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 440 GLN : amide:sc= 0.825 K(o=1.9,f=1.2) USER MOD Set 1.2: A 476 SER OG : rot -19:sc= 1.05 USER MOD Single : A 421 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 LYS NZ :NH3+ -159:sc= 2.33 (180deg=1.68) USER MOD Single : A 429 LYS NZ :NH3+ 159:sc= -0.0195 (180deg=-0.157) USER MOD Single : A 436 THR OG1 : rot 180:sc= 0 USER MOD Single : A 443 THR OG1 : rot -170:sc= -0.084 USER MOD Single : A 445 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 454 THR OG1 : rot 180:sc= 0 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 164:sc= -5.04! (180deg=-5.84!) USER MOD Single : A 464 ASN : amide:sc= 1.02 K(o=1,f=-6.9!) USER MOD Single : A 466 SER OG : rot 180:sc= -0.157 USER MOD Single : A 471 LYS NZ :NH3+ 138:sc= 0.126 (180deg=-1.89!) USER MOD Single : A 477 MET CE :methyl -142:sc= 0 (180deg=-1.61!) USER MOD Single : A 482 THR OG1 : rot -80:sc= 0.965 USER MOD Single : A 485 HIS : no HD1:sc= -0.124 X(o=-0.12,f=0) USER MOD Single : A 489 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 495 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 501 LYS NZ :NH3+ 178:sc= 0.896 (180deg=0.893) USER MOD Single : A 502 LYS NZ :NH3+ -114:sc= 0.802 (180deg=0) USER MOD Single : A 505 GLN :FLIP amide:sc= -0.522 F(o=-2.2,f=-0.52) USER MOD ----------------------------------------------------------------- ATOM 470 N VAL A 419 -9.093 0.319 -1.106 1.00 0.00 N ATOM 471 CA VAL A 419 -7.880 -0.457 -1.274 1.00 0.00 C ATOM 472 C VAL A 419 -6.998 0.217 -2.306 1.00 0.00 C ATOM 473 O VAL A 419 -7.492 0.972 -3.141 1.00 0.00 O ATOM 474 CB VAL A 419 -8.144 -1.943 -1.706 1.00 0.00 C ATOM 475 CG1 VAL A 419 -8.814 -2.748 -0.606 1.00 0.00 C ATOM 476 CG2 VAL A 419 -8.960 -1.997 -2.973 1.00 0.00 C ATOM 0 HA VAL A 419 -7.390 -0.496 -0.301 1.00 0.00 H new ATOM 0 HB VAL A 419 -7.172 -2.398 -1.896 1.00 0.00 H new ATOM 0 HG11 VAL A 419 -8.977 -3.769 -0.950 1.00 0.00 H new ATOM 0 HG12 VAL A 419 -8.175 -2.760 0.277 1.00 0.00 H new ATOM 0 HG13 VAL A 419 -9.772 -2.293 -0.354 1.00 0.00 H new ATOM 0 HG21 VAL A 419 -9.130 -3.037 -3.252 1.00 0.00 H new ATOM 0 HG22 VAL A 419 -9.918 -1.504 -2.810 1.00 0.00 H new ATOM 0 HG23 VAL A 419 -8.422 -1.489 -3.774 1.00 0.00 H new ATOM 486 N GLY A 420 -5.725 -0.047 -2.241 1.00 0.00 N ATOM 487 CA GLY A 420 -4.787 0.525 -3.167 1.00 0.00 C ATOM 488 C GLY A 420 -4.228 -0.546 -4.051 1.00 0.00 C ATOM 489 O GLY A 420 -4.328 -1.731 -3.717 1.00 0.00 O ATOM 0 H GLY A 420 -5.307 -0.665 -1.545 1.00 0.00 H new ATOM 0 HA2 GLY A 420 -5.278 1.288 -3.771 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -3.981 1.018 -2.624 1.00 0.00 H new ATOM 493 N THR A 421 -3.645 -0.171 -5.142 1.00 0.00 N ATOM 494 CA THR A 421 -3.171 -1.135 -6.087 1.00 0.00 C ATOM 495 C THR A 421 -1.663 -1.173 -6.052 1.00 0.00 C ATOM 496 O THR A 421 -1.011 -0.124 -5.915 1.00 0.00 O ATOM 497 CB THR A 421 -3.605 -0.753 -7.507 1.00 0.00 C ATOM 498 OG1 THR A 421 -4.868 -0.074 -7.441 1.00 0.00 O ATOM 499 CG2 THR A 421 -3.774 -2.007 -8.347 1.00 0.00 C ATOM 0 H THR A 421 -3.484 0.801 -5.404 1.00 0.00 H new ATOM 0 HA THR A 421 -3.588 -2.107 -5.824 1.00 0.00 H new ATOM 0 HB THR A 421 -2.848 -0.110 -7.955 1.00 0.00 H new ATOM 0 HG1 THR A 421 -5.153 0.176 -8.345 1.00 0.00 H new ATOM 0 HG21 THR A 421 -4.082 -1.731 -9.355 1.00 0.00 H new ATOM 0 HG22 THR A 421 -2.827 -2.545 -8.392 1.00 0.00 H new ATOM 0 HG23 THR A 421 -4.534 -2.646 -7.898 1.00 0.00 H new ATOM 507 N VAL A 422 -1.109 -2.344 -6.147 1.00 0.00 N ATOM 508 CA VAL A 422 0.316 -2.475 -6.210 1.00 0.00 C ATOM 509 C VAL A 422 0.713 -2.327 -7.671 1.00 0.00 C ATOM 510 O VAL A 422 0.019 -2.837 -8.548 1.00 0.00 O ATOM 511 CB VAL A 422 0.806 -3.853 -5.693 1.00 0.00 C ATOM 512 CG1 VAL A 422 2.316 -3.873 -5.573 1.00 0.00 C ATOM 513 CG2 VAL A 422 0.164 -4.217 -4.369 1.00 0.00 C ATOM 0 H VAL A 422 -1.623 -3.224 -6.183 1.00 0.00 H new ATOM 0 HA VAL A 422 0.771 -1.714 -5.576 1.00 0.00 H new ATOM 0 HB VAL A 422 0.502 -4.602 -6.424 1.00 0.00 H new ATOM 0 HG11 VAL A 422 2.639 -4.848 -5.209 1.00 0.00 H new ATOM 0 HG12 VAL A 422 2.761 -3.685 -6.550 1.00 0.00 H new ATOM 0 HG13 VAL A 422 2.636 -3.100 -4.874 1.00 0.00 H new ATOM 0 HG21 VAL A 422 0.533 -5.189 -4.041 1.00 0.00 H new ATOM 0 HG22 VAL A 422 0.415 -3.463 -3.623 1.00 0.00 H new ATOM 0 HG23 VAL A 422 -0.918 -4.262 -4.490 1.00 0.00 H new ATOM 523 N ILE A 423 1.786 -1.641 -7.942 1.00 0.00 N ATOM 524 CA ILE A 423 2.215 -1.461 -9.308 1.00 0.00 C ATOM 525 C ILE A 423 3.310 -2.454 -9.679 1.00 0.00 C ATOM 526 O ILE A 423 3.304 -3.023 -10.774 1.00 0.00 O ATOM 527 CB ILE A 423 2.620 0.000 -9.626 1.00 0.00 C ATOM 528 CG1 ILE A 423 3.691 0.525 -8.672 1.00 0.00 C ATOM 529 CG2 ILE A 423 1.394 0.909 -9.594 1.00 0.00 C ATOM 530 CD1 ILE A 423 4.110 1.956 -8.957 1.00 0.00 C ATOM 0 H ILE A 423 2.381 -1.197 -7.242 1.00 0.00 H new ATOM 0 HA ILE A 423 1.351 -1.672 -9.938 1.00 0.00 H new ATOM 0 HB ILE A 423 3.048 0.005 -10.628 1.00 0.00 H new ATOM 0 HG12 ILE A 423 3.318 0.461 -7.650 1.00 0.00 H new ATOM 0 HG13 ILE A 423 4.567 -0.120 -8.732 1.00 0.00 H new ATOM 0 HG21 ILE A 423 1.694 1.932 -9.819 1.00 0.00 H new ATOM 0 HG22 ILE A 423 0.671 0.571 -10.336 1.00 0.00 H new ATOM 0 HG23 ILE A 423 0.940 0.874 -8.603 1.00 0.00 H new ATOM 0 HD11 ILE A 423 4.873 2.261 -8.241 1.00 0.00 H new ATOM 0 HD12 ILE A 423 4.514 2.023 -9.967 1.00 0.00 H new ATOM 0 HD13 ILE A 423 3.245 2.613 -8.868 1.00 0.00 H new ATOM 542 N GLU A 424 4.210 -2.700 -8.753 1.00 0.00 N ATOM 543 CA GLU A 424 5.262 -3.680 -8.934 1.00 0.00 C ATOM 544 C GLU A 424 5.634 -4.256 -7.597 1.00 0.00 C ATOM 545 O GLU A 424 5.378 -3.642 -6.560 1.00 0.00 O ATOM 546 CB GLU A 424 6.511 -3.089 -9.596 1.00 0.00 C ATOM 547 CG GLU A 424 7.160 -1.977 -8.794 1.00 0.00 C ATOM 548 CD GLU A 424 8.515 -1.611 -9.309 1.00 0.00 C ATOM 549 OE1 GLU A 424 8.602 -0.757 -10.199 1.00 0.00 O ATOM 550 OE2 GLU A 424 9.518 -2.179 -8.841 1.00 0.00 O ATOM 0 H GLU A 424 4.234 -2.226 -7.850 1.00 0.00 H new ATOM 0 HA GLU A 424 4.878 -4.454 -9.598 1.00 0.00 H new ATOM 0 HB2 GLU A 424 7.239 -3.885 -9.752 1.00 0.00 H new ATOM 0 HB3 GLU A 424 6.242 -2.705 -10.580 1.00 0.00 H new ATOM 0 HG2 GLU A 424 6.518 -1.097 -8.815 1.00 0.00 H new ATOM 0 HG3 GLU A 424 7.243 -2.286 -7.752 1.00 0.00 H new ATOM 557 N ALA A 425 6.220 -5.412 -7.621 1.00 0.00 N ATOM 558 CA ALA A 425 6.643 -6.087 -6.437 1.00 0.00 C ATOM 559 C ALA A 425 7.787 -6.986 -6.797 1.00 0.00 C ATOM 560 O ALA A 425 7.730 -7.654 -7.837 1.00 0.00 O ATOM 561 CB ALA A 425 5.504 -6.898 -5.863 1.00 0.00 C ATOM 0 H ALA A 425 6.421 -5.922 -8.481 1.00 0.00 H new ATOM 0 HA ALA A 425 6.956 -5.363 -5.684 1.00 0.00 H new ATOM 0 HB1 ALA A 425 5.839 -7.408 -4.960 1.00 0.00 H new ATOM 0 HB2 ALA A 425 4.673 -6.236 -5.618 1.00 0.00 H new ATOM 0 HB3 ALA A 425 5.177 -7.635 -6.596 1.00 0.00 H new ATOM 567 N LYS A 426 8.826 -6.985 -5.988 1.00 0.00 N ATOM 568 CA LYS A 426 9.987 -7.819 -6.232 1.00 0.00 C ATOM 569 C LYS A 426 10.823 -7.910 -4.982 1.00 0.00 C ATOM 570 O LYS A 426 10.499 -7.310 -3.952 1.00 0.00 O ATOM 571 CB LYS A 426 10.867 -7.363 -7.434 1.00 0.00 C ATOM 572 CG LYS A 426 11.819 -6.199 -7.189 1.00 0.00 C ATOM 573 CD LYS A 426 11.084 -4.889 -6.955 1.00 0.00 C ATOM 574 CE LYS A 426 12.028 -3.694 -7.036 1.00 0.00 C ATOM 575 NZ LYS A 426 11.311 -2.404 -6.929 1.00 0.00 N ATOM 0 H LYS A 426 8.891 -6.410 -5.148 1.00 0.00 H new ATOM 0 HA LYS A 426 9.599 -8.800 -6.507 1.00 0.00 H new ATOM 0 HB2 LYS A 426 11.455 -8.218 -7.767 1.00 0.00 H new ATOM 0 HB3 LYS A 426 10.204 -7.092 -8.256 1.00 0.00 H new ATOM 0 HG2 LYS A 426 12.445 -6.421 -6.325 1.00 0.00 H new ATOM 0 HG3 LYS A 426 12.485 -6.091 -8.045 1.00 0.00 H new ATOM 0 HD2 LYS A 426 10.292 -4.778 -7.695 1.00 0.00 H new ATOM 0 HD3 LYS A 426 10.605 -4.910 -5.976 1.00 0.00 H new ATOM 0 HE2 LYS A 426 12.768 -3.763 -6.238 1.00 0.00 H new ATOM 0 HE3 LYS A 426 12.573 -3.727 -7.980 1.00 0.00 H new ATOM 0 HZ1 LYS A 426 11.898 -1.646 -7.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 426 10.413 -2.462 -7.450 1.00 0.00 H new ATOM 0 HZ3 LYS A 426 11.118 -2.196 -5.928 1.00 0.00 H new ATOM 589 N LEU A 427 11.859 -8.667 -5.061 1.00 0.00 N ATOM 590 CA LEU A 427 12.730 -8.864 -3.946 1.00 0.00 C ATOM 591 C LEU A 427 13.841 -7.834 -3.965 1.00 0.00 C ATOM 592 O LEU A 427 14.254 -7.351 -5.034 1.00 0.00 O ATOM 593 CB LEU A 427 13.339 -10.259 -3.999 1.00 0.00 C ATOM 594 CG LEU A 427 14.599 -10.481 -4.890 1.00 0.00 C ATOM 595 CD1 LEU A 427 15.171 -11.868 -4.654 1.00 0.00 C ATOM 596 CD2 LEU A 427 14.273 -10.309 -6.369 1.00 0.00 C ATOM 0 H LEU A 427 12.132 -9.172 -5.904 1.00 0.00 H new ATOM 0 HA LEU A 427 12.150 -8.755 -3.029 1.00 0.00 H new ATOM 0 HB2 LEU A 427 13.597 -10.548 -2.980 1.00 0.00 H new ATOM 0 HB3 LEU A 427 12.565 -10.947 -4.340 1.00 0.00 H new ATOM 0 HG LEU A 427 15.337 -9.729 -4.612 1.00 0.00 H new ATOM 0 HD11 LEU A 427 16.050 -12.011 -5.282 1.00 0.00 H new ATOM 0 HD12 LEU A 427 15.453 -11.972 -3.606 1.00 0.00 H new ATOM 0 HD13 LEU A 427 14.421 -12.618 -4.904 1.00 0.00 H new ATOM 0 HD21 LEU A 427 15.174 -10.471 -6.961 1.00 0.00 H new ATOM 0 HD22 LEU A 427 13.512 -11.033 -6.660 1.00 0.00 H new ATOM 0 HD23 LEU A 427 13.900 -9.300 -6.544 1.00 0.00 H new ATOM 608 N ASP A 428 14.292 -7.479 -2.822 1.00 0.00 N ATOM 609 CA ASP A 428 15.435 -6.638 -2.699 1.00 0.00 C ATOM 610 C ASP A 428 16.402 -7.328 -1.781 1.00 0.00 C ATOM 611 O ASP A 428 16.027 -7.776 -0.697 1.00 0.00 O ATOM 612 CB ASP A 428 15.080 -5.249 -2.175 