USER MOD reduce.3.24.130724 H: found=0, std=0, add=668, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 669 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 464 ASN : amide:sc= 0.331 K(o=0.34,f=-6.5!) USER MOD Set 1.2: A 466 SER OG : rot 85:sc= 0.0137 USER MOD Set 2.1: A 421 THR OG1 : rot 86:sc= 0.695 USER MOD Set 2.2: A 440 GLN :FLIP amide:sc= 0.384 F(o=0.12,f=1.1) USER MOD Single : A 426 LYS NZ :NH3+ -171:sc= 2.36 (180deg=1.92) USER MOD Single : A 429 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0116) USER MOD Single : A 436 THR OG1 : rot 180:sc= -0.356 USER MOD Single : A 443 THR OG1 : rot 180:sc= 0 USER MOD Single : A 445 LYS NZ :NH3+ -153:sc= -3.05! (180deg=-3.69!) USER MOD Single : A 454 THR OG1 : rot -36:sc= 0.506 USER MOD Single : A 455 THR OG1 : rot 180:sc= 0 USER MOD Single : A 456 TYR OH : rot 180:sc= 0 USER MOD Single : A 462 MET CE :methyl 167:sc= -5.71! (180deg=-6.56!) USER MOD Single : A 471 LYS NZ :NH3+ -113:sc= 0.205 (180deg=0.0179) USER MOD Single : A 476 SER OG : rot 180:sc= 0 USER MOD Single : A 477 MET CE :methyl -162:sc= -0.0617 (180deg=-0.431) USER MOD Single : A 482 THR OG1 : rot -120:sc= 0.808 USER MOD Single : A 485 HIS : no HD1:sc= -0.0434 X(o=-0.043,f=-0.016) USER MOD Single : A 489 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 495 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 501 LYS NZ :NH3+ -149:sc= 1.22 (180deg=1.03) USER MOD Single : A 502 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 505 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 470 N VAL A 419 -9.188 0.635 -1.649 1.00 0.00 N ATOM 471 CA VAL A 419 -8.002 -0.110 -1.306 1.00 0.00 C ATOM 472 C VAL A 419 -6.961 0.390 -2.260 1.00 0.00 C ATOM 473 O VAL A 419 -7.301 1.137 -3.159 1.00 0.00 O ATOM 474 CB VAL A 419 -8.157 -1.677 -1.442 1.00 0.00 C ATOM 475 CG1 VAL A 419 -9.157 -2.238 -0.445 1.00 0.00 C ATOM 476 CG2 VAL A 419 -8.521 -2.099 -2.857 1.00 0.00 C ATOM 0 HA VAL A 419 -7.755 0.044 -0.256 1.00 0.00 H new ATOM 0 HB VAL A 419 -7.179 -2.099 -1.212 1.00 0.00 H new ATOM 0 HG11 VAL A 419 -9.232 -3.318 -0.574 1.00 0.00 H new ATOM 0 HG12 VAL A 419 -8.824 -2.016 0.569 1.00 0.00 H new ATOM 0 HG13 VAL A 419 -10.133 -1.784 -0.614 1.00 0.00 H new ATOM 0 HG21 VAL A 419 -8.616 -3.184 -2.900 1.00 0.00 H new ATOM 0 HG22 VAL A 419 -9.468 -1.640 -3.141 1.00 0.00 H new ATOM 0 HG23 VAL A 419 -7.740 -1.776 -3.545 1.00 0.00 H new ATOM 486 N GLY A 420 -5.751 0.005 -2.108 1.00 0.00 N ATOM 487 CA GLY A 420 -4.735 0.482 -2.988 1.00 0.00 C ATOM 488 C GLY A 420 -4.303 -0.606 -3.903 1.00 0.00 C ATOM 489 O GLY A 420 -4.547 -1.784 -3.619 1.00 0.00 O ATOM 0 H GLY A 420 -5.432 -0.639 -1.385 1.00 0.00 H new ATOM 0 HA2 GLY A 420 -5.110 1.327 -3.566 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -3.883 0.843 -2.412 1.00 0.00 H new ATOM 493 N THR A 421 -3.672 -0.256 -4.963 1.00 0.00 N ATOM 494 CA THR A 421 -3.264 -1.228 -5.924 1.00 0.00 C ATOM 495 C THR A 421 -1.739 -1.234 -6.007 1.00 0.00 C ATOM 496 O THR A 421 -1.103 -0.170 -5.943 1.00 0.00 O ATOM 497 CB THR A 421 -3.866 -0.892 -7.308 1.00 0.00 C ATOM 498 OG1 THR A 421 -5.200 -0.368 -7.125 1.00 0.00 O ATOM 499 CG2 THR A 421 -3.976 -2.153 -8.143 1.00 0.00 C ATOM 0 H THR A 421 -3.422 0.706 -5.194 1.00 0.00 H new ATOM 0 HA THR A 421 -3.620 -2.213 -5.621 1.00 0.00 H new ATOM 0 HB THR A 421 -3.224 -0.166 -7.807 1.00 0.00 H new ATOM 0 HG1 THR A 421 -5.153 0.597 -6.959 1.00 0.00 H new ATOM 0 HG21 THR A 421 -4.401 -1.909 -9.117 1.00 0.00 H new ATOM 0 HG22 THR A 421 -2.986 -2.588 -8.278 1.00 0.00 H new ATOM 0 HG23 THR A 421 -4.621 -2.870 -7.635 1.00 0.00 H new ATOM 507 N VAL A 422 -1.161 -2.402 -6.095 1.00 0.00 N ATOM 508 CA VAL A 422 0.276 -2.535 -6.222 1.00 0.00 C ATOM 509 C VAL A 422 0.631 -2.352 -7.687 1.00 0.00 C ATOM 510 O VAL A 422 -0.079 -2.842 -8.549 1.00 0.00 O ATOM 511 CB VAL A 422 0.764 -3.935 -5.749 1.00 0.00 C ATOM 512 CG1 VAL A 422 2.282 -4.026 -5.762 1.00 0.00 C ATOM 513 CG2 VAL A 422 0.226 -4.265 -4.369 1.00 0.00 C ATOM 0 H VAL A 422 -1.666 -3.288 -6.081 1.00 0.00 H new ATOM 0 HA VAL A 422 0.761 -1.785 -5.597 1.00 0.00 H new ATOM 0 HB VAL A 422 0.374 -4.670 -6.454 1.00 0.00 H new ATOM 0 HG11 VAL A 422 2.590 -5.016 -5.426 1.00 0.00 H new ATOM 0 HG12 VAL A 422 2.648 -3.856 -6.775 1.00 0.00 H new ATOM 0 HG13 VAL A 422 2.697 -3.271 -5.094 1.00 0.00 H new ATOM 0 HG21 VAL A 422 0.583 -5.249 -4.065 1.00 0.00 H new ATOM 0 HG22 VAL A 422 0.571 -3.517 -3.655 1.00 0.00 H new ATOM 0 HG23 VAL A 422 -0.864 -4.267 -4.394 1.00 0.00 H new ATOM 523 N ILE A 423 1.698 -1.660 -7.972 1.00 0.00 N ATOM 524 CA ILE A 423 2.079 -1.430 -9.344 1.00 0.00 C ATOM 525 C ILE A 423 3.172 -2.394 -9.785 1.00 0.00 C ATOM 526 O ILE A 423 3.136 -2.912 -10.889 1.00 0.00 O ATOM 527 CB ILE A 423 2.443 0.047 -9.628 1.00 0.00 C ATOM 528 CG1 ILE A 423 3.528 0.556 -8.684 1.00 0.00 C ATOM 529 CG2 ILE A 423 1.193 0.924 -9.533 1.00 0.00 C ATOM 530 CD1 ILE A 423 3.885 2.019 -8.893 1.00 0.00 C ATOM 0 H ILE A 423 2.320 -1.245 -7.278 1.00 0.00 H new ATOM 0 HA ILE A 423 1.200 -1.637 -9.954 1.00 0.00 H new ATOM 0 HB ILE A 423 2.843 0.103 -10.641 1.00 0.00 H new ATOM 0 HG12 ILE A 423 3.197 0.416 -7.655 1.00 0.00 H new ATOM 0 HG13 ILE A 423 4.425 -0.050 -8.815 1.00 0.00 H new ATOM 0 HG21 ILE A 423 1.460 1.961 -9.735 1.00 0.00 H new ATOM 0 HG22 ILE A 423 0.458 0.590 -10.265 1.00 0.00 H new ATOM 0 HG23 ILE A 423 0.769 0.846 -8.532 1.00 0.00 H new ATOM 0 HD11 ILE A 423 4.663 2.308 -8.186 1.00 0.00 H new ATOM 0 HD12 ILE A 423 4.248 2.163 -9.911 1.00 0.00 H new ATOM 0 HD13 ILE A 423 3.001 2.636 -8.732 1.00 0.00 H new ATOM 542 N GLU A 424 4.110 -2.662 -8.898 1.00 0.00 N ATOM 543 CA GLU A 424 5.153 -3.639 -9.139 1.00 0.00 C ATOM 544 C GLU A 424 5.635 -4.192 -7.820 1.00 0.00 C ATOM 545 O GLU A 424 5.547 -3.520 -6.793 1.00 0.00 O ATOM 546 CB GLU A 424 6.340 -3.087 -9.941 1.00 0.00 C ATOM 547 CG GLU A 424 7.054 -1.923 -9.297 1.00 0.00 C ATOM 548 CD GLU A 424 8.384 -1.632 -9.952 1.00 0.00 C ATOM 549 OE1 GLU A 424 8.403 -1.223 -11.129 1.00 0.00 O ATOM 550 OE2 GLU A 424 9.451 -1.857 -9.315 1.00 0.00 O ATOM 0 H GLU A 424 4.170 -2.207 -7.987 1.00 0.00 H new ATOM 0 HA GLU A 424 4.713 -4.427 -9.750 1.00 0.00 H new ATOM 0 HB2 GLU A 424 7.058 -3.892 -10.101 1.00 0.00 H new ATOM 0 HB3 GLU A 424 5.984 -2.778 -10.924 1.00 0.00 H new ATOM 0 HG2 GLU A 424 6.422 -1.036 -9.353 1.00 0.00 H new ATOM 0 HG3 GLU A 424 7.211 -2.136 -8.240 1.00 0.00 H new ATOM 557 N ALA A 425 6.118 -5.398 -7.834 1.00 0.00 N ATOM 558 CA ALA A 425 6.609 -6.027 -6.641 1.00 0.00 C ATOM 559 C ALA A 425 7.843 -6.828 -6.972 1.00 0.00 C ATOM 560 O ALA A 425 7.854 -7.544 -7.980 1.00 0.00 O ATOM 561 CB ALA A 425 5.540 -6.911 -6.043 1.00 0.00 C ATOM 0 H ALA A 425 6.184 -5.975 -8.672 1.00 0.00 H new ATOM 0 HA ALA A 425 6.869 -5.266 -5.906 1.00 0.00 H new ATOM 0 HB1 ALA A 425 5.923 -7.384 -5.138 1.00 0.00 H new ATOM 0 HB2 ALA A 425 4.666 -6.309 -5.796 1.00 0.00 H new ATOM 0 HB3 ALA A 425 5.259 -7.680 -6.763 1.00 0.00 H new ATOM 567 N LYS A 426 8.882 -6.709 -6.164 1.00 0.00 N ATOM 568 CA LYS A 426 10.113 -7.430 -6.436 1.00 0.00 C ATOM 569 C LYS A 426 10.955 -7.554 -5.197 1.00 0.00 C ATOM 570 O LYS A 426 10.597 -7.058 -4.127 1.00 0.00 O ATOM 571 CB LYS A 426 10.957 -6.831 -7.589 1.00 0.00 C ATOM 572 CG LYS A 426 11.788 -5.596 -7.258 1.00 0.00 C ATOM 573 CD LYS A 426 10.922 -4.378 -6.961 1.00 0.00 C ATOM 574 CE LYS A 426 11.734 -3.091 -7.010 1.00 0.00 C ATOM 575 NZ LYS A 426 10.876 -1.881 -7.014 1.00 0.00 N ATOM 0 H LYS A 426 8.899 -6.128 -5.325 1.00 0.00 H new ATOM 0 HA LYS A 426 9.795 -8.419 -6.766 1.00 0.00 H new ATOM 0 HB2 LYS A 426 11.630 -7.606 -7.956 1.00 0.00 H new ATOM 0 HB3 LYS A 426 10.284 -6.579 -8.408 1.00 0.00 H new ATOM 0 HG2 LYS A 426 12.421 -5.807 -6.396 1.00 0.00 H new ATOM 0 HG3 LYS A 426 12.451 -5.372 -8.094 1.00 0.00 H new ATOM 0 HD2 LYS A 426 10.108 -4.324 -7.684 1.00 0.00 H new ATOM 0 HD3 LYS A 426 10.467 -4.485 -5.976 1.00 0.00 H new ATOM 0 HE2 LYS A 426 12.405 -3.055 -6.151 1.00 0.00 H new ATOM 0 HE3 LYS A 426 12.359 -3.093 -7.903 1.00 0.00 H new ATOM 0 HZ1 LYS A 426 11.461 -1.041 -7.