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 443 THR OG1 : rot -170:sc=-0.00176 USER MOD Set 1.2: A 501 LYS NZ :NH3+ -170:sc=-0.00639 (180deg=-0.19) USER MOD Set 2.1: A 426 LYS NZ :NH3+ 172:sc= 1.88 (180deg=1.79) USER MOD Set 2.2: A 436 THR OG1 : rot -42:sc= 0.563 USER MOD Set 3.1: A 421 THR OG1 : rot 72:sc= 0.192 USER MOD Set 3.2: A 440 GLN : amide:sc= -0.272 K(o=-0.081,f=-4.2!) USER MOD Single : A 429 LYS NZ :NH3+ -169:sc= -0.0239 (180deg=-0.156) USER MOD Single : A 445 LYS NZ :NH3+ -170:sc= -1.72! (180deg=-2.31!) 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 155:sc= -5.15! (180deg=-6.06!) USER MOD Single : A 464 ASN : amide:sc= -0.686! C(o=-0.69!,f=-6.6!) USER MOD Single : A 466 SER OG : rot 180:sc= 0 USER MOD Single : A 471 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 476 SER OG : rot 180:sc= 0 USER MOD Single : A 477 MET CE :methyl -170:sc= -0.905 (180deg=-0.995) USER MOD Single : A 482 THR OG1 : rot -64:sc= 1.27 USER MOD Single : A 485 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.11) USER MOD Single : A 489 GLN : amide:sc= 0 X(o=0,f=-0.46) USER MOD Single : A 495 MET CE :methyl 165:sc= -0.0408 (180deg=-0.345) USER MOD Single : A 502 LYS NZ :NH3+ 172:sc=-0.00805 (180deg=-0.121) USER MOD Single : A 505 GLN : amide:sc= -0.0482 K(o=-0.048,f=-0.66) USER MOD ----------------------------------------------------------------- ATOM 470 N VAL A 419 -9.281 0.518 -1.407 1.00 0.00 N ATOM 471 CA VAL A 419 -8.040 -0.192 -1.399 1.00 0.00 C ATOM 472 C VAL A 419 -7.113 0.513 -2.353 1.00 0.00 C ATOM 473 O VAL A 419 -7.497 1.502 -2.960 1.00 0.00 O ATOM 474 CB VAL A 419 -8.197 -1.705 -1.834 1.00 0.00 C ATOM 475 CG1 VAL A 419 -8.925 -2.520 -0.779 1.00 0.00 C ATOM 476 CG2 VAL A 419 -8.916 -1.831 -3.172 1.00 0.00 C ATOM 0 HA VAL A 419 -7.649 -0.202 -0.382 1.00 0.00 H new ATOM 0 HB VAL A 419 -7.189 -2.104 -1.943 1.00 0.00 H new ATOM 0 HG11 VAL A 419 -9.013 -3.553 -1.114 1.00 0.00 H new ATOM 0 HG12 VAL A 419 -8.365 -2.488 0.156 1.00 0.00 H new ATOM 0 HG13 VAL A 419 -9.920 -2.104 -0.620 1.00 0.00 H new ATOM 0 HG21 VAL A 419 -9.006 -2.884 -3.439 1.00 0.00 H new ATOM 0 HG22 VAL A 419 -9.910 -1.390 -3.094 1.00 0.00 H new ATOM 0 HG23 VAL A 419 -8.347 -1.309 -3.941 1.00 0.00 H new ATOM 486 N GLY A 420 -5.926 0.040 -2.459 1.00 0.00 N ATOM 487 CA GLY A 420 -4.990 0.582 -3.381 1.00 0.00 C ATOM 488 C GLY A 420 -4.502 -0.509 -4.270 1.00 0.00 C ATOM 489 O GLY A 420 -4.757 -1.693 -3.987 1.00 0.00 O ATOM 0 H GLY A 420 -5.571 -0.740 -1.906 1.00 0.00 H new ATOM 0 HA2 GLY A 420 -5.456 1.370 -3.972 1.00 0.00 H new ATOM 0 HA3 GLY A 420 -4.155 1.036 -2.848 1.00 0.00 H new ATOM 493 N THR A 421 -3.802 -0.171 -5.296 1.00 0.00 N ATOM 494 CA THR A 421 -3.314 -1.171 -6.192 1.00 0.00 C ATOM 495 C THR A 421 -1.789 -1.172 -6.150 1.00 0.00 C ATOM 496 O THR A 421 -1.158 -0.105 -6.038 1.00 0.00 O ATOM 497 CB THR A 421 -3.798 -0.906 -7.632 1.00 0.00 C ATOM 498 OG1 THR A 421 -5.164 -0.448 -7.596 1.00 0.00 O ATOM 499 CG2 THR A 421 -3.754 -2.198 -8.442 1.00 0.00 C ATOM 0 H THR A 421 -3.552 0.788 -5.539 1.00 0.00 H new ATOM 0 HA THR A 421 -3.698 -2.143 -5.881 1.00 0.00 H new ATOM 0 HB THR A 421 -3.151 -0.157 -8.089 1.00 0.00 H new ATOM 0 HG1 THR A 421 -5.193 0.467 -7.246 1.00 0.00 H new ATOM 0 HG21 THR A 421 -4.097 -2.002 -9.458 1.00 0.00 H new ATOM 0 HG22 THR A 421 -2.732 -2.575 -8.471 1.00 0.00 H new ATOM 0 HG23 THR A 421 -4.402 -2.941 -7.977 1.00 0.00 H new ATOM 507 N VAL A 422 -1.203 -2.341 -6.171 1.00 0.00 N ATOM 508 CA VAL A 422 0.236 -2.456 -6.214 1.00 0.00 C ATOM 509 C VAL A 422 0.665 -2.268 -7.658 1.00 0.00 C ATOM 510 O VAL A 422 0.061 -2.854 -8.553 1.00 0.00 O ATOM 511 CB VAL A 422 0.725 -3.842 -5.708 1.00 0.00 C ATOM 512 CG1 VAL A 422 2.244 -3.905 -5.683 1.00 0.00 C ATOM 513 CG2 VAL A 422 0.153 -4.154 -4.333 1.00 0.00 C ATOM 0 H VAL A 422 -1.700 -3.231 -6.159 1.00 0.00 H new ATOM 0 HA VAL A 422 0.674 -1.701 -5.561 1.00 0.00 H new ATOM 0 HB VAL A 422 0.363 -4.598 -6.405 1.00 0.00 H new ATOM 0 HG11 VAL A 422 2.562 -4.884 -5.325 1.00 0.00 H new ATOM 0 HG12 VAL A 422 2.631 -3.743 -6.689 1.00 0.00 H new ATOM 0 HG13 VAL A 422 2.629 -3.133 -5.017 1.00 0.00 H new ATOM 0 HG21 VAL A 422 0.511 -5.129 -4.003 1.00 0.00 H new ATOM 0 HG22 VAL A 422 0.473 -3.391 -3.624 1.00 0.00 H new ATOM 0 HG23 VAL A 422 -0.936 -4.166 -4.386 1.00 0.00 H new ATOM 523 N ILE A 423 1.672 -1.471 -7.895 1.00 0.00 N ATOM 524 CA ILE A 423 2.092 -1.201 -9.253 1.00 0.00 C ATOM 525 C ILE A 423 3.171 -2.163 -9.713 1.00 0.00 C ATOM 526 O ILE A 423 3.137 -2.646 -10.847 1.00 0.00 O ATOM 527 CB ILE A 423 2.486 0.280 -9.481 1.00 0.00 C ATOM 528 CG1 ILE A 423 3.543 0.753 -8.474 1.00 0.00 C ATOM 529 CG2 ILE A 423 1.246 1.161 -9.418 1.00 0.00 C ATOM 530 CD1 ILE A 423 3.889 2.228 -8.576 1.00 0.00 C ATOM 0 H ILE A 423 2.217 -0.998 -7.174 1.00 0.00 H new ATOM 0 HA ILE A 423 1.220 -1.375 -9.883 1.00 0.00 H new ATOM 0 HB ILE A 423 2.932 0.361 -10.472 1.00 0.00 H new ATOM 0 HG12 ILE A 423 3.186 0.545 -7.466 1.00 0.00 H new ATOM 0 HG13 ILE A 423 4.452 0.168 -8.617 1.00 0.00 H new ATOM 0 HG21 ILE A 423 1.530 2.201 -9.579 1.00 0.00 H new ATOM 0 HG22 ILE A 423 0.541 0.853 -10.191 1.00 0.00 H new ATOM 0 HG23 ILE A 423 0.777 1.060 -8.439 1.00 0.00 H new ATOM 0 HD11 ILE A 423 4.643 2.477 -7.829 1.00 0.00 H new ATOM 0 HD12 ILE A 423 4.279 2.442 -9.571 1.00 0.00 H new ATOM 0 HD13 ILE A 423 2.994 2.825 -8.401 1.00 0.00 H new ATOM 542 N GLU A 424 4.090 -2.473 -8.825 1.00 0.00 N ATOM 543 CA GLU A 424 5.143 -3.428 -9.091 1.00 0.00 C ATOM 544 C GLU A 424 5.648 -3.974 -7.778 1.00 0.00 C ATOM 545 O GLU A 424 5.531 -3.321 -6.751 1.00 0.00 O ATOM 546 CB GLU A 424 6.298 -2.821 -9.905 1.00 0.00 C ATOM 547 CG GLU A 424 6.950 -1.627 -9.255 1.00 0.00 C ATOM 548 CD GLU A 424 8.179 -1.167 -9.975 1.00 0.00 