1.00 0.00 C ATOM 613 CG ASP A 428 16.250 -4.287 -2.206 1.00 0.00 C ATOM 614 OD1 ASP A 428 17.247 -4.513 -1.518 1.00 0.00 O ATOM 615 OD2 ASP A 428 16.162 -3.264 -2.902 1.00 0.00 O ATOM 0 H ASP A 428 13.879 -7.763 -1.933 1.00 0.00 H new ATOM 0 HA ASP A 428 15.878 -6.479 -3.682 1.00 0.00 H new ATOM 0 HB2 ASP A 428 14.264 -4.840 -2.771 1.00 0.00 H new ATOM 0 HB3 ASP A 428 14.715 -5.335 -1.152 1.00 0.00 H new ATOM 620 N LYS A 429 17.617 -7.464 -2.225 1.00 0.00 N ATOM 621 CA LYS A 429 18.661 -8.128 -1.461 1.00 0.00 C ATOM 622 C LYS A 429 18.990 -7.416 -0.140 1.00 0.00 C ATOM 623 O LYS A 429 19.279 -8.071 0.861 1.00 0.00 O ATOM 624 CB LYS A 429 19.955 -8.363 -2.295 1.00 0.00 C ATOM 625 CG LYS A 429 20.642 -7.119 -2.904 1.00 0.00 C ATOM 626 CD LYS A 429 19.919 -6.580 -4.133 1.00 0.00 C ATOM 627 CE LYS A 429 19.303 -5.222 -3.882 1.00 0.00 C ATOM 628 NZ LYS A 429 20.316 -4.172 -3.641 1.00 0.00 N ATOM 0 H LYS A 429 17.925 -7.118 -3.134 1.00 0.00 H new ATOM 0 HA LYS A 429 18.246 -9.103 -1.206 1.00 0.00 H new ATOM 0 HB2 LYS A 429 20.679 -8.870 -1.658 1.00 0.00 H new ATOM 0 HB3 LYS A 429 19.712 -9.047 -3.109 1.00 0.00 H new ATOM 0 HG2 LYS A 429 20.697 -6.335 -2.149 1.00 0.00 H new ATOM 0 HG3 LYS A 429 21.667 -7.373 -3.175 1.00 0.00 H new ATOM 0 HD2 LYS A 429 20.621 -6.511 -4.964 1.00 0.00 H new ATOM 0 HD3 LYS A 429 19.140 -7.281 -4.431 1.00 0.00 H new ATOM 0 HE2 LYS A 429 18.691 -4.941 -4.739 1.00 0.00 H new ATOM 0 HE3 LYS A 429 18.637 -5.283 -3.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 19.898 -3.238 -3.827 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 20.636 -4.218 -2.652 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 21.127 -4.321 -4.274 1.00 0.00 H new ATOM 642 N GLY A 430 18.884 -6.110 -0.118 1.00 0.00 N ATOM 643 CA GLY A 430 19.275 -5.380 1.056 1.00 0.00 C ATOM 644 C GLY A 430 18.095 -4.882 1.849 1.00 0.00 C ATOM 645 O GLY A 430 18.105 -4.922 3.073 1.00 0.00 O ATOM 0 H GLY A 430 18.535 -5.540 -0.889 1.00 0.00 H new ATOM 0 HA2 GLY A 430 19.889 -6.020 1.689 1.00 0.00 H new ATOM 0 HA3 GLY A 430 19.895 -4.533 0.763 1.00 0.00 H new ATOM 649 N ARG A 431 17.079 -4.435 1.158 1.00 0.00 N ATOM 650 CA ARG A 431 15.913 -3.855 1.808 1.00 0.00 C ATOM 651 C ARG A 431 14.877 -4.921 2.168 1.00 0.00 C ATOM 652 O ARG A 431 14.025 -4.705 3.038 1.00 0.00 O ATOM 653 CB ARG A 431 15.288 -2.778 0.913 1.00 0.00 C ATOM 654 CG ARG A 431 16.256 -1.665 0.525 1.00 0.00 C ATOM 655 CD ARG A 431 15.591 -0.619 -0.357 1.00 0.00 C ATOM 656 NE ARG A 431 15.083 -1.179 -1.622 1.00 0.00 N ATOM 657 CZ ARG A 431 14.058 -0.691 -2.312 1.00 0.00 C ATOM 658 NH1 ARG A 431 13.480 0.437 -1.936 1.00 0.00 N ATOM 659 NH2 ARG A 431 13.629 -1.310 -3.409 1.00 0.00 N ATOM 0 H ARG A 431 17.027 -4.458 0.140 1.00 0.00 H new ATOM 0 HA ARG A 431 16.245 -3.395 2.739 1.00 0.00 H new ATOM 0 HB2 ARG A 431 14.907 -3.248 0.006 1.00 0.00 H new ATOM 0 HB3 ARG A 431 14.433 -2.341 1.429 1.00 0.00 H new ATOM 0 HG2 ARG A 431 16.642 -1.188 1.426 1.00 0.00 H new ATOM 0 HG3 ARG A 431 17.110 -2.093 0.000 1.00 0.00 H new ATOM 0 HD2 ARG A 431 14.767 -0.161 0.189 1.00 0.00 H new ATOM 0 HD3 ARG A 431 16.307 0.173 -0.577 1.00 0.00 H new ATOM 0 HE ARG A 431 15.554 -2.003 -1.996 1.00 0.00 H new ATOM 0 HH11 ARG A 431 13.821 0.935 -1.114 1.00 0.00 H new ATOM 0 HH12 ARG A 431 12.693 0.809 -2.468 1.00 0.00 H new ATOM 0 HH21 ARG A 431 14.088 -2.165 -3.725 1.00 0.00 H new ATOM 0 HH22 ARG A 431 12.841 -0.930 -3.934 1.00 0.00 H new ATOM 673 N GLY A 432 14.957 -6.061 1.516 1.00 0.00 N ATOM 674 CA GLY A 432 14.016 -7.131 1.770 1.00 0.00 C ATOM 675 C GLY A 432 12.894 -7.128 0.750 1.00 0.00 C ATOM 676 O GLY A 432 13.029 -6.506 -0.293 1.00 0.00 O ATOM 0 H GLY A 432 15.661 -6.271 0.808 1.00 0.00 H new ATOM 0 HA2 GLY A 432 14.535 -8.089 1.741 1.00 0.00 H new ATOM 0 HA3 GLY A 432 13.601 -7.023 2.772 1.00 0.00 H new ATOM 680 N PRO A 433 11.800 -7.866 0.989 1.00 0.00 N ATOM 681 CA PRO A 433 10.623 -7.852 0.101 1.00 0.00 C ATOM 682 C PRO A 433 10.043 -6.438 -0.023 1.00 0.00 C ATOM 683 O PRO A 433 9.592 -5.850 0.979 1.00 0.00 O ATOM 684 CB PRO A 433 9.629 -8.771 0.828 1.00 0.00 C ATOM 685 CG PRO A 433 10.490 -9.672 1.636 1.00 0.00 C ATOM 686 CD PRO A 433 11.630 -8.814 2.104 1.00 0.00 C ATOM 0 HA PRO A 433 10.855 -8.173 -0.914 1.00 0.00 H new ATOM 0 HB2 PRO A 433 8.947 -8.201 1.459 1.00 0.00 H new ATOM 0 HB3 PRO A 433 9.016 -9.332 0.123 1.00 0.00 H new ATOM 0 HG2 PRO A 433 9.940 -10.090 2.479 1.00 0.00 H new ATOM 0 HG3 PRO A 433 10.848 -10.512 1.041 1.00 0.00 H new ATOM 0 HD2 PRO A 433 11.396 -8.303 3.038 1.00 0.00 H new ATOM 0 HD3 PRO A 433 12.533 -9.400 2.279 1.00 0.00 H new ATOM 694 N VAL A 434 10.065 -5.898 -1.222 1.00 0.00 N ATOM 695 CA VAL A 434 9.602 -4.548 -1.468 1.00 0.00 C ATOM 696 C VAL A 434 8.414 -4.558 -2.417 1.00 0.00 C ATOM 697 O VAL A 434 8.255 -5.491 -3.229 1.00 0.00 O ATOM 698 CB VAL A 434 10.731 -3.631 -2.043 1.00 0.00 C ATOM 699 CG1 VAL A 434 11.848 -3.436 -1.039 1.00 0.00 C ATOM 700 CG2 VAL A 434 11.301 -4.200 -3.329 1.00 0.00 C ATOM 0 H VAL A 434 10.404 -6.381 -2.054 1.00 0.00 H new ATOM 0 HA VAL A 434 9.297 -4.136 -0.506 1.00 0.00 H new ATOM 0 HB VAL A 434 10.276 -2.664 -2.256 1.00 0.00 H new ATOM 0 HG11 VAL A 434 12.616 -2.794 -1.470 1.00 0.00 H new ATOM 0 HG12 VAL A 434 11.450 -2.970 -0.137 1.00 0.00 H new ATOM 0 HG13 VAL A 434 12.283 -4.403 -0.786 1.00 0.00 H new ATOM 0 HG21 VAL A 434 12.083 -3.540 -3.704 1.00 0.00 H new ATOM 0 HG22 VAL A 434 11.721 -5.187 -3.135 1.00 0.00 H new ATOM 0 HG23 VAL A 434 10.509 -4.282 -4.073 1.00 0.00 H new ATOM 710 N ALA A 435 7.582 -3.555 -2.306 1.00 0.00 N ATOM 711 CA ALA A 435 6.415 -3.432 -3.152 1.00 0.00 C ATOM 712 C ALA A 435 6.109 -1.978 -3.396 1.00 0.00 C ATOM 713 O ALA A 435 5.946 -1.212 -2.444 1.00 0.00 O ATOM 714 CB ALA A 435 5.211 -4.101 -2.506 1.00 0.00 C ATOM 0 H ALA A 435 7.691 -2.800 -1.629 1.00 0.00 H new ATOM 0 HA ALA A 435 6.625 -3.926 -4.101 1.00 0.00 H new ATOM 0 HB1 ALA A 435 4.344 -3.997 -3.158 1.00 0.00 H new ATOM 0 HB2 ALA A 435 5.423 -5.159 -2.349 1.00 0.00 H new ATOM 0 HB3 ALA A 435 5.002 -3.627 -1.547 1.00 0.00 H new ATOM 720 N THR A 436 6.046 -1.594 -4.636 1.00 0.00 N ATOM 721 CA THR A 436 5.700 -0.253 -4.977 1.00 0.00 C ATOM 722 C THR A 436 4.221 -0.240 -5.281 1.00 0.00 C ATOM 723 O THR A 436 3.738 -1.040 -6.091 1.00 0.00 O ATOM 724 CB THR A 436 6.484 0.253 -6.207 1.00 0.00 C ATOM 725 OG1 THR A 436 7.868 -0.133 -6.085 1.00 0.00 O ATOM 726 CG2 THR A 436 6.430 1.775 -6.260 1.00 0.00 C ATOM 0 H THR A 436 6.233 -2.201 -5.434 1.00 0.00 H new ATOM 0 HA THR A 436 5.951 0.407 -4.147 1.00 0.00 H new ATOM 0 HB THR A 436 6.041 -0.175 -7.106 1.00 0.00 H new ATOM 0 HG1 THR A 436 8.367 0.186 -6.866 1.00 0.00 H new ATOM 0 HG21 THR A 436 6.984 2.129 -7.129 1.00 0.00 H new ATOM 0 HG22 THR A 436 5.392 2.100 -6.335 1.00 0.00 H new ATOM 0 HG23 THR A 436 6.875 2.187 -5.354 1.00 0.00 H new ATOM 734 N LEU A 437 3.503 0.611 -4.639 1.00 0.00 N ATOM 735 CA LEU A 437 2.095 0.671 -4.810 1.00 0.00 C ATOM 736 C LEU A 437 1.623 2.098 -4.959 1.00 0.00 C ATOM 737 O LEU A 437 2.406 3.048 -4.818 1.00 0.00 O ATOM 738 CB LEU A 437 1.325 -0.082 -3.655 1.00 0.00 C ATOM 739 CG LEU A 437 1.464 0.375 -2.153 1.00 0.00 C ATOM 740 CD1 LEU A 437 2.837 0.182 -1.582 1.00 0.00 C ATOM 741 CD2 LEU A 437 1.020 1.795 -1.932 1.00 0.00 C ATOM 0 H LEU A 437 3.878 1.290 -3.976 1.00 0.00 H new ATOM 0 HA LEU A 437 1.859 0.147 -5.736 1.00 0.00 H new ATOM 0 HB2 LEU A 437 0.264 -0.046 -3.903 1.00 0.00 H new ATOM 0 HB3 LEU A 437 1.627 -1.128 -3.699 1.00 0.00 H new ATOM 0 HG LEU A 437 0.790 -0.291 -1.614 1.00 0.00 H new ATOM 0 HD11 LEU A 437 2.851 0.520 -0.546 1.00 0.00 H new ATOM 0 HD12 LEU A 437 3.103 -0.874 -1.623 1.00 0.00 H new ATOM 0 HD13 LEU A 437 3.557 0.760 -2.162 1.00 0.00 H new ATOM 0 HD21 LEU A 437 1.138 2.054 -0.880 1.00 0.00 H new ATOM 0 HD22 LEU A 437 1.627 2.465 -2.541 1.00 0.00 H new ATOM 0 HD23 LEU A 437 -0.028 1.897 -2.215 1.00 0.00 H new ATOM 753 N LEU A 438 0.369 2.234 -5.252 1.00 0.00 N ATOM 754 CA LEU A 438 -0.289 3.502 -5.283 1.00 0.00 C ATOM 755 C LEU A 438 -1.358 3.433 -4.177 1.00 0.00 C ATOM 756 O LEU A 438 -2.344 2.686 -4.292 1.00 0.00 O ATOM 757 CB LEU A 438 -0.905 3.720 -6.690 1.00 0.00 C ATOM 758 CG LEU A 438 -1.345 5.151 -7.098 1.00 0.00 C ATOM 759 CD1 LEU A 438 -2.476 5.683 -6.246 1.00 0.00 C ATOM 760 CD2 LEU A 438 -0.164 6.114 -7.087 1.00 0.00 C ATOM 0 H LEU A 438 -0.240 1.449 -5.482 1.00 0.00 H new ATOM 0 HA LEU A 438 0.381 4.343 -5.106 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -0.178 3.375 -7.426 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -1.776 3.070 -6.774 1.00 0.00 H new ATOM 0 HG LEU A 438 -1.725 5.076 -8.117 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -2.741 6.687 -6.578 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -3.343 5.029 -6.342 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -2.161 5.717 -5.203 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -0.503 7.109 -7.377 1.00 0.00 H new ATOM 0 HD22 LEU A 438 0.263 6.154 -6.085 1.00 0.00 H new ATOM 0 HD23 LEU A 438 0.593 5.769 -7.791 1.00 0.00 H new ATOM 772 N VAL A 439 -1.128 4.143 -3.087 1.00 0.00 N ATOM 773 CA VAL A 439 -2.019 4.077 -1.933 1.00 0.00 C ATOM 774 C VAL A 439 -3.327 4.833 -2.173 1.00 0.00 C ATOM 775 O VAL A 439 -3.331 6.036 -2.437 1.00 0.00 O ATOM 776 CB VAL A 439 -1.321 4.523 -0.592 1.00 0.00 C ATOM 777 CG1 VAL A 439 -0.738 5.922 -0.686 1.00 0.00 C ATOM 778 CG2 VAL A 439 -2.284 4.422 0.594 1.00 0.00 C ATOM 0 H VAL A 439 -0.334 4.773 -2.973 1.00 0.00 H new ATOM 0 HA VAL A 439 -2.273 3.024 -1.809 1.00 0.00 H new ATOM 0 HB VAL A 439 -0.493 3.834 -0.426 1.00 0.00 H new ATOM 0 HG11 VAL A 439 -0.268 6.185 0.262 1.00 0.00 H new ATOM 0 HG12 VAL A 439 0.007 5.953 -1.481 1.00 0.00 H new ATOM 0 HG13 VAL A 439 -1.534 6.634 -0.906 1.00 0.00 H new ATOM 0 HG21 VAL A 439 -1.774 4.736 1.505 1.00 0.00 H new ATOM 0 HG22 VAL A 439 -3.145 5.067 0.419 1.00 0.00 H new ATOM 0 HG23 VAL A 439 -2.620 3.391 0.703 1.00 0.00 H new ATOM 788 N GLN A 440 -4.432 4.105 -2.104 1.00 0.00 N ATOM 789 CA GLN A 440 -5.762 4.693 -2.322 1.00 0.00 C ATOM 790 C GLN A 440 -6.667 4.432 -1.147 1.00 0.00 C ATOM 791 O GLN A 440 -7.669 5.112 -0.968 1.00 0.00 O ATOM 792 CB GLN A 440 -6.415 4.148 -3.601 1.00 0.00 C ATOM 793 CG GLN A 440 -5.809 4.663 -4.892 1.00 0.00 C ATOM 794 CD GLN A 440 -6.077 6.147 -5.109 1.00 0.00 C ATOM 795 OE1 GLN A 440 -5.305 7.009 -4.688 1.00 0.00 O ATOM 796 NE2 GLN A 440 -7.162 6.455 -5.774 1.00 0.00 N ATOM 0 H GLN A 440 -4.443 3.106 -1.899 1.00 0.00 H new ATOM 0 HA GLN A 440 -5.621 5.768 -2.433 1.00 0.00 H new ATOM 0 HB2 GLN A 440 -6.347 3.060 -3.592 1.00 0.00 H new ATOM 0 HB3 GLN A 440 -7.475 4.401 -3.587 1.00 0.00 H new ATOM 0 HG2 GLN A 440 -4.733 4.489 -4.880 1.00 0.00 H new ATOM 0 HG3 GLN A 440 -6.214 4.097 -5.731 1.00 0.00 H new ATOM 0 HE21 GLN A 440 -7.781 5.717 -6.109 1.00 0.00 H new ATOM 0 HE22 GLN A 440 -7.388 7.433 -5.957 1.00 0.00 H new ATOM 805 N ALA A 441 -6.269 3.470 -0.317 1.00 0.00 N ATOM 806 CA ALA A 441 -7.085 2.998 0.780 1.00 0.00 C ATOM 807 C ALA A 441 -7.220 4.043 1.866 1.00 0.00 C ATOM 808 O ALA A 441 -8.228 4.093 2.558 1.00 0.00 O ATOM 809 CB ALA A 441 -6.492 1.719 1.335 1.00 0.00 C ATOM 0 H ALA A 441 -5.367 3.000 -0.394 1.00 0.00 H new ATOM 0 HA ALA A 441 -8.088 2.798 0.403 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -7.106 1.362 2.162 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -6.463 0.962 0.552 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -5.480 1.912 1.691 1.00 0.00 H new ATOM 815 N GLY A 442 -6.232 4.888 1.978 1.00 0.00 N ATOM 816 CA GLY A 442 -6.251 5.895 2.981 1.00 0.00 C ATOM 817 C GLY A 442 -4.974 6.661 2.996 1.00 0.00 C ATOM 818 O GLY A 442 -4.806 7.604 2.244 1.00 0.00 O ATOM 0 H GLY A 442 -5.405 4.892 1.381 1.00 0.00 H new ATOM 0 HA2 GLY A 442 -7.084 6.575 2.803 1.00 0.00 H new ATOM 0 HA3 GLY A 442 -6.416 5.438 3.957 1.00 0.00 H new ATOM 822 N THR A 443 -4.079 6.283 3.851 1.00 0.00 N ATOM 823 CA THR A 443 -2.786 6.934 3.978 1.00 0.00 C ATOM 824 C THR A 443 -1.773 5.881 4.426 1.00 0.00 C ATOM 825 O THR A 443 -2.130 4.995 5.183 1.00 0.00 O ATOM 826 CB THR A 443 -2.880 8.090 5.005 1.00 0.00 C ATOM 827 OG1 THR A 443 -3.955 8.973 4.613 1.00 0.00 O ATOM 828 CG2 THR A 443 -1.587 8.895 5.078 1.00 0.00 C ATOM 0 H THR A 443 -4.214 5.504 4.496 1.00 0.00 H new ATOM 0 HA THR A 443 -2.471 7.362 3.026 1.00 0.00 H new ATOM 0 HB THR A 443 -3.063 7.655 5.987 1.00 0.00 H new ATOM 0 HG1 THR A 443 -3.925 9.787 5.158 1.00 0.00 H new ATOM 0 HG21 THR A 443 -1.697 9.695 5.810 1.00 0.00 H new ATOM 0 HG22 THR A 443 -0.768 8.241 5.376 1.00 0.00 H new ATOM 0 HG23 THR A 443 -1.371 9.325 4.100 1.00 0.00 H new ATOM 836 N LEU A 444 -0.552 5.958 3.953 1.00 0.00 N ATOM 837 CA LEU A 444 0.448 4.950 4.269 1.00 0.00 C ATOM 838 C LEU A 444 1.494 5.566 5.197 1.00 0.00 C ATOM 839 O LEU A 444 1.916 6.696 4.982 1.00 0.00 O ATOM 840 CB LEU A 444 1.112 4.475 2.960 1.00 0.00 C ATOM 841 CG LEU A 444 1.179 2.956 2.693 1.00 0.00 C ATOM 842 CD1 LEU A 444 1.801 2.720 1.365 1.00 0.00 C ATOM 843 CD2 LEU A 444 1.973 2.225 3.752 1.00 0.00 C ATOM 0 H LEU A 444 -0.220 6.708 3.346 1.00 0.00 H new ATOM 0 HA LEU A 444 -0.015 4.097 4.765 1.00 0.00 H new ATOM 0 HB2 LEU A 444 0.580 4.937 2.128 1.00 0.00 H new ATOM 0 HB3 LEU A 444 2.131 4.863 2.942 1.00 0.00 H new ATOM 0 HG LEU A 444 0.160 2.569 2.716 1.00 0.00 H new ATOM 0 HD11 LEU A 444 1.851 1.648 1.172 1.00 0.00 H new ATOM 0 HD12 LEU A 444 1.202 3.201 0.592 1.00 0.00 H new ATOM 0 HD13 LEU A 444 2.808 3.137 1.355 1.00 0.00 H new ATOM 0 HD21 LEU A 444 1.992 1.160 3.522 1.00 0.00 H new ATOM 0 HD22 LEU A 444 2.992 2.610 3.773 1.00 0.00 H new ATOM 0 HD23 LEU A 444 1.507 2.377 4.726 1.00 0.00 H new ATOM 855 N LYS A 445 1.890 4.848 6.224 1.00 0.00 N ATOM 856 CA LYS A 445 2.905 5.330 7.152 1.00 0.00 C ATOM 857 C LYS A 445 3.710 4.149 7.661 1.00 0.00 C ATOM 858 O LYS A 445 3.193 3.030 7.736 1.00 0.00 O ATOM 859 CB LYS A 445 2.257 6.019 8.354 1.00 0.00 C ATOM 860 CG LYS A 445 3.259 6.648 9.329 1.00 0.00 C ATOM 861 CD LYS A 445 2.710 6.762 10.744 1.00 0.00 C ATOM 862 CE LYS A 445 2.479 5.376 11.358 1.00 0.00 C ATOM 863 NZ LYS A 445 2.035 5.439 12.766 1.00 0.00 N ATOM 0 H LYS A 445 1.525 3.921 6.444 1.00 0.00 H new ATOM 0 HA LYS A 445 3.542 6.042 6.628 1.00 0.00 H new ATOM 0 HB2 LYS A 445 1.581 6.794 7.994 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.650 5.291 8.893 1.00 0.00 H new ATOM 0 HG2 LYS A 445 4.170 6.049 9.344 1.00 0.00 H new ATOM 0 HG3 LYS A 445 3.535 7.639 8.970 1.00 0.00 H new ATOM 0 HD2 LYS A 445 3.407 7.326 11.364 1.00 0.00 H new ATOM 0 HD3 LYS A 445 1.773 7.318 10.730 1.00 0.00 H new ATOM 0 HE2 LYS A 445 1.732 4.843 10.770 1.00 0.00 H new ATOM 0 HE3 LYS A 445 3.402 4.799 11.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 1.895 4.475 13.129 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 2.758 5.922 13.337 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 1.140 5.965 12.824 1.00 0.00 H new ATOM 877 N VAL A 446 4.966 4.388 7.993 1.00 0.00 N ATOM 878 CA VAL A 446 5.786 3.368 8.574 1.00 0.00 C ATOM 879 C VAL A 446 5.313 3.059 9.975 1.00 0.00 C ATOM 880 O VAL A 446 5.067 3.962 10.780 1.00 0.00 O ATOM 881 CB VAL A 446 7.309 3.693 8.562 1.00 0.00 C ATOM 882 CG1 VAL A 446 7.805 3.862 7.155 1.00 0.00 C ATOM 883 CG2 VAL A 446 7.641 4.936 9.382 1.00 0.00 C ATOM 0 H VAL A 446 5.432 5.286 7.865 1.00 0.00 H new ATOM 0 HA VAL A 446 5.673 2.487 7.942 1.00 0.00 H new ATOM 0 HB VAL A 446 7.816 2.846 9.024 1.00 0.00 H new ATOM 0 HG11 VAL A 446 8.871 4.088 7.170 1.00 0.00 H new ATOM 0 HG12 VAL A 446 7.637 2.941 6.597 1.00 0.00 H new ATOM 0 HG13 VAL A 446 7.267 4.680 6.675 1.00 0.00 H new ATOM 0 HG21 VAL A 446 8.714 5.122 9.343 1.00 0.00 H new ATOM 0 HG22 VAL A 446 7.109 5.795 8.972 1.00 0.00 H new ATOM 0 HG23 VAL A 446 7.337 4.781 10.417 1.00 0.00 H new ATOM 893 N GLY A 447 5.151 1.806 10.248 1.00 0.00 N ATOM 894 CA GLY A 447 4.668 1.400 11.517 1.00 0.00 C ATOM 895 C GLY A 447 3.200 1.081 11.496 1.00 0.00 C ATOM 896 O GLY A 447 2.665 0.552 12.479 1.00 0.00 O ATOM 0 H GLY A 447 5.349 1.044 9.600 1.00 0.00 H new ATOM 0 HA2 GLY A 447 5.223 0.523 11.850 1.00 0.00 H new ATOM 0 HA3 GLY A 447 4.855 2.191 12.244 1.00 0.00 H new ATOM 900 N ASP A 448 2.529 1.415 10.406 1.00 0.00 N ATOM 901 CA ASP A 448 1.121 1.072 10.268 1.00 0.00 C ATOM 902 C ASP A 448 0.979 -0.294 9.637 1.00 0.00 C ATOM 903 O ASP A 448 1.848 -0.708 8.837 1.00 0.00 O ATOM 904 CB ASP A 448 0.280 2.129 9.492 1.00 0.00 C ATOM 905 CG ASP A 448 -0.184 3.288 10.366 1.00 0.00 C ATOM 906 OD1 ASP A 448 -0.608 3.047 11.522 1.00 0.00 O ATOM 907 OD2 ASP A 448 -0.105 4.459 9.948 1.00 0.00 O ATOM 0 H ASP A 448 2.929 1.917 9.613 1.00 0.00 H new ATOM 0 HA ASP A 448 0.711 1.059 11.278 1.00 0.00 H new ATOM 0 HB2 ASP A 448 0.874 2.521 8.666 1.00 0.00 H new ATOM 0 HB3 ASP A 448 -0.591 1.641 9.055 1.00 0.00 H new ATOM 912 N PRO A 449 -0.054 -1.060 10.026 1.00 0.00 N ATOM 913 CA PRO A 449 -0.306 -2.367 9.457 1.00 0.00 C ATOM 914 C PRO A 449 -0.906 -2.267 8.057 1.00 0.00 C ATOM 915 O PRO A 449 -1.638 -1.327 7.730 1.00 0.00 O ATOM 916 CB PRO A 449 -1.320 -3.015 10.423 1.00 0.00 C ATOM 917 CG PRO A 449 -1.442 -2.071 11.575 1.00 0.00 C ATOM 918 CD PRO A 449 -1.058 -0.723 11.047 1.00 0.00 C ATOM 0 HA PRO A 449 0.613 -2.943 9.350 1.00 0.00 H new ATOM 0 HB2 PRO A 449 -2.284 -3.165 9.936 1.00 0.00 H new ATOM 0 HB3 PRO A 449 -0.974 -3.994 10.754 1.00 0.00 H new ATOM 0 HG2 PRO A 449 -2.460 -2.062 11.966 1.00 0.00 H new ATOM 0 HG3 PRO A 449 -0.789 -2.369 12.395 1.00 0.00 H new ATOM 0 HD2 PRO A 449 -1.911 -0.196 10.620 1.00 0.00 H new ATOM 0 HD3 PRO A 449 -0.646 -0.083 11.827 1.00 0.00 H new ATOM 926 N ILE A 450 -0.593 -3.222 7.247 1.00 0.00 N ATOM 927 CA ILE A 450 -1.092 -3.292 5.899 1.00 0.00 C ATOM 928 C ILE A 450 -1.583 -4.682 5.613 1.00 0.00 C ATOM 929 O ILE A 450 -1.126 -5.646 6.229 1.00 0.00 O ATOM 930 CB ILE A 450 -0.016 -2.935 4.855 1.00 0.00 C ATOM 931 CG1 ILE A 450 1.289 -3.685 5.161 1.00 0.00 C ATOM 932 CG2 ILE A 450 0.203 -1.428 4.783 1.00 0.00 C ATOM 933 CD1 ILE A 450 2.281 -3.653 4.048 1.00 0.00 C ATOM 0 H ILE A 450 0.026 -3.992 7.499 1.00 0.00 H new ATOM 0 HA ILE A 450 -1.901 -2.565 5.821 1.00 0.00 H new ATOM 0 HB ILE A 450 -0.365 -3.253 3.873 1.00 0.00 H new ATOM 0 HG12 ILE A 450 1.744 -3.253 6.052 1.00 0.00 H new ATOM 0 HG13 ILE A 450 1.053 -4.723 5.395 1.00 0.00 H new ATOM 0 HG21 ILE A 450 0.967 -1.207 4.038 1.00 0.00 H new ATOM 0 HG22 ILE A 450 -0.729 -0.938 4.503 1.00 0.00 H new ATOM 0 HG23 ILE A 450 0.528 -1.061 5.756 1.00 0.00 H new ATOM 0 HD11 ILE A 450 3.175 -4.204 4.341 1.00 0.00 H new ATOM 0 HD12 ILE A 450 1.847 -4.112 3.160 1.00 0.00 H new ATOM 0 HD13 ILE A 450 2.548 -2.619 3.828 1.00 0.00 H new ATOM 945 N VAL A 451 -2.506 -4.786 4.707 1.00 0.00 N ATOM 946 CA VAL A 451 -3.059 -6.059 4.307 1.00 0.00 C ATOM 947 C VAL A 451 -3.051 -6.141 2.797 1.00 