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 426 10.152 -1.971 -7.755 1.00 0.00 H new ATOM 0 HZ3 LYS A 426 10.413 -1.781 -6.088 1.00 0.00 H new ATOM 589 N LEU A 427 12.046 -8.231 -5.346 1.00 0.00 N ATOM 590 CA LEU A 427 12.956 -8.481 -4.268 1.00 0.00 C ATOM 591 C LEU A 427 13.969 -7.352 -4.144 1.00 0.00 C ATOM 592 O LEU A 427 14.362 -6.724 -5.147 1.00 0.00 O ATOM 593 CB LEU A 427 13.699 -9.796 -4.522 1.00 0.00 C ATOM 594 CG LEU A 427 14.951 -9.771 -5.454 1.00 0.00 C ATOM 595 CD1 LEU A 427 15.635 -11.123 -5.465 1.00 0.00 C ATOM 596 CD2 LEU A 427 14.579 -9.380 -6.874 1.00 0.00 C ATOM 0 H LEU A 427 12.339 -8.635 -6.236 1.00 0.00 H new ATOM 0 HA LEU A 427 12.385 -8.545 -3.342 1.00 0.00 H new ATOM 0 HB2 LEU A 427 14.011 -10.193 -3.556 1.00 0.00 H new ATOM 0 HB3 LEU A 427 12.986 -10.505 -4.942 1.00 0.00 H new ATOM 0 HG LEU A 427 15.636 -9.022 -5.057 1.00 0.00 H new ATOM 0 HD11 LEU A 427 16.505 -11.085 -6.120 1.00 0.00 H new ATOM 0 HD12 LEU A 427 15.953 -11.378 -4.454 1.00 0.00 H new ATOM 0 HD13 LEU A 427 14.940 -11.880 -5.829 1.00 0.00 H new ATOM 0 HD21 LEU A 427 15.474 -9.373 -7.496 1.00 0.00 H new ATOM 0 HD22 LEU A 427 13.865 -10.100 -7.274 1.00 0.00 H new ATOM 0 HD23 LEU A 427 14.130 -8.387 -6.872 1.00 0.00 H new ATOM 608 N ASP A 428 14.339 -7.065 -2.949 1.00 0.00 N ATOM 609 CA ASP A 428 15.415 -6.157 -2.691 1.00 0.00 C ATOM 610 C ASP A 428 16.378 -6.859 -1.752 1.00 0.00 C ATOM 611 O ASP A 428 15.966 -7.381 -0.718 1.00 0.00 O ATOM 612 CB ASP A 428 14.921 -4.851 -2.083 1.00 0.00 C ATOM 613 CG ASP A 428 15.996 -3.796 -2.027 1.00 0.00 C ATOM 614 OD1 ASP A 428 16.981 -3.960 -1.267 1.00 0.00 O ATOM 615 OD2 ASP A 428 15.887 -2.782 -2.745 1.00 0.00 O ATOM 0 H ASP A 428 13.905 -7.452 -2.111 1.00 0.00 H new ATOM 0 HA ASP A 428 15.908 -5.890 -3.626 1.00 0.00 H new ATOM 0 HB2 ASP A 428 14.080 -4.477 -2.667 1.00 0.00 H new ATOM 0 HB3 ASP A 428 14.550 -5.041 -1.076 1.00 0.00 H new ATOM 620 N LYS A 429 17.637 -6.872 -2.095 1.00 0.00 N ATOM 621 CA LYS A 429 18.643 -7.603 -1.311 1.00 0.00 C ATOM 622 C LYS A 429 19.028 -6.902 -0.009 1.00 0.00 C ATOM 623 O LYS A 429 19.703 -7.494 0.838 1.00 0.00 O ATOM 624 CB LYS A 429 19.918 -7.987 -2.122 1.00 0.00 C ATOM 625 CG LYS A 429 20.567 -6.843 -2.873 1.00 0.00 C ATOM 626 CD LYS A 429 19.870 -6.593 -4.199 1.00 0.00 C ATOM 627 CE LYS A 429 20.030 -5.169 -4.629 1.00 0.00 C ATOM 628 NZ LYS A 429 21.443 -4.797 -4.884 1.00 0.00 N ATOM 0 H LYS A 429 18.010 -6.388 -2.912 1.00 0.00 H new ATOM 0 HA LYS A 429 18.138 -8.532 -1.047 1.00 0.00 H new ATOM 0 HB2 LYS A 429 20.651 -8.415 -1.438 1.00 0.00 H new ATOM 0 HB3 LYS A 429 19.655 -8.768 -2.836 1.00 0.00 H new ATOM 0 HG2 LYS A 429 20.533 -5.939 -2.265 1.00 0.00 H new ATOM 0 HG3 LYS A 429 21.619 -7.070 -3.049 1.00 0.00 H new ATOM 0 HD2 LYS A 429 20.282 -7.255 -4.961 1.00 0.00 H new ATOM 0 HD3 LYS A 429 18.810 -6.832 -4.108 1.00 0.00 H new ATOM 0 HE2 LYS A 429 19.446 -5.001 -5.534 1.00 0.00 H new ATOM 0 HE3 LYS A 429 19.621 -4.514 -3.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 21.485 -3.828 -5.259 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 21.981 -4.848 -3.995 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 21.855 -5.454 -5.577 1.00 0.00 H new ATOM 642 N GLY A 430 18.615 -5.665 0.151 1.00 0.00 N ATOM 643 CA GLY A 430 18.955 -4.937 1.348 1.00 0.00 C ATOM 644 C GLY A 430 17.735 -4.509 2.130 1.00 0.00 C ATOM 645 O GLY A 430 17.746 -4.482 3.361 1.00 0.00 O ATOM 0 H GLY A 430 18.051 -5.149 -0.524 1.00 0.00 H new ATOM 0 HA2 GLY A 430 19.588 -5.559 1.980 1.00 0.00 H new ATOM 0 HA3 GLY A 430 19.539 -4.056 1.080 1.00 0.00 H new ATOM 649 N ARG A 431 16.692 -4.170 1.420 1.00 0.00 N ATOM 650 CA ARG A 431 15.453 -3.680 2.017 1.00 0.00 C ATOM 651 C ARG A 431 14.456 -4.823 2.230 1.00 0.00 C ATOM 652 O ARG A 431 13.462 -4.677 2.960 1.00 0.00 O ATOM 653 CB ARG A 431 14.870 -2.612 1.099 1.00 0.00 C ATOM 654 CG ARG A 431 15.811 -1.430 0.904 1.00 0.00 C ATOM 655 CD ARG A 431 15.550 -0.691 -0.398 1.00 0.00 C ATOM 656 NE ARG A 431 14.197 -0.142 -0.516 1.00 0.00 N ATOM 657 CZ ARG A 431 13.505 -0.099 -1.668 1.00 0.00 C ATOM 658 NH1 ARG A 431 13.907 -0.817 -2.724 1.00 0.00 N ATOM 659 NH2 ARG A 431 12.389 0.601 -1.744 1.00 0.00 N ATOM 0 H ARG A 431 16.666 -4.222 0.402 1.00 0.00 H new ATOM 0 HA ARG A 431 15.661 -3.251 2.997 1.00 0.00 H new ATOM 0 HB2 ARG A 431 14.644 -3.056 0.129 1.00 0.00 H new ATOM 0 HB3 ARG A 431 13.927 -2.256 1.514 1.00 0.00 H new ATOM 0 HG2 ARG A 431 15.700 -0.739 1.740 1.00 0.00 H new ATOM 0 HG3 ARG A 431 16.842 -1.784 0.918 1.00 0.00 H new ATOM 0 HD2 ARG A 431 16.269 0.122 -0.492 1.00 0.00 H new ATOM 0 HD3 ARG A 431 15.728 -1.371 -1.231 1.00 0.00 H new ATOM 0 HE ARG A 431 13.754 0.229 0.325 1.00 0.00 H new ATOM 0 HH11 ARG A 431 14.741 -1.400 -2.657 1.00 0.00 H new ATOM 0 HH12 ARG A 431 13.379 -0.781 -3.596 1.00 0.00 H new ATOM 0 HH21 ARG A 431 12.050 1.111 -0.928 1.00 0.00 H new ATOM 0 HH22 ARG A 431 11.865 0.633 -2.619 1.00 0.00 H new ATOM 673 N GLY A 432 14.715 -5.945 1.587 1.00 0.00 N ATOM 674 CA GLY A 432 13.866 -7.100 1.733 1.00 0.00 C ATOM 675 C GLY A 432 12.742 -7.064 0.733 1.00 0.00 C ATOM 676 O GLY A 432 12.905 -6.488 -0.336 1.00 0.00 O ATOM 0 H GLY A 432 15.508 -6.076 0.959 1.00 0.00 H new ATOM 0 HA2 GLY A 432 14.453 -8.008 1.596 1.00 0.00 H new ATOM 0 HA3 GLY A 432 13.459 -7.133 2.744 1.00 0.00 H new ATOM 680 N PRO A 433 11.607 -7.704 1.018 1.00 0.00 N ATOM 681 CA PRO A 433 10.436 -7.640 0.141 1.00 0.00 C ATOM 682 C PRO A 433 9.942 -6.197 -0.019 1.00 0.00 C ATOM 683 O PRO A 433 9.536 -5.558 0.967 1.00 0.00 O ATOM 684 CB PRO A 433 9.391 -8.458 0.914 1.00 0.00 C ATOM 685 CG PRO A 433 10.192 -9.388 1.748 1.00 0.00 C ATOM 686 CD PRO A 433 11.384 -8.594 2.175 1.00 0.00 C ATOM 0 HA PRO A 433 10.640 -8.007 -0.865 1.00 0.00 H new ATOM 0 HB2 PRO A 433 8.760 -7.816 1.529 1.00 0.00 H new ATOM 0 HB3 PRO A 433 8.731 -9.000 0.237 1.00 0.00 H new ATOM 0 HG2 PRO A 433 9.622 -9.738 2.609 1.00 0.00 H new ATOM 0 HG3 PRO A 433 10.488 -10.271 1.182 1.00 0.00 H new ATOM 0 HD2 PRO A 433 11.191 -8.031 3.088 1.00 0.00 H new ATOM 0 HD3 PRO A 433 12.247 -9.231 2.369 1.00 0.00 H new ATOM 694 N VAL A 434 10.006 -5.686 -1.228 1.00 0.00 N ATOM 695 CA VAL A 434 9.554 -4.346 -1.519 1.00 0.00 C ATOM 696 C VAL A 434 8.419 -4.378 -2.531 1.00 0.00 C ATOM 697 O VAL A 434 8.444 -5.148 -3.513 1.00 0.00 O ATOM 698 CB VAL A 434 10.702 -3.400 -2.018 1.00 0.00 C ATOM 699 CG1 VAL A 434 11.743 -3.199 -0.940 1.00 0.00 C ATOM 700 CG2 VAL A 434 11.362 -3.930 -3.277 1.00 0.00 C ATOM 0 H VAL A 434 10.373 -6.188 -2.036 1.00 0.00 H new ATOM 0 HA VAL A 434 9.195 -3.929 -0.578 1.00 0.00 H new ATOM 0 HB VAL A 434 10.243 -2.440 -2.254 1.00 0.00 H new ATOM 0 HG11 VAL A 434 12.528 -2.540 -1.311 1.00 0.00 H new ATOM 0 HG12 VAL A 434 11.277 -2.751 -0.063 1.00 0.00 H new ATOM 0 HG13 VAL A 434 12.176 -4.162 -0.668 1.00 0.00 H new ATOM 0 HG21 VAL A 434 12.151 -3.246 -3.590 1.00 0.00 H new ATOM 0 HG22 VAL A 434 11.791 -4.912 -3.077 1.00 0.00 H new ATOM 0 HG23 VAL A 434 10.619 -4.013 -4.070 1.00 0.00 H new ATOM 710 N ALA A 435 7.427 -3.584 -2.283 1.00 0.00 N ATOM 711 CA ALA A 435 6.281 -3.512 -3.148 1.00 0.00 C ATOM 712 C ALA A 435 5.961 -2.082 -3.461 1.00 0.00 C ATOM 713 O ALA A 435 5.615 -1.312 -2.560 1.00 0.00 O ATOM 714 CB ALA A 435 5.087 -4.177 -2.495 1.00 0.00 C ATOM 0 H ALA A 435 7.383 -2.964 -1.475 1.00 0.00 H new ATOM 0 HA ALA A 435 6.511 -4.036 -4.076 1.00 0.00 H new ATOM 0 HB1 ALA A 435 4.227 -4.115 -3.161 1.00 0.00 H new ATOM 0 HB2 ALA A 435 5.317 -5.224 -2.296 1.00 0.00 H new ATOM 0 HB3 ALA A 435 4.857 -3.672 -1.557 1.00 0.00 H new ATOM 720 N THR A 436 6.100 -1.718 -4.704 1.00 0.00 N ATOM 721 CA THR A 436 5.783 -0.401 -5.139 1.00 0.00 C ATOM 722 C THR A 436 4.282 -0.381 -5.388 1.00 0.00 C ATOM 723 O THR A 436 3.766 -1.157 -6.199 1.00 0.00 O ATOM 724 CB THR A 436 6.519 -0.085 -6.449 1.00 0.00 C ATOM 725 OG1 THR A 436 7.829 -0.715 -6.428 1.00 0.00 O ATOM 726 CG2 THR A 436 6.703 1.422 -6.603 1.00 0.00 C ATOM 0 H THR A 436 6.439 -2.335 -5.443 1.00 0.00 H new ATOM 0 HA THR A 436 6.080 0.338 -4.395 1.00 0.00 H new ATOM 0 HB THR A 436 5.929 -0.464 -7.283 1.00 0.00 H new ATOM 0 HG1 THR A 436 8.301 -0.516 -7.264 1.00 0.00 H new ATOM 0 HG21 THR A 436 7.226 1.631 -7.536 1.00 0.00 H new ATOM 0 HG22 THR A 436 5.727 1.908 -6.617 1.00 0.00 H new ATOM 0 HG23 THR A 436 7.287 1.805 -5.766 1.00 0.00 H new ATOM 734 N LEU A 437 3.590 0.442 -4.690 1.00 0.00 N ATOM 735 CA LEU A 437 2.165 0.483 -4.771 1.00 0.00 C ATOM 736 C LEU A 437 1.657 1.910 -4.844 1.00 0.00 C ATOM 737 O LEU A 437 2.431 2.861 -4.711 1.00 0.00 O ATOM 738 CB LEU A 437 1.571 -0.288 -3.565 1.00 0.00 C ATOM 739 CG LEU A 437 2.148 0.051 -2.165 1.00 0.00 C ATOM 740 CD1 LEU A 437 1.833 1.460 -1.743 1.00 0.00 C ATOM 741 CD2 LEU A 437 1.655 -0.917 -1.118 1.00 0.00 C ATOM 0 H LEU A 437 3.994 1.115 -4.039 1.00 0.00 H new ATOM 0 HA LEU A 437 1.838 -0.002 -5.691 1.00 0.00 H new ATOM 0 HB2 LEU A 437 0.496 -0.107 -3.542 1.00 0.00 H new ATOM 0 HB3 LEU A 437 1.711 -1.354 -3.741 1.00 0.00 H new ATOM 0 HG LEU A 437 3.231 -0.040 -2.251 1.00 0.00 H new ATOM 0 HD11 LEU A 437 2.258 1.648 -0.757 1.00 0.00 H new ATOM 0 HD12 LEU A 437 2.260 2.159 -2.462 1.00 0.00 H new ATOM 0 HD13 LEU A 437 0.752 1.595 -1.704 1.00 0.00 H new ATOM 0 HD21 LEU A 437 2.078 -0.651 -0.149 1.00 0.00 H new ATOM 0 HD22 LEU A 437 0.567 -0.872 -1.064 1.00 0.00 H new ATOM 0 HD23 LEU A 437 1.963 -1.928 -1.383 1.00 0.00 H new ATOM 753 N LEU A 438 0.383 2.050 -5.061 1.00 0.00 N ATOM 754 CA LEU A 438 -0.263 3.338 -5.062 1.00 0.00 C ATOM 755 C LEU A 438 -1.331 3.295 -3.957 1.00 0.00 C ATOM 756 O LEU A 438 -2.306 2.525 -4.052 1.00 0.00 O ATOM 757 CB LEU A 438 -0.895 3.588 -6.463 1.00 0.00 C ATOM 758 CG LEU A 438 -1.326 5.033 -6.857 1.00 0.00 C ATOM 759 CD1 LEU A 438 -2.405 5.604 -5.953 1.00 0.00 C ATOM 760 CD2 LEU A 438 -0.127 5.966 -6.922 1.00 0.00 C ATOM 0 H LEU A 438 -0.247 1.269 -5.244 1.00 0.00 H new ATOM 0 HA LEU A 438 0.435 4.153 -4.869 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -0.181 3.243 -7.211 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -1.775 2.950 -6.544 1.00 0.00 H new ATOM 0 HG LEU A 438 -1.764 4.956 -7.852 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -2.659 6.612 -6.282 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -3.292 4.972 -6.001 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -2.039 5.639 -4.927 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -0.459 6.966 -7.199 1.00 0.00 H new ATOM 0 HD22 LEU A 438 0.359 6.002 -5.947 1.00 0.00 H new ATOM 0 HD23 LEU A 438 0.580 5.599 -7.666 1.00 0.00 H new ATOM 772 N VAL A 439 -1.132 4.071 -2.900 1.00 0.00 N ATOM 773 CA VAL A 439 -2.073 4.084 -1.783 1.00 0.00 C ATOM 774 C VAL A 439 -3.345 4.863 -2.121 1.00 0.00 C ATOM 775 O VAL A 439 -3.299 6.025 -2.543 1.00 0.00 O ATOM 776 CB VAL A 439 -1.427 