C ATOM 549 OE1 GLU A 424 8.052 -0.452 -10.996 1.00 0.00 O ATOM 550 OE2 GLU A 424 9.308 -1.509 -9.527 1.00 0.00 O ATOM 0 H GLU A 424 4.128 -2.066 -7.890 1.00 0.00 H new ATOM 0 HA GLU A 424 4.728 -4.232 -9.699 1.00 0.00 H new ATOM 0 HB2 GLU A 424 7.054 -3.589 -10.071 1.00 0.00 H new ATOM 0 HB3 GLU A 424 5.922 -2.527 -10.885 1.00 0.00 H new ATOM 0 HG2 GLU A 424 6.233 -0.807 -9.212 1.00 0.00 H new ATOM 0 HG3 GLU A 424 7.210 -1.877 -8.227 1.00 0.00 H new ATOM 557 N ALA A 425 6.177 -5.154 -7.795 1.00 0.00 N ATOM 558 CA ALA A 425 6.683 -5.767 -6.600 1.00 0.00 C ATOM 559 C ALA A 425 7.859 -6.611 -6.967 1.00 0.00 C ATOM 560 O ALA A 425 7.889 -7.179 -8.066 1.00 0.00 O ATOM 561 CB ALA A 425 5.606 -6.598 -5.930 1.00 0.00 C ATOM 0 H ALA A 425 6.273 -5.724 -8.635 1.00 0.00 H new ATOM 0 HA ALA A 425 6.991 -5.000 -5.889 1.00 0.00 H new ATOM 0 HB1 ALA A 425 6.009 -7.055 -5.026 1.00 0.00 H new ATOM 0 HB2 ALA A 425 4.763 -5.959 -5.669 1.00 0.00 H new ATOM 0 HB3 ALA A 425 5.271 -7.379 -6.613 1.00 0.00 H new ATOM 567 N LYS A 426 8.831 -6.677 -6.092 1.00 0.00 N ATOM 568 CA LYS A 426 10.029 -7.434 -6.354 1.00 0.00 C ATOM 569 C LYS A 426 10.764 -7.600 -5.051 1.00 0.00 C ATOM 570 O LYS A 426 10.310 -7.097 -4.030 1.00 0.00 O ATOM 571 CB LYS A 426 10.941 -6.746 -7.432 1.00 0.00 C ATOM 572 CG LYS A 426 12.009 -5.746 -6.939 1.00 0.00 C ATOM 573 CD LYS A 426 11.474 -4.419 -6.356 1.00 0.00 C ATOM 574 CE LYS A 426 10.647 -3.625 -7.357 1.00 0.00 C ATOM 575 NZ LYS A 426 10.444 -2.197 -6.964 1.00 0.00 N ATOM 0 H LYS A 426 8.815 -6.211 -5.185 1.00 0.00 H new ATOM 0 HA LYS A 426 9.758 -8.406 -6.766 1.00 0.00 H new ATOM 0 HB2 LYS A 426 11.450 -7.531 -7.991 1.00 0.00 H new ATOM 0 HB3 LYS A 426 10.292 -6.224 -8.135 1.00 0.00 H new ATOM 0 HG2 LYS A 426 12.614 -6.237 -6.177 1.00 0.00 H new ATOM 0 HG3 LYS A 426 12.672 -5.513 -7.772 1.00 0.00 H new ATOM 0 HD2 LYS A 426 10.865 -4.633 -5.477 1.00 0.00 H new ATOM 0 HD3 LYS A 426 12.314 -3.810 -6.021 1.00 0.00 H new ATOM 0 HE2 LYS A 426 11.137 -3.660 -8.330 1.00 0.00 H new ATOM 0 HE3 LYS A 426 9.674 -4.103 -7.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 426 9.993 -1.682 -7.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 426 9.834 -2.152 -6.123 1.00 0.00 H new ATOM 0 HZ3 LYS A 426 11.364 -1.762 -6.748 1.00 0.00 H new ATOM 589 N LEU A 427 11.841 -8.319 -5.053 1.00 0.00 N ATOM 590 CA LEU A 427 12.632 -8.418 -3.861 1.00 0.00 C ATOM 591 C LEU A 427 13.706 -7.390 -3.958 1.00 0.00 C ATOM 592 O LEU A 427 14.137 -7.040 -5.068 1.00 0.00 O ATOM 593 CB LEU A 427 13.317 -9.791 -3.719 1.00 0.00 C ATOM 594 CG LEU A 427 14.724 -9.975 -4.392 1.00 0.00 C ATOM 595 CD1 LEU A 427 15.372 -11.255 -3.911 1.00 0.00 C ATOM 596 CD2 LEU A 427 14.600 -10.015 -5.904 1.00 0.00 C ATOM 0 H LEU A 427 12.193 -8.842 -5.855 1.00 0.00 H new ATOM 0 HA LEU A 427 11.976 -8.277 -3.002 1.00 0.00 H new ATOM 0 HB2 LEU A 427 13.423 -10.005 -2.656 1.00 0.00 H new ATOM 0 HB3 LEU A 427 12.646 -10.545 -4.131 1.00 0.00 H new ATOM 0 HG LEU A 427 15.343 -9.124 -4.110 1.00 0.00 H new ATOM 0 HD11 LEU A 427 16.347 -11.370 -4.385 1.00 0.00 H new ATOM 0 HD12 LEU A 427 15.498 -11.215 -2.829 1.00 0.00 H new ATOM 0 HD13 LEU A 427 14.739 -12.103 -4.172 1.00 0.00 H new ATOM 0 HD21 LEU A 427 15.588 -10.143 -6.347 1.00 0.00 H new ATOM 0 HD22 LEU A 427 13.961 -10.849 -6.195 1.00 0.00 H new ATOM 0 HD23 LEU A 427 14.162 -9.082 -6.258 1.00 0.00 H new ATOM 608 N ASP A 428 14.119 -6.862 -2.887 1.00 0.00 N ATOM 609 CA ASP A 428 15.283 -6.105 -2.966 1.00 0.00 C ATOM 610 C ASP A 428 16.255 -6.575 -1.949 1.00 0.00 C ATOM 611 O ASP A 428 15.972 -6.626 -0.764 1.00 0.00 O ATOM 612 CB ASP A 428 15.078 -4.613 -2.917 1.00 0.00 C ATOM 613 CG ASP A 428 16.331 -3.929 -3.390 1.00 0.00 C ATOM 614 OD1 ASP A 428 16.572 -3.892 -4.608 1.00 0.00 O ATOM 615 OD2 ASP A 428 17.130 -3.507 -2.554 1.00 0.00 O ATOM 0 H ASP A 428 13.682 -6.936 -1.968 1.00 0.00 H new ATOM 0 HA ASP A 428 15.692 -6.271 -3.963 1.00 0.00 H new ATOM 0 HB2 ASP A 428 14.234 -4.328 -3.545 1.00 0.00 H new ATOM 0 HB3 ASP A 428 14.839 -4.299 -1.901 1.00 0.00 H new ATOM 620 N LYS A 429 17.382 -6.960 -2.425 1.00 0.00 N ATOM 621 CA LYS A 429 18.489 -7.454 -1.623 1.00 0.00 C ATOM 622 C LYS A 429 18.959 -6.389 -0.614 1.00 0.00 C ATOM 623 O LYS A 429 19.544 -6.707 0.409 1.00 0.00 O ATOM 624 CB LYS A 429 19.660 -7.844 -2.562 1.00 0.00 C ATOM 625 CG LYS A 429 20.437 -6.660 -3.179 1.00 0.00 C ATOM 626 CD LYS A 429 19.578 -5.745 -4.035 1.00 0.00 C ATOM 627 CE LYS A 429 19.128 -6.356 -5.321 1.00 0.00 C ATOM 628 NZ LYS A 429 20.246 -6.735 -6.221 1.00 0.00 N ATOM 0 H LYS A 429 17.588 -6.947 -3.424 1.00 0.00 H new ATOM 0 HA LYS A 429 18.155 -8.326 -1.061 1.00 0.00 H new ATOM 0 HB2 LYS A 429 20.361 -8.464 -2.003 1.00 0.00 H new ATOM 0 HB3 LYS A 429 19.265 -8.459 -3.371 1.00 0.00 H new ATOM 0 HG2 LYS A 429 20.887 -6.075 -2.377 1.00 0.00 H new ATOM 0 HG3 LYS A 429 21.254 -7.050 -3.786 1.00 0.00 H new ATOM 0 HD2 LYS A 429 18.701 -5.446 -3.461 1.00 0.00 H new ATOM 0 HD3 LYS A 429 20.140 -4.837 -4.254 1.00 0.00 H new ATOM 0 HE2 LYS A 429 18.531 -7.242 -5.104 1.00 0.00 H new ATOM 0 HE3 LYS A 429 18.477 -5.652 -5.