0.00 C ATOM 948 O VAL A 451 -3.797 -5.453 2.139 1.00 0.00 O ATOM 949 CB VAL A 451 -4.523 -6.264 4.816 1.00 0.00 C ATOM 950 CG1 VAL A 451 -5.055 -7.627 4.392 1.00 0.00 C ATOM 951 CG2 VAL A 451 -4.616 -6.111 6.332 1.00 0.00 C ATOM 0 H VAL A 451 -2.906 -3.987 4.215 1.00 0.00 H new ATOM 0 HA VAL A 451 -2.443 -6.841 4.752 1.00 0.00 H new ATOM 0 HB VAL A 451 -5.138 -5.488 4.361 1.00 0.00 H new ATOM 0 HG11 VAL A 451 -6.075 -7.749 4.757 1.00 0.00 H new ATOM 0 HG12 VAL A 451 -5.047 -7.698 3.304 1.00 0.00 H new ATOM 0 HG13 VAL A 451 -4.424 -8.410 4.811 1.00 0.00 H new ATOM 0 HG21 VAL A 451 -5.648 -6.260 6.650 1.00 0.00 H new ATOM 0 HG22 VAL A 451 -3.978 -6.852 6.812 1.00 0.00 H new ATOM 0 HG23 VAL A 451 -4.289 -5.111 6.618 1.00 0.00 H new ATOM 961 N VAL A 452 -2.191 -6.940 2.272 1.00 0.00 N ATOM 962 CA VAL A 452 -2.093 -7.172 0.849 1.00 0.00 C ATOM 963 C VAL A 452 -2.886 -8.451 0.589 1.00 0.00 C ATOM 964 O VAL A 452 -3.256 -9.123 1.572 1.00 0.00 O ATOM 965 CB VAL A 452 -0.593 -7.341 0.415 1.00 0.00 C ATOM 966 CG1 VAL A 452 -0.438 -7.464 -1.101 1.00 0.00 C ATOM 967 CG2 VAL A 452 0.246 -6.176 0.931 1.00 0.00 C ATOM 0 H VAL A 452 -1.514 -7.470 2.821 1.00 0.00 H new ATOM 0 HA VAL A 452 -2.486 -6.334 0.274 1.00 0.00 H new ATOM 0 HB VAL A 452 -0.236 -8.271 0.858 1.00 0.00 H new ATOM 0 HG11 VAL A 452 0.617 -7.579 -1.351 1.00 0.00 H new ATOM 0 HG12 VAL A 452 -0.991 -8.334 -1.454 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -0.829 -6.567 -1.581 1.00 0.00 H new ATOM 0 HG21 VAL A 452 1.283 -6.309 0.621 1.00 0.00 H new ATOM 0 HG22 VAL A 452 -0.138 -5.242 0.522 1.00 0.00 H new ATOM 0 HG23 VAL A 452 0.194 -6.144 2.019 1.00 0.00 H new ATOM 977 N GLY A 453 -3.260 -8.718 -0.661 1.00 0.00 N ATOM 978 CA GLY A 453 -3.943 -9.952 -1.019 1.00 0.00 C ATOM 979 C GLY A 453 -3.392 -11.178 -0.291 1.00 0.00 C ATOM 980 O GLY A 453 -2.262 -11.608 -0.522 1.00 0.00 O ATOM 0 H GLY A 453 -3.098 -8.088 -1.446 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -5.005 -9.851 -0.794 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -3.859 -10.108 -2.095 1.00 0.00 H new ATOM 984 N THR A 454 -4.201 -11.680 0.642 1.00 0.00 N ATOM 985 CA THR A 454 -3.944 -12.825 1.470 1.00 0.00 C ATOM 986 C THR A 454 -2.836 -12.621 2.572 1.00 0.00 C ATOM 987 O THR A 454 -2.885 -13.265 3.620 1.00 0.00 O ATOM 988 CB THR A 454 -3.687 -14.062 0.612 1.00 0.00 C ATOM 989 OG1 THR A 454 -4.625 -14.036 -0.491 1.00 0.00 O ATOM 990 CG2 THR A 454 -3.978 -15.285 1.419 1.00 0.00 C ATOM 0 H THR A 454 -5.109 -11.259 0.841 1.00 0.00 H new ATOM 0 HA THR A 454 -4.855 -12.979 2.048 1.00 0.00 H new ATOM 0 HB THR A 454 -2.654 -14.071 0.264 1.00 0.00 H new ATOM 0 HG1 THR A 454 -4.481 -14.820 -1.061 1.00 0.00 H new ATOM 0 HG21 THR A 454 -3.797 -16.173 0.813 1.00 0.00 H new ATOM 0 HG22 THR A 454 -3.330 -15.305 2.295 1.00 0.00 H new ATOM 0 HG23 THR A 454 -5.020 -15.271 1.739 1.00 0.00 H new ATOM 998 N THR A 455 -1.907 -11.713 2.380 1.00 0.00 N ATOM 999 CA THR A 455 -0.832 -11.542 3.340 1.00 0.00 C ATOM 1000 C THR A 455 -0.812 -10.132 3.947 1.00 0.00 C ATOM 1001 O THR A 455 -0.884 -9.136 3.239 1.00 0.00 O ATOM 1002 CB THR A 455 0.537 -11.889 2.703 1.00 0.00 C ATOM 1003 OG1 THR A 455 0.492 -13.242 2.221 1.00 0.00 O ATOM 1004 CG2 THR A 455 1.657 -11.769 3.724 1.00 0.00 C ATOM 0 H THR A 455 -1.870 -11.085 1.577 1.00 0.00 H new ATOM 0 HA THR A 455 -1.020 -12.238 4.157 1.00 0.00 H new ATOM 0 HB THR A 455 0.731 -11.192 1.888 1.00 0.00 H new ATOM 0 HG1 THR A 455 1.353 -13.473 1.814 1.00 0.00 H new ATOM 0 HG21 THR A 455 2.608 -12.018 3.252 1.00 0.00 H new ATOM 0 HG22 THR A 455 1.696 -10.748 4.103 1.00 0.00 H new ATOM 0 HG23 THR A 455 1.471 -12.455 4.550 1.00 0.00 H new ATOM 1012 N TYR A 456 -0.692 -10.061 5.249 1.00 0.00 N ATOM 1013 CA TYR A 456 -0.670 -8.802 5.949 1.00 0.00 C ATOM 1014 C TYR A 456 0.720 -8.562 6.530 1.00 0.00 C ATOM 1015 O TYR A 456 1.536 -9.482 6.588 1.00 0.00 O ATOM 1016 CB TYR A 456 -1.757 -8.752 7.052 1.00 0.00 C ATOM 1017 CG TYR A 456 -1.646 -9.824 8.125 1.00 0.00 C ATOM 1018 CD1 TYR A 456 -0.826 -9.642 9.235 1.00 0.00 C ATOM 1019 CD2 TYR A 456 -2.359 -11.014 8.026 1.00 0.00 C ATOM 1020 CE1 TYR A 456 -0.722 -10.608 10.211 1.00 0.00 C ATOM 1021 CE2 TYR A 456 -2.260 -11.986 9.003 1.00 0.00 C ATOM 1022 CZ TYR A 456 -1.437 -11.777 10.090 1.00 0.00 C ATOM 1023 OH TYR A 456 -1.336 -12.744 11.073 1.00 0.00 O ATOM 0 H TYR A 456 -0.607 -10.877 5.855 1.00 0.00 H new ATOM 0 HA TYR A 456 -0.897 -8.004 5.242 1.00 0.00 H new ATOM 0 HB2 TYR A 456 -1.718 -7.775 7.533 1.00 0.00 H new ATOM 0 HB3 TYR A 456 -2.735 -8.835 6.579 1.00 0.00 H new ATOM 0 HD1 TYR A 456 -0.261 -8.727 9.333 1.00 0.00 H new ATOM 0 HD2 TYR A 456 -3.000 -11.181 7.173 1.00 0.00 H new ATOM 0 HE1 TYR A 456 -0.083 -10.449 11.067 1.00 0.00 H new ATOM 0 HE2 TYR A 456 -2.823 -12.903 8.916 1.00 0.00 H new ATOM 0 HH TYR A 456 -1.904 -13.508 10.840 1.00 0.00 H new ATOM 1033 N GLY A 457 0.987 -7.353 6.935 1.00 0.00 N ATOM 1034 CA GLY A 457 2.273 -7.013 7.480 1.00 0.00 C ATOM 1035 C GLY A 457 2.252 -5.645 8.094 1.00 0.00 C ATOM 1036 O GLY A 457 1.173 -5.089 8.334 1.00 0.00 O ATOM 0 H GLY A 457 0.325 -6.578 6.898 1.00 0.00 H new ATOM 0 HA2 GLY A 457 2.559 -7.749 8.232 1.00 0.00 H new ATOM 0 HA3 GLY A 457 3.027 -7.051 6.694 1.00 0.00 H new ATOM 1040 N ARG A 458 3.407 -5.093 8.331 1.00 0.00 N ATOM 1041 CA ARG A 458 3.534 -3.780 8.914 1.00 0.00 C ATOM 1042 C ARG A 458 4.632 -3.056 8.171 1.00 0.00 C ATOM 1043 O ARG A 458 5.675 -3.637 7.904 1.00 0.00 O ATOM 1044 CB ARG A 458 3.869 -3.884 10.405 1.00 0.00 C ATOM 1045 CG ARG A 458 3.927 -2.546 11.129 1.00 0.00 C ATOM 1046 CD ARG A 458 4.330 -2.722 12.581 1.00 0.00 C ATOM 1047 NE ARG A 458 5.658 -3.330 12.701 1.00 0.00 N ATOM 1048 CZ ARG A 458 6.258 -3.676 13.849 1.00 0.00 C ATOM 1049 NH1 ARG A 458 5.665 -3.444 15.021 1.00 0.00 N ATOM 1050 NH2 ARG A 458 7.465 -4.236 13.822 1.00 0.00 N ATOM 0 H ARG A 458 4.299 -5.543 8.124 1.00 0.00 H new ATOM 0 HA ARG A 458 2.595 -3.233 8.829 1.00 0.00 H new ATOM 0 HB2 ARG A 458 3.123 -4.514 10.890 1.00 0.00 H new ATOM 0 HB3 ARG A 458 4.830 -4.385 10.515 1.00 0.00 H new ATOM 0 HG2 ARG A 458 4.639 -1.890 10.629 1.00 0.00 H new ATOM 0 HG3 ARG A 458 2.953 -2.059 11.076 1.00 0.00 H new ATOM 0 HD2 ARG A 458 4.326 -1.753 13.081 1.00 0.00 H new ATOM 0 HD3 ARG A 458 3.596 -3.346 13.090 1.00 0.00 H new ATOM 0 HE ARG A 458 6.170 -3.505 11.836 1.00 0.00 H new ATOM 0 HH11 ARG A 458 4.747 -3.000 15.049 1.00 0.00 H new ATOM 0 HH12 ARG A 458 6.129 -3.711 15.889 1.00 0.00 H new ATOM 0 HH21 ARG A 458 7.931 -4.401 12.930 1.00 0.00 H new ATOM 0 HH22 ARG A 458 7.924 -4.500 14.694 1.00 0.00 H new ATOM 1064 N VAL A 459 4.397 -1.812 7.838 1.00 0.00 N ATOM 1065 CA VAL A 459 5.337 -1.053 7.028 1.00 0.00 C ATOM 1066 C VAL A 459 6.610 -0.734 7.800 1.00 0.00 C ATOM 1067 O VAL A 459 6.576 -0.043 8.814 1.00 0.00 O ATOM 1068 CB VAL A 459 4.706 0.238 6.494 1.00 0.00 C ATOM 1069 CG1 VAL A 459 5.653 0.958 5.542 1.00 0.00 C ATOM 1070 CG2 VAL A 459 3.406 -0.081 5.807 1.00 0.00 C ATOM 0 H VAL A 459 3.562 -1.295 8.113 1.00 0.00 H new ATOM 0 HA VAL A 459 5.600 -1.682 6.178 1.00 0.00 H new ATOM 0 HB VAL A 459 4.512 0.905 7.334 1.00 0.00 H new ATOM 0 HG11 VAL A 459 5.180 1.870 5.179 1.00 0.00 H new ATOM 0 HG12 VAL A 459 6.574 1.212 6.067 1.00 0.00 H new ATOM 0 HG13 VAL A 459 5.884 0.308 4.698 1.00 0.00 H new ATOM 0 HG21 VAL A 459 2.959 0.838 5.428 1.00 0.00 H new ATOM 0 HG22 VAL A 459 3.591 -0.763 4.977 1.00 0.00 H new ATOM 0 HG23 VAL A 459 2.725 -0.550 6.517 1.00 0.00 H new ATOM 1080 N ARG A 460 7.710 -1.235 7.295 1.00 0.00 N ATOM 1081 CA ARG A 460 9.011 -1.083 7.920 1.00 0.00 C ATOM 1082 C ARG A 460 9.708 0.217 7.450 1.00 0.00 C ATOM 1083 O ARG A 460 10.106 1.038 8.261 1.00 0.00 O ATOM 1084 CB ARG A 460 9.837 -2.385 7.653 1.00 0.00 C ATOM 1085 CG ARG A 460 11.279 -2.457 8.189 1.00 0.00 C ATOM 1086 CD ARG A 460 12.265 -1.785 7.249 1.00 0.00 C ATOM 1087 NE ARG A 460 13.660 -1.928 7.670 1.00 0.00 N ATOM 1088 CZ ARG A 460 14.712 -1.608 6.897 1.00 0.00 C ATOM 1089 NH1 ARG A 460 14.513 -1.153 5.661 1.00 0.00 N ATOM 1090 NH2 ARG A 460 15.945 -1.758 7.349 1.00 0.00 N ATOM 0 H ARG A 460 7.733 -1.768 6.426 1.00 0.00 H new ATOM 0 HA ARG A 460 8.914 -0.967 8.999 1.00 0.00 H new ATOM 0 HB2 ARG A 460 9.283 -3.223 8.076 1.00 0.00 H new ATOM 0 HB3 ARG A 460 9.875 -2.540 6.575 1.00 0.00 H new ATOM 0 HG2 ARG A 460 11.327 -1.980 9.168 1.00 0.00 H new ATOM 0 HG3 ARG A 460 11.563 -3.500 8.329 1.00 0.00 H new ATOM 0 HD2 ARG A 460 12.149 -2.207 6.251 1.00 0.00 H new ATOM 0 HD3 ARG A 460 12.022 -0.725 7.177 1.00 0.00 H new ATOM 0 HE ARG A 460 13.844 -2.292 8.605 1.00 0.00 H new ATOM 0 HH11 ARG A 460 13.564 -1.048 5.303 1.00 0.00 H new ATOM 0 HH12 ARG A 460 15.310 -0.910 5.073 1.00 0.00 H new ATOM 0 HH21 ARG A 460 16.103 -2.119 8.290 1.00 0.00 H new ATOM 0 HH22 ARG A 460 16.739 -1.513 6.757 1.00 0.00 H new ATOM 1104 N ALA A 461 9.851 0.385 6.162 1.00 0.00 N ATOM 1105 CA ALA A 461 10.477 1.570 5.582 1.00 0.00 C ATOM 1106 C ALA A 461 9.623 2.064 4.465 1.00 0.00 C ATOM 1107 O ALA A 461 8.975 1.264 3.777 1.00 0.00 O ATOM 1108 CB ALA A 461 11.868 1.237 5.059 1.00 0.00 C ATOM 0 H ALA A 461 9.538 -0.296 5.470 1.00 0.00 H new ATOM 0 HA ALA A 461 10.574 2.339 6.348 1.00 0.00 H new ATOM 0 HB1 ALA A 461 12.319 2.132 4.630 1.00 0.00 H new ATOM 0 HB2 ALA A 461 12.488 0.875 5.879 1.00 0.00 H new ATOM 0 HB3 ALA A 461 11.794 0.465 4.293 1.00 0.00 H new ATOM 1114 N MET A 462 9.599 3.356 4.290 