4.561 -0.439 1.00 0.00 C ATOM 777 CG1 VAL A 439 -0.807 5.939 -0.552 1.00 0.00 C ATOM 778 CG2 VAL A 439 -2.430 4.511 0.705 1.00 0.00 C ATOM 0 H VAL A 439 -0.334 4.696 -2.791 1.00 0.00 H new ATOM 0 HA VAL A 439 -2.363 3.046 -1.619 1.00 0.00 H new ATOM 0 HB VAL A 439 -0.619 3.863 -0.218 1.00 0.00 H new ATOM 0 HG11 VAL A 439 -0.373 6.223 0.407 1.00 0.00 H new ATOM 0 HG12 VAL A 439 -0.027 5.926 -1.313 1.00 0.00 H new ATOM 0 HG13 VAL A 439 -1.574 6.661 -0.831 1.00 0.00 H new ATOM 0 HG21 VAL A 439 -1.951 4.848 1.624 1.00 0.00 H new ATOM 0 HG22 VAL A 439 -3.275 5.161 0.477 1.00 0.00 H new ATOM 0 HG23 VAL A 439 -2.784 3.488 0.834 1.00 0.00 H new ATOM 788 N GLN A 440 -4.474 4.196 -1.954 1.00 0.00 N ATOM 789 CA GLN A 440 -5.771 4.772 -2.314 1.00 0.00 C ATOM 790 C GLN A 440 -6.737 4.777 -1.138 1.00 0.00 C ATOM 791 O GLN A 440 -7.752 5.454 -1.175 1.00 0.00 O ATOM 792 CB GLN A 440 -6.407 4.001 -3.471 1.00 0.00 C ATOM 793 CG GLN A 440 -5.620 4.003 -4.766 1.00 0.00 C ATOM 794 CD GLN A 440 -6.186 3.032 -5.793 1.00 0.00 C ATOM 795 OE1 GLN A 440 -5.323 2.503 -6.617 1.00 0.00 O flip ATOM 796 NE2 GLN A 440 -7.398 2.760 -5.833 1.00 0.00 N flip ATOM 0 H GLN A 440 -4.525 3.252 -1.571 1.00 0.00 H new ATOM 0 HA GLN A 440 -5.581 5.802 -2.616 1.00 0.00 H new ATOM 0 HB2 GLN A 440 -6.556 2.968 -3.158 1.00 0.00 H new ATOM 0 HB3 GLN A 440 -7.394 4.420 -3.665 1.00 0.00 H new ATOM 0 HG2 GLN A 440 -5.618 5.009 -5.185 1.00 0.00 H new ATOM 0 HG3 GLN A 440 -4.582 3.742 -4.557 1.00 0.00 H new ATOM 0 HE21 GLN A 440 -8.040 3.195 -5.171 1.00 0.00 H new ATOM 0 HE22 GLN A 440 -7.750 2.102 -6.528 1.00 0.00 H new ATOM 805 N ALA A 441 -6.430 4.018 -0.089 1.00 0.00 N ATOM 806 CA ALA A 441 -7.376 3.849 1.004 1.00 0.00 C ATOM 807 C ALA A 441 -7.059 4.795 2.136 1.00 0.00 C ATOM 808 O ALA A 441 -7.653 4.717 3.224 1.00 0.00 O ATOM 809 CB ALA A 441 -7.370 2.411 1.489 1.00 0.00 C ATOM 0 H ALA A 441 -5.548 3.519 0.025 1.00 0.00 H new ATOM 0 HA ALA A 441 -8.374 4.085 0.636 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -8.082 2.300 2.307 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -7.652 1.750 0.670 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -6.372 2.149 1.840 1.00 0.00 H new ATOM 815 N GLY A 442 -6.112 5.664 1.906 1.00 0.00 N ATOM 816 CA GLY A 442 -5.790 6.624 2.883 1.00 0.00 C ATOM 817 C GLY A 442 -4.355 6.979 2.864 1.00 0.00 C ATOM 818 O GLY A 442 -3.801 7.267 1.820 1.00 0.00 O ATOM 0 H GLY A 442 -5.561 5.714 1.049 1.00 0.00 H new ATOM 0 HA2 GLY A 442 -6.387 7.521 2.719 1.00 0.00 H new ATOM 0 HA3 GLY A 442 -6.055 6.240 3.868 1.00 0.00 H new ATOM 822 N THR A 443 -3.747 6.856 3.984 1.00 0.00 N ATOM 823 CA THR A 443 -2.394 7.295 4.188 1.00 0.00 C ATOM 824 C THR A 443 -1.527 6.092 4.503 1.00 0.00 C ATOM 825 O THR A 443 -1.976 5.160 5.176 1.00 0.00 O ATOM 826 CB THR A 443 -2.363 8.308 5.365 1.00 0.00 C ATOM 827 OG1 THR A 443 -3.334 9.337 5.110 1.00 0.00 O ATOM 828 CG2 THR A 443 -0.989 8.952 5.534 1.00 0.00 C ATOM 0 H THR A 443 -4.175 6.440 4.811 1.00 0.00 H new ATOM 0 HA THR A 443 -2.013 7.782 3.290 1.00 0.00 H new ATOM 0 HB THR A 443 -2.591 7.767 6.284 1.00 0.00 H new ATOM 0 HG1 THR A 443 -3.327 9.983 5.847 1.00 0.00 H new ATOM 0 HG21 THR A 443 -1.016 9.653 6.369 1.00 0.00 H new ATOM 0 HG22 THR A 443 -0.247 8.179 5.733 1.00 0.00 H new ATOM 0 HG23 THR A 443 -0.722 9.485 4.621 1.00 0.00 H new ATOM 836 N LEU A 444 -0.329 6.086 3.991 1.00 0.00 N ATOM 837 CA LEU A 444 0.579 5.014 4.246 1.00 0.00 C ATOM 838 C LEU A 444 1.729 5.565 5.058 1.00 0.00 C ATOM 839 O LEU A 444 2.417 6.484 4.631 1.00 0.00 O ATOM 840 CB LEU A 444 1.087 4.412 2.934 1.00 0.00 C ATOM 841 CG LEU A 444 0.940 2.885 2.767 1.00 0.00 C ATOM 842 CD1 LEU A 444 1.513 2.477 1.457 1.00 0.00 C ATOM 843 CD2 LEU A 444 1.618 2.120 3.889 1.00 0.00 C ATOM 0 H LEU A 444 0.040 6.822 3.389 1.00 0.00 H new ATOM 0 HA LEU A 444 0.076 4.219 4.796 1.00 0.00 H new ATOM 0 HB2 LEU A 444 0.560 4.896 2.112 1.00 0.00 H new ATOM 0 HB3 LEU A 444 2.142 4.665 2.830 1.00 0.00 H new ATOM 0 HG LEU A 444 -0.122 2.643 2.805 1.00 0.00 H new ATOM 0 HD11 LEU A 444 1.411 1.399 1.335 1.00 0.00 H new ATOM 0 HD12 LEU A 444 0.980 2.985 0.653 1.00 0.00 H new ATOM 0 HD13 LEU A 444 2.568 2.748 1.421 1.00 0.00 H new ATOM 0 HD21 LEU A 444 1.489 1.050 3.730 1.00 0.00 H new ATOM 0 HD22 LEU A 444 2.681 2.359 3.902 1.00 0.00 H new ATOM 0 HD23 LEU A 444 1.172 2.401 4.843 1.00 0.00 H new ATOM 855 N LYS A 445 1.903 5.045 6.216 1.00 0.00 N ATOM 856 CA LYS A 445 2.925 5.469 7.118 1.00 0.00 C ATOM 857 C LYS A 445 3.678 4.239 7.603 1.00 0.00 C ATOM 858 O LYS A 445 3.149 3.121 7.562 1.00 0.00 O ATOM 859 CB LYS A 445 2.249 6.174 8.304 1.00 0.00 C ATOM 860 CG LYS A 445 3.159 6.543 9.452 1.00 0.00 C ATOM 861 CD LYS A 445 2.436 6.498 10.803 1.00 0.00 C ATOM 862 CE LYS A 445 1.965 5.069 11.176 1.00 0.00 C ATOM 863 NZ LYS A 445 0.629 4.715 10.634 1.00 0.00 N ATOM 0 H LYS A 445 1.324 4.289 6.580 1.00 0.00 H new ATOM 0 HA LYS A 445 3.623 6.152 6.633 1.00 0.00 H new ATOM 0 HB2 LYS A 445 1.770 7.082 7.938 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.458 5.527 8.685 1.00 0.00 H new ATOM 0 HG2 LYS A 445 4.008 5.860 9.474 1.00 0.00 H new ATOM 0 HG3 LYS A 445 3.559 7.544 9.289 1.00 0.00 H new ATOM 0 HD2 LYS A 445 3.102 6.872 11.581 1.00 0.00 H new ATOM 0 HD3 LYS A 445 1.574 7.165 10.773 1.00 0.00 H new ATOM 0 HE2 LYS A 445 2.697 4.349 10.810 1.00 0.00 H new ATOM 0 HE3 LYS A 445 1.942 4.977 12.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 0.183 4.003 11.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 0.032 5.566 10.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 0.735 4.328 9.675 1.00 0.00 H new ATOM 877 N VAL A 446 4.905 4.415 8.009 1.00 0.00 N ATOM 878 CA VAL A 446 5.644 3.334 8.578 1.00 0.00 C ATOM 879 C VAL A 446 5.019 2.944 9.909 1.00 0.00 C ATOM 880 O VAL A 446 4.692 3.799 10.731 1.00 0.00 O ATOM 881 CB VAL A 446 7.163 3.639 8.729 1.00 0.00 C ATOM 882 CG1 VAL A 446 7.785 3.914 7.379 1.00 0.00 C ATOM 883 CG2 VAL A 446 7.422 4.815 9.672 1.00 0.00 C ATOM 0 H VAL A 446 5.410 5.299 7.954 1.00 0.00 H new ATOM 0 HA VAL A 446 5.587 2.494 7.886 1.00 0.00 H new ATOM 0 HB VAL A 446 7.626 2.754 9.167 1.00 0.00 H new ATOM 0 HG11 VAL A 446 8.847 4.125 7.504 1.00 0.00 H new ATOM 0 HG12 VAL A 446 7.662 3.042 6.737 1.00 0.00 H new ATOM 0 HG13 VAL A 446 7.296 4.774 6.921 1.00 0.00 H new ATOM 0 HG21 VAL A 446 8.495 4.992 9.747 1.00 0.00 H new ATOM 0 HG22 VAL A 446 6.934 5.708 9.282 1.00 0.00 H new ATOM 0 HG23 VAL A 446 7.022 4.584 10.660 1.00 0.00 H new ATOM 893 N GLY A 447 4.813 1.674 10.093 1.00 0.00 N ATOM 894 CA GLY A 447 4.168 1.224 11.281 1.00 0.00 C ATOM 895 C GLY A 447 2.722 0.828 11.054 1.00 0.00 C ATOM 896 O GLY A 447 2.085 0.305 11.965 1.00 0.00 O ATOM 0 H GLY A 447 5.081 0.939 9.439 1.00 0.00 H new ATOM 0 HA2 GLY A 447 4.714 0.371 11.684 1.00 0.00 H new ATOM 0 HA3 GLY A 447 4.210 2.013 12.032 1.00 0.00 H new ATOM 900 N ASP A 448 2.194 1.077 9.851 1.00 0.00 N ATOM 901 CA ASP A 448 0.807 0.681 9.540 1.00 0.00 C ATOM 902 C ASP A 448 0.678 -0.806 9.340 1.00 0.00 C ATOM 903 O ASP A 448 1.547 -1.433 8.697 1.00 0.00 O ATOM 904 CB ASP A 448 0.215 1.383 8.292 1.00 0.00 C ATOM 905 CG ASP A 448 -0.236 2.791 8.536 1.00 0.00 C ATOM 906 OD1 ASP A 448 -1.208 3.009 9.251 1.00 0.00 O ATOM 907 OD2 ASP A 448 0.394 3.729 8.044 1.00 0.00 O ATOM 0 H ASP A 448 2.689 1.540 9.089 1.00 0.00 H new ATOM 0 HA ASP A 448 0.240 1.001 10.414 1.00 0.00 H new ATOM 0 HB2 ASP A 448 0.964 1.385 7.500 1.00 0.00 H new ATOM 0 HB3 ASP A 448 -0.631 0.800 7.928 1.00 0.00 H new ATOM 912 N PRO A 449 -0.356 -1.411 9.935 1.00 0.00 N ATOM 913 CA PRO A 449 -0.706 -2.788 9.677 1.00 0.00 C ATOM 914 C PRO A 449 -1.364 -2.893 8.301 1.00 0.00 C ATOM 915 O PRO A 449 -2.394 -2.273 8.032 1.00 0.00 O ATOM 916 CB PRO A 449 -1.705 -3.141 10.787 1.00 0.00 C ATOM 917 CG PRO A 449 -2.280 -1.839 11.231 1.00 0.00 C ATOM 918 CD PRO A 449 -1.252 -0.786 10.938 1.00 0.00 C ATOM 0 HA PRO A 449 0.153 -3.459 9.675 1.00 0.00 H new ATOM 0 HB2 PRO A 449 -2.483 -3.809 10.417 1.00 0.00 H new ATOM 0 HB3 PRO A 449 -1.211 -3.654 11.612 1.00 0.00 H new ATOM 0 HG2 PRO A 449 -3.210 -1.628 10.704 1.00 0.00 H new ATOM 0 HG3 PRO A 449 -2.515 -1.864 12.295 1.00 0.00 H new ATOM 0 HD2 PRO A 449 -1.713 0.121 10.548 1.00 0.00 H new ATOM 0 HD3 PRO A 449 -0.705 -0.504 11.838 1.00 0.00 H new ATOM 926 N ILE A 450 -0.762 -3.642 7.433 1.00 0.00 N ATOM 927 CA ILE A 450 -1.230 -3.727 6.076 1.00 0.00 C ATOM 928 C ILE A 450 -1.521 -5.147 5.662 1.00 0.00 C ATOM 929 O ILE A 450 -1.045 -6.101 6.290 1.00 0.00 O ATOM 930 CB ILE A 450 -0.227 -3.040 5.086 1.00 0.00 C ATOM 931 CG1 ILE A 450 1.231 -3.523 5.304 1.00 0.00 C ATOM 932 CG2 ILE A 450 -0.315 -1.523 5.181 1.00 0.00 C ATOM 933 CD1 ILE A 450 1.582 -4.839 4.643 1.00 0.00 C ATOM 0 H ILE A 450 0.061 -4.209 7.636 1.00 0.00 H new ATOM 0 HA ILE A 450 -2.174 -3.184 6.030 1.00 0.00 H new ATOM 0 HB ILE A 450 -0.519 -3.338 4.079 1.00 0.00 H new ATOM 0 HG12 ILE A 450 1.910 -2.756 4.932 1.00 0.00 H new ATOM 0 HG13 ILE A 450 1.410 -3.614 6.375 1.00 0.00 H new ATOM 0 HG21 ILE A 450 0.392 -1.073 4.483 1.00 0.00 H new ATOM 0 HG22 ILE A 450 -1.326 -1.201 4.932 1.00 0.00 H new ATOM 0 HG23 ILE A 450 -0.074 -1.207 6.196 1.00 0.00 H new ATOM 0 HD11 ILE A 450 2.622 -5.087 4.856 1.00 0.00 H new ATOM 0 HD12 ILE A 450 0.935 -5.625 5.031 1.00 0.00 H new ATOM 0 HD13 ILE A 450 1.443 -4.753 3.565 1.00 0.00 H new ATOM 945 N VAL A 451 -2.313 -5.279 4.636 1.00 0.00 N ATOM 946 CA VAL A 451 -2.636 -6.549 4.055 1.00 0.00 C ATOM 947 C VAL A 451 -2.555 -6.429 2.534 1.00 0.00 C ATOM 948 O VAL A 451 -3.278 -5.640 1.930 1.00 0.00 O ATOM 949 CB VAL A 451 -4.032 -7.087 4.543 1.00 0.00 C ATOM 950 CG1 VAL A 451 -5.167 -6.100 4.273 1.00 0.00 C ATOM 951 CG2 VAL A 451 -4.339 -8.450 3.934 1.00 0.00 C ATOM 0 H VAL A 451 -2.761 -4.489 4.171 1.00 0.00 H new ATOM 0 HA VAL A 451 -1.911 -7.291 4.389 1.00 0.00 H new ATOM 0 HB VAL A 451 -3.962 -7.201 5.625 1.00 0.00 H new ATOM 0 HG11 VAL A 451 -6.107 -6.521 4.629 1.00 0.00 H new ATOM 0 HG12 VAL A 451 -4.967 -5.164 4.795 1.00 0.00 H new ATOM 0 HG13 VAL A 451 -5.237 -5.910 3.202 1.00 0.00 H new ATOM 0 HG21 VAL A 451 -5.309 -8.797 4.289 1.00 0.00 H new ATOM 0 HG22 VAL A 451 -4.359 -8.367 2.847 1.00 0.00 H new ATOM 0 HG23 VAL A 451 -3.569 -9.162 4.230 1.00 0.00 H new ATOM 961 N VAL A 452 -1.621 -7.156 1.945 1.00 0.00 N ATOM 962 CA VAL A 452 -1.362 -7.114 0.513 1.00 0.00 C ATOM 963 C VAL A 452 -1.377 -8.538 0.003 1.00 0.00 C ATOM 964 O VAL A 452 -0.631 -9.378 0.531 1.00 0.00 O ATOM 965 CB VAL A 452 0.050 -6.540 0.203 1.00 0.00 C ATOM 966 CG1 VAL A 452 0.216 -6.274 -1.283 1.00 0.00 C ATOM 967 CG2 VAL A 452 0.367 -5.300 1.022 1.00 0.00 C ATOM 0 H VAL A 452 -1.014 -7.800 2.452 1.00 0.00 H new ATOM 0 HA VAL A 452 -2.117 -6.483 0.044 1.00 0.00 H new ATOM 0 HB VAL A 452 0.772 -7.302 0.497 1.00 0.00 H new ATOM 0 HG11 VAL A 452 1.212 -5.873 -1.472 1.00 0.00 H new ATOM 0 HG12 VAL A 452 0.089 -7.205 -1.836 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -0.533 -5.553 -1.609 1.00 0.00 H new ATOM 0 HG21 VAL A 452 1.364 -4.940 0.767 1.00 0.00 H new ATOM 0 HG22 VAL A 452 -0.366 -4.523 0.804 1.00 0.00 H new ATOM 0 HG23 VAL A 452 0.331 -5.546 2.083 1.00 0.00 H new ATOM 977 N GLY A 453 -2.215 -8.825 -0.987 1.00 0.00 N ATOM 978 CA GLY A 453 -2.321 -10.176 -1.519 1.00 0.00 C ATOM 979 C GLY A 453 -2.674 -11.163 -0.435 1.00 0.00 C ATOM 980 O GLY A 453 -2.059 -12.229 -0.341 1.00 0.00 O ATOM 0 H GLY A 453 -2.827 -8.143 -1.435 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -3.080 -10.203 -2.301 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -1.377 -10.463 -1.982 1.00 0.00 H new ATOM 984 N THR A 454 -3.615 -10.739 0.422 1.00 0.00 N ATOM 985 CA THR A 454 -4.129 -11.442 1.613 1.00 0.00 C ATOM 986 C THR A 454 -3.035 -11.738 2.676 1.00 0.00 C ATOM 987 O THR A 454 -3.314 -12.342 3.724 1.00 0.00 O ATOM 988 CB THR A 454 -5.038 -12.704 1.310 1.00 0.00 C ATOM 989 OG1 THR A 454 -5.750 -13.093 2.503 1.00 0.00 O ATOM 990 CG2 THR A 454 -4.238 -13.912 0.827 1.00 0.00 C ATOM 0 H THR A 454 -4.070 -9.835 0.295 1.00 0.00 H new ATOM 0 HA THR A 454 -4.809 -10.717 2.060 1.00 0.00 H new ATOM 0 HB THR A 454 -5.722 -12.405 0.515 1.00 0.00 H new ATOM 0 HG1 THR A 454 -5.177 -12.955 3.286 1.00 0.00 H new ATOM 0 HG21 THR A 454 -4.915 -14.744 0.636 1.00 0.00 H new ATOM 0 HG22 THR A 454 -3.711 -13.655 -0.092 1.00 0.00 H new ATOM 0 HG23 THR A 454 -3.516 -14.200 1.591 1.00 0.00 H new ATOM 998 N THR A 455 -1.828 -11.266 2.437 1.00 0.00 N ATOM 999 CA THR A 455 -0.753 -11.433 3.368 1.00 0.00 C ATOM 1000 C THR A 455 -0.662 -10.161 4.208 1.00 0.00 C ATOM 1001 O THR A 455 -0.767 -9.066 3.676 1.00 0.00 O ATOM 1002 CB THR A 455 0.577 -11.689 2.619 1.00 0.00 C ATOM 1003 OG1 THR A 455 0.372 -12.745 1.657 1.00 0.00 O ATOM 1004 CG2 THR A 455 1.658 -12.104 3.608 1.00 0.00 C ATOM 0 H THR A 455 -1.574 -10.758 1.590 1.00 0.00 H new ATOM 0 HA THR A 455 -0.938 -12.295 4.010 1.00 0.00 H new ATOM 0 HB THR A 455 0.894 -10.778 2.112 1.00 0.00 H new ATOM 0 HG1 THR A 455 1.208 -12.915 1.175 1.00 0.00 H new ATOM 0 HG21 THR A 455 2.591 -12.282 3.074 1.00 0.00 H new ATOM 0 HG22 THR A 455 1.805 -11.310 4.340 1.00 0.00 H new ATOM 0 HG23 THR A 455 1.352 -13.017 4.119 1.00 0.00 H new ATOM 1012 N TYR A 456 -0.505 -10.295 5.494 1.00 0.00 N ATOM 1013 CA TYR A 456 -0.472 -9.137 6.355 1.00 0.00 C ATOM 1014 C TYR A 456 0.894 -8.923 6.942 1.00 0.00 C ATOM 1015 O TYR A 456 1.657 -9.872 7.120 1.00 0.00 O ATOM 1016 CB TYR A 456 -1.538 -9.208 7.457 1.00 0.00 C ATOM 1017 CG TYR A 456 -1.473 -10.465 8.309 1.00 0.00 C ATOM 1018 CD1 TYR A 456 -2.102 -11.630 7.896 1.00 0.00 C ATOM 1019 CD2 TYR A 456 -0.777 -10.491 9.512 1.00 0.00 C ATOM 1020 CE1 TYR A 456 -2.046 -12.778 8.646 1.00 0.00 C ATOM 1021 CE2 TYR A 456 -0.712 -11.645 10.268 1.00 0.00 C ATOM 1022 CZ TYR A 456 -1.351 -12.785 9.827 1.00 0.00 C ATOM 1023 OH TYR A 456 -1.282 -13.948 10.569 1.00 0.00 O ATOM 0 H TYR A 456 -0.398 -11.189 5.973 1.00 0.00 H new ATOM 0 HA TYR A 456 -0.706 -8.275 5.730 1.00 0.00 H new ATOM 0 HB2 TYR A 456 -1.433 -8.338 8.105 1.00 0.00 H new ATOM 0 HB3 TYR A 456 -2.524 -9.145 6.997 1.00 0.00 H new ATOM 0 HD1 TYR A 456 -2.648 -11.634 6.964 1.00 0.00 H new ATOM 0 HD2 TYR A 456 -0.281 -9.597 9.860 1.00 0.00 H new ATOM 0 HE1 TYR A 456 -2.548 -13.672 8.307 1.00 0.00 H new ATOM 0 HE2 TYR A 456 -0.164 -11.655 11.199 1.00 0.00 H new ATOM 0 HH TYR A 456 -0.752 -13.789 11.378 1.00 0.00 H new ATOM 1033 N GLY A 457 1.185 -7.688 7.225 1.00 0.00 N ATOM 1034 CA GLY A 457 2.444 -7.306 7.772 1.00 0.00 C ATOM 1035 C GLY A 457 2.364 -5.914 8.327 1.00 0.00 C ATOM 1036 O GLY A 457 1.256 -5.388 8.539 1.00 0.00 O ATOM 0 H GLY A 457 0.542 -6.910 7.079 1.00 0.00 H new ATOM 0 HA2 GLY A 457 2.734 -8.003 8.558 1.00 0.00 H new ATOM 0 HA3 GLY A 457 3.214 -7.355 7.002 1.00 0.00 H new ATOM 1040 N ARG A 458 3.492 -5.315 8.563 1.00 0.00 N ATOM 1041 CA ARG A 458 3.555 -3.975 9.079 1.00 0.00 C ATOM 1042 C ARG A 458 4.592 -3.221 8.274 1.00 0.00 C ATOM 1043 O ARG A 458 5.644 -3.770 7.969 1.00 0.00 O ATOM 1044 CB ARG A 458 3.943 -3.996 10.557 1.00 0.00 C ATOM 1045 CG ARG A 458 3.830 -2.654 11.246 1.00 0.00 C ATOM 1046 CD ARG A 458 4.281 -2.731 12.692 1.00 0.00 C ATOM 1047 NE ARG A 458 4.069 -1.458 13.386 1.00 0.00 N ATOM 1048 CZ ARG A 458 5.017 -0.765 14.044 1.00 0.00 C ATOM 1049 NH1 ARG A 458 6.298 -1.155 14.005 1.00 0.00 N ATOM 1050 NH2 ARG A 458 4.685 0.342 14.702 1.00 0.00 N ATOM 0 H ARG A 458 4.404 -5.743 8.403 1.00 0.00 H new ATOM 0 HA ARG A 458 2.583 -3.489 8.996 1.00 0.00 H new ATOM 0 HB2 ARG A 458 3.309 -4.714 11.078 1.00 0.00 H new ATOM 0 HB3 ARG A 458 4.969 -4.353 10.647 1.00 0.00 H new ATOM 0 HG2 ARG A 458 4.434 -1.919 10.714 1.00 0.00 H new ATOM 0 HG3 ARG A 458 2.797 -2.308 11.204 1.00 0.00 H new ATOM 0 HD2 ARG A 458 3.733 -3.522 13.204 1.00 0.00 H new ATOM 0 HD3 ARG A 458 5.337 -2.997 12.732 1.00 0.00 H new ATOM 0 HE ARG A 458 3.128 -1.066 13.369 1.00 0.00 H new ATOM 0 HH11 ARG A 458 6.563 -1.984 13.473 1.00 0.00 H new ATOM 0 HH12 ARG A 458 7.009 -0.623 14.507 1.00 0.00 H new ATOM 0 HH21 ARG A 458 3.716 0.662 14.706 1.00 0.00 H new ATOM 0 HH22 ARG A 458 5.399 0.871 15.202 1.00 0.00 H new ATOM 1064 N VAL A 459 4.290 -1.995 7.911 1.00 0.00 N ATOM 1065 CA VAL A 459 5.187 -1.202 7.086 1.00 0.00 C ATOM 1066 C VAL A 459 6.476 -0.857 7.812 1.00 0.00 C ATOM 1067 O VAL A 459 6.465 -0.198 8.856 1.00 0.00 O ATOM 1068 CB VAL A 459 4.527 0.084 6.577 1.00 0.00 C ATOM 1069 CG1 VAL A 459 5.487 0.845 5.665 1.00 0.00 C ATOM 1070 CG2 VAL A 459 3.243 -0.242 5.848 1.00 0.00 C ATOM 0 H VAL A 459 3.427 -1.519 8.173 1.00 0.00 H new ATOM 0 HA VAL A 459 5.427 -1.829 6.227 1.00 0.00 H new ATOM 0 HB VAL A 459 4.287 0.719 7.430 1.00 0.00 H new ATOM 0 HG11 VAL A 459 5.006 1.757 5.310 1.00 0.00 H new ATOM 0 HG12 VAL A 459 6.389 1.103 6.220 1.00 0.00 H new ATOM 0 HG13 VAL A 459 5.752 0.219 4.813 1.00 0.00 H new ATOM 0 HG21 VAL A 459 2.783 0.680 5.491 1.00 0.00 H new ATOM 0 HG22 VAL A 459 3.461 -0.891 5.000 1.00 0.00 H new ATOM 0 HG23 VAL A 459 2.558 -0.750 6.527 1.00 0.00 H new ATOM 1080 N ARG A 460 7.556 -1.308 7.247 1.00 0.00 N ATOM 1081 CA ARG A 460 8.884 -1.081 7.760 1.00 0.00 C ATOM 1082 C ARG A 460 9.430 0.312 7.356 1.00 0.00 C ATOM 1083 O ARG A 460 9.715 1.146 8.211 1.00 0.00 O ATOM 1084 CB ARG A 460 9.785 -2.235 7.252 1.00 0.00 C ATOM 1085 CG ARG A 460 11.286 -2.008 7.295 1.00 0.00 C ATOM 1086 CD ARG A 460 11.772 -1.691 8.674 1.00 0.00 C ATOM 1087 NE ARG A 460 13.220 -1.480 8.678 1.00 0.00 N ATOM 1088 CZ ARG A 460 13.960 -1.115 9.725 1.00 0.00 C ATOM 1089 NH1 ARG A 460 13.395 -0.891 10.909 1.00 0.00 N ATOM 1090 NH2 ARG A 460 15.275 -0.959 9.572 1.00 0.00 N ATOM 0 H ARG A 460 7.542 -1.861 6.390 1.00 0.00 H new ATOM 0 HA ARG A 460 8.870 -1.077 8.850 1.00 0.00 H new ATOM 0 HB2 ARG A 460 9.560 -3.125 7.840 1.00 0.00 H new ATOM 0 HB3 ARG A 460 9.505 -2.455 6.222 1.00 0.00 H new ATOM 0 HG2 ARG A 460 11.797 -2.898 6.928 1.00 0.00 H new ATOM 0 HG3 ARG A 460 11.547 -1.190 6.623 1.00 0.00 H new ATOM 0 HD2 ARG A 460 11.269 -0.798 9.046 1.00 0.00 H new ATOM 0 HD3 ARG A 460 11.517 -2.506 9.351 1.00 0.00 H new ATOM 0 HE ARG A 460 13.710 -1.626 7.795 1.00 0.00 H new ATOM 0 HH11 ARG A 460 12.387 -0.998 11.021 1.00 0.00 H new ATOM 0 HH12 ARG A 460 13.970 -0.612 11.704 1.00 0.00 H new ATOM 0 HH21 ARG A 460 15.705 -1.119 8.661 1.00 0.00 H new ATOM 0 HH22 ARG A 460 15.851 -0.680 10.366 1.00 0.00 H new ATOM 1104 N ALA A 461 9.544 0.548 6.085 1.00 0.00 N ATOM 1105 CA ALA A 461 10.077 1.782 5.554 1.00 0.00 C ATOM 1106 C ALA A 461 9.220 2.235 4.418 1.00 0.00 C ATOM 1107 O ALA A 461 8.580 1.419 3.744 1.00 0.00 O ATOM 1108 CB ALA A 461 11.514 1.571 5.082 1.00 0.00 C ATOM 0 H ALA A 461 9.266 -0.120 5.367 1.00 0.00 H new ATOM 0 HA ALA A 461 10.079 2.545 6.332 1.00 0.00 H new ATOM 0 HB1 ALA A 461 11.907 2.506 4.684 1.00 0.00 H new ATOM 0 HB2 ALA A 461 12.129 1.247 5.922 1.00 0.00 H new ATOM 0 HB3 ALA A 461 11.533 0.808 4.303 1.00 0.00 H