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 429 19.869 -6.976 -7.160 1.00 0.00 H new ATOM 0 HZ2 LYS A 429 20.907 -5.937 -6.308 1.00 0.00 H new ATOM 0 HZ3 LYS A 429 20.746 -7.557 -5.827 1.00 0.00 H new ATOM 642 N GLY A 430 18.663 -5.144 -0.919 1.00 0.00 N ATOM 643 CA GLY A 430 19.097 -4.053 -0.136 1.00 0.00 C ATOM 644 C GLY A 430 17.978 -3.444 0.693 1.00 0.00 C ATOM 645 O GLY A 430 18.106 -3.289 1.903 1.00 0.00 O ATOM 0 H GLY A 430 18.106 -4.879 -1.731 1.00 0.00 H new ATOM 0 HA2 GLY A 430 19.897 -4.382 0.527 1.00 0.00 H new ATOM 0 HA3 GLY A 430 19.518 -3.288 -0.788 1.00 0.00 H new ATOM 649 N ARG A 431 16.879 -3.116 0.040 1.00 0.00 N ATOM 650 CA ARG A 431 15.721 -2.494 0.690 1.00 0.00 C ATOM 651 C ARG A 431 14.921 -3.518 1.507 1.00 0.00 C ATOM 652 O ARG A 431 14.236 -3.161 2.471 1.00 0.00 O ATOM 653 CB ARG A 431 14.788 -1.849 -0.350 1.00 0.00 C ATOM 654 CG ARG A 431 15.429 -0.805 -1.254 1.00 0.00 C ATOM 655 CD ARG A 431 14.402 -0.237 -2.232 1.00 0.00 C ATOM 656 NE ARG A 431 14.968 0.807 -3.109 1.00 0.00 N ATOM 657 CZ ARG A 431 14.281 1.486 -4.049 1.00 0.00 C ATOM 658 NH1 ARG A 431 12.998 1.243 -4.260 1.00 0.00 N ATOM 659 NH2 ARG A 431 14.899 2.400 -4.790 1.00 0.00 N ATOM 0 H ARG A 431 16.755 -3.271 -0.961 1.00 0.00 H new ATOM 0 HA ARG A 431 16.107 -1.726 1.360 1.00 0.00 H new ATOM 0 HB2 ARG A 431 14.371 -2.638 -0.976 1.00 0.00 H new ATOM 0 HB3 ARG A 431 13.954 -1.385 0.176 1.00 0.00 H new ATOM 0 HG2 ARG A 431 15.847 -0.000 -0.649 1.00 0.00 H new ATOM 0 HG3 ARG A 431 16.256 -1.252 -1.806 1.00 0.00 H new ATOM 0 HD2 ARG A 431 14.005 -1.045 -2.846 1.00 0.00 H new ATOM 0 HD3 ARG A 431 13.564 0.179 -1.672 1.00 0.00 H new ATOM 0 HE ARG A 431 15.956 1.032 -2.995 1.00 0.00 H new ATOM 0 HH11 ARG A 431 12.516 0.534 -3.708 1.00 0.00 H new ATOM 0 HH12 ARG A 431 12.491 1.765 -4.975 1.00 0.00 H new ATOM 0 HH21 ARG A 431 15.892 2.587 -4.647 1.00 0.00 H new ATOM 0 HH22 ARG A 431 14.381 2.915 -5.502 1.00 0.00 H new ATOM 673 N GLY A 432 15.001 -4.769 1.112 1.00 0.00 N ATOM 674 CA GLY A 432 14.270 -5.817 1.786 1.00 0.00 C ATOM 675 C GLY A 432 13.115 -6.303 0.929 1.00 0.00 C ATOM 676 O GLY A 432 13.120 -6.082 -0.289 1.00 0.00 O ATOM 0 H GLY A 432 15.567 -5.085 0.325 1.00 0.00 H new ATOM 0 HA2 GLY A 432 14.939 -6.648 2.009 1.00 0.00 H new ATOM 0 HA3 GLY A 432 13.892 -5.448 2.739 1.00 0.00 H new ATOM 680 N PRO A 433 12.143 -7.021 1.502 1.00 0.00 N ATOM 681 CA PRO A 433 10.931 -7.400 0.776 1.00 0.00 C ATOM 682 C PRO A 433 10.111 -6.143 0.531 1.00 0.00 C ATOM 683 O PRO A 433 9.622 -5.517 1.485 1.00 0.00 O ATOM 684 CB PRO A 433 10.206 -8.339 1.767 1.00 0.00 C ATOM 685 CG PRO A 433 11.265 -8.736 2.741 1.00 0.00 C ATOM 686 CD PRO A 433 12.150 -7.540 2.864 1.00 0.00 C ATOM 0 HA PRO A 433 11.109 -7.873 -0.190 1.00 0.00 H new ATOM 0 HB2 PRO A 433 9.379 -7.831 2.264 1.00 0.00 H new ATOM 0 HB3 PRO A 433 9.788 -9.208 1.258 1.00 0.00 H new ATOM 0 HG2 PRO A 433 10.833 -9.007 3.704 1.00 0.00 H new ATOM 0 HG3 PRO A 433 11.822 -9.603 2.386 1.00 0.00 H new ATOM 0 HD2 PRO A 433 11.761 -6.816 3.579 1.00 0.00 H new ATOM 0 HD3 PRO A 433 13.154 -7.807 3.195 1.00 0.00 H new ATOM 694 N VAL A 434 9.949 -5.788 -0.720 1.00 0.00 N ATOM 695 CA VAL A 434 9.353 -4.520 -1.074 1.00 0.00 C ATOM 696 C VAL A 434 8.160 -4.682 -1.985 1.00 0.00 C ATOM 697 O VAL A 434 7.967 -5.728 -2.617 1.00 0.00 O ATOM 698 CB VAL A 434 10.372 -3.590 -1.790 1.00 0.00 C ATOM 699 CG1 VAL A 434 11.491 -3.170 -0.893 1.00 0.00 C ATOM 700 CG2 VAL A 434 10.946 -4.251 -3.010 1.00 0.00 C ATOM 0 H VAL A 434 10.223 -6.363 -1.517 1.00 0.00 H new ATOM 0 HA VAL A 434 9.033 -4.075 -0.132 1.00 0.00 H new ATOM 0 HB VAL A 434 9.814 -2.700 -2.082 1.00 0.00 H new ATOM 0 HG11 VAL A 434 12.174 -2.522 -1.442 1.00 0.00 H new ATOM 0 HG12 VAL A 434 11.088 -2.629 -0.037 1.00 0.00 H new ATOM 0 HG13 VAL A 434 12.029 -4.052 -0.545 1.00 0.00 H new ATOM 0 HG21 VAL A 434 11.655 -3.576 -3.490 1.00 0.00 H new ATOM 0 HG22 VAL A 434 11.457 -5.169 -2.720 1.00 0.00 H new ATOM 0 HG23 VAL A 434 10.143 -4.488 -3.707 1.00 0.00 H new ATOM 710 N ALA A 435 7.382 -3.642 -2.055 1.00 0.00 N ATOM 711 CA ALA A 435 6.238 -3.573 -2.937 1.00 0.00 C ATOM 712 C ALA A 435 5.936 -2.128 -3.264 1.00 0.00 C ATOM 713 O ALA A 435 5.600 -1.344 -2.369 1.00 0.00 O ATOM 714 CB ALA A 435 5.022 -4.234 -2.304 1.00 0.00 C ATOM 0 H ALA A 435 7.521 -2.801 -1.495 1.00 0.00 H new ATOM 0 HA ALA A 435 6.474 -4.110 -3.856 1.00 0.00 H new ATOM 0 HB1 ALA A 435 4.175 -4.169 -2.987 1.00 0.00 H new ATOM 0 HB2 ALA A 435 5.243 -5.282 -2.099 1.00 0.00 H new ATOM 0 HB3 ALA A 435 4.776 -3.726 -1.372 1.00 0.00 H new ATOM 720 N THR A 436 6.087 -1.763 -4.517 1.00 0.00 N ATOM 721 CA THR A 436 5.798 -0.430 -4.948 1.00 0.00 C ATOM 722 C THR A 436 4.306 -0.373 -5.221 1.00 0.00 C ATOM 723 O THR A 436 3.789 -1.115 -6.062 1.00 0.00 O ATOM 724 CB THR A 436 6.546 -0.091 -6.244 1.00 0.00 C ATOM 725 OG1 THR A 436 7.818 -0.783 -6.268 1.00 0.00 O ATOM 726 CG2 THR A 436 6.809 1.413 -6.320 1.00 0.00 C ATOM 0 H THR A 436 6.413 -2.385 -5.257 1.00 0.00 H new ATOM 0 HA THR A 436 6.108 0.282 -4.183 1.00 0.00 H new ATOM 0 HB THR A 436 5.934 -0.401 -7.091 1.00 0.00 H new ATOM 0 HG1 THR A 436 8.234 -0.734 -5.382 1.00 0.00 H new ATOM 0 HG21 THR A 436 7.340 1.643 -7.243 1.00 0.00 H new ATOM 0 HG22 THR A 436 5.860 1.950 -6.304 1.00 0.00 H new ATOM 0 HG23 THR A 436 7.414 1.720 -5.467 1.00 0.00 H new ATOM 734 N LEU A 437 3.627 0.456 -4.535 1.00 0.00 N ATOM 735 CA LEU A 437 2.211 0.507 -4.621 1.00 0.00 C ATOM 736 C LEU A 437 1.696 1.934 -4.695 1.00 0.00 C ATOM 737 O LEU A 437 2.469 2.893 -4.576 1.00 0.00 O ATOM 738 CB LEU A 437 1.610 -0.284 -3.445 1.00 0.00 C ATOM 739 CG LEU A 437 2.212 -0.032 -2.042 1.00 0.00 C ATOM 740 CD1 LEU A 437 2.023 1.392 -1.590 1.00 0.00 C ATOM 741 CD2 LEU A 437 1.611 -0.971 -1.029 1.00 0.00 C ATOM 0 H LEU A 437 4.035 1.130 -3.888 1.00 0.00 H new ATOM 0 HA LEU A 437 1.889 0.039 -5.552 1.00 0.00 H new ATOM 0 HB2 LEU A 437 0.544 -0.063 -3.400 1.00 0.00 H new ATOM 0 HB3 LEU A 437 1.707 -1.347 -3.668 1.00 0.00 H new ATOM 0 HG LEU A 437 3.283 -0.219 -2.119 1.00 0.00 H new ATOM 0 HD11 LEU A 437 2.461 1.521 -0.600 1.00 0.00 H new ATOM 0 HD12 LEU A 437 2.512 2.065 -2.294 1.00 0.00 H new ATOM 0 HD13 LEU A 437 0.958 1.622 -1.548 1.00 0.00 H new ATOM 0 HD21 LEU A 437 2.048 -0.777 -0.049 1.00 0.00 H new ATOM 0 HD22 LEU A 437 0.533 -0.815 -0.983 1.00 0.00 H new ATOM 0 HD23 LEU A 437 1.817 -2.001 -1.321 1.00 0.00 H new