -4.694 -4.363 1.00 0.00 H new ATOM 1845 N ARG A1556 4.307 -5.413 -7.986 1.00 0.00 N ATOM 1846 CA ARG A1556 5.249 -5.866 -9.000 1.00 0.00 C ATOM 1847 C ARG A1556 5.375 -4.828 -10.107 1.00 0.00 C ATOM 1848 O ARG A1556 6.463 -4.597 -10.634 1.00 0.00 O ATOM 1849 CB ARG A1556 4.781 -7.200 -9.589 1.00 0.00 C ATOM 1850 CG ARG A1556 4.766 -8.283 -8.496 1.00 0.00 C ATOM 1851 CD ARG A1556 6.176 -8.844 -8.266 1.00 0.00 C ATOM 1852 NE ARG A1556 6.781 -9.229 -9.533 1.00 0.00 N ATOM 1853 CZ ARG A1556 8.080 -9.466 -9.629 1.00 0.00 C ATOM 1854 NH1 ARG A1556 8.843 -9.359 -8.576 1.00 0.00 N ATOM 1855 NH2 ARG A1556 8.595 -9.801 -10.780 1.00 0.00 N ATOM 0 H ARG A1556 3.464 -5.981 -7.902 1.00 0.00 H new ATOM 0 HA ARG A1556 6.225 -6.003 -8.534 1.00 0.00 H new ATOM 0 HB2 ARG A1556 3.784 -7.089 -10.015 1.00 0.00 H new ATOM 0 HB3 ARG A1556 5.443 -7.501 -10.401 1.00 0.00 H new ATOM 0 HG2 ARG A1556 4.381 -7.863 -7.567 1.00 0.00 H new ATOM 0 HG3 ARG A1556 4.092 -9.089 -8.785 1.00 0.00 H new ATOM 0 HD2 ARG A1556 6.796 -8.096 -7.772 1.00 0.00 H new ATOM 0 HD3 ARG A1556 6.127 -9.707 -7.602 1.00 0.00 H new ATOM 0 HE ARG A1556 6.193 -9.318 -10.362 1.00 0.00 H new ATOM 0 HH11 ARG A1556 8.439 -9.093 -7.678 1.00 0.00 H new ATOM 0 HH12 ARG A1556 9.844 -9.542 -8.651 1.00 0.00 H new ATOM 0 HH21 ARG A1556 7.997 -9.880 -11.603 1.00 0.00 H new ATOM 0 HH22 ARG A1556 9.595 -9.984 -10.857 1.00 0.00 H new ATOM 1869 N LYS A1557 4.259 -4.197 -10.450 1.00 0.00 N ATOM 1870 CA LYS A1557 4.266 -3.180 -11.492 1.00 0.00 C ATOM 1871 C LYS A1557 5.083 -1.972 -11.051 1.00 0.00 C ATOM 1872 O LYS A1557 6.005 -1.545 -11.744 1.00 0.00 O ATOM 1873 CB LYS A1557 2.829 -2.750 -11.797 1.00 0.00 C ATOM 1874 CG LYS A1557 2.110 -3.878 -12.540 1.00 0.00 C ATOM 1875 CD LYS A1557 0.642 -3.506 -12.743 1.00 0.00 C ATOM 1876 CE LYS A1557 -0.085 -4.656 -13.446 1.00 0.00 C ATOM 1877 NZ LYS A1557 -1.551 -4.394 -13.434 1.00 0.00 N ATOM 0 H LYS A1557 3.347 -4.369 -10.027 1.00 0.00 H new ATOM 0 HA LYS A1557 4.720 -3.598 -12.390 1.00 0.00 H new ATOM 0 HB2 LYS A1557 2.303 -2.516 -10.871 1.00 0.00 H new ATOM 0 HB3 LYS A1557 2.829 -1.843 -12.402 1.00 0.00 H new ATOM 0 HG2 LYS A1557 2.587 -4.054 -13.504 1.00 0.00 H new ATOM 0 HG3 LYS A1557 2.185 -4.806 -11.973 1.00 0.00 H new ATOM 0 HD2 LYS A1557 0.172 -3.299 -11.782 1.00 0.00 H new ATOM 0 HD3 LYS A1557 0.566 -2.596 -13.338 1.00 0.00 H new ATOM 0 HE2 LYS A1557 0.270 -4.752 -14.472 1.00 0.00 H new ATOM 0 HE3 LYS A1557 0.131 -5.599 -12.944 1.00 0.00 H new ATOM 0 HZ1 LYS A1557 -2.047 -5.174 -13.911 1.00 0.00 H new ATOM 0 HZ2 LYS A1557 -1.883 -4.322 -12.451 1.00 0.00 H new ATOM 0 HZ3 LYS A1557 -1.748 -3.502 -13.932 1.00 0.00 H new ATOM 1891 N LEU A1558 4.735 -1.427 -9.895 1.00 0.00 N ATOM 1892 CA LEU A1558 5.440 -0.268 -9.372 1.00 0.00 C ATOM 1893 C LEU A1558 6.944 -0.496 -9.403 