new ATOM 1114 N MET A 462 9.197 3.515 4.214 1.00 0.00 N ATOM 1115 CA MET A 462 8.411 4.109 3.184 1.00 0.00 C ATOM 1116 C MET A 462 9.353 4.731 2.208 1.00 0.00 C ATOM 1117 O MET A 462 10.109 5.614 2.575 1.00 0.00 O ATOM 1118 CB MET A 462 7.555 5.216 3.790 1.00 0.00 C ATOM 1119 CG MET A 462 6.515 5.783 2.848 1.00 0.00 C ATOM 1120 SD MET A 462 5.314 4.554 2.386 1.00 0.00 S ATOM 1121 CE MET A 462 4.732 4.080 4.000 1.00 0.00 C ATOM 0 H MET A 462 9.732 4.184 4.767 1.00 0.00 H new ATOM 0 HA MET A 462 7.774 3.365 2.706 1.00 0.00 H new ATOM 0 HB2 MET A 462 7.053 4.828 4.676 1.00 0.00 H new ATOM 0 HB3 MET A 462 8.207 6.024 4.122 1.00 0.00 H new ATOM 0 HG2 MET A 462 6.011 6.624 3.324 1.00 0.00 H new ATOM 0 HG3 MET A 462 7.004 6.169 1.954 1.00 0.00 H new ATOM 0 HE1 MET A 462 3.821 3.491 3.900 1.00 0.00 H new ATOM 0 HE2 MET A 462 5.495 3.485 4.502 1.00 0.00 H new ATOM 0 HE3 MET A 462 4.523 4.973 4.588 1.00 0.00 H new ATOM 1131 N VAL A 463 9.361 4.274 1.009 1.00 0.00 N ATOM 1132 CA VAL A 463 10.212 4.870 0.006 1.00 0.00 C ATOM 1133 C VAL A 463 9.325 5.301 -1.115 1.00 0.00 C ATOM 1134 O VAL A 463 8.558 4.506 -1.603 1.00 0.00 O ATOM 1135 CB VAL A 463 11.277 3.883 -0.538 1.00 0.00 C ATOM 1136 CG1 VAL A 463 12.310 4.628 -1.360 1.00 0.00 C ATOM 1137 CG2 VAL A 463 11.950 3.113 0.583 1.00 0.00 C ATOM 0 H VAL A 463 8.794 3.491 0.684 1.00 0.00 H new ATOM 0 HA VAL A 463 10.756 5.703 0.452 1.00 0.00 H new ATOM 0 HB VAL A 463 10.767 3.161 -1.175 1.00 0.00 H new ATOM 0 HG11 VAL A 463 13.052 3.924 -1.736 1.00 0.00 H new ATOM 0 HG12 VAL A 463 11.820 5.122 -2.199 1.00 0.00 H new ATOM 0 HG13 VAL A 463 12.802 5.375 -0.736 1.00 0.00 H new ATOM 0 HG21 VAL A 463 12.690 2.431 0.163 1.00 0.00 H new ATOM 0 HG22 VAL A 463 12.443 3.811 1.260 1.00 0.00 H new ATOM 0 HG23 VAL A 463 11.202 2.542 1.133 1.00 0.00 H new ATOM 1147 N ASN A 464 9.396 6.533 -1.516 1.00 0.00 N ATOM 1148 CA ASN A 464 8.479 6.992 -2.528 1.00 0.00 C ATOM 1149 C ASN A 464 9.105 6.836 -3.884 1.00 0.00 C ATOM 1150 O ASN A 464 10.286 6.498 -3.978 1.00 0.00 O ATOM 1151 CB ASN A 464 8.021 8.438 -2.267 1.00 0.00 C ATOM 1152 CG ASN A 464 8.981 9.501 -2.734 1.00 0.00 C ATOM 1153 OD1 ASN A 464 8.890 9.967 -3.852 1.00 0.00 O ATOM 1154 ND2 ASN A 464 9.898 9.892 -1.900 1.00 0.00 N ATOM 0 H ASN A 464 10.059 7.228 -1.172 1.00 0.00 H new ATOM 0 HA ASN A 464 7.580 6.377 -2.491 1.00 0.00 H new ATOM 0 HB2 ASN A 464 7.061 8.594 -2.759 1.00 0.00 H new ATOM 0 HB3 ASN A 464 7.855 8.564 -1.197 1.00 0.00 H new ATOM 0 HD21 ASN A 464 10.567 10.610 -2.178 1.00 0.00 H new ATOM 0 HD22 ASN A 464 9.948 9.481 -0.968 1.00 0.00 H new ATOM 1161 N ASP A 465 8.336 7.118 -4.912 1.00 0.00 N ATOM 1162 CA ASP A 465 8.754 6.969 -6.319 1.00 0.00 C ATOM 1163 C ASP A 465 10.026 7.752 -6.655 1.00 0.00 C ATOM 1164 O ASP A 465 10.797 7.350 -7.524 1.00 0.00 O ATOM 1165 CB ASP A 465 7.609 7.365 -7.259 1.00 0.00 C ATOM 1166 CG ASP A 465 8.009 7.411 -8.719 1.00 0.00 C ATOM 1167 OD1 ASP A 465 8.239 6.341 -9.326 1.00 0.00 O ATOM 1168 OD2 ASP A 465 8.105 8.528 -9.279 1.00 0.00 O ATOM 0 H ASP A 465 7.382 7.465 -4.809 1.00 0.00 H new ATOM 0 HA ASP A 465 8.995 5.916 -6.466 1.00 0.00 H new ATOM 0 HB2 ASP A 465 6.790 6.656 -7.138 1.00 0.00 H new ATOM 0 HB3 ASP A 465 7.230 8.344 -6.964 1.00 0.00 H new ATOM 1173 N SER A 466 10.270 8.836 -5.943 1.00 0.00 N ATOM 1174 CA SER A 466 11.442 9.641 -6.185 1.00 0.00 C ATOM 1175 C SER A 466 12.692 9.001 -5.551 1.00 0.00 C ATOM 1176 O SER A 466 13.818 9.423 -5.815 1.00 0.00 O ATOM 1177 CB SER A 466 11.217 11.054 -5.673 1.00 0.00 C ATOM 1178 OG SER A 466 10.035 11.597 -6.251 1.00 0.00 O ATOM 0 H SER A 466 9.669 9.176 -5.192 1.00 0.00 H new ATOM 0 HA SER A 466 11.617 9.692 -7.260 1.00 0.00 H new ATOM 0 HB2 SER A 466 11.131 11.047 -4.586 1.00 0.00 H new ATOM 0 HB3 SER A 466 12.074 11.680 -5.920 1.00 0.00 H new ATOM 0 HG SER A 466 9.256 11.314 -5.728 1.00 0.00 H new ATOM 1184 N GLY A 467 12.490 7.999 -4.702 1.00 0.00 N ATOM 1185 CA GLY A 467 13.619 7.261 -4.158 1.00 0.00 C ATOM 1186 C GLY A 467 14.012 7.722 -2.787 1.00 0.00 C ATOM 1187 O GLY A 467 15.031 7.309 -2.246 1.00 0.00 O ATOM 0 H GLY A 467 11.574 7.685 -4.382 1.00 0.00 H new ATOM 0 HA2 GLY A 467 13.370 6.201 -4.121 1.00 0.00 H new ATOM 0 HA3 GLY A 467 14.472 7.365 -4.829 1.00 0.00 H new ATOM 1191 N ARG A 468 13.209 8.572 -2.220 1.00 0.00 N ATOM 1192 CA ARG A 468 13.474 9.079 -0.902 1.00 0.00 C ATOM 1193 C ARG A 468 12.700 8.300 0.109 1.00 0.00 C ATOM 1194 O ARG A 468 11.480 8.094 -0.049 1.00 0.00 O ATOM 1195 CB ARG A 468 13.155 10.570 -0.791 1.00 0.00 C ATOM 1196 CG ARG A 468 14.245 11.509 -1.319 1.00 0.00 C ATOM 1197 CD ARG A 468 14.532 11.324 -2.801 1.00 0.00 C ATOM 1198 NE ARG A 468 15.701 12.092 -3.215 1.00 0.00 N ATOM 1199 CZ ARG A 468 16.389 11.925 -4.348 1.00 0.00 C ATOM 1200 NH1 ARG A 468 15.978 11.064 -5.274 1.00 0.00 N ATOM 1201 NH2 ARG A 468 17.491 12.633 -4.558 1.00 0.00 N ATOM 0 H ARG A 468 12.358 8.933 -2.651 1.00 0.00 H new ATOM 0 HA ARG A 468 14.540 8.961 -0.706 1.00 0.00 H new ATOM 0 HB2 ARG A 468 12.231 10.769 -1.334 1.00 0.00 H new ATOM 0 HB3 ARG A 468 12.967 10.809 0.256 1.00 0.00 H new ATOM 0 HG2 ARG A 468 13.943 12.541 -1.140 1.00 0.00 H new ATOM 0 HG3 ARG A 468 15.163 11.343 -0.755 1.00 0.00 H new ATOM 0 HD2 ARG A 468 14.695 10.267 -3.013 1.00 0.00 H new ATOM 0 HD3 ARG A 468 13.665 11.636 -3.383 1.00 0.00 H new ATOM 0 HE ARG A 468 16.023 12.824 -2.581 1.00 0.00 H new ATOM 0 HH11 ARG A 468 15.128 10.521 -5.124 1.00 0.00 H new ATOM 0 HH12 ARG A 468 16.513 10.947 -6.134 1.00 0.00 H new ATOM 0 HH21 ARG A 468 17.809 13.301 -3.856 1.00 0.00 H new ATOM 0 HH22 ARG A 468 18.020 12.509 -5.421 1.00 0.00 H new ATOM 1215 N ARG A 469 13.392 7.839 1.110 1.00 0.00 N ATOM 1216 CA ARG A 469 12.802 7.084 2.169 1.00 0.00 C ATOM 1217 C ARG A 469 12.249 8.088 3.181 1.00 0.00 C ATOM 1218 O ARG A 469 12.969 8.950 3.666 1.00 0.00 O ATOM 1219 CB ARG A 469 13.871 6.137 2.772 1.00 0.00 C ATOM 1220 CG ARG A 469 13.348 4.967 3.628 1.00 0.00 C ATOM 1221 CD ARG A 469 12.743 5.409 4.935 1.00 0.00 C ATOM 1222 NE ARG A 469 13.733 6.024 5.821 1.00 0.00 N ATOM 1223 CZ ARG A 469 13.444 6.741 6.917 1.00 0.00 C ATOM 1224 NH1 ARG A 469 12.181 7.039 7.217 1.00 0.00 N ATOM 1225 NH2 ARG A 469 14.413 7.173 7.705 1.00 0.00 N ATOM 0 H ARG A 469 14.397 7.981 1.212 1.00 0.00 H new ATOM 0 HA ARG A 469 11.984 6.450 1.828 1.00 0.00 H new ATOM 0 HB2 ARG A 469 14.462 5.724 1.954 1.00 0.00 H new ATOM 0 HB3 ARG A 469 14.548 6.732 3.385 1.00 0.00 H new ATOM 0 HG2 ARG A 469 12.601 4.415 3.058 1.00 0.00 H new ATOM 0 HG3 ARG A 469 14.168 4.278 3.830 1.00 0.00 H new ATOM 0 HD2 ARG A 469 11.940 6.120 4.740 1.00 0.00 H new ATOM 0 HD3 ARG A 469 12.294 4.551 5.435 1.00 0.00 H new ATOM 0 HE ARG A 469 14.718 5.898 5.587 1.00 0.00 H new ATOM 0 HH11 ARG A 469 11.424 6.721 6.611 1.00 0.00 H new ATOM 0 HH12 ARG A 469 11.970 7.585 8.053 1.00 0.00 H new ATOM 0 HH21 ARG A 469 15.385 6.961 7.481 1.00 0.00 H new ATOM 0 HH22 ARG A 469 14.189 7.718 8.537 1.00 0.00 H new ATOM 1239 N VAL A 470 10.986 7.967 3.466 1.00 0.00 N ATOM 1240 CA VAL A 470 10.267 8.897 4.308 1.00 0.00 C ATOM 1241 C VAL A 470 9.565 8.125 5.397 1.00 0.00 C ATOM 1242 O VAL A 470 9.798 6.911 5.548 1.00 0.00 O ATOM 1243 CB VAL A 470 9.240 9.756 3.490 1.00 0.00 C ATOM 1244 CG1 VAL A 470 9.958 10.686 2.522 1.00 0.00 C ATOM 1245 CG2 VAL A 470 8.271 8.870 2.720 1.00 0.00 C ATOM 0 H VAL A 470 10.408 7.204 3.115 1.00 0.00 H new ATOM 0 HA VAL A 470 10.982 9.594 4.746 1.00 0.00 H new ATOM 0 HB VAL A 470 8.675 10.354 4.205 1.00 0.00 H new ATOM 0 HG11 VAL A 470 9.224 11.270 1.967 1.00 0.00 H new ATOM 0 HG12 VAL A 470 10.611 11.358 3.079 1.00 0.00 H new ATOM 0 HG13 VAL A 470 10.554 10.096 1.825 1.00 0.00 H new ATOM 0 HG21 VAL A 470 7.572 9.494 2.163 1.00 0.00 H new ATOM 0 HG22 VAL A 470 8.827 8.240 2.026 1.00 0.00 H new ATOM 0 HG23 VAL A 470 7.719 8.241 3.419 1.00 0.00 H new ATOM 1255 N LYS A 471 8.768 8.792 6.188 1.00 0.00 N ATOM 1256 CA LYS A 471 8.060 8.108 7.254 1.00 0.00 C ATOM 1257 C LYS A 471 6.637 7.815 6.825 1.00 0.00 C ATOM 1258 O LYS A 471 6.049 6.816 7.233 1.00 0.00 O ATOM 1259 CB LYS A 471 8.022 8.955 8.524 1.00 0.00 C ATOM 1260 CG LYS A 471 9.332 9.639 8.858 1.00 0.00 C ATOM 1261 CD LYS A 471 9.298 10.340 10.216 1.00 0.00 C ATOM 1262 CE LYS A 471 8.075 11.240 10.413 1.00 0.00 C ATOM 1263 NZ LYS A 471 7.873 12.239 9.329 1.00 0.00 N ATOM 0 H LYS A 471 8.589 9.794 6.123 1.00 0.00 H new ATOM 0 HA LYS A 471 8.591 7.179 7.462 1.00 0.00 H new ATOM 0 HB2 LYS A 471 7.247 9.714 8.417 1.00 0.00 H new ATOM 0 HB3 LYS A 471 7.734 8.320 9.362 1.00 0.00 H new ATOM 0 HG2 LYS A 471 10.134 8.901 8.854 1.00 0.00 H new ATOM 0 HG3 LYS A 471 9.565 10.368 8.082 1.00 0.00 H new ATOM 0 HD2 LYS A 471 9.315 9.587 11.004 1.00 0.00 H new ATOM 0 HD3 LYS A 471 10.201 10.940 10.328 1.00 0.00 H new ATOM 0 HE2 LYS A 471 7.185 10.614 10.486 1.00 0.00 H new ATOM 0 HE3 LYS A 471 8.174 11.766 11.363 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 8.023 13.196 9.707 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 8.551 12.060 8.561 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 6.904 12.160 8.960 1.00 0.00 H new ATOM 1277 N GLU A 472 6.091 8.686 6.005 1.00 0.00 N ATOM 1278 CA GLU A 472 4.716 8.568 5.589 1.00 0.00 C ATOM 1279 C GLU A 472 4.499 9.187 4.222 1.00 0.00 C ATOM 1280 O GLU A 472 5.268 10.050 3.787 1.00 0.00 O ATOM 1281 CB GLU A 472 3.752 9.209 6.624 1.00 0.00 C ATOM 1282 CG GLU A 472 3.907 10.727 6.855 1.00 0.00 C ATOM 1283 CD