ATOM 753 N LEU A 438 0.416 2.065 -4.909 1.00 0.00 N ATOM 754 CA LEU A 438 -0.219 3.344 -4.964 1.00 0.00 C ATOM 755 C LEU A 438 -1.328 3.343 -3.893 1.00 0.00 C ATOM 756 O LEU A 438 -2.332 2.630 -4.028 1.00 0.00 O ATOM 757 CB LEU A 438 -0.786 3.548 -6.396 1.00 0.00 C ATOM 758 CG LEU A 438 -1.135 4.978 -6.870 1.00 0.00 C ATOM 759 CD1 LEU A 438 -2.210 5.625 -6.033 1.00 0.00 C ATOM 760 CD2 LEU A 438 0.107 5.851 -6.925 1.00 0.00 C ATOM 0 H LEU A 438 -0.217 1.278 -5.051 1.00 0.00 H new ATOM 0 HA LEU A 438 0.469 4.165 -4.761 1.00 0.00 H new ATOM 0 HB2 LEU A 438 -0.061 3.137 -7.098 1.00 0.00 H new ATOM 0 HB3 LEU A 438 -1.689 2.944 -6.481 1.00 0.00 H new ATOM 0 HG LEU A 438 -1.539 4.882 -7.878 1.00 0.00 H new ATOM 0 HD11 LEU A 438 -2.413 6.626 -6.412 1.00 0.00 H new ATOM 0 HD12 LEU A 438 -3.120 5.027 -6.083 1.00 0.00 H new ATOM 0 HD13 LEU A 438 -1.875 5.690 -4.998 1.00 0.00 H new ATOM 0 HD21 LEU A 438 -0.166 6.851 -7.261 1.00 0.00 H new ATOM 0 HD22 LEU A 438 0.554 5.911 -5.933 1.00 0.00 H new ATOM 0 HD23 LEU A 438 0.826 5.418 -7.621 1.00 0.00 H new ATOM 772 N VAL A 439 -1.112 4.083 -2.811 1.00 0.00 N ATOM 773 CA VAL A 439 -2.072 4.134 -1.708 1.00 0.00 C ATOM 774 C VAL A 439 -3.299 4.955 -2.067 1.00 0.00 C ATOM 775 O VAL A 439 -3.202 6.132 -2.410 1.00 0.00 O ATOM 776 CB VAL A 439 -1.431 4.598 -0.356 1.00 0.00 C ATOM 777 CG1 VAL A 439 -0.726 5.944 -0.476 1.00 0.00 C ATOM 778 CG2 VAL A 439 -2.470 4.628 0.758 1.00 0.00 C ATOM 0 H VAL A 439 -0.281 4.657 -2.672 1.00 0.00 H new ATOM 0 HA VAL A 439 -2.402 3.108 -1.545 1.00 0.00 H new ATOM 0 HB VAL A 439 -0.669 3.862 -0.101 1.00 0.00 H new ATOM 0 HG11 VAL A 439 -0.300 6.219 0.489 1.00 0.00 H new ATOM 0 HG12 VAL A 439 0.070 5.873 -1.217 1.00 0.00 H new ATOM 0 HG13 VAL A 439 -1.443 6.704 -0.785 1.00 0.00 H new ATOM 0 HG21 VAL A 439 -1.999 4.953 1.686 1.00 0.00 H new ATOM 0 HG22 VAL A 439 -3.268 5.322 0.493 1.00 0.00 H new ATOM 0 HG23 VAL A 439 -2.887 3.630 0.893 1.00 0.00 H new ATOM 788 N GLN A 440 -4.453 4.311 -2.029 1.00 0.00 N ATOM 789 CA GLN A 440 -5.688 4.969 -2.418 1.00 0.00 C ATOM 790 C GLN A 440 -6.711 4.910 -1.290 1.00 0.00 C ATOM 791 O GLN A 440 -7.649 5.695 -1.251 1.00 0.00 O ATOM 792 CB GLN A 440 -6.243 4.298 -3.678 1.00 0.00 C ATOM 793 CG GLN A 440 -5.216 4.198 -4.793 1.00 0.00 C ATOM 794 CD GLN A 440 -5.709 3.479 -6.017 1.00 0.00 C ATOM 795 OE1 GLN A 440 -5.599 2.250 -6.131 1.00 0.00 O ATOM 796 NE2 GLN A 440 -6.201 4.218 -6.959 1.00 0.00 N ATOM 0 H GLN A 440 -4.560 3.340 -1.735 1.00 0.00 H new ATOM 0 HA GLN A 440 -5.481 6.019 -2.627 1.00 0.00 H new ATOM 0 HB2 GLN A 440 -6.597 3.298 -3.426 1.00 0.00 H new ATOM 0 HB3 GLN A 440 -7.106 4.861 -4.034 1.00 0.00 H new ATOM 0 HG2 GLN A 440 -4.904 5.203 -5.076 1.00 0.00 H new ATOM 0 HG3 GLN A 440 -4.332 3.684 -4.414 1.00 0.00 H new ATOM 0 HE21 GLN A 440 -6.276 5.227 -6.829 1.00 0.00 H new ATOM 0 HE22 GLN A 440 -6.514 3.791 -7.831 1.00 0.00 H new ATOM 805 N ALA A 441 -6.466 4.033 -0.322 1.00 0.00 N ATOM 806 CA ALA A 441 -7.445 3.751 0.713 1.00 0.00 C ATOM 807 C ALA A 441 -7.230 4.634 1.905 1.00 0.00 C ATOM 808 O ALA A 441 -7.925 4.521 2.908 1.00 0.00 O ATOM 809 CB ALA A 441 -7.357 2.295 1.116 1.00 0.00 C ATOM 0 H ALA A 441 -5.596 3.507 -0.236 1.00 0.00 H new ATOM 0 HA ALA A 441 -8.440 3.954 0.317 1.00 0.00 H new ATOM 0 HB1 ALA A 441 -8.093 2.087 1.893 1.00 0.00 H new ATOM 0 HB2 ALA A 441 -7.556 1.665 0.249 1.00 0.00 H new ATOM 0 HB3 ALA A 441 -6.358 2.083 1.497 1.00 0.00 H new ATOM 815 N GLY A 442 -6.273 5.505 1.811 1.00 0.00 N ATOM 816 CA GLY A 442 -6.031 6.382 2.878 1.00 0.00 C ATOM 817 C GLY A 442 -4.664 6.923 2.822 1.00 0.00 C ATOM 818 O GLY A 442 -4.229 7.417 1.803 1.00 0.00 O ATOM 0 H GLY A 442 -5.658 5.616 1.005 1.00 0.00 H new ATOM 0 HA2 GLY A 442 -6.750 7.200 2.850 1.00 0.00 H new ATOM 0 HA3 GLY A 442 -6.180 5.859 3.823 1.00 0.00 H new ATOM 822 N THR A 443 -3.974 6.763 3.873 1.00 0.00 N ATOM 823 CA THR A 443 -2.648 7.287 4.024 1.00 0.00 C ATOM 824 C THR A 443 -1.763 6.152 4.507 1.00 0.00 C ATOM 825 O THR A 443 -2.164 5.395 5.396 1.00 0.00 O ATOM 826 CB THR A 443 -2.662 8.446 5.053 1.00 0.00 C ATOM 827 OG1 THR A 443 -3.694 9.381 4.677 1.00 0.00 O ATOM 828 CG2 THR A 443 -1.324 9.173 5.106 1.00 0.00 C ATOM 0 H THR A 443 -4.309 6.251 4.689 1.00 0.00 H new ATOM 0 HA THR A 443 -2.270 7.680 3.080 1.00 0.00 H new ATOM 0 HB THR A 443 -2.853 8.027 6.041 1.00 0.00 H new ATOM 0 HG1 THR A 443 -3.614 10.193 5.220 1.00 0.00 H new ATOM 0 HG21 THR A 443 -1.376 9.978 5.839 1.00 0.00 H new ATOM 0 HG22 THR A 443 -0.540 8.472 5.392 1.00 0.00 H new ATOM 0 HG23 THR A 443 -1.097 9.590 4.125 1.00 0.00 H new ATOM 836 N LEU A 444 -0.616 6.011 3.913 1.00 0.00 N ATOM 837 CA LEU A 444 0.264 4.923 4.237 1.00 0.00 C ATOM 838 C LEU A 444 1.383 5.481 5.075 1.00 0.00 C ATOM 839 O LEU A 444 1.923 6.534 4.758 1.00 0.00 O ATOM 840 CB LEU A 444 0.815 4.311 2.941 1.00 0.00 C ATOM 841 CG LEU A 444 0.898 2.774 2.858 1.00 0.00 C ATOM 842 CD1 LEU A 444 1.438 2.383 1.529 1.00 0.00 C ATOM 843 CD2 LEU A 444 1.757 2.180 3.948 1.00 0.00 C ATOM 0 H LEU A 444 -0.263 6.642 3.194 1.00 0.00 H new ATOM 0 HA LEU A 444 -0.261 4.141 4.786 1.00 0.00 H new ATOM 0 HB2 LEU A 444 0.195 4.659 2.115 1.00 0.00 H new ATOM 0 HB3 LEU A 444 1.816 4.711 2.779 1.00 0.00 H new ATOM 0 HG LEU A 444 -0.110 2.383 2.993 1.00 0.00 H new ATOM 0 HD11 LEU A 444 1.498 1.296 1.466 1.00 0.00 H new ATOM 0 HD12 LEU A 444 0.779 2.756 0.745 1.00 0.00 H new ATOM 0 HD13 LEU A 444 2.433 2.810 1.401 1.00 0.00 H new ATOM 0 HD21 LEU A 444 1.781 1.095 3.842 1.00 0.00 H new ATOM 0 HD22 LEU A 444 2.770 2.575 3.869 1.00 0.00 H new ATOM 0 HD23 LEU A 444 1.341 2.441 4.921 1.00 0.00 H new ATOM 855 N LYS A 445 1.700 4.831 6.147 1.00 0.00 N ATOM 856 CA LYS A 445 2.745 5.288 6.998 1.00 0.00 C ATOM 857 C LYS A 445 3.428 4.084 