1.00 0.00 N ATOM 1115 CA MET A 462 8.802 3.952 3.259 1.00 0.00 C ATOM 1116 C MET A 462 9.729 4.607 2.284 1.00 0.00 C ATOM 1117 O MET A 462 10.468 5.527 2.648 1.00 0.00 O ATOM 1118 CB MET A 462 7.896 5.024 3.860 1.00 0.00 C ATOM 1119 CG MET A 462 6.879 5.628 2.904 1.00 0.00 C ATOM 1120 SD MET A 462 5.525 4.526 2.542 1.00 0.00 S ATOM 1121 CE MET A 462 4.793 4.449 4.166 1.00 0.00 C ATOM 0 H MET A 462 10.128 4.020 4.855 1.00 0.00 H new ATOM 0 HA MET A 462 8.190 3.191 2.774 1.00 0.00 H new ATOM 0 HB2 MET A 462 7.362 4.592 4.706 1.00 0.00 H new ATOM 0 HB3 MET A 462 8.521 5.826 4.253 1.00 0.00 H new ATOM 0 HG2 MET A 462 6.486 6.549 3.335 1.00 0.00 H new ATOM 0 HG3 MET A 462 7.379 5.899 1.974 1.00 0.00 H new ATOM 0 HE1 MET A 462 3.784 4.044 4.091 1.00 0.00 H new ATOM 0 HE2 MET A 462 5.396 3.805 4.807 1.00 0.00 H new ATOM 0 HE3 MET A 462 4.752 5.450 4.594 1.00 0.00 H new ATOM 1131 N VAL A 463 9.725 4.139 1.094 1.00 0.00 N ATOM 1132 CA VAL A 463 10.493 4.736 0.050 1.00 0.00 C ATOM 1133 C VAL A 463 9.487 5.337 -0.884 1.00 0.00 C ATOM 1134 O VAL A 463 8.511 4.700 -1.204 1.00 0.00 O ATOM 1135 CB VAL A 463 11.358 3.692 -0.697 1.00 0.00 C ATOM 1136 CG1 VAL A 463 12.225 4.361 -1.745 1.00 0.00 C ATOM 1137 CG2 VAL A 463 12.216 2.900 0.284 1.00 0.00 C ATOM 0 H VAL A 463 9.186 3.323 0.806 1.00 0.00 H new ATOM 0 HA VAL A 463 11.188 5.475 0.450 1.00 0.00 H new ATOM 0 HB VAL A 463 10.687 2.997 -1.203 1.00 0.00 H new ATOM 0 HG11 VAL A 463 12.824 3.608 -2.257 1.00 0.00 H new ATOM 0 HG12 VAL A 463 11.591 4.874 -2.469 1.00 0.00 H new ATOM 0 HG13 VAL A 463 12.884 5.084 -1.264 1.00 0.00 H new ATOM 0 HG21 VAL A 463 12.816 2.172 -0.263 1.00 0.00 H new ATOM 0 HG22 VAL A 463 12.874 3.581 0.823 1.00 0.00 H new ATOM 0 HG23 VAL A 463 11.572 2.380 0.993 1.00 0.00 H new ATOM 1147 N ASN A 464 9.666 6.544 -1.279 1.00 0.00 N ATOM 1148 CA ASN A 464 8.640 7.166 -2.080 1.00 0.00 C ATOM 1149 C ASN A 464 9.047 7.216 -3.537 1.00 0.00 C ATOM 1150 O ASN A 464 10.141 6.802 -3.873 1.00 0.00 O ATOM 1151 CB ASN A 464 8.283 8.555 -1.540 1.00 0.00 C ATOM 1152 CG ASN A 464 9.228 9.660 -1.969 1.00 0.00 C ATOM 1153 OD1 ASN A 464 9.002 10.306 -2.977 1.00 0.00 O ATOM 1154 ND2 ASN A 464 10.297 9.863 -1.254 1.00 0.00 N ATOM 0 H ASN A 464 10.483 7.120 -1.076 1.00 0.00 H new ATOM 0 HA ASN A 464 7.740 6.554 -2.014 1.00 0.00 H new ATOM 0 HB2 ASN A 464 7.275 8.810 -1.867 1.00 0.00 H new ATOM 0 HB3 ASN A 464 8.264 8.513 -0.451 1.00 0.00 H new ATOM 0 HD21 ASN A 464 10.970 10.577 -1.534 1.00 0.00 H new ATOM 0 HD22 ASN A 464 10.462 9.308 -0.414 1.00 0.00 H new ATOM 1161 N ASP A 465 8.160 7.737 -4.377 1.00 0.00 N ATOM 1162 CA ASP A 465 8.349 7.884 -5.846 1.00 0.00 C ATOM 1163 C ASP A 465 9.661 8.604 -6.215 1.00 0.00 C ATOM 1164 O ASP A 465 10.261 8.341 -7.258 1.00 0.00 O ATOM 1165 CB ASP A 465 7.138 8.640 -6.417 1.00 0.00 C ATOM 1166 CG ASP A 465 7.215 8.954 -7.898 1.00 0.00 C ATOM 1167 OD1 ASP A 465 7.287 8.036 -8.724 1.00 0.00 O ATOM 1168 OD2 ASP A 465 7.120 10.147 -8.266 1.00 0.00 O ATOM 0 H ASP A 465 7.255 8.085 -4.061 1.00 0.00 H new ATOM 0 HA ASP A 465 8.422 6.888 -6.282 1.00 0.00 H new ATOM 0 HB2 ASP A 465 6.241 8.049 -6.233 1.00 0.00 H new ATOM 0 HB3 ASP A 465 7.022 9.575 -5.869 1.00 0.00 H new ATOM 1173 N SER A 466 10.112 9.487 -5.349 1.00 0.00 N ATOM 1174 CA SER A 466 11.347 10.205 -5.565 1.00 0.00 C ATOM 1175 C SER A 466 12.562 9.309 -5.222 1.00 0.00 C ATOM 1176 O SER A 466 13.690 9.592 -5.619 1.00 0.00 O ATOM 1177 CB SER A 466 11.341 11.514 -4.743 1.00 0.00 C ATOM 1178 OG SER A 466 12.539 12.266 -4.896 1.00 0.00 O ATOM 0 H SER A 466 9.634 9.725 -4.480 1.00 0.00 H new ATOM 0 HA SER A 466 11.433 10.472 -6.618 1.00 0.00 H new ATOM 0 HB2 SER A 466 10.492 12.126 -5.048 1.00 0.00 H new ATOM 0 HB3 SER A 466 11.199 11.275 -3.689 1.00 0.00 H new ATOM 0 HG SER A 466 12.483 13.083 -4.358 1.00 0.00 H new ATOM 1184 N GLY A 467 12.327 8.238 -4.489 1.00 0.00 N ATOM 1185 CA GLY A 467 13.385 7.295 -4.164 1.00 0.00 C ATOM 1186 C GLY A 467 13.928 7.508 -2.781 1.00 0.00 C ATOM 1187 O GLY A 467 14.783 6.766 -2.314 1.00 0.00 O ATOM 0 H GLY A 467 11.413 7.997 -4.106 1.00 0.00 H new ATOM 0 HA2 GLY A 467 13.002 6.278 -4.250 1.00 0.00 H new ATOM 0 HA3 GLY A 467 14.193 7.394 -4.889 1.00 0.00 H new ATOM 1191 N ARG A 468 13.408 8.500 -2.116 1.00 0.00 N ATOM 1192 CA ARG A 468 13.875 8.858 -0.799 1.00 0.00 C ATOM 1193 C ARG A 468 13.082 8.159 0.282 1.00 0.00 C ATOM 1194 O ARG A 468 11.879 7.864 0.103 1.00 0.00 O ATOM 1195 CB ARG A 468 13.817 10.377 -0.584 1.00 0.00 C ATOM 1196 CG ARG A 468 14.964 11.187 -1.204 1.00 0.00 C ATOM 1197 CD ARG A 468 14.961 11.164 -2.721 1.00 0.00 C ATOM 1198 NE ARG A 468 16.057 11.975 -3.278 1.00 0.00 N ATOM 1199 CZ ARG A 468 16.341 12.126 -4.582 1.00 0.00 C ATOM 1200 NH1 ARG A 468 15.636 11.485 -5.509 1.00 0.00 N ATOM 1201 NH2 ARG A 468 17.339 12.916 -4.959 1.00 0.00 N ATOM 0 H ARG A 468 12.650 9.085 -2.467 1.00 0.00 H new ATOM 0 HA ARG A 468 14.913 8.531 -0.731 1.00 0.00 H new ATOM 0 HB2 ARG A 468 12.876 10.746 -0.991 1.00 0.00 H new ATOM 0 HB3 ARG A 468 13.799 10.572 0.488 1.00 0.00 H new ATOM 0 HG2 ARG A 468 14.896 12.220 -0.863 1.00 0.00 H new ATOM 0 HG3 ARG A 468 15.914 10.794 -0.843 1.00 0.00 H new ATOM 0 HD2 ARG A 468 15.055 10.136 -3.070 1.00 0.00 H new ATOM 0 HD3 ARG A 468 14.006 11.540 -3.089 1.00 0.00 H new ATOM 0 HE ARG A 468 16.654 12.466 -2.613 1.00 0.00 H new ATOM 0 HH11 ARG A 468 14.870 10.871 -5.233 1.00 0.00 H new ATOM 0 HH12 ARG A 468 15.861 11.608 -6.496 1.00 0.00 H new ATOM 0 HH21 ARG A 468 17.892 13.409 -4.258 1.00 0.00 H new ATOM 0 HH22 ARG A 468 17.553 13.029 -5.950 1.00 0.00 H new ATOM 1215 N ARG A 469 13.753 7.897 1.380 1.00 0.00 N ATOM 1216 CA ARG A 469 13.164 7.319 2.557 1.00 0.00 C ATOM 1217 C ARG A 469 12.353 8.383 3.269 1.00 0.00 C ATOM 1218 O ARG A 469 12.833 9.490 3.507 1.00 0.00 O ATOM 1219 CB ARG A 469 14.264 6.762 3.495 1.00 0.00 C ATOM 1220 CG ARG A 469 13.797 6.458 4.927 1.00 0.00 C ATOM 1221 CD ARG A 469 12.766 5.346 5.003 1.00 0.00 C ATOM 1222 NE ARG A 469 12.158 5.296 6.353 1.00 0.00 N ATOM 1223 CZ ARG A 469 12.444 4.397 7.317 1.00 0.00 C ATOM 1224 NH1 ARG A 469 13.336 3.436 7.100 1.00 0.00 N ATOM 1225 NH2 ARG A 469 11.850 4.492 8.508 1.00 0.00 N ATOM 0 H ARG A 469 14.750 8.087 1.478 1.00 0.00 H new ATOM 0 HA ARG A 469 12.514 6.492 2.272 1.00 0.00 H new ATOM 0 HB2 ARG A 469 14.666 5.848 3.057 1.00 0.00 H new ATOM 0 HB3 ARG A 469 15.082 7.481 3.540 1.00 0.00 H new ATOM 0 HG2 ARG A 469 14.661 6.184 5.532 1.00 0.00 H new ATOM 0 HG3 ARG A 469 13.376 7.364 5.364 1.00 0.00 H new ATOM 0 HD2 ARG A 469 11.991 5.508 4.254 1.00 0.00 H new ATOM 0 HD3 ARG A 469 13.236 4.390 4.773 1.00 0.00 H new ATOM 0 HE ARG A 469 11.460 6.006 6.574 1.00 0.00 H new ATOM 0 HH11 ARG A 469 13.810 3.374 6.199 1.00 0.00 H new ATOM 0 HH12 ARG A 469 13.546 2.760 7.834 1.00 0.00 H new ATOM 0 HH21 ARG A 469 11.183 5.242 8.687 1.00 0.00 H new ATOM 0 HH22 ARG A 469 12.063 3.814 9.240 1.00 0.00 H new ATOM 1239 N VAL A 470 11.143 8.053 3.584 1.00 0.00 N ATOM 1240 CA VAL A 470 10.247 8.945 4.274 1.00 0.00 C ATOM 1241 C VAL A 470 9.518 8.153 5.334 1.00 0.00 C ATOM 1242 O VAL A 470 9.829 6.967 5.536 1.00 0.00 O ATOM 1243 CB VAL A 470 9.238 9.661 3.307 1.00 0.00 C ATOM 1244 CG1 VAL A 470 9.952 10.666 2.413 1.00 0.00 C ATOM 1245 CG2 VAL A 470 8.489 8.658 2.450 1.00 0.00 C ATOM 0 H VAL A 470 10.735 7.143 3.369 1.00 0.00 H new ATOM 0 HA VAL A 470 10.831 9.744 4.731 1.00 0.00 H new ATOM 0 HB VAL A 470 8.519 10.193 3.931 1.00 0.00 H new ATOM 0 HG11 VAL A 470 9.228 11.146 1.754 1.00 0.00 H new ATOM 0 HG12 VAL A 470 10.438 11.422 3.031 1.00 0.00 H new ATOM 0 HG13 VAL A 470 10.702 10.151 1.813 1.00 0.00 H new ATOM 0 HG21 VAL A 470 7.799 9.186 1.792 1.00 0.00 H new ATOM 0 HG22 VAL A 470 9.200 8.090 1.850 1.00 0.00 H new ATOM 0 HG23 VAL A 470 7.930 7.977 3.092 1.00 0.00 H new ATOM 1255 N LYS A 471 8.597 8.766 6.023 1.00 0.00 N ATOM 1256 CA LYS A 471 7.868 8.058 7.046 1.00 0.00 C ATOM 1257 C LYS A 471 6.420 7.852 6.673 1.00 0.00 C ATOM 1258 O LYS A 471 5.785 6.913 7.148 1.00 0.00 O ATOM 1259 CB LYS A 471 7.945 8.762 8.409 1.00 0.00 C ATOM 1260 CG LYS A 471 7.495 10.223 8.405 1.00 0.00 C ATOM 1261 CD LYS A 471 7.244 10.741 9.814 1.00 0.00 C ATOM 1262 CE LYS A 471 5.941 10.182 10.396 1.00 0.00 C ATOM 1263 NZ LYS A 471 4.745 10.737 9.712 1.00 0.00 N ATOM 0 H LYS A 471 8.333 9.743 5.900 1.00 0.00 H new ATOM 0 HA LYS A 471 8.351 7.085 7.129 1.00 0.00 H new ATOM 0 HB2 LYS A 471 7.332 8.210 9.122 1.00 0.00 H new ATOM 0 HB3 LYS A 471 8.973 8.715 8.769 1.00 0.00 H new ATOM 0 HG2 LYS A 471 8.256 10.836 7.922 1.00 0.00 H new ATOM 0 HG3 LYS A 471 6.584 10.321 7.814 1.00 0.00 H new ATOM 0 HD2 LYS A 471 8.079 10.465 10.458 1.00 0.00 H new ATOM 0 HD3 LYS A 471 7.199 11.830 9.799 1.00 0.00 H new ATOM 0 HE2 LYS A 471 5.940 9.096 10.305 1.00 0.00 H new ATOM 0 HE3 LYS A 471 5.890 10.413 11.460 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 4.052 9.978 9.553 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 4.318 11.477 10.305 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 5.026 11.146 8.798 1.00 0.00 H new ATOM 1277 N GLU A 472 5.899 8.696 5.820 1.00 0.00 N ATOM 1278 CA GLU A 472 4.492 8.665 5.541 1.00 0.00 C ATOM 1279 C GLU A 472 4.236 9.106 4.107 1.00 0.00 C ATOM 1280 O GLU A 472 5.083 9.781 3.497 1.00 0.00 O ATOM 1281 CB GLU A 472 3.824 9.601 6.538 1.00 0.00 C ATOM 1282 CG GLU A 472 2.329 9.501 6.657 1.00 0.00 C ATOM 1283 CD GLU A 472 