GLU A 472 5.206 11.134 7.539 1.00 0.00 C ATOM 1284 OE1 GLU A 472 5.249 11.167 8.775 1.00 0.00 O ATOM 1285 OE2 GLU A 472 6.208 11.448 6.846 1.00 0.00 O ATOM 0 H GLU A 472 6.584 9.488 5.612 1.00 0.00 H new ATOM 0 HA GLU A 472 4.492 7.503 5.526 1.00 0.00 H new ATOM 0 HB2 GLU A 472 2.728 9.015 6.304 1.00 0.00 H new ATOM 0 HB3 GLU A 472 3.889 8.702 7.579 1.00 0.00 H new ATOM 0 HG2 GLU A 472 3.843 11.236 5.893 1.00 0.00 H new ATOM 0 HG3 GLU A 472 3.069 11.077 7.458 1.00 0.00 H new ATOM 1292 N ALA A 473 3.471 8.739 3.565 1.00 0.00 N ATOM 1293 CA ALA A 473 3.061 9.226 2.283 1.00 0.00 C ATOM 1294 C ALA A 473 1.555 9.270 2.260 1.00 0.00 C ATOM 1295 O ALA A 473 0.897 8.472 2.940 1.00 0.00 O ATOM 1296 CB ALA A 473 3.567 8.316 1.198 1.00 0.00 C ATOM 0 H ALA A 473 2.872 7.995 3.922 1.00 0.00 H new ATOM 0 HA ALA A 473 3.470 10.221 2.110 1.00 0.00 H new ATOM 0 HB1 ALA A 473 3.249 8.696 0.227 1.00 0.00 H new ATOM 0 HB2 ALA A 473 4.656 8.277 1.234 1.00 0.00 H new ATOM 0 HB3 ALA A 473 3.163 7.314 1.346 1.00 0.00 H new ATOM 1302 N GLY A 474 1.005 10.171 1.506 1.00 0.00 N ATOM 1303 CA GLY A 474 -0.422 10.319 1.484 1.00 0.00 C ATOM 1304 C GLY A 474 -1.024 9.658 0.277 1.00 0.00 C ATOM 1305 O GLY A 474 -0.283 9.170 -0.583 1.00 0.00 O ATOM 0 H GLY A 474 1.516 10.813 0.900 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -0.848 9.885 2.389 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -0.679 11.378 1.487 1.00 0.00 H new ATOM 1309 N PRO A 475 -2.352 9.663 0.155 1.00 0.00 N ATOM 1310 CA PRO A 475 -3.050 9.029 -0.960 1.00 0.00 C ATOM 1311 C PRO A 475 -2.648 9.609 -2.309 1.00 0.00 C ATOM 1312 O PRO A 475 -2.163 10.755 -2.390 1.00 0.00 O ATOM 1313 CB PRO A 475 -4.525 9.301 -0.677 1.00 0.00 C ATOM 1314 CG PRO A 475 -4.538 10.431 0.286 1.00 0.00 C ATOM 1315 CD PRO A 475 -3.288 10.302 1.092 1.00 0.00 C ATOM 0 HA PRO A 475 -2.810 7.968 -1.027 1.00 0.00 H new ATOM 0 HB2 PRO A 475 -5.060 9.557 -1.591 1.00 0.00 H new ATOM 0 HB3 PRO A 475 -5.014 8.421 -0.258 1.00 0.00 H new ATOM 0 HG2 PRO A 475 -4.568 11.387 -0.236 1.00 0.00 H new ATOM 0 HG3 PRO A 475 -5.420 10.388 0.925 1.00 0.00 H new ATOM 0 HD2 PRO A 475 -2.923 11.273 1.428 1.00 0.00 H new ATOM 0 HD3 PRO A 475 -3.444 9.694 1.983 1.00 0.00 H new ATOM 1323 N SER A 476 -2.817 8.800 -3.349 1.00 0.00 N ATOM 1324 CA SER A 476 -2.484 9.159 -4.723 1.00 0.00 C ATOM 1325 C SER A 476 -0.961 9.239 -4.950 1.00 0.00 C ATOM 1326 O SER A 476 -0.498 9.784 -5.954 1.00 0.00 O ATOM 1327 CB SER A 476 -3.184 10.464 -5.138 1.00 0.00 C ATOM 1328 OG SER A 476 -4.601 10.341 -5.003 1.00 0.00 O ATOM 0 H SER A 476 -3.197 7.858 -3.259 1.00 0.00 H new ATOM 0 HA SER A 476 -2.856 8.360 -5.364 1.00 0.00 H new ATOM 0 HB2 SER A 476 -2.825 11.288 -4.521 1.00 0.00 H new ATOM 0 HB3 SER A 476 -2.931 10.706 -6.170 1.00 0.00 H new ATOM 0 HG SER A 476 -5.029 11.181 -5.270 1.00 0.00 H new ATOM 1334 N MET A 477 -0.191 8.665 -4.050 1.00 0.00 N ATOM 1335 CA MET A 477 1.246 8.660 -4.197 1.00 0.00 C ATOM 1336 C MET A 477 1.783 7.237 -4.317 1.00 0.00 C ATOM 1337 O MET A 477 1.306 6.330 -3.618 1.00 0.00 O ATOM 1338 CB MET A 477 1.939 9.398 -3.044 1.00 0.00 C ATOM 1339 CG MET A 477 3.458 9.278 -3.081 1.00 0.00 C ATOM 1340 SD MET A 477 4.311 10.316 -1.868 1.00 0.00 S ATOM 1341 CE MET A 477 3.924 11.961 -2.473 1.00 0.00 C ATOM 0 H MET A 477 -0.536 8.198 -3.212 1.00 0.00 H new ATOM 0 HA MET A 477 1.474 9.194 -5.120 1.00 0.00 H new ATOM 0 HB2 MET A 477 1.663 10.452 -3.078 1.00 0.00 H new ATOM 0 HB3 MET A 477 1.573 9.003 -2.096 1.00 0.00 H new ATOM 0 HG2 MET A 477 3.734 8.237 -2.911 1.00 0.00 H new ATOM 0 HG3 MET A 477 3.808 9.541 -4.079 1.00 0.00 H new ATOM 0 HE1 MET A 477 4.620 12.681 -2.041 1.00 0.00 H new ATOM 0 HE2 MET A 477 4.011 11.979 -3.559 1.00 0.00 H new ATOM 0 HE3 MET A 477 2.906 12.224 -2.187 1.00 0.00 H new ATOM 1351 N PRO A 478 2.730 7.000 -5.250 1.00 0.00 N ATOM 1352 CA PRO A 478 3.385 5.716 -5.376 1.00 0.00 C ATOM 1353 C PRO A 478 4.531 5.589 -4.375 1.00 0.00 C ATOM 1354 O PRO A 478 5.444 6.438 -4.335 1.00 0.00 O ATOM 1355 CB PRO A 478 3.961 5.728 -6.798 1.00 0.00 C ATOM 1356 CG PRO A 478 3.617 7.059 -7.391 1.00 0.00 C ATOM 1357 CD PRO A 478 3.220 7.949 -6.262 1.00 0.00 C ATOM 0 HA PRO A 478 2.700 4.889 -5.189 1.00 0.00 H new ATOM 0 HB2 PRO A 478 5.041 5.580 -6.779 1.00 0.00 H new ATOM 0 HB3 PRO A 478 3.539 4.918 -7.393 1.00 0.00 H new ATOM 0 HG2 PRO A 478 4.470 7.474 -7.928 1.00 0.00 H new ATOM 0 HG3 PRO A 478 2.804 6.962 -8.110 1.00 0.00 H new ATOM 0 HD2 PRO A 478 4.063 8.533 -5.893 1.00 0.00 H new ATOM 0 HD3 PRO A 478 2.447 8.657 -6.559 1.00 0.00 H new ATOM 1365 N VAL A 479 4.497 4.543 -3.597 1.00 0.00 N ATOM 1366 CA VAL A 479 5.507 4.283 -2.596 1.00 0.00 C ATOM 1367 C VAL A 479 5.773 2.806 -2.510 1.00 0.00 C ATOM 1368 O VAL A 479 4.942 1.998 -2.920 1.00 0.00 O ATOM 1369 CB VAL A 479 5.116 4.807 -1.173 1.00 0.00 C ATOM 1370 CG1 VAL A 479 5.103 6.315 -1.119 1.00 0.00 C ATOM 1371 CG2 VAL A 479 3.762 4.271 -0.740 1.00 0.00 C ATOM 0 H VAL A 479 3.762 3.837 -3.636 1.00 0.00 H new ATOM 0 HA VAL A 479 6.399 4.824 -2.912 1.00 0.00 H new ATOM 0 HB VAL A 479 5.878 4.442 -0.484 1.00 0.00 H new ATOM 0 HG11 VAL A 479 4.827 6.641 -0.116 1.00 0.00 H new ATOM 0 HG12 VAL A 479 6.094 6.696 -1.365 1.00 0.00 H new ATOM 0 HG13 VAL A 479 4.378 6.699 -1.837 1.00 0.00 H new ATOM 0 HG21 VAL A 479 3.520 4.653 0.252 1.00 0.00 H new ATOM 0 HG22 VAL A 479 2.999 4.593 -1.449 1.00 0.00 H new ATOM 0 HG23 VAL A 479 3.794 3.182 -0.711 1.00 0.00 H new ATOM 1381 N GLU A 480 6.924 2.463 -2.031 1.00 0.00 N ATOM 1382 CA GLU A 480 7.270 1.102 -1.807 1.00 0.00 C ATOM 1383 C GLU A 480 7.214 0.819 -0.340 1.00 0.00 C ATOM 1384 O GLU A 480 7.838 1.536 0.465 1.00 0.00 O ATOM 1385 CB GLU A 480 8.665 0.768 -2.316 1.00 0.00 C ATOM 1386 CG GLU A 480 8.893 1.086 -3.764 1.00 0.00 C ATOM 1387 CD GLU A 480 10.148 0.468 -4.276 1.00 0.00 C ATOM 1388 OE1 GLU A 480 11.238 1.040 -4.084 1.00 0.00 O ATOM 1389 OE2 GLU A 480 10.074 -0.617 -4.864 1.00 0.00 O ATOM 0 H GLU A 480 7.656 3.128 -1.782 1.00 0.00 H new ATOM 0 HA GLU A 480 6.557 0.487 -2.356 1.00 0.00 H new ATOM 0 HB2 GLU A 480 9.396 1.313 -1.718 1.00 0.00 H new ATOM 0 HB3 GLU A 480 8.851 -0.294 -2.157 1.00 0.00 H new ATOM 0 HG2 GLU A 480 8.047 0.730 -4.352 1.00 0.00 H new ATOM 0 HG3 GLU A 480 8.940 2.167 -3.895 1.00 0.00 H new ATOM 1396 N ILE A 481 6.479 -0.189 0.016 1.00 0.00 N ATOM 1397 CA ILE A 481 6.405 -0.598 1.382 1.00 0.00 C ATOM 1398 C ILE A 481 7.347 -1.749 1.600 1.00 0.00 C ATOM 1399 O ILE A 481 7.880 -2.331 0.639 1.00 0.00 O ATOM 1400 CB ILE A 481 4.990 -1.046 1.823 1.00 0.00 C ATOM 1401 CG1 ILE A 481 4.524 -2.275 1.024 1.00 0.00 C ATOM 1402 CG2 ILE A 481 4.011 0.104 1.694 1.00 0.00 C ATOM 1403 CD1 ILE A 481 3.244 -2.889 1.536 1.00 0.00 C ATOM 0 H ILE A 481 5.918 -0.747 -0.628 1.00 0.00 H new ATOM 0 HA ILE A 481 6.672 0.274 1.980 1.00 0.00 H new ATOM 0 HB ILE A 481 5.031 -1.340 2.872 1.00 0.00 H new ATOM 0 HG12 ILE A 481 4.386 -1.987 -0.018 1.00 0.00 H new ATOM 0 HG13 ILE A 481 5.311 -3.029 1.045 1.00 0.00 H new ATOM 0 HG21 ILE A 481 3.020 -0.225 2.007 1.00 0.00 H new ATOM 0 HG22 ILE A 481 4.336 0.931 2.326 1.00 0.00 H new ATOM 0 HG23 ILE A 481 3.972 0.434 0.656 1.00 0.00 H new ATOM 0 HD11 ILE A 481 2.982 -3.750 0.921 1.00 0.00 H new ATOM 0 HD12 ILE A 481 3.382 -3.210 2.569 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.443 -2.152 1.489 1.00 0.00 H new ATOM 1415 N THR A 482 7.518 -2.085 2.831 1.00 0.00 N ATOM 1416 CA THR A 482 8.389 -3.132 3.265 1.00 0.00 C ATOM 1417 C THR A 482 7.811 -3.703 4.543 1.00 0.00 C ATOM 1418 O THR A 482 6.903 -3.095 5.122 1.00 0.00 O ATOM 1419 CB THR A 482 9.777 -2.547 3.565 1.00 0.00 C ATOM 1420 OG1 THR A 482 9.601 -1.244 4.107 1.00 0.00 O ATOM 1421 CG2 THR A 482 10.661 -2.468 2.341 1.00 0.00 C ATOM 0 H THR A 482 7.035 -1.620 3.600 1.00 0.00 H new ATOM 0 HA THR A 482 8.480 -3.900 2.497 1.00 0.00 H new ATOM 0 HB THR A 482 10.277 -3.211 4.270 1.00 0.00 H new ATOM 0 HG1 THR A 482 10.048 -0.588 3.533 1.00 0.00 H new ATOM 0 HG21 THR A 482 11.628 -2.047 2.617 1.00 0.00 H new ATOM 0 HG22 THR A 482 10.805 -3.468 1.931 1.00 0.00 H new ATOM 0 HG23 THR A 482 10.189 -1.833 1.592 1.00 0.00 H new ATOM 1429 N GLY A 483 8.309 -4.833 4.976 1.00 0.00 N ATOM 1430 CA GLY A 483 7.872 -5.407 6.230 1.00 0.00 C ATOM 1431 C GLY A 483 6.677 -6.317 6.102 1.00 0.00 C ATOM 1432 O GLY A 483 6.045 -6.670 7.103 1.00 0.00 O ATOM 0 H GLY A 483 9.017 -5.376 4.482 1.00 0.00 H new ATOM 0 HA2 GLY A 483 8.698 -5.967 6.669 1.00 0.00 H new ATOM 0 HA3 GLY A 483 7.630 -4.601 6.922 1.00 0.00 H new ATOM 1436 N LEU A 484 6.353 -6.707 4.881 1.00 0.00 N ATOM 1437 CA LEU A 484 5.273 -7.659 4.663 1.00 0.00 C ATOM 1438 C LEU A 484 5.755 -9.046 5.088 1.00 0.00 C ATOM 1439 O LEU A 484 4.991 -9.862 5.592 1.00 0.00 O ATOM 1440 CB LEU A 484 4.855 -7.672 3.183 1.00 0.00 C ATOM 1441 CG LEU A 484 3.693 -8.609 2.816 1.00 0.00 C ATOM 1442 CD1 LEU A 484 2.419 -8.196 3.522 1.00 0.00 C ATOM 1443 CD2 LEU A 484 3.485 -8.643 1.317 1.00 0.00 C ATOM 0 H LEU A 484 6.816 -6.384 4.032 1.00 0.00 H new ATOM 0 HA LEU A 484 4.404 -7.369 5.254 1.00 0.00 H new ATOM 0 HB2 LEU A 484 4.581 -6.657 2.895 1.00 0.00 H new ATOM 0 HB3 LEU A 484 5.722 -7.950 2.584 1.00 0.00 H new ATOM 0 HG LEU A 484 3.953 -9.614 3.149 1.00 0.00 H new ATOM 0 HD11 LEU A 484 1.613 -8.875 3.245 1.00 0.00 H new ATOM 0 HD12 LEU A 484 2.572 -8.235 4.601 1.00 0.00 H new ATOM 0 HD13 LEU A 484 2.154 -7.180 3.230 1.00 0.00 H new ATOM 0 HD21 LEU A 484 2.658 -9.312 1.080 1.00 