1.00 0.00 C ATOM 1894 O LEU A1558 7.686 0.249 -10.040 1.00 0.00 O ATOM 1895 CB LEU A1558 4.994 0.001 -7.931 1.00 0.00 C ATOM 1896 CG LEU A1558 3.523 0.452 -7.916 1.00 0.00 C ATOM 1897 CD1 LEU A1558 2.971 0.343 -6.491 1.00 0.00 C ATOM 1898 CD2 LEU A1558 3.390 1.909 -8.400 1.00 0.00 C ATOM 0 H LEU A1558 3.975 -1.766 -9.306 1.00 0.00 H new ATOM 0 HA LEU A1558 5.203 0.593 -9.997 1.00 0.00 H new ATOM 0 HB2 LEU A1558 5.114 -0.900 -7.329 1.00 0.00 H new ATOM 0 HB3 LEU A1558 5.624 0.769 -7.483 1.00 0.00 H new ATOM 0 HG LEU A1558 2.958 -0.193 -8.589 1.00 0.00 H new ATOM 0 HD11 LEU A1558 1.929 0.662 -6.479 1.00 0.00 H new ATOM 0 HD12 LEU A1558 3.038 -0.691 -6.153 1.00 0.00 H new ATOM 0 HD13 LEU A1558 3.553 0.980 -5.826 1.00 0.00 H new ATOM 0 HD21 LEU A1558 2.341 2.205 -8.380 1.00 0.00 H new ATOM 0 HD22 LEU A1558 3.964 2.564 -7.744 1.00 0.00 H new ATOM 0 HD23 LEU A1558 3.771 1.990 -9.418 1.00 0.00 H new ATOM 1910 N GLN A1559 7.384 -1.533 -8.700 1.00 0.00 N ATOM 1911 CA GLN A1559 8.804 -1.858 -8.638 1.00 0.00 C ATOM 1912 C GLN A1559 9.422 -1.822 -10.036 1.00 0.00 C ATOM 1913 O GLN A1559 10.533 -1.334 -10.226 1.00 0.00 O ATOM 1914 CB GLN A1559 8.997 -3.254 -8.015 1.00 0.00 C ATOM 1915 CG GLN A1559 10.346 -3.325 -7.270 1.00 0.00 C ATOM 1916 CD GLN A1559 10.876 -4.755 -7.251 1.00 0.00 C ATOM 1917 OE1 GLN A1559 11.275 -5.256 -6.201 1.00 0.00 O ATOM 1918 NE2 GLN A1559 10.907 -5.440 -8.359 1.00 0.00 N ATOM 0 H GLN A1559 6.781 -2.160 -8.167 1.00 0.00 H new ATOM 0 HA GLN A1559 9.304 -1.116 -8.016 1.00 0.00 H new ATOM 0 HB2 GLN A1559 8.181 -3.468 -7.325 1.00 0.00 H new ATOM 0 HB3 GLN A1559 8.963 -4.015 -8.794 1.00 0.00 H new ATOM 0 HG2 GLN A1559 11.070 -2.670 -7.755 1.00 0.00 H new ATOM 0 HG3 GLN A1559 10.223 -2.964 -6.249 1.00 0.00 H new ATOM 0 HE21 GLN A1559 10.575 -5.020 -9.227 1.00 0.00 H new ATOM 0 HE22 GLN A1559 11.263 -6.396 -8.358 1.00 0.00 H new ATOM 1927 N SER A1560 8.694 -2.363 -11.004 1.00 0.00 N ATOM 1928 CA SER A1560 9.177 -2.408 -12.375 1.00 0.00 C ATOM 1929 C SER A1560 9.602 -1.020 -12.847 1.00 0.00 C ATOM 1930 O SER A1560 10.783 -0.778 -13.103 1.00 0.00 O ATOM 1931 CB SER A1560 8.086 -2.956 -13.296 1.00 0.00 C ATOM 1932 OG SER A1560 8.683 -3.461 -14.482 1.00 0.00 O ATOM 0 H SER A1560 7.771 -2.775 -10.865 1.00 0.00 H new ATOM 0 HA SER A1560 10.045 -3.066 -12.410 1.00 0.00 H new ATOM 0 HB2 SER A1560 7.530 -3.745 -12.790 1.00 0.00 H new ATOM 0 HB3 SER A1560 7.372 -2.170 -13.541 1.00 0.00 H new ATOM 0 HG SER A1560 7.987 -3.815 -15.074 1.00 0.00 H new ATOM 1938 N TYR A1561 8.635 -0.121 -12.968 1.00 0.00 N ATOM 1939 CA TYR A1561 8.920 1.236 -13.422 1.00 0.00 C ATOM 1940 C TYR A1561 10.021 1.874 -12.578 1.00 0.00 C ATOM 1941 O TYR A1561 10.852 2.624 -13.091 1.00 0.00 O ATOM 1942 CB TYR A1561 7.646 2.090 -13.350 1.00 0.00 C ATOM 1943 CG TYR A1561 6.442 