1.833 10.386 7.756 1.00 0.00 C ATOM 1284 OE1 GLU A 472 2.173 10.131 8.937 1.00 0.00 O ATOM 1285 OE2 GLU A 472 1.121 11.358 7.467 1.00 0.00 O ATOM 0 H GLU A 472 6.425 9.407 5.312 1.00 0.00 H new ATOM 0 HA GLU A 472 4.086 7.658 5.642 1.00 0.00 H new ATOM 0 HB2 GLU A 472 4.257 9.417 7.521 1.00 0.00 H new ATOM 0 HB3 GLU A 472 4.076 10.626 6.265 1.00 0.00 H new ATOM 0 HG2 GLU A 472 1.863 9.786 5.714 1.00 0.00 H new ATOM 0 HG3 GLU A 472 2.042 8.468 6.855 1.00 0.00 H new ATOM 1292 N ALA A 473 3.109 8.709 3.573 1.00 0.00 N ATOM 1293 CA ALA A 473 2.719 9.044 2.236 1.00 0.00 C ATOM 1294 C ALA A 473 1.216 9.173 2.148 1.00 0.00 C ATOM 1295 O ALA A 473 0.475 8.331 2.690 1.00 0.00 O ATOM 1296 CB ALA A 473 3.203 7.991 1.282 1.00 0.00 C ATOM 0 H ALA A 473 2.428 8.134 4.068 1.00 0.00 H new ATOM 0 HA ALA A 473 3.169 10.000 1.967 1.00 0.00 H new ATOM 0 HB1 ALA A 473 2.902 8.253 0.268 1.00 0.00 H new ATOM 0 HB2 ALA A 473 4.290 7.926 1.333 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.769 7.028 1.552 1.00 0.00 H new ATOM 1302 N GLY A 474 0.769 10.201 1.473 1.00 0.00 N ATOM 1303 CA GLY A 474 -0.642 10.444 1.329 1.00 0.00 C ATOM 1304 C GLY A 474 -1.216 9.702 0.141 1.00 0.00 C ATOM 1305 O GLY A 474 -0.457 9.206 -0.697 1.00 0.00 O ATOM 0 H GLY A 474 1.367 10.887 1.012 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -1.160 10.135 2.237 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -0.818 11.513 1.211 1.00 0.00 H new ATOM 1309 N PRO A 475 -2.551 9.628 0.021 1.00 0.00 N ATOM 1310 CA PRO A 475 -3.218 8.907 -1.072 1.00 0.00 C ATOM 1311 C PRO A 475 -2.917 9.496 -2.440 1.00 0.00 C ATOM 1312 O PRO A 475 -2.609 10.698 -2.566 1.00 0.00 O ATOM 1313 CB PRO A 475 -4.703 9.052 -0.747 1.00 0.00 C ATOM 1314 CG PRO A 475 -4.780 10.271 0.104 1.00 0.00 C ATOM 1315 CD PRO A 475 -3.528 10.264 0.928 1.00 0.00 C ATOM 0 HA PRO A 475 -2.878 7.873 -1.132 1.00 0.00 H new ATOM 0 HB2 PRO A 475 -5.299 9.162 -1.653 1.00 0.00 H new ATOM 0 HB3 PRO A 475 -5.082 8.176 -0.221 1.00 0.00 H new ATOM 0 HG2 PRO A 475 -4.843 11.172 -0.506 1.00 0.00 H new ATOM 0 HG3 PRO A 475 -5.667 10.252 0.737 1.00 0.00 H new ATOM 0 HD2 PRO A 475 -3.223 11.271 1.211 1.00 0.00 H new ATOM 0 HD3 PRO A 475 -3.653 9.698 1.851 1.00 0.00 H new ATOM 1323 N SER A 476 -2.994 8.627 -3.448 1.00 0.00 N ATOM 1324 CA SER A 476 -2.751 8.956 -4.844 1.00 0.00 C ATOM 1325 C SER A 476 -1.258 9.213 -5.117 1.00 0.00 C ATOM 1326 O SER A 476 -0.880 9.818 -6.132 1.00 0.00 O ATOM 1327 CB SER A 476 -3.655 10.116 -5.290 1.00 0.00 C ATOM 1328 OG SER A 476 -5.025 9.792 -5.019 1.00 0.00 O ATOM 0 H SER A 476 -3.235 7.646 -3.306 1.00 0.00 H new ATOM 0 HA SER A 476 -3.017 8.093 -5.454 1.00 0.00 H new ATOM 0 HB2 SER A 476 -3.376 11.030 -4.765 1.00 0.00 H new ATOM 0 HB3 SER A 476 -3.520 10.307 -6.355 1.00 0.00 H new ATOM 0 HG SER A 476 -5.116 8.823 -4.906 1.00 0.00 H new ATOM 1334 N MET A 477 -0.419 8.685 -4.241 1.00 0.00 N ATOM 1335 CA MET A 477 1.009 8.819 -4.376 1.00 0.00 C ATOM 1336 C MET A 477 1.679 7.445 -4.466 1.00 0.00 C ATOM 1337 O MET A 477 1.278 6.514 -3.754 1.00 0.00 O ATOM 1338 CB MET A 477 1.585 9.622 -3.213 1.00 0.00 C ATOM 1339 CG MET A 477 3.092 9.750 -3.256 1.00 0.00 C ATOM 1340 SD MET A 477 3.735 10.913 -2.044 1.00 0.00 S ATOM 1341 CE MET A 477 5.458 10.952 -2.511 1.00 0.00 C ATOM 0 H MET A 477 -0.714 8.154 -3.421 1.00 0.00 H new ATOM 0 HA MET A 477 1.214 9.358 -5.301 1.00 0.00 H new ATOM 0 HB2 MET A 477 1.143 10.619 -3.216 1.00 0.00 H new ATOM 0 HB3 MET A 477 1.295 9.148 -2.275 1.00 0.00 H new ATOM 0 HG2 MET A 477 3.539 8.771 -3.084 1.00 0.00 H new ATOM 0 HG3 MET A 477 3.396 10.068 -4.253 1.00 0.00 H new ATOM 0 HE1 MET A 477 6.076 11.011 -1.615 1.00 0.00 H new ATOM 0 HE2 MET A 477 5.706 10.046 -3.064 1.00 0.00 H new ATOM 0 HE3 MET A 477 5.645 11.823 -3.139 1.00 0.00 H new ATOM 1351 N PRO A 478 2.662 7.282 -5.385 1.00 0.00 N ATOM 1352 CA PRO A 478 3.420 6.040 -5.523 1.00 0.00 C ATOM 1353 C PRO A 478 4.497 5.917 -4.452 1.00 0.00 C ATOM 1354 O PRO A 478 5.320 6.833 -4.273 1.00 0.00 O ATOM 1355 CB PRO A 478 4.111 6.170 -6.884 1.00 0.00 C ATOM 1356 CG PRO A 478 3.654 7.458 -7.482 1.00 0.00 C ATOM 1357 CD PRO A 478 3.095 8.283 -6.376 1.00 0.00 C ATOM 0 HA PRO A 478 2.769 5.171 -5.430 1.00 0.00 H new ATOM 0 HB2 PRO A 478 5.195 6.161 -6.769 1.00 0.00 H new ATOM 0 HB3 PRO A 478 3.852 5.331 -7.530 1.00 0.00 H new ATOM 0 HG2 PRO A 478 4.484 7.974 -7.965 1.00 0.00 H new ATOM 0 HG3 PRO A 478 2.900 7.280 -8.248 1.00 0.00 H new ATOM 0 HD2 PRO A 478 3.843 8.960 -5.963 1.00 0.00 H new ATOM 0 HD3 PRO A 478 2.262 8.898 -6.716 1.00 0.00 H new ATOM 1365 N VAL A 479 4.495 4.817 -3.746 1.00 0.00 N ATOM 1366 CA VAL A 479 5.488 4.546 -2.717 1.00 0.00 C ATOM 1367 C VAL A 479 5.842 3.074 -2.695 1.00 0.00 C ATOM 1368 O VAL A 479 5.060 2.236 -3.136 1.00 0.00 O ATOM 1369 CB VAL A 479 5.028 4.981 -1.298 1.00 0.00 C ATOM 1370 CG1 VAL A 479 5.006 6.487 -1.166 1.00 0.00 C ATOM 1371 CG2 VAL A 479 3.655 4.421 -0.988 1.00 0.00 C ATOM 0 H VAL A 479 3.805 4.075 -3.862 1.00 0.00 H new ATOM 0 HA VAL A 479 6.364 5.141 -2.977 1.00 0.00 H new ATOM 0 HB VAL A 479 5.747 4.582 -0.583 1.00 0.00 H new ATOM 0 HG11 VAL A 479 4.680 6.760 -0.162 1.00 0.00 H new ATOM 0 HG12 VAL A 479 6.006 6.882 -1.343 1.00 0.00 H new ATOM 0 HG13 VAL A 479 4.316 6.906 -1.898 1.00 0.00 H new ATOM 0 HG21 VAL A 479 3.350 4.736 0.010 1.00 0.00 H new ATOM 0 HG22 VAL A 479 2.937 4.791 -1.720 1.00 0.00 H new ATOM 0 HG23 VAL A 479 3.688 3.332 -1.030 1.00 0.00 H new ATOM 1381 N GLU A 480 7.003 2.781 -2.204 1.00 0.00 N ATOM 1382 CA GLU A 480 7.508 1.454 -2.090 1.00 0.00 C ATOM 1383 C GLU A 480 7.690 1.133 -0.614 1.00 0.00 C ATOM 1384 O GLU A 480 8.475 1.780 0.099 1.00 0.00 O ATOM 1385 CB GLU A 480 8.813 1.315 -2.893 1.00 0.00 C ATOM 1386 CG GLU A 480 9.461 -0.060 -2.856 1.00 0.00 C ATOM 1387 CD GLU A 480 10.672 -0.139 -3.758 1.00 0.00 C ATOM 1388 OE1 GLU A 480 11.545 0.743 -3.687 1.00 0.00 O ATOM 1389 OE2 GLU A 480 10.806 -1.098 -4.545 1.00 0.00 O ATOM 0 H GLU A 480 7.650 3.490 -1.858 1.00 0.00 H new ATOM 0 HA GLU A 480 6.807 0.733 -2.511 1.00 0.00 H new ATOM 0 HB2 GLU A 480 8.609 1.573 -3.932 1.00 0.00 H new ATOM 0 HB3 GLU A 480 9.530 2.045 -2.518 1.00 0.00 H new ATOM 0 HG2 GLU A 480 9.755 -0.295 -1.833 1.00 0.00 H new ATOM 0 HG3 GLU A 480 8.733 -0.812 -3.159 1.00 0.00 H new ATOM 1396 N ILE A 481 6.929 0.181 -0.164 1.00 0.00 N ATOM 1397 CA ILE A 481 6.901 -0.225 1.218 1.00 0.00 C ATOM 1398 C ILE A 481 7.758 -1.442 1.441 1.00 0.00 C ATOM 1399 O ILE A 481 8.306 -2.027 0.499 1.00 0.00 O ATOM 1400 CB ILE A 481 5.473 -0.591 1.652 1.00 0.00 C ATOM 1401 CG1 ILE A 481 4.898 -1.690 0.736 1.00 0.00 C ATOM 1402 CG2 ILE A 481 4.602 0.646 1.661 1.00 0.00 C ATOM 1403 CD1 ILE A 481 3.548 -2.198 1.152 1.00 0.00 C ATOM 0 H ILE A 481 6.293 -0.351 -0.758 1.00 0.00 H new ATOM 0 HA ILE A 481 7.276 0.617 1.800 1.00 0.00 H new ATOM 0 HB ILE A 481 5.496 -0.991 2.666 1.00 0.00 H new ATOM 0 HG12 ILE A 481 4.829 -1.301 -0.280 1.00 0.00 H new ATOM 0 HG13 ILE A 481 5.596 -2.527 0.710 1.00 0.00 H new ATOM 0 HG21 ILE A 481 3.592 0.377 1.970 1.00 0.00 H new ATOM 0 HG22 ILE A 481 5.013 1.375 2.359 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.573 1.078 0.661 1.00 0.00 H new ATOM 0 HD11 ILE A 481 3.218 -2.968 0.454 1.00 0.00 H new ATOM 0 HD12 ILE A 481 3.611 -2.620 2.155 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.833 -1.375 1.149 1.00 0.00 H new ATOM 1415 N THR A 482 7.826 -1.832 2.680 1.00 0.00 N ATOM 1416 CA THR A 482 8.530 -2.987 3.138 1.00 0.00 C ATOM 1417 C THR A 482 7.840 -3.457 4.392 1.00 0.00 C ATOM 1418 O THR A 482 7.030 -2.716 4.961 1.00 0.00 O ATOM 1419 CB THR A 482 10.000 -2.657 3.473 1.00 0.00 C ATOM 1420 OG1 THR A 482 10.066 -1.368 4.082 1.00 0.00 O ATOM 1421 CG2 THR A 482 10.897 -2.700 2.253 1.00 0.00 C ATOM 0 H THR A 482 7.366 -1.324 3.436 1.00 0.00 H new ATOM 0 HA THR A 482 8.528 -3.748 2.358 1.00 0.00 H new ATOM 0 HB THR A 482 10.363 -3.421 4.161 1.00 0.00 H new ATOM 0 HG1 THR A 482 10.024 -0.676 3.389 1.00 0.00 H new ATOM 0 HG21 THR A 482 11.920 -2.460 2.545 1.00 0.00 H new ATOM 0 HG22 THR A 482 10.869 -3.698 1.816 1.00 0.00 H new ATOM 0 HG23 THR A 482 10.549 -1.973 1.520 1.00 0.00 H new ATOM 1429 N GLY A 483 8.156 -4.638 4.815 1.00 0.00 N ATOM 1430 CA GLY A 483 7.616 -5.192 6.019 1.00 0.00 C ATOM 1431 C GLY A 483 6.433 -6.102 5.810 1.00 0.00 C ATOM 1432 O GLY A 483 5.652 -6.349 6.738 1.00 0.00 O ATOM 0 H GLY A 483 8.806 -5.256 4.328 1.00 0.00 H new ATOM 0 HA2 GLY A 483 8.400 -5.748 6.532 1.00 0.00 H new ATOM 0 HA3 GLY A 483 7.320 -4.377 6.679 1.00 0.00 H new ATOM 1436 N LEU A 484 6.285 -6.611 4.611 1.00 0.00 N ATOM 1437 CA LEU A 484 5.262 -7.591 4.370 1.00 0.00 C ATOM 1438 C LEU A 484 5.840 -8.944 4.744 1.00 0.00 C ATOM 1439 O LEU A 484 5.140 -9.833 5.235 1.00 0.00 O ATOM 1440 CB LEU A 484 4.826 -7.594 2.908 1.00 0.00 C ATOM 1441 CG LEU A 484 3.650 -8.513 2.585 1.00 0.00 C ATOM 1442 CD1 LEU A 484 2.393 -8.050 3.301 1.00 0.00 C ATOM 1443 CD2 LEU A 484 3.422 -8.587 1.097 1.00 0.00 C ATOM 0 H LEU A 484 6.852 -6.366 3.800 1.00 0.00 H new ATOM 0 HA LEU A 484 4.379 -7.360 4.966 1.00 0.00 H new ATOM 0 HB2 LEU A 484 4.561 -6.576 2.622 1.00 0.00 H new ATOM 0 HB3 LEU A 484 5.676 -7.887 2.292 1.00 0.00 H new ATOM 0 HG LEU A 484 3.894 -9.514 2.940 1.00 0.00 H new ATOM 0 HD11 LEU A 484 1.568 -8.719 3.057 1.00 0.00 H new ATOM 0 HD12 LEU A 484 2.563 -8.061 4.378 1.00 0.00 H new ATOM 0 HD13 LEU A 484 2.145 -7.037 2.983 1.00 0.00 H