7.651 1.00 0.00 C ATOM 858 O LYS A 445 2.873 2.981 7.684 1.00 0.00 O ATOM 859 CB LYS A 445 2.155 6.199 8.068 1.00 0.00 C ATOM 860 CG LYS A 445 3.167 6.782 9.022 1.00 0.00 C ATOM 861 CD LYS A 445 2.563 7.125 10.363 1.00 0.00 C ATOM 862 CE LYS A 445 2.018 5.869 11.063 1.00 0.00 C ATOM 863 NZ LYS A 445 0.583 5.612 10.789 1.00 0.00 N ATOM 0 H LYS A 445 1.243 3.973 6.455 1.00 0.00 H new ATOM 0 HA LYS A 445 3.482 5.845 6.419 1.00 0.00 H new ATOM 0 HB2 LYS A 445 1.623 7.015 7.579 1.00 0.00 H new ATOM 0 HB3 LYS A 445 1.418 5.636 8.640 1.00 0.00 H new ATOM 0 HG2 LYS A 445 3.980 6.070 9.164 1.00 0.00 H new ATOM 0 HG3 LYS A 445 3.602 7.679 8.582 1.00 0.00 H new ATOM 0 HD2 LYS A 445 3.315 7.599 10.994 1.00 0.00 H new ATOM 0 HD3 LYS A 445 1.758 7.848 10.229 1.00 0.00 H new ATOM 0 HE2 LYS A 445 2.601 5.004 10.745 1.00 0.00 H new ATOM 0 HE3 LYS A 445 2.161 5.972 12.139 1.00 0.00 H new ATOM 0 HZ1 LYS A 445 0.239 4.858 11.418 1.00 0.00 H new ATOM 0 HZ2 LYS A 445 0.036 6.480 10.958 1.00 0.00 H new ATOM 0 HZ3 LYS A 445 0.466 5.317 9.799 1.00 0.00 H new ATOM 877 N VAL A 446 4.636 4.291 8.119 1.00 0.00 N ATOM 878 CA VAL A 446 5.365 3.279 8.817 1.00 0.00 C ATOM 879 C VAL A 446 4.727 2.972 10.161 1.00 0.00 C ATOM 880 O VAL A 446 4.307 3.876 10.886 1.00 0.00 O ATOM 881 CB VAL A 446 6.871 3.626 8.978 1.00 0.00 C ATOM 882 CG1 VAL A 446 7.531 3.782 7.620 1.00 0.00 C ATOM 883 CG2 VAL A 446 7.068 4.892 9.807 1.00 0.00 C ATOM 0 H VAL A 446 5.137 5.174 8.022 1.00 0.00 H new ATOM 0 HA VAL A 446 5.317 2.381 8.201 1.00 0.00 H new ATOM 0 HB VAL A 446 7.344 2.799 9.508 1.00 0.00 H new ATOM 0 HG11 VAL A 446 8.585 4.025 7.754 1.00 0.00 H new ATOM 0 HG12 VAL A 446 7.441 2.850 7.063 1.00 0.00 H new ATOM 0 HG13 VAL A 446 7.041 4.584 7.067 1.00 0.00 H new ATOM 0 HG21 VAL A 446 8.133 5.105 9.899 1.00 0.00 H new ATOM 0 HG22 VAL A 446 6.572 5.729 9.316 1.00 0.00 H new ATOM 0 HG23 VAL A 446 6.640 4.748 10.799 1.00 0.00 H new ATOM 893 N GLY A 447 4.630 1.708 10.471 1.00 0.00 N ATOM 894 CA GLY A 447 4.033 1.310 11.715 1.00 0.00 C ATOM 895 C GLY A 447 2.581 0.913 11.584 1.00 0.00 C ATOM 896 O GLY A 447 1.961 0.507 12.568 1.00 0.00 O ATOM 0 H GLY A 447 4.955 0.940 9.883 1.00 0.00 H new ATOM 0 HA2 GLY A 447 4.595 0.472 12.128 1.00 0.00 H new ATOM 0 HA3 GLY A 447 4.115 2.131 12.428 1.00 0.00 H new ATOM 900 N ASP A 448 2.027 1.029 10.393 1.00 0.00 N ATOM 901 CA ASP A 448 0.640 0.622 10.179 1.00 0.00 C ATOM 902 C ASP A 448 0.589 -0.818 9.706 1.00 0.00 C ATOM 903 O ASP A 448 1.397 -1.216 8.839 1.00 0.00 O ATOM 904 CB ASP A 448 -0.088 1.522 9.160 1.00 0.00 C ATOM 905 CG ASP A 448 -0.239 2.951 9.617 1.00 0.00 C ATOM 906 OD1 ASP A 448 -0.767 3.197 10.736 1.00 0.00 O ATOM 907 OD2 ASP A 448 0.161 3.870 8.877 1.00 0.00 O ATOM 0 H ASP A 448 2.501 1.395 9.567 1.00 0.00 H new ATOM 0 HA ASP A 448 0.127 0.723 11.135 1.00 0.00 H new ATOM 0 HB2 ASP A 448 0.460 1.507 8.218 1.00 0.00 H new ATOM 0 HB3 ASP A 448 -1.076 1.106 8.961 1.00 0.00 H new ATOM 912 N PRO A 449 -0.285 -1.662 10.297 1.00 0.00 N ATOM 913 CA PRO A 449 -0.463 -3.022 9.845 1.00 0.00 C ATOM 914 C PRO A 449 -1.370 -3.097 8.623 1.00 0.00 C ATOM 915 O PRO A 449 -2.597 -2.982 8.704 1.00 0.00 O ATOM 916 CB PRO A 449 -1.095 -3.754 11.025 1.00 0.00 C ATOM 917 CG PRO A 449 -1.257 -2.727 12.111 1.00 0.00 C ATOM 918 CD PRO A 449 -1.135 -1.376 11.455 1.00 0.00 C ATOM 0 HA PRO A 449 0.486 -3.464 9.541 1.00 0.00 H new ATOM 0 HB2 PRO A 449 -2.058 -4.184 10.747 1.00 0.00 H new ATOM 0 HB3 PRO A 449 -0.463 -4.577 11.358 1.00 0.00 H new ATOM 0 HG2 PRO A 449 -2.225 -2.833 12.601 1.00 0.00 H new ATOM 0 HG3 PRO A 449 -0.495 -2.854 12.880 1.00 0.00 H new ATOM 0 HD2 PRO A 449 -2.106 -0.980 11.158 1.00 0.00 H new ATOM 0 HD3 PRO A 449 -0.681 -0.641 12.120 1.00 0.00 H new ATOM 926 N ILE A 450 -0.762 -3.343 7.525 1.00 0.00 N ATOM 927 CA ILE A 450 -1.398 -3.375 6.233 1.00 0.00 C ATOM 928 C ILE A 450 -1.753 -4.799 5.829 1.00 0.00 C ATOM 929 O ILE A 450 -1.388 -5.770 6.520 1.00 0.00 O ATOM 930 CB ILE A 450 -0.443 -2.827 5.171 1.00 0.00 C ATOM 931 CG1 ILE A 450 0.914 -3.517 5.334 1.00 0.00 C ATOM 932 CG2 ILE A 450 -0.313 -1.311 5.281 1.00 0.00 C ATOM 933 CD1 ILE A 450 1.831 -3.349 4.178 1.00 0.00 C ATOM 0 H ILE A 450 0.238 -3.538 7.484 1.00 0.00 H new ATOM 0 HA ILE A 450 -2.303 -2.772 6.301 1.00 0.00 H new ATOM 0 HB ILE A 450 -0.838 -3.037 4.177 1.00 0.00 H new ATOM 0 HG12 ILE A 450 1.401 -3.127 6.228 1.00 0.00 H new ATOM 0 HG13 ILE A 450 0.749 -4.582 5.499 1.00 0.00 H new ATOM 0 HG21 ILE A 450 0.372 -0.948 4.514 1.00 0.00 H new ATOM 0 HG22 ILE A 450 -1.291 -0.851 5.141 1.00 0.00 H new ATOM 0 HG23 ILE A 450 0.074 -1.049 6.266 1.00 0.00 H new ATOM 0 HD11 ILE A 450 2.768 -3.869 4.378 1.00 0.00 H new ATOM 0 HD12 ILE A 450 1.369 -3.766 3.283 1.00 0.00 H new ATOM 0 HD13 ILE A 450 2.031 -2.289 4.023 1.00 0.00 H new ATOM 945 N VAL A 451 -2.470 -4.918 4.737 1.00 0.00 N ATOM 946 CA VAL A 451 -2.792 -6.193 4.148 1.00 0.00 C ATOM 947 C VAL A 451 -2.697 -6.081 2.620 1.00 0.00 C ATOM 948 O VAL A 451 -3.292 -5.187 2.012 1.00 0.00 O ATOM 949 CB VAL A 451 -4.187 -6.745 4.617 1.00 0.00 C ATOM 950 CG1 VAL A 451 -5.326 -5.786 4.298 1.00 0.00 C ATOM 951 CG2 VAL A 451 -4.460 -8.128 4.029 1.00 0.00 C ATOM 0 H VAL A 451 -2.850 -4.121 4.227 1.00 0.00 H new ATOM 0 HA VAL A 451 -2.064 -6.926 4.496 1.00 0.00 H new ATOM 0 HB VAL A 451 -4.139 -6.837 5.702 1.00 0.00 H new ATOM 0 HG11 VAL A 451 -6.268 -6.213 4.642 1.00 0.00 H new ATOM 0 HG12 VAL A 451 -5.153 -4.835 4.802 1.00 0.00 H new ATOM 0 HG13 VAL A 451 -5.373 -5.622 3.221 1.00 0.00 H new ATOM 0 HG21 VAL A 451 -5.432 -8.484 4.371 1.00 0.00 H new ATOM 0 HG22 VAL A 451 -4.458 -8.067 2.941 1.00 0.00 H new ATOM 0 HG23 VAL A 451 -3.685 -8.821 4.355 1.00 0.00 H new ATOM 961 N VAL A 452 -1.895 -6.933 2.036 1.00 0.00 N ATOM 962 CA VAL