1.235 -13.683 1.00 0.00 C ATOM 1944 CD1 TYR A1561 6.469 0.385 -14.797 1.00 0.00 C ATOM 1945 CD2 TYR A1561 5.295 1.297 -12.879 1.00 0.00 C ATOM 1946 CE1 TYR A1561 5.354 -0.401 -15.104 1.00 0.00 C ATOM 1947 CE2 TYR A1561 4.179 0.510 -13.188 1.00 0.00 C ATOM 1948 CZ TYR A1561 4.209 -0.340 -14.302 1.00 0.00 C ATOM 1949 OH TYR A1561 3.110 -1.114 -14.612 1.00 0.00 O ATOM 0 H TYR A1561 7.653 -0.303 -12.760 1.00 0.00 H new ATOM 0 HA TYR A1561 9.265 1.186 -14.455 1.00 0.00 H new ATOM 0 HB2 TYR A1561 7.538 2.516 -12.353 1.00 0.00 H new ATOM 0 HB3 TYR A1561 7.716 2.925 -14.047 1.00 0.00 H new ATOM 0 HD1 TYR A1561 7.351 0.337 -15.418 1.00 0.00 H new ATOM 0 HD2 TYR A1561 5.272 1.952 -12.021 1.00 0.00 H new ATOM 0 HE1 TYR A1561 5.377 -1.057 -15.962 1.00 0.00 H new ATOM 0 HE2 TYR A1561 3.296 0.558 -12.568 1.00 0.00 H new ATOM 0 HH TYR A1561 3.404 -1.937 -15.056 1.00 0.00 H new ATOM 1959 N LEU A1562 10.019 1.580 -11.287 1.00 0.00 N ATOM 1960 CA LEU A1562 11.019 2.143 -10.391 1.00 0.00 C ATOM 1961 C LEU A1562 12.419 1.718 -10.822 1.00 0.00 C ATOM 1962 O LEU A1562 13.412 2.106 -10.207 1.00 0.00 O ATOM 1963 CB LEU A1562 10.749 1.669 -8.955 1.00 0.00 C ATOM 1964 CG LEU A1562 9.623 2.512 -8.315 1.00 0.00 C ATOM 1965 CD1 LEU A1562 8.907 1.697 -7.235 1.00 0.00 C ATOM 1966 CD2 LEU A1562 10.220 3.774 -7.677 1.00 0.00 C ATOM 0 H LEU A1562 9.343 0.961 -10.839 1.00 0.00 H new ATOM 0 HA LEU A1562 10.957 3.230 -10.432 1.00 0.00 H new ATOM 0 HB2 LEU A1562 10.467 0.616 -8.959 1.00 0.00 H new ATOM 0 HB3 LEU A1562 11.658 1.753 -8.360 1.00 0.00 H new ATOM 0 HG LEU A1562 8.910 2.793 -9.090 1.00 0.00 H new ATOM 0 HD11 LEU A1562 8.115 2.299 -6.790 1.00 0.00 H new ATOM 0 HD12 LEU A1562 8.474 0.802 -7.682 1.00 0.00 H new ATOM 0 HD13 LEU A1562 9.621 1.409 -6.464 1.00 0.00 H new ATOM 0 HD21 LEU A1562 9.423 4.366 -7.227 1.00 0.00 H new ATOM 0 HD22 LEU A1562 10.938 3.488 -6.909 1.00 0.00 H new ATOM 0 HD23 LEU A1562 10.723 4.365 -8.442 1.00 0.00 H new ATOM 1978 N GLU A1563 12.497 0.916 -11.881 1.00 0.00 N ATOM 1979 CA GLU A1563 13.785 0.441 -12.382 1.00 0.00 C ATOM 1980 C GLU A1563 13.787 0.424 -13.905 1.00 0.00 C ATOM 1981 O GLU A1563 13.844 -0.638 -14.525 1.00 0.00 O ATOM 1982 CB GLU A1563 14.058 -0.967 -11.851 1.00 0.00 C ATOM 1983 CG GLU A1563 13.919 -0.976 -10.327 1.00 0.00 C ATOM 1984 CD GLU A1563 14.343 -2.332 -9.773 1.00 0.00 C ATOM 1985 OE1 GLU A1563 13.777 -3.326 -10.197 1.00 0.00 O ATOM 1986 OE2 GLU A1563 15.228 -2.358 -8.933 1.00 0.00 O ATOM 0 H GLU A1563 11.689 0.583 -12.407 1.00 0.00 H new ATOM 0 HA GLU A1563 14.567 1.117 -12.037 1.00 0.00 H new ATOM 0 HB2 GLU A1563 13.359 -1.676 -12.294 1.00 0.00 H new ATOM 0 HB3 GLU A1563 15.060 -1.287 -12.137 1.00 0.00 H new ATOM 0 HG2 GLU A1563 14.534 -0.188 -9.893 1.00 0.00 H new ATOM 0 HG3 GLU A1563 12.887 -0.766 -10.046 1.00 0.00 H new