new ATOM 0 HD21 LEU A 484 2.580 -9.247 0.890 1.00 0.00 H new ATOM 0 HD22 LEU A 484 3.205 -7.591 0.712 1.00 0.00 H new ATOM 0 HD23 LEU A 484 4.316 -8.977 0.611 1.00 0.00 H new ATOM 1455 N HIS A 485 7.155 -9.063 4.506 1.00 0.00 N ATOM 1456 CA HIS A 485 7.968 -10.233 4.823 1.00 0.00 C ATOM 1457 C HIS A 485 7.457 -11.486 4.064 1.00 0.00 C ATOM 1458 O HIS A 485 7.728 -12.628 4.442 1.00 0.00 O ATOM 1459 CB HIS A 485 7.994 -10.427 6.350 1.00 0.00 C ATOM 1460 CG HIS A 485 9.134 -11.254 6.886 1.00 0.00 C ATOM 1461 ND1 HIS A 485 10.284 -10.705 7.413 1.00 0.00 N ATOM 1462 CD2 HIS A 485 9.274 -12.596 7.007 1.00 0.00 C ATOM 1463 CE1 HIS A 485 11.069 -11.703 7.829 1.00 0.00 C ATOM 1464 NE2 HIS A 485 10.497 -12.881 7.605 1.00 0.00 N ATOM 0 H HIS A 485 7.696 -8.315 4.071 1.00 0.00 H new ATOM 0 HA HIS A 485 8.993 -10.077 4.486 1.00 0.00 H new ATOM 0 HB2 HIS A 485 8.029 -9.445 6.822 1.00 0.00 H new ATOM 0 HB3 HIS A 485 7.057 -10.893 6.654 1.00 0.00 H new ATOM 0 HD2 HIS A 485 8.549 -13.330 6.689 1.00 0.00 H new ATOM 0 HE1 HIS A 485 12.038 -11.570 8.286 1.00 0.00 H new ATOM 0 HE2 HIS A 485 10.876 -13.802 7.826 1.00 0.00 H new ATOM 1472 N ASP A 486 6.778 -11.246 2.975 1.00 0.00 N ATOM 1473 CA ASP A 486 6.273 -12.286 2.108 1.00 0.00 C ATOM 1474 C ASP A 486 6.384 -11.719 0.718 1.00 0.00 C ATOM 1475 O ASP A 486 6.814 -10.565 0.578 1.00 0.00 O ATOM 1476 CB ASP A 486 4.809 -12.649 2.420 1.00 0.00 C ATOM 1477 CG ASP A 486 4.394 -14.020 1.869 1.00 0.00 C ATOM 1478 OD1 ASP A 486 3.993 -14.122 0.691 1.00 0.00 O ATOM 1479 OD2 ASP A 486 4.484 -15.026 2.614 1.00 0.00 O ATOM 0 H ASP A 486 6.554 -10.304 2.656 1.00 0.00 H new ATOM 0 HA ASP A 486 6.838 -13.209 2.238 1.00 0.00 H new ATOM 0 HB2 ASP A 486 4.662 -12.639 3.500 1.00 0.00 H new ATOM 0 HB3 ASP A 486 4.155 -11.884 2.002 1.00 0.00 H new ATOM 1484 N VAL A 487 5.994 -12.448 -0.277 1.00 0.00 N ATOM 1485 CA VAL A 487 6.166 -12.007 -1.636 1.00 0.00 C ATOM 1486 C VAL A 487 4.902 -11.287 -2.096 1.00 0.00 C ATOM 1487 O VAL A 487 3.845 -11.906 -2.211 1.00 0.00 O ATOM 1488 CB VAL A 487 6.464 -13.200 -2.580 1.00 0.00 C ATOM 1489 CG1 VAL A 487 6.772 -12.720 -3.994 1.00 0.00 C ATOM 1490 CG2 VAL A 487 7.612 -14.038 -2.032 1.00 0.00 C ATOM 0 H VAL A 487 5.549 -13.361 -0.179 1.00 0.00 H new ATOM 0 HA VAL A 487 7.017 -11.327 -1.674 1.00 0.00 H new ATOM 0 HB VAL A 487 5.572 -13.824 -2.628 1.00 0.00 H new ATOM 0 HG11 VAL A 487 6.977 -13.579 -4.633 1.00 0.00 H new ATOM 0 HG12 VAL A 487 5.916 -12.171 -4.387 1.00 0.00 H new ATOM 0 HG13 VAL A 487 7.644 -12.066 -3.974 1.00 0.00 H new ATOM 0 HG21 VAL A 487 7.808 -14.871 -2.707 1.00 0.00 H new ATOM 0 HG22 VAL A 487 8.506 -13.420 -1.949 1.00 0.00 H new ATOM 0 HG23 VAL A 487 7.344 -14.423 -1.048 1.00 0.00 H new ATOM 1500 N PRO A 488 4.972 -9.970 -2.333 1.00 0.00 N ATOM 1501 CA PRO A 488 3.827 -9.212 -2.796 1.00 0.00 C ATOM 1502 C PRO A 488 3.610 -9.435 -4.288 1.00 0.00 C ATOM 1503 O PRO A 488 4.493 -9.963 -4.980 1.00 0.00 O ATOM 1504 CB PRO A 488 4.202 -7.745 -2.520 1.00 0.00 C ATOM 1505 CG PRO A 488 5.603 -7.757 -1.967 1.00 0.00 C ATOM 1506 CD PRO A 488 6.167 -9.126 -2.193 1.00 0.00 C ATOM 0 HA PRO A 488 2.903 -9.506 -2.298 1.00 0.00 H new ATOM 0 HB2 PRO A 488 4.151 -7.153 -3.434 1.00 0.00 H new ATOM 0 HB3 PRO A 488 3.509 -7.295 -1.810 1.00 0.00 H new ATOM 0 HG2 PRO A 488 6.216 -7.004 -2.461 1.00 0.00 H new ATOM 0 HG3 PRO A 488 5.597 -7.516 -0.904 1.00 0.00 H new ATOM 0 HD2 PRO A 488 6.790 -9.161 -3.087 1.00 0.00 H new ATOM 0 HD3 PRO A 488 6.789 -9.447 -1.358 1.00 0.00 H new ATOM 1514 N GLN A 489 2.468 -9.047 -4.793 1.00 0.00 N ATOM 1515 CA GLN A 489 2.176 -9.244 -6.157 1.00 0.00 C ATOM 1516 C GLN A 489 1.919 -7.923 -6.841 1.00 0.00 C ATOM 1517 O GLN A 489 1.217 -7.054 -6.328 1.00 0.00 O ATOM 1518 CB GLN A 489 0.986 -10.142 -6.271 1.00 0.00 C ATOM 1519 CG GLN A 489 0.526 -10.412 -7.662 1.00 0.00 C ATOM 1520 CD GLN A 489 1.498 -11.272 -8.431 1.00 0.00 C ATOM 1521 OE1 GLN A 489 2.419 -10.770 -9.089 1.00 0.00 O ATOM 1522 NE2 GLN A 489 1.300 -12.562 -8.381 1.00 0.00 N ATOM 0 H GLN A 489 1.729 -8.589 -4.259 1.00 0.00 H new ATOM 0 HA GLN A 489 3.029 -9.710 -6.650 1.00 0.00 H new ATOM 0 HB2 GLN A 489 1.221 -11.093 -5.792 1.00 0.00 H new ATOM 0 HB3 GLN A 489 0.162 -9.699 -5.712 1.00 0.00 H new ATOM 0 HG2 GLN A 489 -0.446 -10.905 -7.631 1.00 0.00 H new ATOM 0 HG3 GLN A 489 0.388 -9.466 -8.186 1.00 0.00 H new ATOM 0 HE21 GLN A 489 0.530 -12.939 -7.828 1.00 0.00 H new ATOM 0 HE22 GLN A 489 1.915 -13.193 -8.895 1.00 0.00 H new ATOM 1531 N ALA A 490 2.534 -7.772 -7.951 1.00 0.00 N ATOM 1532 CA ALA A 490 2.373 -6.607 -8.789 1.00 0.00 C ATOM 1533 C ALA A 490 0.994 -6.621 -9.445 1.00 0.00 C ATOM 1534 O ALA A 490 0.645 -7.568 -10.168 1.00 0.00 O ATOM 1535 CB ALA A 490 3.460 -6.572 -9.844 1.00 0.00 C ATOM 0 H ALA A 490 3.184 -8.462 -8.328 1.00 0.00 H new ATOM 0 HA ALA A 490 2.457 -5.712 -8.173 1.00 0.00 H new ATOM 0 HB1 ALA A 490 3.330 -5.690 -10.471 1.00 0.00 H new ATOM 0 HB2 ALA A 490 4.436 -6.533 -9.360 1.00 0.00 H new ATOM 0 HB3 ALA A 490 3.397 -7.468 -10.461 1.00 0.00 H new ATOM 1541 N GLY A 491 0.222 -5.592 -9.201 1.00 0.00 N ATOM 1542 CA GLY A 491 -1.109 -5.519 -9.754 1.00 0.00 C ATOM 1543 C GLY A 491 -2.140 -5.973 -8.761 1.00 0.00 C ATOM 1544 O GLY A 491 -3.334 -5.974 -9.050 1.00 0.00 O ATOM 0 H GLY A 491 0.490 -4.794 -8.625 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -1.322 -4.495 -10.060 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -1.167 -6.137 -10.650 1.00 0.00 H new ATOM 1548 N ASP A 492 -1.679 -6.360 -7.578 1.00 0.00 N ATOM 1549 CA ASP A 492 -2.567 -6.846 -6.526 1.00 0.00 C ATOM 1550 C ASP A 492 -3.210 -5.655 -5.819 1.00 0.00 C ATOM 1551 O ASP A 492 -3.081 -4.498 -6.265 1.00 0.00 O ATOM 1552 CB ASP A 492 -1.789 -7.652 -5.503 1.00 0.00 C ATOM 1553 CG ASP A 492 -2.633 -8.678 -4.762 1.00 0.00 C ATOM 1554 OD1 ASP A 492 -3.204 -8.329 -3.713 1.00 0.00 O ATOM 1555 OD2 ASP A 492 -2.738 -9.819 -5.235 1.00 0.00 O ATOM 0 H ASP A 492 -0.692 -6.347 -7.321 1.00 0.00 H new ATOM 0 HA ASP A 492 -3.329 -7.479 -6.980 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -0.968 -8.164 -6.005 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -1.343 -6.970 -4.779 1.00 0.00 H new ATOM 1560 N ARG A 493 -3.821 -5.914 -4.710 1.00 0.00 N ATOM 1561 CA ARG A 493 -4.583 -4.957 -4.021 1.00 0.00 C ATOM 1562 C ARG A 493 -4.321 -5.042 -2.547 1.00 0.00 C ATOM 1563 O ARG A 493 -4.376 -6.119 -1.945 1.00 0.00 O ATOM 1564 CB ARG A 493 -6.073 -5.153 -4.320 1.00 0.00 C ATOM 1565 CG ARG A 493 -6.682 -6.519 -3.940 1.00 0.00 C ATOM 1566 CD ARG A 493 -6.292 -7.621 -4.920 1.00 0.00 C ATOM 1567 NE ARG A 493 -6.681 -8.946 -4.454 1.00 0.00 N ATOM 1568 CZ ARG A 493 -6.621 -10.062 -5.191 1.00 0.00 C ATOM 1569 NH1 ARG A 493 -6.377 -9.994 -6.504 1.00 0.00 N ATOM 1570 NH2 ARG A 493 -6.847 -11.245 -4.617 1.00 0.00 N ATOM 0 H ARG A 493 -3.796 -6.827 -4.255 1.00 0.00 H new ATOM 0 HA ARG A 493 -4.291 -3.964 -4.362 1.00 0.00 H new ATOM 0 HB2 ARG A 493 -6.630 -4.375 -3.798 1.00 0.00 H new ATOM 0 HB3 ARG A 493 -6.230 -4.996 -5.387 1.00 0.00 H new ATOM 0 HG2 ARG A 493 -6.353 -6.794 -2.938 1.00 0.00 H new ATOM 0 HG3 ARG A 493 -7.768 -6.433 -3.907 1.00 0.00 H new ATOM 0 HD2 ARG A 493 -6.760 -7.427 -5.885 1.00 0.00 H new ATOM 0 HD3 ARG A 493 -5.214 -7.597 -5.078 1.00 0.00 H new ATOM 0 HE ARG A 493 -7.024 -9.029 -3.497 1.00 0.00 H new ATOM 0 HH11 ARG A 493 -6.235 -9.088 -6.950 1.00 0.00 H new ATOM 0 HH12 ARG A 493 -6.333 -10.848 -7.059 1.00 0.00 H new ATOM 0 HH21 ARG A 493 -7.064 -11.296 -3.622 1.00 0.00 H new ATOM 0 HH22 ARG A 493 -6.803 -12.099 -5.174 1.00 0.00 H new ATOM 1584 N PHE A 494 -4.036 -3.934 -1.959 1.00 0.00 N ATOM 1585 CA PHE A 494 -3.785 -3.929 -0.553 1.00 0.00 C ATOM 1586 C PHE A 494 -4.724 -2.973 0.126 1.00 0.00 C ATOM 1587 O PHE A 494 -5.243 -2.041 -0.481 1.00 0.00 O ATOM 1588 CB PHE A 494 -2.317 -3.561 -0.215 1.00 0.00 C ATOM 1589 CG PHE A 494 -2.032 -2.082 -0.182 1.00 0.00 C ATOM 1590 CD1 PHE A 494 -2.062 -1.320 -1.329 1.00 0.00 C ATOM 1591 CD2 PHE A 494 -1.771 -1.454 1.028 1.00 0.00 C ATOM 1592 CE1 PHE A 494 -1.839 0.033 -1.274 1.00 0.00 C ATOM 1593 CE2 PHE A 494 -1.551 -0.101 1.087 1.00 0.00 C ATOM 1594 CZ PHE A 494 -1.583 0.644 -0.063 1.00 0.00 C ATOM 0 H PHE A 494 -3.970 -3.026 -2.419 1.00 0.00 H new ATOM 0 HA PHE A 494 -3.955 -4.942 -0.187 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -2.064 -3.988 0.755 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -1.661 -4.028 -0.950 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -2.263 -1.791 -2.280 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -1.741 -2.038 1.936 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -1.864 0.621 -2.180 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -1.353 0.375 2.036 1.00 0.00 H new ATOM 0 HZ PHE A 494 -1.408 1.709 -0.022 1.00 0.00 H new ATOM 1604 N MET A 495 -4.888 -3.179 1.354 1.00 0.00 N ATOM 1605 CA MET A 495 -5.679 -2.352 2.189 1.00 0.00 C ATOM 1606 C MET A 495 -4.749 -1.796 3.226 1.00 0.00 C ATOM 1607 O MET A 495 -4.034 -2.552 3.893 1.00 0.00 O ATOM 1608 CB MET A 495 -6.787 -3.175 2.860 1.00 0.00 C ATOM 1609 CG MET A 495 -7.684 -2.381 3.799 1.00 0.00 C ATOM 1610 SD MET A 495 -8.941 -3.412 4.581 1.00 0.00 S ATOM 1611 CE MET A 495 -9.783 -2.199 5.604 1.00 0.00 C ATOM 0 H MET A 495 -4.461 -3.963 1.847 1.00 0.00 H new ATOM 0 HA MET A 495 -6.162 -1.559 1.618 1.00 0.00 H new ATOM 0 HB2 MET A 495 -7.405 -3.628 2.085 1.00 0.00 H new ATOM 0 HB3 