A 452 -1.657 -6.968 0.608 1.00 0.00 C ATOM 963 C VAL A 452 -1.976 -8.369 0.127 1.00 0.00 C ATOM 964 O VAL A 452 -1.266 -9.321 0.474 1.00 0.00 O ATOM 965 CB VAL A 452 -0.166 -6.645 0.262 1.00 0.00 C ATOM 966 CG1 VAL A 452 0.061 -6.639 -1.248 1.00 0.00 C ATOM 967 CG2 VAL A 452 0.278 -5.320 0.874 1.00 0.00 C ATOM 0 H VAL A 452 -1.373 -7.643 2.550 1.00 0.00 H new ATOM 0 HA VAL A 452 -2.282 -6.218 0.124 1.00 0.00 H new ATOM 0 HB VAL A 452 0.444 -7.436 0.698 1.00 0.00 H new ATOM 0 HG11 VAL A 452 1.106 -6.412 -1.458 1.00 0.00 H new ATOM 0 HG12 VAL A 452 -0.186 -7.619 -1.657 1.00 0.00 H new ATOM 0 HG13 VAL A 452 -0.574 -5.883 -1.708 1.00 0.00 H new ATOM 0 HG21 VAL A 452 1.319 -5.129 0.612 1.00 0.00 H new ATOM 0 HG22 VAL A 452 -0.347 -4.514 0.489 1.00 0.00 H new ATOM 0 HG23 VAL A 452 0.180 -5.369 1.958 1.00 0.00 H new ATOM 977 N GLY A 453 -3.027 -8.500 -0.649 1.00 0.00 N ATOM 978 CA GLY A 453 -3.461 -9.802 -1.091 1.00 0.00 C ATOM 979 C GLY A 453 -3.863 -10.689 0.073 1.00 0.00 C ATOM 980 O GLY A 453 -4.801 -10.370 0.821 1.00 0.00 O ATOM 0 H GLY A 453 -3.595 -7.722 -0.986 1.00 0.00 H new ATOM 0 HA2 GLY A 453 -4.305 -9.692 -1.772 1.00 0.00 H new ATOM 0 HA3 GLY A 453 -2.659 -10.281 -1.653 1.00 0.00 H new ATOM 984 N THR A 454 -3.148 -11.776 0.238 1.00 0.00 N ATOM 985 CA THR A 454 -3.384 -12.696 1.292 1.00 0.00 C ATOM 986 C THR A 454 -2.381 -12.448 2.462 1.00 0.00 C ATOM 987 O THR A 454 -2.472 -13.067 3.529 1.00 0.00 O ATOM 988 CB THR A 454 -3.203 -14.123 0.724 1.00 0.00 C ATOM 989 OG1 THR A 454 -3.975 -14.259 -0.487 1.00 0.00 O ATOM 990 CG2 THR A 454 -3.684 -15.154 1.702 1.00 0.00 C ATOM 0 H THR A 454 -2.376 -12.038 -0.374 1.00 0.00 H new ATOM 0 HA THR A 454 -4.393 -12.570 1.685 1.00 0.00 H new ATOM 0 HB THR A 454 -2.142 -14.277 0.528 1.00 0.00 H new ATOM 0 HG1 THR A 454 -3.860 -15.162 -0.849 1.00 0.00 H new ATOM 0 HG21 THR A 454 -3.546 -16.149 1.279 1.00 0.00 H new ATOM 0 HG22 THR A 454 -3.115 -15.071 2.628 1.00 0.00 H new ATOM 0 HG23 THR A 454 -4.741 -14.992 1.911 1.00 0.00 H new ATOM 998 N THR A 455 -1.455 -11.537 2.272 1.00 0.00 N ATOM 999 CA THR A 455 -0.433 -11.301 3.264 1.00 0.00 C ATOM 1000 C THR A 455 -0.707 -10.036 4.082 1.00 0.00 C ATOM 1001 O THR A 455 -1.082 -9.006 3.540 1.00 0.00 O ATOM 1002 CB THR A 455 0.958 -11.194 2.601 1.00 0.00 C ATOM 1003 OG1 THR A 455 1.205 -12.373 1.814 1.00 0.00 O ATOM 1004 CG2 THR A 455 2.045 -11.041 3.656 1.00 0.00 C ATOM 0 H THR A 455 -1.389 -10.949 1.442 1.00 0.00 H new ATOM 0 HA THR A 455 -0.449 -12.154 3.942 1.00 0.00 H new ATOM 0 HB THR A 455 0.975 -10.314 1.958 1.00 0.00 H new ATOM 0 HG1 THR A 455 2.087 -12.306 1.392 1.00 0.00 H new ATOM 0 HG21 THR A 455 3.017 -10.967 3.169 1.00 0.00 H new ATOM 0 HG22 THR A 455 1.862 -10.138 4.239 1.00 0.00 H new ATOM 0 HG23 THR A 455 2.035 -11.908 4.317 1.00 0.00 H new ATOM 1012 N TYR A 456 -0.523 -10.122 5.377 1.00 0.00 N ATOM 1013 CA TYR A 456 -0.644 -8.967 6.222 1.00 0.00 C ATOM 1014 C TYR A 456 0.751 -8.678 6.757 1.00 0.00 C ATOM 1015 O TYR A 456 1.626 -9.551 6.708 1.00 0.00 O ATOM 1016 CB TYR A 456 -1.647 -9.194 7.396 1.00 0.00 C ATOM 1017 CG TYR A 456 -1.081 -9.938 8.599 1.00 0.00 C ATOM 1018 CD1 TYR A 456 -0.988 -11.321 8.624 1.00 0.00 C ATOM 1019 CD2 TYR A 456 -0.621 -9.231 9.709 1.00 0.00 C ATOM 1020 CE1 TYR A 456 -0.451 -11.977 9.717 1.00 0.00 C ATOM 1021 CE2 TYR A 456 -0.080 -9.875 10.791 1.00 0.00 C ATOM 1022 CZ TYR A 456 0.003 -11.244 10.795 1.00 0.00 C ATOM 1023 OH TYR A 456 0.566 -11.887 11.879 1.00 0.00 O ATOM 0 H TYR A 456 -0.288 -10.985 5.867 1.00 0.00 H new ATOM 0 HA TYR A 456 -1.040 -8.127 5.652 1.00 0.00 H new ATOM 0 HB2 TYR A 456 -2.016 -8.224 7.730 1.00 0.00 H new ATOM 0 HB3 TYR A 456 -2.505 -9.749 7.017 1.00 0.00 H new ATOM 0 HD1 TYR A 456 -1.340 -11.894 7.779 1.00 0.00 H new ATOM 0 HD2 TYR A 456 -0.692 -8.153 9.716 1.00 0.00 H new ATOM 0 HE1 TYR A 456 -0.387 -13.055 9.727 1.00 0.00 H new ATOM 0 HE2 TYR A 456 0.279 -9.307 11.637 1.00 0.00 H new ATOM 0 HH TYR A 456 0.834 -11.224 12.550 1.00 0.00 H new ATOM 1033 N GLY A 457 0.968 -7.507 7.239 1.00 0.00 N ATOM 1034 CA GLY A 457 2.241 -7.178 7.798 1.00 0.00 C ATOM 1035 C GLY A 457 2.206 -5.805 8.335 1.00 0.00 C ATOM 1036 O GLY A 457 1.135 -5.212 8.415 1.00 0.00 O ATOM 0 H GLY A 457 0.281 -6.754 7.260 1.00 0.00 H new ATOM 0 HA2 GLY A 457 2.495 -7.883 8.590 1.00 0.00 H new ATOM 0 HA3 GLY A 457 3.016 -7.262 7.037 1.00 0.00 H new ATOM 1040 N ARG A 458 3.324 -5.278 8.683 1.00 0.00 N ATOM 1041 CA ARG A 458 3.369 -3.937 9.201 1.00 0.00 C ATOM 1042 C ARG A 458 4.434 -3.182 8.464 1.00 0.00 C ATOM 1043 O ARG A 458 5.507 -3.722 8.219 1.00 0.00 O ATOM 1044 CB ARG A 458 3.639 -3.932 10.709 1.00 0.00 C ATOM 1045 CG ARG A 458 3.504 -2.560 11.341 1.00 0.00 C ATOM 1046 CD ARG A 458 3.830 -2.573 12.818 1.00 0.00 C ATOM 1047 NE ARG A 458 5.264 -2.754 13.090 1.00 0.00 N ATOM 1048 CZ ARG A 458 5.797 -2.791 14.331 1.00 0.00 C ATOM 1049 NH1 ARG A 458 5.003 -2.793 15.399 1.00 0.00 N ATOM 1050 NH2 ARG A 458 7.110 -2.833 14.492 1.00 0.00 N ATOM 0 H ARG A 458 4.228 -5.747 8.623 1.00 0.00 H new ATOM 0 HA ARG A 458 2.402 -3.456 9.051 1.00 0.00 H new ATOM 0 HB2 ARG A 458 2.947 -4.618 11.197 1.00 0.00 H new ATOM 0 HB3 ARG A 458 4.645 -4.311 10.892 1.00 0.00 H new ATOM 0 HG2 ARG A 458 4.167 -1.861 10.831 1.00 0.00 H new ATOM 0 HG3 ARG A 458 2.487 -2.196 11.199 1.00 0.00 H new ATOM 0 HD2 ARG A 458 3.497 -1.637 13.266 1.00 0.00 H new ATOM 0 HD3 ARG A 458 3.271 -3.374 13.301 1.00 0.00 H new ATOM 0 HE ARG A 458 5.894 -2.858 12.294 1.00 0.00 H new ATOM 0 HH11 ARG A 458 3.990 -2.767 15.282 1.00 0.00 H new ATOM 0 HH12 ARG A 458 5.407 -2.821 16.335 1.00 0.00 H new ATOM 0 HH21 ARG A 458 7.724 -2.838 13.677 1.00 0.00 H new ATOM 0 HH22 ARG A 458 7.508 -2.861 15.431 1.00 0.00 H new ATOM 1064 N VAL A 459 4.153 -1.955 