0.00 H new ATOM 0 HD22 LEU A 484 3.254 -7.640 0.959 1.00 0.00 H new ATOM 0 HD23 LEU A 484 4.393 -9.002 0.832 1.00 0.00 H new ATOM 1455 N HIS A 485 7.063 -9.250 4.887 1.00 0.00 N ATOM 1456 CA HIS A 485 7.806 -10.483 5.197 1.00 0.00 C ATOM 1457 C HIS A 485 7.340 -11.621 4.267 1.00 0.00 C ATOM 1458 O HIS A 485 7.599 -12.793 4.489 1.00 0.00 O ATOM 1459 CB HIS A 485 7.656 -10.818 6.708 1.00 0.00 C ATOM 1460 CG HIS A 485 8.558 -11.902 7.256 1.00 0.00 C ATOM 1461 ND1 HIS A 485 9.822 -11.670 7.765 1.00 0.00 N ATOM 1462 CD2 HIS A 485 8.341 -13.232 7.412 1.00 0.00 C ATOM 1463 CE1 HIS A 485 10.314 -12.827 8.201 1.00 0.00 C ATOM 1464 NE2 HIS A 485 9.458 -13.811 8.010 1.00 0.00 N ATOM 0 H HIS A 485 7.662 -8.528 4.486 1.00 0.00 H new ATOM 0 HA HIS A 485 8.871 -10.346 5.011 1.00 0.00 H new ATOM 0 HB2 HIS A 485 7.834 -9.906 7.278 1.00 0.00 H new ATOM 0 HB3 HIS A 485 6.622 -11.111 6.891 1.00 0.00 H new ATOM 0 HD2 HIS A 485 7.445 -13.758 7.119 1.00 0.00 H new ATOM 0 HE1 HIS A 485 11.288 -12.944 8.653 1.00 0.00 H new ATOM 0 HE2 HIS A 485 9.587 -14.794 8.250 1.00 0.00 H new ATOM 1472 N ASP A 486 6.737 -11.225 3.176 1.00 0.00 N ATOM 1473 CA ASP A 486 6.298 -12.126 2.143 1.00 0.00 C ATOM 1474 C ASP A 486 6.418 -11.345 0.867 1.00 0.00 C ATOM 1475 O ASP A 486 6.775 -10.160 0.917 1.00 0.00 O ATOM 1476 CB ASP A 486 4.856 -12.577 2.353 1.00 0.00 C ATOM 1477 CG ASP A 486 4.531 -13.863 1.607 1.00 0.00 C ATOM 1478 OD1 ASP A 486 4.219 -13.828 0.385 1.00 0.00 O ATOM 1479 OD2 ASP A 486 4.591 -14.935 2.224 1.00 0.00 O ATOM 0 H ASP A 486 6.533 -10.246 2.977 1.00 0.00 H new ATOM 0 HA ASP A 486 6.898 -13.036 2.137 1.00 0.00 H new ATOM 0 HB2 ASP A 486 4.676 -12.724 3.418 1.00 0.00 H new ATOM 0 HB3 ASP A 486 4.181 -11.788 2.022 1.00 0.00 H new ATOM 1484 N VAL A 487 6.082 -11.926 -0.237 1.00 0.00 N ATOM 1485 CA VAL A 487 6.298 -11.283 -1.503 1.00 0.00 C ATOM 1486 C VAL A 487 4.961 -11.118 -2.216 1.00 0.00 C ATOM 1487 O VAL A 487 4.327 -12.107 -2.600 1.00 0.00 O ATOM 1488 CB VAL A 487 7.285 -12.084 -2.404 1.00 0.00 C ATOM 1489 CG1 VAL A 487 7.668 -11.281 -3.645 1.00 0.00 C ATOM 1490 CG2 VAL A 487 8.530 -12.484 -1.626 1.00 0.00 C ATOM 0 H VAL A 487 5.654 -12.850 -0.294 1.00 0.00 H new ATOM 0 HA VAL A 487 6.748 -10.308 -1.315 1.00 0.00 H new ATOM 0 HB VAL A 487 6.776 -12.992 -2.727 1.00 0.00 H new ATOM 0 HG11 VAL A 487 8.358 -11.863 -4.256 1.00 0.00 H new ATOM 0 HG12 VAL A 487 6.772 -11.055 -4.223 1.00 0.00 H new ATOM 0 HG13 VAL A 487 8.148 -10.350 -3.342 1.00 0.00 H new ATOM 0 HG21 VAL A 487 9.203 -13.042 -2.278 1.00 0.00 H new ATOM 0 HG22 VAL A 487 9.036 -11.589 -1.263 1.00 0.00 H new ATOM 0 HG23 VAL A 487 8.245 -13.108 -0.779 1.00 0.00 H new ATOM 1500 N PRO A 488 4.509 -9.882 -2.396 1.00 0.00 N ATOM 1501 CA PRO A 488 3.244 -9.595 -3.048 1.00 0.00 C ATOM 1502 C PRO A 488 3.371 -9.657 -4.568 1.00 0.00 C ATOM 1503 O PRO A 488 4.468 -9.878 -5.108 1.00 0.00 O ATOM 1504 CB PRO A 488 2.928 -8.180 -2.589 1.00 0.00 C ATOM 1505 CG PRO A 488 4.254 -7.545 -2.363 1.00 0.00 C ATOM 1506 CD PRO A 488 5.215 -8.648 -1.999 1.00 0.00 C ATOM 0 HA PRO A 488 2.467 -10.315 -2.793 1.00 0.00 H new ATOM 0 HB2 PRO A 488 2.354 -7.639 -3.342 1.00 0.00 H new ATOM 0 HB3 PRO A 488 2.332 -8.185 -1.677 1.00 0.00 H new ATOM 0 HG2 PRO A 488 4.589 -7.022 -3.259 1.00 0.00 H new ATOM 0 HG3 PRO A 488 4.196 -6.805 -1.565 1.00 0.00 H new ATOM 0 HD2 PRO A 488 6.162 -8.543 -2.528 1.00 0.00 H new ATOM 0 HD3 PRO A 488 5.442 -8.644 -0.933 1.00 0.00 H new ATOM 1514 N GLN A 489 2.274 -9.507 -5.252 1.00 0.00 N ATOM 1515 CA GLN A 489 2.273 -9.534 -6.649 1.00 0.00 C ATOM 1516 C GLN A 489 1.960 -8.141 -7.141 1.00 0.00 C ATOM 1517 O GLN A 489 1.258 -7.375 -6.471 1.00 0.00 O ATOM 1518 CB GLN A 489 1.202 -10.481 -7.133 1.00 0.00 C ATOM 1519 CG GLN A 489 1.374 -10.880 -8.557 1.00 0.00 C ATOM 1520 CD GLN A 489 0.267 -11.776 -9.079 1.00 0.00 C ATOM 1521 OE1 GLN A 489 -0.728 -11.303 -9.631 1.00 0.00 O ATOM 1522 NE2 GLN A 489 0.407 -13.058 -8.886 1.00 0.00 N ATOM 0 H GLN A 489 1.356 -9.362 -4.832 1.00 0.00 H new ATOM 0 HA GLN A 489 3.242 -9.866 -7.023 1.00 0.00 H new ATOM 0 HB2 GLN A 489 1.206 -11.374 -6.509 1.00 0.00 H new ATOM 0 HB3 GLN A 489 0.227 -10.011 -7.009 1.00 0.00 H new ATOM 0 HG2 GLN A 489 1.423 -9.982 -9.173 1.00 0.00 H new ATOM 0 HG3 GLN A 489 2.328 -11.395 -8.668 1.00 0.00 H new ATOM 0 HE21 GLN A 489 1.244 -13.416 -8.426 1.00 0.00 H new ATOM 0 HE22 GLN A 489 -0.320 -13.703 -9.196 1.00 0.00 H new ATOM 1531 N ALA A 490 2.507 -7.806 -8.252 1.00 0.00 N ATOM 1532 CA ALA A 490 2.225 -6.556 -8.908 1.00 0.00 C ATOM 1533 C ALA A 490 0.811 -6.585 -9.452 1.00 0.00 C ATOM 1534 O ALA A 490 0.367 -7.611 -9.968 1.00 0.00 O ATOM 1535 CB ALA A 490 3.201 -6.345 -10.038 1.00 0.00 C ATOM 0 H ALA A 490 3.176 -8.394 -8.750 1.00 0.00 H new ATOM 0 HA ALA A 490 2.323 -5.738 -8.194 1.00 0.00 H new ATOM 0 HB1 ALA A 490 2.985 -5.398 -10.533 1.00 0.00 H new ATOM 0 HB2 ALA A 490 4.217 -6.325 -9.643 1.00 0.00 H new ATOM 0 HB3 ALA A 490 3.108 -7.159 -10.756 1.00 0.00 H new ATOM 1541 N GLY A 491 0.102 -5.496 -9.317 1.00 0.00 N ATOM 1542 CA GLY A 491 -1.256 -5.433 -9.799 1.00 0.00 C ATOM 1543 C GLY A 491 -2.248 -5.934 -8.776 1.00 0.00 C ATOM 1544 O GLY A 491 -3.455 -5.931 -9.028 1.00 0.00 O ATOM 0 H GLY A 491 0.440 -4.640 -8.878 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -1.498 -4.404 -10.064 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -1.345 -6.026 -10.709 1.00 0.00 H new ATOM 1548 N ASP A 492 -1.746 -6.351 -7.621 1.00 0.00 N ATOM 1549 CA ASP A 492 -2.590 -6.869 -6.564 1.00 0.00 C ATOM 1550 C ASP A 492 -3.134 -5.693 -5.758 1.00 0.00 C ATOM 1551 O ASP A 492 -2.995 -4.530 -6.165 1.00 0.00 O ATOM 1552 CB ASP A 492 -1.796 -7.795 -5.648 1.00 0.00 C ATOM 1553 CG ASP A 492 -2.664 -8.797 -4.924 1.00 0.00 C ATOM 1554 OD1 ASP A 492 -3.206 -8.473 -3.869 1.00 0.00 O ATOM 1555 OD2 ASP A 492 -2.838 -9.914 -5.417 1.00 0.00 O ATOM 0 H ASP A 492 -0.751 -6.338 -7.396 1.00 0.00 H new ATOM 0 HA ASP A 492 -3.409 -7.440 -7.001 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -1.050 -8.328 -6.238 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -1.255 -7.196 -4.916 1.00 0.00 H new ATOM 1560 N ARG A 493 -3.663 -5.956 -4.614 1.00 0.00 N ATOM 1561 CA ARG A 493 -4.354 -4.961 -3.884 1.00 0.00 C ATOM 1562 C ARG A 493 -4.032 -5.024 -2.417 1.00 0.00 C ATOM 1563 O ARG A 493 -3.753 -6.101 -1.866 1.00 0.00 O ATOM 1564 CB ARG A 493 -5.859 -5.103 -4.124 1.00 0.00 C ATOM 1565 CG ARG A 493 -6.569 -6.319 -3.476 1.00 0.00 C ATOM 1566 CD ARG A 493 -6.083 -7.663 -4.019 1.00 0.00 C ATOM 1567 NE ARG A 493 -6.846 -8.787 -3.474 1.00 0.00 N ATOM 1568 CZ ARG A 493 -6.402 -10.040 -3.313 1.00 0.00 C ATOM 1569 NH1 ARG A 493 -5.133 -10.346 -3.531 1.00 0.00 N ATOM 1570 NH2 ARG A 493 -7.238 -10.980 -2.899 1.00 0.00 N ATOM 0 H ARG A 493 -3.627 -6.869 -4.161 1.00 0.00 H new ATOM 0 HA ARG A 493 -4.027 -3.983 -4.237 1.00 0.00 H new ATOM 0 HB2 ARG A 493 -6.345 -4.197 -3.764 1.00 0.00 H new ATOM 0 HB3 ARG A 493 -6.027 -5.148 -5.200 1.00 0.00 H new ATOM 0 HG2 ARG A 493 -6.410 -6.292 -2.398 1.00 0.00 H new ATOM 0 HG3 ARG A 493 -7.643 -6.235 -3.642 1.00 0.00 H new ATOM 0 HD2 ARG A 493 -6.163 -7.664 -5.106 1.00 0.00 H new ATOM 0 HD3 ARG A 493 -5.028 -7.791 -3.777 1.00 0.00 H new ATOM 0 HE ARG A 493 -7.807 -8.598 -3.190 1.00 0.00 H new ATOM 0 HH11 ARG A 493 -4.477 -9.623 -3.826 1.00 0.00 H new ATOM 0 HH12 ARG A 493 -4.811 -11.305 -3.404 1.00 0.00 H new ATOM 0 HH21 ARG A 493 -8.212 -10.747 -2.705 1.00 0.00 H new ATOM 0 HH22 ARG A 493 -6.908 -11.937 -2.774 1.00 0.00 H new ATOM 1584 N PHE A 494 -4.065 -3.892 -1.788 1.00 0.00 N ATOM 1585 CA PHE A 494 -3.815 -3.827 -0.383 1.00 0.00 C ATOM 1586 C PHE A 494 -4.758 -2.862 0.255 1.00 0.00 C ATOM 1587 O PHE A 494 -5.251 -1.947 -0.386 1.00 0.00 O ATOM 1588 CB PHE A 494 -2.370 -3.404 -0.071 1.00 0.00 C ATOM 1589 CG PHE A 494 -2.053 -1.944 -0.276 1.00 0.00 C ATOM 1590 CD1 PHE A 494 -1.916 -1.410 -1.539 1.00 0.00 C ATOM 1591 CD2 PHE A 494 -1.902 -1.106 0.822 1.00 0.00 C ATOM 1592 CE1 PHE A 494 -1.631 -0.071 -1.704 1.00 0.00 C ATOM 1593 CE2 PHE A 494 -1.617 0.226 0.659 1.00 0.00 C ATOM 1594 CZ PHE A 494 -1.485 0.745 -0.603 1.00 0.00 C ATOM 0 H PHE A 494 -4.264 -2.994 -2.229 1.00 0.00 H new ATOM 0 HA PHE A 494 -3.967 -4.828 0.020 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -2.152 -3.661 0.966 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -1.697 -3.993 -0.694 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -2.033 -2.044 -2.405 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -2.011 -1.509 1.818 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -1.522 0.339 -2.697 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -1.497 0.864 1.522 1.00 0.00 H new ATOM 0 HZ PHE A 494 -1.266 1.794 -0.735 1.00 0.00 H new ATOM 1604 N MET A 495 -4.979 -3.036 1.491 1.00 0.00 N ATOM 1605 CA MET A 495 -5.790 -2.119 2.233 1.00 0.00 C ATOM 1606 C MET A 495 -4.939 -1.531 3.312 1.00 0.00 C ATOM 1607 O MET A 495 -4.263 -2.259 4.041 1.00 0.00 O ATOM 1608 CB MET A 495 -7.032 -2.785 2.834 1.00 0.00 C ATOM 1609 CG MET A 495 -7.951 -1.795 3.549 1.00 0.00 C ATOM 1610 SD MET A 495 -9.422 -2.561 4.249 1.00 0.00 S ATOM 1611 CE MET A 495 -10.253 -1.121 4.928 1.00 0.00 C ATOM 0 H MET A 495 -4.610 -3.815 2.036 1.00 0.00 H new ATOM 0 HA MET A 495 -6.158 -1.346 1.558 1.00 0.00 H new ATOM 0 HB2 MET A 495 -7.590 -3.284 2.041 1.00 0.00 H new ATOM 0 HB3 MET A 495 -6.720 -3.556 3.538 1.00 0.00 H new ATOM 0 HG2 MET A 495 -7.393 -1.303 4.345 1.00 0.00 H new ATOM 0 HG3 MET A 495 -8.254 -1.019 2.846 1.00 0.00 H new ATOM 0 HE1 MET A 495 -11.187 -1.428 5.399 1.00 0.00 H new ATOM 0 HE2 MET A 495 -9.611 -0.647 5.670 1.00 0.00 H new ATOM 0 HE3 MET A 495 -10.467 -0.413 4.127 1.00 0.00 H new ATOM 1621 N VAL A 496 -4.909 -0.228 3.379 1.00 0.00 N ATOM 1622 CA VAL A 496 -4.129 0.428 4.376 1.00 0.00 C ATOM 1623 C VAL A 496 -5.071 0.884 5.484 1.00 0.00 C ATOM 1624 O VAL A 496 -6.201 1.334 5.201 1.00 0.00 O ATOM 1625 CB VAL A 496 -3.309 1.644 3.794 1.00 0.00 C ATOM 1626 CG1 VAL A 496 -4.159 2.885 3.548 1.00 0.00 C ATOM 1627 CG2 VAL A 496 -2.104 1.951 4.660 1.00 0.00 C ATOM 0 H VAL A 496 -5.418 0.395 2.752 1.00 0.00 H new ATOM 0 HA VAL A 496 -3.389 -0.271 4.767 1.00 0.00 H new ATOM 0 HB VAL A 496 -2.953 1.334 2.812 1.00 0.00 H new ATOM 0 HG11 VAL A 496 -3.532 3.682 3.148 1.00 0.00 H new ATOM 0 HG12 VAL A 496 -4.947 2.650 2.833 1.00 0.00 H new ATOM 0 HG13 VAL A 496 -4.606 3.212 4.487 1.00 0.00 H new ATOM 0 HG21 VAL A 496 -1.557 2.793 4.236 1.00 0.00 H new ATOM 0 HG22 VAL A 496 -2.435 2.203 5.668 1.00 0.00 H new ATOM 0 HG23 VAL A 496 -1.453 1.078 4.700 1.00 0.00 H new ATOM 1684 N GLU A 500 -4.399 2.935 15.340 1.00 0.00 N ATOM 1685 CA GLU A 500 -5.345 3.608 16.228 1.00 0.00 C ATOM 1686 C GLU A 500 -6.711 3.734 15.592 1.00 0.00 C ATOM 1687 O GLU A 500 -7.724 3.641 16.257 1.00 0.00 O ATOM 1688 CB GLU A 500 -4.864 5.001 16.607 1.00 0.00 C ATOM 1689 CG GLU A 500 -4.379 5.828 15.415 1.00 0.00 C ATOM 1690 CD GLU A 500 -4.681 7.303 15.515 1.00 0.00 C ATOM 1691 OE1 GLU A 500 -4.169 7.982 16.417 1.00 0.00 O ATOM 1692 OE2 GLU A 500 -5.468 7.812 14.684 1.00 0.00 O ATOM 0 HA GLU A 500 -5.414 2.990 17.123 1.00 0.00 H new ATOM 0 HB2 GLU A 500 -5.676 5.534 17.102 1.00 0.00 H new ATOM 0 HB3 GLU A 500 -4.053 4.912 17.330 1.00 0.00 H new ATOM 0 HG2 GLU A 500 -3.302 5.696 15.311 1.00 0.00 H new ATOM 0 HG3 GLU A 500 -4.837 5.437 14.507 1.00 0.00 H new ATOM 1699 N LYS A 501 -6.719 3.922 14.303 1.00 0.00 N ATOM 1700 CA LYS A 501 -7.929 4.149 13.562 1.00 0.00 C ATOM 1701 C LYS A 501 -8.729 2.881 13.454 1.00 0.00 C ATOM 1702 O LYS A 501 -9.957 2.890 13.558 1.00 0.00 O ATOM 1703 CB LYS A 501 -7.587 4.723 12.210 1.00 0.00 C ATOM 1704 CG LYS A 501 -6.907 6.083 12.322 1.00 0.00 C ATOM 1705 CD LYS A 501 -6.789 6.823 10.996 1.00 0.00 C ATOM 1706 CE LYS A 501 -5.786 7.987 11.098 1.00 0.00 C ATOM 1707 NZ LYS A 501 -6.041 8.878 12.257 1.00 0.00 N ATOM 0 H LYS A 501 -5.876 3.922 13.729 1.00 0.00 H new ATOM 0 HA LYS A 501 -8.553 4.871 14.088 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -6.932 4.033 11.678 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -8.496 4.820 11.617 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -7.466 6.702 13.024 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -5.910 5.947 12.741 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -6.470 6.131 10.217 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -7.766 7.206 10.701 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -4.777 7.583 11.174 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -5.826 8.574 10.181 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -5.746 9.847 12.021 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -7.056 8.871 12.484 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -5.500 8.542 13.079 1.00 0.00 H new ATOM 1721 N LYS A 502 -8.024 1.807 13.273 1.00 0.00 N ATOM 1722 CA LYS A 502 -8.589 0.478 13.260 1.00 0.00 C ATOM 1723 C LYS A 502 -9.243 0.215 14.609 1.00 0.00 C ATOM 1724 O LYS A 502 -10.399 -0.199 14.681 1.00 0.00 O ATOM 1725 CB LYS A 502 -7.477 -0.551 13.008 1.00 0.00 C ATOM 1726 CG LYS A 502 -7.941 -1.997 12.947 1.00 0.00 C ATOM 1727 CD LYS A 502 -8.847 -2.250 11.759 1.00 0.00 C ATOM 1728 CE LYS A 502 -9.296 -3.691 11.730 1.00 0.00 C ATOM 1729 NZ LYS A 502 -10.106 -3.995 10.532 1.00 0.00 N ATOM 0 H LYS A 502 -7.015 1.823 13.126 1.00 0.00 H new ATOM 0 HA LYS A 502 -9.332 0.394 12.467 1.00 0.00 H new ATOM 0 HB2 LYS A 502 -6.981 -0.305 12.069 1.00 0.00 H new ATOM 0 HB3 LYS A 502 -6.731 -0.458 13.797 1.00 0.00 H new ATOM 0 HG2 LYS A 502 -7.074 -2.654 12.889 1.00 0.00 H new ATOM 0 HG3 LYS A 502 -8.470 -2.248 13.867 1.00 0.00 H new ATOM 0 HD2 LYS A 502 -9.716 -1.594 11.811 1.00 0.00 H new ATOM 0 HD3 LYS A 502 -8.321 -2.009 10.836 1.00 0.00 H new ATOM 0 HE2 LYS A 502 -8.423 -4.343 11.752 1.00 0.00 H new ATOM 0 HE3 LYS A 502 -9.878 -3.907 12.626 1.00 0.00 H new ATOM 0 HZ1 LYS A 502 -10.393 -4.994 10.552 1.00 0.00 H new ATOM 0 HZ2 LYS A 502 -10.953 -3.391 10.523 1.00 0.00 H new ATOM 0 HZ3 LYS A 502 -9.543 -3.814 9.677 1.00 0.00 H new ATOM 1743 N ALA A 503 -8.516 0.542 15.671 1.00 0.00 N ATOM 1744 CA ALA A 503 -8.997 0.345 17.024 1.00 0.00 C ATOM 1745 C ALA A 503 -10.244 1.202 17.271 1.00 0.00 C ATOM 1746 O ALA A 503 -11.255 0.737 17.815 1.00 0.00 O ATOM 1747 CB ALA A 503 -7.894 0.715 17.992 1.00 0.00 C ATOM 0 H ALA A 503 -7.582 0.949 15.614 1.00 0.00 H new ATOM 0 HA ALA A 503 -9.272 -0.699 17.172 1.00 0.00 H new ATOM 0 HB1 ALA A 503 -8.244 0.571 19.014 1.00 0.00 H new ATOM 0 HB2 ALA A 503 -7.025 0.082 17.813 1.00 0.00 H new ATOM 0 HB3 ALA A 503 -7.618 1.759 17.847 1.00 0.00 H new ATOM 1753 N ARG A 504 -10.157 2.441 16.837 1.00 0.00 N ATOM 1754 CA ARG A 504 -11.209 3.446 16.936 1.00 0.00 C ATOM 1755 C ARG A 504 -12.483 3.002 16.227 1.00 0.00 C ATOM 1756 O ARG A 504 -13.591 3.256 16.711 1.00 0.00 O ATOM 1757 CB ARG A 504 -10.657 4.742 16.348 1.00 0.00 C ATOM 1758 CG ARG A 504 -11.557 5.958 16.381 1.00 0.00 C ATOM 1759 CD ARG A 504 -10.732 7.196 16.065 1.00 0.00 C ATOM 1760 NE ARG A 504 -9.601 7.308 17.012 1.00 0.00 N ATOM 1761 CZ ARG A 504 -8.328 7.589 16.703 1.00 0.00 C ATOM 1762 NH1 ARG A 504 -8.000 7.971 15.473 1.00 0.00 N ATOM 1763 NH2 ARG A 504 -7.385 7.502 17.647 1.00 0.00 N ATOM 0 H ARG A 504 -9.315 2.797 16.384 1.00 0.00 H new ATOM 0 HA ARG A 504 -11.490 3.595 17.979 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -9.738 4.988 16.879 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -10.385 4.552 15.310 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -12.364 5.849 15.656 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -12.021 6.056 17.362 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -10.357 7.141 15.043 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -11.358 8.086 16.128 1.00 0.00 H new ATOM 0 HE ARG A 504 -9.811 7.156 17.998 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -8.720 8.052 14.755 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -7.028 8.183 15.247 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -7.637 7.223 18.595 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -6.414 7.714 17.419 1.00 0.00 H new ATOM 1777 N GLN A 505 -12.315 2.308 15.124 1.00 0.00 N ATOM 1778 CA GLN A 505 -13.421 1.829 14.319 1.00 0.00 C ATOM 1779 C GLN A 505 -14.062 0.603 15.011 1.00 0.00 C ATOM 1780 O GLN A 505 -15.272 0.416 14.970 1.00 0.00 O ATOM 1781 CB GLN A 505 -12.872 1.448 12.929 1.00 0.00 C ATOM 1782 CG GLN A 505 -13.810 1.673 11.735 1.00 0.00 C ATOM 1783 CD GLN A 505 -15.094 0.878 11.765 1.00 0.00 C ATOM 1784 OE1 GLN A 505 -16.118 1.335 12.281 1.00 0.00 O ATOM 1785 NE2 GLN A 505 -15.055 -0.307 11.226 1.00 0.00 N ATOM 0 H GLN A 505 -11.398 2.057 14.755 1.00 0.00 H new ATOM 0 HA GLN A 505 -14.185 2.598 14.209 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -11.958 2.016 12.756 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -12.593 0.394 12.950 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -14.059 2.733 11.684 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -13.271 1.428 10.820 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -14.189 -0.649 10.809 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -15.890 -0.893 11.221 1.00 0.00 H new ATOM 1794 N ILE A 506 -13.236 -0.196 15.677 1.00 0.00 N ATOM 1795 CA ILE A 506 -13.700 -1.414 16.340 1.00 0.00 C ATOM 1796 C ILE A 506 -14.355 -1.126 17.710 1.00 0.00 C ATOM 1797 O ILE A 506 -15.498 -1.545 17.959 1.00 0.00 O ATOM 1798 CB ILE A 506 -12.546 -2.461 16.497 1.00 0.00 C ATOM 1799 CG1 ILE A 506 -11.995 -2.898 15.119 1.00 0.00 C ATOM 1800 CG2 ILE A 506 -12.991 -3.680 17.306 1.00 0.00 C ATOM 1801 CD1 ILE A 506 -13.021 -3.548 14.198 1.00 0.00 C ATOM 0 H ILE A 506 -12.236 -0.023 15.774 1.00 0.00 H new ATOM 0 HA ILE A 506 -14.466 -1.840 15.692 1.00 0.00 H new ATOM 0 HB ILE A 506 -11.744 -1.970 17.048 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -11.578 -2.025 14.617 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -11.174 -3.598 15.277 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -12.162 -4.382 17.392 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -13.302 -3.362 18.301 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -13.827 -4.166 16.802 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -12.544 -3.821 13.257 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -13.422 -4.443 14.674 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -13.832 -2.846 14.004 1.00 0.00 H new ATOM 1813 N GLY A 507 -13.657 -0.432 18.590 1.00 0.00 N ATOM 1814 CA GLY A 507 -14.238 -0.179 19.899 1.00 0.00 C ATOM 1815 C GLY A 507 -13.458 0.782 20.772 1.00 0.00 C ATOM 1816 O GLY A 507 -13.750 0.923 21.960 1.00 0.00 O ATOM 0 H GLY A 507 -12.725 -0.047 18.435 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -15.245 0.214 19.763 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -14.335 -1.128 20.426 1.00 0.00 H new