MET A 495 -6.328 -3.990 3.419 1.00 0.00 H new ATOM 0 HG2 MET A 495 -7.073 -1.910 4.569 1.00 0.00 H new ATOM 0 HG3 MET A 495 -8.170 -1.579 3.242 1.00 0.00 H new ATOM 0 HE1 MET A 495 -10.590 -2.684 6.153 1.00 0.00 H new ATOM 0 HE2 MET A 495 -9.075 -1.764 6.309 1.00 0.00 H new ATOM 0 HE3 MET A 495 -10.195 -1.413 4.971 1.00 0.00 H new ATOM 1621 N VAL A 496 -4.688 -0.501 3.313 1.00 0.00 N ATOM 1622 CA VAL A 496 -3.841 0.116 4.292 1.00 0.00 C ATOM 1623 C VAL A 496 -4.670 0.223 5.568 1.00 0.00 C ATOM 1624 O VAL A 496 -5.897 0.365 5.481 1.00 0.00 O ATOM 1625 CB VAL A 496 -3.332 1.534 3.813 1.00 0.00 C ATOM 1626 CG1 VAL A 496 -4.352 2.646 4.044 1.00 0.00 C ATOM 1627 CG2 VAL A 496 -1.998 1.867 4.452 1.00 0.00 C ATOM 0 H VAL A 496 -5.210 0.146 2.723 1.00 0.00 H new ATOM 0 HA VAL A 496 -2.942 -0.478 4.457 1.00 0.00 H new ATOM 0 HB VAL A 496 -3.196 1.471 2.733 1.00 0.00 H new ATOM 0 HG11 VAL A 496 -3.943 3.594 3.694 1.00 0.00 H new ATOM 0 HG12 VAL A 496 -5.266 2.421 3.495 1.00 0.00 H new ATOM 0 HG13 VAL A 496 -4.577 2.718 5.108 1.00 0.00 H new ATOM 0 HG21 VAL A 496 -1.665 2.847 4.109 1.00 0.00 H new ATOM 0 HG22 VAL A 496 -2.107 1.879 5.536 1.00 0.00 H new ATOM 0 HG23 VAL A 496 -1.262 1.114 4.170 1.00 0.00 H new ATOM 1684 N GLU A 500 -7.429 7.546 11.686 1.00 0.00 N ATOM 1685 CA GLU A 500 -7.253 8.978 11.785 1.00 0.00 C ATOM 1686 C GLU A 500 -6.725 9.614 10.527 1.00 0.00 C ATOM 1687 O GLU A 500 -7.110 10.692 10.209 1.00 0.00 O ATOM 1688 CB GLU A 500 -6.357 9.351 12.964 1.00 0.00 C ATOM 1689 CG GLU A 500 -5.316 8.303 13.366 1.00 0.00 C ATOM 1690 CD GLU A 500 -4.356 7.816 12.275 1.00 0.00 C ATOM 1691 OE1 GLU A 500 -4.758 6.944 11.460 1.00 0.00 O ATOM 1692 OE2 GLU A 500 -3.199 8.244 12.241 1.00 0.00 O ATOM 0 HA GLU A 500 -8.255 9.375 11.947 1.00 0.00 H new ATOM 0 HB2 GLU A 500 -5.837 10.278 12.722 1.00 0.00 H new ATOM 0 HB3 GLU A 500 -6.990 9.556 13.827 1.00 0.00 H new ATOM 0 HG2 GLU A 500 -4.721 8.714 14.181 1.00 0.00 H new ATOM 0 HG3 GLU A 500 -5.845 7.436 13.762 1.00 0.00 H new ATOM 1699 N LYS A 501 -5.838 8.944 9.831 1.00 0.00 N ATOM 1700 CA LYS A 501 -5.243 9.496 8.619 1.00 0.00 C ATOM 1701 C LYS A 501 -6.268 9.735 7.540 1.00 0.00 C ATOM 1702 O LYS A 501 -6.305 10.791 6.920 1.00 0.00 O ATOM 1703 CB LYS A 501 -4.137 8.613 8.118 1.00 0.00 C ATOM 1704 CG LYS A 501 -2.987 8.538 9.079 1.00 0.00 C ATOM 1705 CD LYS A 501 -1.851 7.694 8.570 1.00 0.00 C ATOM 1706 CE LYS A 501 -0.778 7.593 9.626 1.00 0.00 C ATOM 1707 NZ LYS A 501 -1.257 6.858 10.809 1.00 0.00 N ATOM 0 H LYS A 501 -5.506 8.012 10.077 1.00 0.00 H new ATOM 0 HA LYS A 501 -4.821 10.466 8.882 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -4.527 7.610 7.943 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -3.782 8.989 7.159 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -2.622 9.545 9.280 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -3.339 8.131 10.027 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -2.213 6.699 8.310 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -1.439 8.132 7.661 1.00 0.00 H new ATOM 0 HE2 LYS A 501 0.096 7.090 9.212 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -0.460 8.593 9.921 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -0.486 6.776 11.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -2.055 7.370 11.237 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -1.569 5.908 10.524 1.00 0.00 H new ATOM 1721 N LYS A 502 -7.113 8.776 7.346 1.00 0.00 N ATOM 1722 CA LYS A 502 -8.167 8.896 6.376 1.00 0.00 C ATOM 1723 C LYS A 502 -9.258 9.822 6.911 1.00 0.00 C ATOM 1724 O LYS A 502 -9.931 10.510 6.156 1.00 0.00 O ATOM 1725 CB LYS A 502 -8.689 7.513 6.023 1.00 0.00 C ATOM 1726 CG LYS A 502 -9.766 7.462 4.947 1.00 0.00 C ATOM 1727 CD LYS A 502 -9.858 6.059 4.377 1.00 0.00 C ATOM 1728 CE LYS A 502 -10.205 5.022 5.433 1.00 0.00 C ATOM 1729 NZ LYS A 502 -9.767 3.679 5.026 1.00 0.00 N ATOM 0 H LYS A 502 -7.098 7.889 7.849 1.00 0.00 H new ATOM 0 HA LYS A 502 -7.791 9.345 5.457 1.00 0.00 H new ATOM 0 HB2 LYS A 502 -7.848 6.901 5.697 1.00 0.00 H new ATOM 0 HB3 LYS A 502 -9.086 7.054 6.928 1.00 0.00 H new ATOM 0 HG2 LYS A 502 -10.727 7.757 5.368 1.00 0.00 H new ATOM 0 HG3 LYS A 502 -9.534 8.172 4.153 1.00 0.00 H new ATOM 0 HD2 LYS A 502 -10.613 6.039 3.591 1.00 0.00 H new ATOM 0 HD3 LYS A 502 -8.907 5.796 3.913 1.00 0.00 H new ATOM 0 HE2 LYS A 502 -9.733 5.290 6.378 1.00 0.00 H new ATOM 0 HE3 LYS A 502 -11.282 5.020 5.604 1.00 0.00 H new ATOM 0 HZ1 LYS A 502 -10.599 3.074 4.874 1.00 0.00 H new ATOM 0 HZ2 LYS A 502 -9.221 3.745 4.143 1.00 0.00 H new ATOM 0 HZ3 LYS A 502 -9.171 3.267 5.772 1.00 0.00 H new ATOM 1743 N ALA A 503 -9.376 9.878 8.223 1.00 0.00 N ATOM 1744 CA ALA A 503 -10.314 10.766 8.853 1.00 0.00 C ATOM 1745 C ALA A 503 -9.860 12.206 8.698 1.00 0.00 C ATOM 1746 O ALA A 503 -10.635 13.050 8.263 1.00 0.00 O ATOM 1747 CB ALA A 503 -10.509 10.421 10.315 1.00 0.00 C ATOM 0 H ALA A 503 -8.827 9.313 8.871 1.00 0.00 H new ATOM 0 HA ALA A 503 -11.277 10.645 8.356 1.00 0.00 H new ATOM 0 HB1 ALA A 503 -11.224 11.113 10.760 1.00 0.00 H new ATOM 0 HB2 ALA A 503 -10.887 9.402 10.401 1.00 0.00 H new ATOM 0 HB3 ALA A 503 -9.556 10.499 10.838 1.00 0.00 H new ATOM 1753 N ARG A 504 -8.597 12.502 9.052 1.00 0.00 N ATOM 1754 CA ARG A 504 -8.045 13.834 8.915 1.00 0.00 C ATOM 1755 C ARG A 504 -7.948 14.287 7.461 1.00 0.00 C ATOM 1756 O ARG A 504 -7.936 15.483 7.184 1.00 0.00 O ATOM 1757 CB ARG A 504 -6.720 13.944 9.632 1.00 0.00 C ATOM 1758 CG ARG A 504 -5.598 13.090 9.088 1.00 0.00 C ATOM 1759 CD ARG A 504 -4.348 13.209 9.949 1.00 0.00 C ATOM 1760 NE ARG A 504 -4.638 12.945 11.371 1.00 0.00 N ATOM 1761 CZ ARG A 504 -3.896 12.216 12.198 1.00 0.00 C ATOM 1762 NH1 ARG A 504 -2.798 11.585 11.766 1.00 0.00 N ATOM 1763 NH2 ARG A 504 -4.262 12.126 13.467 1.00 0.00 N ATOM 0 H ARG A 504 -7.945 11.819 9.438 1.00 0.00 H new ATOM 0 HA ARG A 504 -8.743 14.520 9.394 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -6.401 14.986 9.607 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -6.874 13.683 10.679 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -5.917 12.049 9.048 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -5.369 13.393 8.066 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -3.594 12.506 9.595 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -3.927 14.209 9.843 1.00 0.00 H new ATOM 0 HE ARG A 504 -5.487 13.360 11.755 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -2.519 11.659 10.788 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -2.240 11.030 12.415 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -5.099 12.611 13.792 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -3.708 11.572 14.120 1.00 0.00 H new ATOM 1777 N GLN A 505 -7.902 13.325 6.551 1.00 0.00 N ATOM 1778 CA GLN A 505 -7.967 13.600 5.110 1.00 0.00 C ATOM 1779 C GLN A 505 -9.304 14.290 4.791 1.00 0.00 C ATOM 1780 O GLN A 505 -9.414 15.134 3.887 1.00 0.00 O ATOM 1781 CB GLN A 505 -7.845 12.283 4.333 1.00 0.00 C ATOM 1782 CG GLN A 505 -7.984 12.400 2.818 1.00 0.00 C ATOM 1783 CD GLN A 505 -7.859 11.058 2.109 1.00 0.00 C ATOM 1784 OE1 GLN A 505 -7.075 10.161 2.663 1.00 0.00 O flip ATOM 1785 NE2 GLN A 505 -8.462 10.836 1.054 1.00 0.00 N flip ATOM 0 H GLN A 505 -7.819 12.335 6.782 1.00 0.00 H new ATOM 0 HA GLN A 505 -7.148 14.256 4.816 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -6.876 11.837 4.558 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -8.606 11.594 4.698 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -8.951 12.843 2.580 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -7.220 13.079 2.439 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -9.063 11.554 0.650 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -8.359 9.935 0.587 1.00 0.00 H new ATOM 1794 N ILE A 506 -10.312 13.921 5.544 1.00 0.00 N ATOM 1795 CA ILE A 506 -11.614 14.516 5.432 1.00 0.00 C ATOM 1796 C ILE A 506 -11.688 15.767 6.327 1.00 0.00 C ATOM 1797 O ILE A 506 -12.167 16.808 5.901 1.00 0.00 O ATOM 1798 CB ILE A 506 -12.727 13.506 5.817 1.00 0.00 C ATOM 1799 CG1 ILE A 506 -12.585 12.230 4.972 1.00 0.00 C ATOM 1800 CG2 ILE A 506 -14.103 14.131 5.597 1.00 0.00 C ATOM 1801 CD1 ILE A 506 -13.556 11.128 5.338 1.00 0.00 C ATOM 0 H ILE A 506 -10.247 13.193 6.256 1.00 0.00 H new ATOM 0 HA ILE A 506 -11.776 14.806 4.394 1.00 0.00 H new ATOM 0 HB ILE A 506 -12.625 13.249 6.871 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -12.724 12.487 3.922 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -11.568 11.851 5.076 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -14.877 13.413 5.870 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -14.201 15.023 6.216 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -14.215 14.403 4.548 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -13.387 10.265 4.694 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -13.404 10.839 6.378 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -14.578 11.485 5.206 1.00 0.00 H new ATOM 1813 N GLY A 507 -11.192 15.652 7.554 1.00 0.00 N ATOM 1814 CA GLY A 507 -11.187 16.775 8.477 1.00 0.00 C ATOM 1815 C GLY A 507 -10.973 16.334 9.914 1.00 0.00 C ATOM 1816 O GLY A 507 -10.880 17.155 10.823 1.00 0.00 O ATOM 0 H GLY A 507 -10.790 14.793 7.930 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -10.401 17.474 8.192 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -12.133 17.311 8.400 1.00 0.00 H new