8.105 1.00 0.00 N ATOM 1065 CA VAL A 459 5.087 -1.165 7.326 1.00 0.00 C ATOM 1066 C VAL A 459 6.352 -0.857 8.105 1.00 0.00 C ATOM 1067 O VAL A 459 6.314 -0.189 9.142 1.00 0.00 O ATOM 1068 CB VAL A 459 4.467 0.144 6.821 1.00 0.00 C ATOM 1069 CG1 VAL A 459 5.472 0.901 5.958 1.00 0.00 C ATOM 1070 CG2 VAL A 459 3.214 -0.157 6.034 1.00 0.00 C ATOM 0 H VAL A 459 3.283 -1.476 8.338 1.00 0.00 H new ATOM 0 HA VAL A 459 5.344 -1.778 6.462 1.00 0.00 H new ATOM 0 HB VAL A 459 4.205 0.770 7.674 1.00 0.00 H new ATOM 0 HG11 VAL A 459 5.022 1.829 5.604 1.00 0.00 H new ATOM 0 HG12 VAL A 459 6.359 1.130 6.549 1.00 0.00 H new ATOM 0 HG13 VAL A 459 5.754 0.286 5.103 1.00 0.00 H new ATOM 0 HG21 VAL A 459 2.776 0.775 5.677 1.00 0.00 H new ATOM 0 HG22 VAL A 459 3.462 -0.791 5.183 1.00 0.00 H new ATOM 0 HG23 VAL A 459 2.498 -0.673 6.674 1.00 0.00 H new ATOM 1080 N ARG A 460 7.448 -1.363 7.599 1.00 0.00 N ATOM 1081 CA ARG A 460 8.756 -1.153 8.173 1.00 0.00 C ATOM 1082 C ARG A 460 9.305 0.225 7.783 1.00 0.00 C ATOM 1083 O ARG A 460 9.560 1.059 8.646 1.00 0.00 O ATOM 1084 CB ARG A 460 9.700 -2.322 7.742 1.00 0.00 C ATOM 1085 CG ARG A 460 11.207 -2.026 7.736 1.00 0.00 C ATOM 1086 CD ARG A 460 11.728 -1.543 9.072 1.00 0.00 C ATOM 1087 NE ARG A 460 11.714 -2.576 10.113 1.00 0.00 N ATOM 1088 CZ ARG A 460 12.001 -2.351 11.408 1.00 0.00 C ATOM 1089 NH1 ARG A 460 12.273 -1.117 11.836 1.00 0.00 N ATOM 1090 NH2 ARG A 460 12.013 -3.349 12.269 1.00 0.00 N ATOM 0 H ARG A 460 7.458 -1.944 6.761 1.00 0.00 H new ATOM 0 HA ARG A 460 8.690 -1.159 9.261 1.00 0.00 H new ATOM 0 HB2 ARG A 460 9.522 -3.166 8.408 1.00 0.00 H new ATOM 0 HB3 ARG A 460 9.412 -2.640 6.740 1.00 0.00 H new ATOM 0 HG2 ARG A 460 11.746 -2.929 7.448 1.00 0.00 H new ATOM 0 HG3 ARG A 460 11.419 -1.273 6.977 1.00 0.00 H new ATOM 0 HD2 ARG A 460 12.748 -1.180 8.946 1.00 0.00 H new ATOM 0 HD3 ARG A 460 11.127 -0.696 9.403 1.00 0.00 H new ATOM 0 HE ARG A 460 11.471 -3.527 9.837 1.00 0.00 H new ATOM 0 HH11 ARG A 460 12.264 -0.336 11.180 1.00 0.00 H new ATOM 0 HH12 ARG A 460 12.490 -0.954 12.819 1.00 0.00 H new ATOM 0 HH21 ARG A 460 11.804 -4.297 11.954 1.00 0.00 H new ATOM 0 HH22 ARG A 460 12.231 -3.174 13.250 1.00 0.00 H new ATOM 1104 N ALA A 461 9.453 0.449 6.513 1.00 0.00 N ATOM 1105 CA ALA A 461 9.989 1.675 5.989 1.00 0.00 C ATOM 1106 C ALA A 461 9.265 2.003 4.724 1.00 0.00 C ATOM 1107 O ALA A 461 8.650 1.118 4.108 1.00 0.00 O ATOM 1108 CB ALA A 461 11.479 1.523 5.730 1.00 0.00 C ATOM 0 H ALA A 461 9.200 -0.228 5.794 1.00 0.00 H new ATOM 0 HA ALA A 461 9.854 2.483 6.708 1.00 0.00 H new ATOM 0 HB1 ALA A 461 11.876 2.457 5.333 1.00 0.00 H new ATOM 0 HB2 ALA A 461 11.988 1.280 6.663 1.00 0.00 H new ATOM 0 HB3 ALA A 461 11.643 0.723 5.008 1.00 0.00 H new ATOM 1114 N MET A 462 9.330 3.236 4.335 1.00 0.00 N ATOM 1115 CA MET A 462 8.635 3.702 3.193 1.00 0.00 C ATOM 1116 C MET A 462 9.663 4.269 2.240 1.00 0.00 C ATOM 1117 O MET A 462 10.608 4.958 2.663 1.00 0.00 O ATOM 1118 CB MET A 462 7.686 4.815 3.626 1.00 0.00 C ATOM 1119 CG MET A 462 6.593 5.171 2.634 1.00 0.00 C ATOM 1120 SD MET A 462 5.274 3.972 2.630 1.00 0.00 S ATOM 1121 CE MET A 462 4.700 4.210 4.303 1.00 0.00 C ATOM 0 H MET A 462 9.877 3.952 4.813 1.00 0.00 H new ATOM 0 HA MET A 462 8.068 2.901 2.718 1.00 0.00 H new ATOM 0 HB2 MET A 462 7.217 4.523 4.566 1.00 0.00 H new ATOM 0 HB3 MET A 462 8.274 5.710 3.828 1.00 0.00 H new ATOM 0 HG2 MET A 462 6.189 6.153 2.878 1.00 0.00 H new ATOM 0 HG3 MET A 462 7.021 5.242 1.634 1.00 0.00 H new ATOM 0 HE1 MET A 462 3.654 3.912 4.375 1.00 0.00 H new ATOM 0 HE2 MET A 462 5.298 3.603 4.983 1.00 0.00 H new ATOM 0 HE3 MET A 462 4.797 5.261 4.575 1.00 0.00 H new ATOM 1131 N VAL A 463 9.546 3.934 1.014 1.00 0.00 N ATOM 1132 CA VAL A 463 10.385 4.482 -0.023 1.00 0.00 C ATOM 1133 C VAL A 463 9.447 5.219 -0.937 1.00 0.00 C ATOM 1134 O VAL A 463 8.337 4.762 -1.135 1.00 0.00 O ATOM 1135 CB VAL A 463 11.093 3.376 -0.853 1.00 0.00 C ATOM 1136 CG1 VAL A 463 12.215 3.952 -1.699 1.00 0.00 C ATOM 1137 CG2 VAL A 463 11.581 2.223 0.010 1.00 0.00 C ATOM 0 H VAL A 463 8.858 3.260 0.678 1.00 0.00 H new ATOM 0 HA VAL A 463 11.163 5.106 0.416 1.00 0.00 H new ATOM 0 HB VAL A 463 10.344 2.963 -1.529 1.00 0.00 H new ATOM 0 HG11 VAL A 463 12.690 3.152 -2.267 1.00 0.00 H new ATOM 0 HG12 VAL A 463 11.808 4.694 -2.387 1.00 0.00 H new ATOM 0 HG13 VAL A 463 12.953 4.424 -1.051 1.00 0.00 H new ATOM 0 HG21 VAL A 463 12.068 1.478 -0.619 1.00 0.00 H new ATOM 0 HG22 VAL A 463 12.292 2.596 0.747 1.00 0.00 H new ATOM 0 HG23 VAL A 463 10.733 1.767 0.522 1.00 0.00 H new ATOM 1147 N ASN A 464 9.830 6.339 -1.462 1.00 0.00 N ATOM 1148 CA ASN A 464 8.906 7.063 -2.328 1.00 0.00 C ATOM 1149 C ASN A 464 9.298 6.879 -3.781 1.00 0.00 C ATOM 1150 O ASN A 464 10.300 6.221 -4.065 1.00 0.00 O ATOM 1151 CB ASN A 464 8.825 8.547 -1.957 1.00 0.00 C ATOM 1152 CG ASN A 464 9.989 9.391 -2.451 1.00 0.00 C ATOM 1153 OD1 ASN A 464 9.959 9.928 -3.545 1.00 0.00 O ATOM 1154 ND2 ASN A 464 11.015 9.500 -1.673 1.00 0.00 N ATOM 0 H ASN A 464 10.742 6.775 -1.324 1.00 0.00 H new ATOM 0 HA ASN A 464 7.909 6.646 -2.183 1.00 0.00 H new ATOM 0 HB2 ASN A 464 7.899 8.958 -2.360 1.00 0.00 H new ATOM 0 HB3 ASN A 464 8.766 8.633 -0.872 1.00 0.00 H new ATOM 0 HD21 ASN A 464 11.824 10.045 -1.970 1.00 0.00 H new ATOM 0 HD22 ASN A 464 11.015 9.041 -0.762 1.00 0.00 H new ATOM 1161 N ASP A 465 8.530 7.486 -4.682 1.00 0.00 N ATOM 1162 CA ASP A 465 8.720 7.395 -6.145 1.00 0.00 C ATOM 1163 C ASP A 465 10.139 7.788 -6.591 1.00 0.00 C ATOM 1164 O ASP A 465 10.659 7.272 -7.597 1.00 0.00 O ATOM 1165 CB ASP A 465 7.679 8.284 -6.853 1.00 0.00 C ATOM 1166 CG ASP A 465 7.759 8.228 -8.362 1.00 0.00 C ATOM 1167 OD1 ASP A 465 7.408 7.185 -8.942 1.00 0.00 O ATOM 1168 OD2 ASP A 465 8.171 9.235 -9.002 1.00 0.00 O ATOM 0 H ASP A 465 7.737 8.071 -4.419 1.00 0.00 H new ATOM 0 HA ASP A 465 8.582 6.351 -6.426 1.00 0.00 H new ATOM 0 HB2 ASP A 465 6.681 7.980 -6.539 1.00 0.00 H new ATOM 0 HB3 ASP A 465 7.814 9.316 -6.529 1.00 0.00 H new ATOM 1173 N SER A 466 10.772 8.667 -5.838 1.00 0.00 N ATOM 1174 CA SER A 466 12.102 9.121 -6.156 1.00 0.00 C ATOM 1175 C SER A 466 13.195 8.207 -5.551 1.00 0.00 C ATOM 1176 O SER A 466 14.379 8.411 -5.793 1.00 0.00 O ATOM 1177 CB SER A 466 12.266 10.559 -5.693 1.00 0.00 C ATOM 1178 OG SER A 466 11.260 11.388 -6.276 1.00 0.00 O ATOM 0 H SER A 466 10.377 9.082 -4.994 1.00 0.00 H new ATOM 0 HA SER A 466 12.231 9.073 -7.237 1.00 0.00 H new ATOM 0 HB2 SER A 466 12.201 10.607 -4.606 1.00 0.00 H new ATOM 0 HB3 SER A 466 13.254 10.926 -5.970 1.00 0.00 H new ATOM 0 HG SER A 466 11.377 12.311 -5.967 1.00 0.00 H new ATOM 1184 N GLY A 467 12.804 7.241 -4.728 1.00 0.00 N ATOM 1185 CA GLY A 467 13.766 6.254 -4.229 1.00 0.00 C ATOM 1186 C GLY A 467 14.360 6.624 -2.889 1.00 0.00 C ATOM 1187 O GLY A 467 15.231 5.928 -2.361 1.00 0.00 O ATOM 0 H GLY A 467 11.848 7.117 -4.395 1.00 0.00 H new ATOM 0 HA2 GLY A 467 13.272 5.286 -4.145 1.00 0.00 H new ATOM 0 HA3 GLY A 467 14.570 6.140 -4.956 1.00 0.00 H new ATOM 1191 N ARG A 468 13.883 7.701 -2.335 1.00 0.00 N ATOM 1192 CA ARG A 468 14.362 8.182 -1.060 1.00 0.00 C ATOM 1193 C ARG A 468 13.505 7.641 0.070 1.00 0.00 C ATOM 1194 O ARG A 468 12.329 7.276 -0.140 1.00 0.00 O ATOM 1195 CB ARG A 468 14.363 9.706 -1.011 1.00 0.00 C ATOM 1196 CG ARG A 468 15.531 10.425 -1.711 1.00 0.00 C ATOM 1197 CD ARG A 468 15.580 10.205 -3.216 1.00 0.00 C ATOM 1198 NE ARG A 468 16.631 11.025 -3.834 1.00 0.00 N ATOM 1199 CZ ARG A 468 16.875 11.153 -5.151 1.00 0.00 C ATOM 1200 NH1 ARG A 468 16.228 10.406 -6.046 1.00 0.00 N ATOM 1201 NH2 ARG A 468 17.808 12.007 -5.558 1.00 0.00 N ATOM 0 H ARG A 468 13.150 8.275 -2.751 1.00 0.00 H new ATOM 0 HA ARG A 468 15.386 7.828 -0.939 1.00 0.00 H new ATOM 0 HB2 ARG A 468 13.432 10.060 -1.454 1.00 0.00 H new ATOM 0 HB3 ARG A 468 14.355 10.012 0.035 1.00 0.00 H new ATOM 0 HG2 ARG A 468 15.457 11.494 -1.513 1.00 0.00 H new ATOM 0 HG3 ARG A 468 16.469 10.084 -1.273 1.00 0.00 H new ATOM 0 HD2 ARG A 468 15.764 9.152 -3.427 1.00 0.00 H new ATOM 0 HD3 ARG A 468 14.614 10.454 -3.655 1.00 0.00 H new ATOM 0 HE ARG A 468 17.236 11.549 -3.202 1.00 0.00 H new ATOM 0 HH11 ARG A 468 15.535 9.724 -5.736 1.00 0.00 H new ATOM 0 HH12 ARG A 468 16.426 10.516 -7.041 1.00 0.00 H new ATOM 0 HH21 ARG A 468 18.330 12.556 -4.875 1.00 0.00 H new ATOM 0 HH22 ARG A 468 18.003 12.113 -6.554 1.00 0.00 H new ATOM 1215 N ARG A 469 14.082 7.605 1.242 1.00 0.00 N ATOM 1216 CA ARG A 469 13.438 7.117 2.442 1.00 0.00 C ATOM 1217 C ARG A 469 12.434 8.133 2.974 1.00 0.00 C ATOM 1218 O ARG A 469 12.747 9.329 3.096 1.00 0.00 O ATOM 1219 CB ARG A 469 14.490 6.851 3.525 1.00 0.00 C ATOM 1220 CG ARG A 469 13.921 6.300 4.827 1.00 0.00 C ATOM 1221 CD ARG A 469 13.333 4.925 4.618 1.00 0.00 C ATOM 1222 NE ARG A 469 14.378 3.958 4.258 1.00 0.00 N ATOM 1223 CZ ARG A 469 14.209 2.857 3.526 1.00 0.00 C ATOM 1224 NH1 ARG A 469 13.051 2.622 2.925 1.00 0.00 N ATOM 1225 NH2 ARG A 469 15.220 2.013 3.352 1.00 0.00 N ATOM 0 H ARG A 469 15.039 7.922 1.397 1.00 0.00 H new ATOM 0 HA ARG A 469 12.913 6.195 2.191 1.00 0.00 H new ATOM 0 HB2 ARG A 469 15.225 6.147 3.136 1.00 0.00 H new ATOM 0 HB3 ARG A 469 15.019 7.780 3.737 1.00 0.00 H new ATOM 0 HG2 ARG A 469 14.707 6.253 5.581 1.00 0.00 H new ATOM 0 HG3 ARG A 469 13.154 6.974 5.207 1.00 0.00 H new ATOM 0 HD2 ARG A 469 12.828 4.599 5.527 1.00 0.00 H new ATOM 0 HD3 ARG A 469 12.580 4.963 3.831 1.00 0.00 H new ATOM 0 HE ARG A 469 15.320 4.146 4.600 1.00 0.00 H new ATOM 0 HH11 ARG A 469 12.283 3.286 3.021 1.00 0.00 H new ATOM 0 HH12 ARG A 469 12.929 1.777 2.366 1.00 0.00 H new ATOM 0 HH21 ARG A 469 16.126 2.207 3.779 1.00 0.00 H new ATOM 0 HH22 ARG A 469 15.090 1.171 2.792 1.00 0.00 H new ATOM 1239 N VAL A 470 11.252 7.655 3.300 1.00 0.00 N ATOM 1240 CA VAL A 470 10.207 8.465 3.889 1.00 0.00 C ATOM 1241 C VAL A 470 9.499 7.632 4.936 1.00 0.00 C ATOM 1242 O VAL A 470 9.844 6.454 5.120 1.00 0.00 O ATOM 1243 CB VAL A 470 9.191 9.042 2.837 1.00 0.00 C ATOM 1244 CG1 VAL A 470 9.860 10.073 1.957 1.00 0.00 C ATOM 1245 CG2 VAL A 470 8.598 7.951 1.968 1.00 0.00 C ATOM 0 H VAL A 470 10.986 6.680 3.162 1.00 0.00 H new ATOM 0 HA VAL A 470 10.670 9.342 4.343 1.00 0.00 H new ATOM 0 HB VAL A 470 8.384 9.510 3.400 1.00 0.00 H new ATOM 0 HG11 VAL A 470 9.139 10.459 1.236 1.00 0.00 H new ATOM 0 HG12 VAL A 470 10.231 10.892 2.573 1.00 0.00 H new ATOM 0 HG13 VAL A 470 10.693 9.612 1.426 1.00 0.00 H new ATOM 0 HG21 VAL A 470 7.901 8.392 1.255 1.00 0.00 H new ATOM 0 HG22 VAL A 470 9.396 7.442 1.428 1.00 0.00 H new ATOM 0 HG23 VAL A 470 8.069 7.233 2.595 1.00 0.00 H new ATOM 1255 N LYS A 471 8.574 8.216 5.648 1.00 0.00 N ATOM 1256 CA LYS A 471 7.846 7.490 6.681 1.00 0.00 C ATOM 1257 C LYS A 471 6.344 7.583 6.479 1.00 0.00 C ATOM 1258 O LYS A 471 5.601 6.677 6.858 1.00 0.00 O ATOM 1259 CB LYS A 471 8.225 7.998 8.075 1.00 0.00 C ATOM 1260 CG LYS A 471 9.680 7.765 8.443 1.00 0.00 C ATOM 1261 CD LYS A 471 9.987 8.305 9.822 1.00 0.00 C ATOM 1262 CE LYS A 471 11.450 8.112 10.184 1.00 0.00 C ATOM 1263 NZ LYS A 471 11.781 8.738 11.476 1.00 0.00 N ATOM 0 H LYS A 471 8.299 9.192 5.540 1.00 0.00 H new ATOM 0 HA LYS A 471 8.131 6.441 6.600 1.00 0.00 H new ATOM 0 HB2 LYS A 471 8.013 9.066 8.131 1.00 0.00 H new ATOM 0 HB3 LYS A 471 7.591 7.508 8.814 1.00 0.00 H new ATOM 0 HG2 LYS A 471 9.900 6.698 8.410 1.00 0.00 H new ATOM 0 HG3 LYS A 471 10.326 8.247 7.709 1.00 0.00 H new ATOM 0 HD2 LYS A 471 9.738 9.365 9.862 1.00 0.00 H new ATOM 0 HD3 LYS A 471 9.360 7.803 10.558 1.00 0.00 H new ATOM 0 HE2 LYS A 471 11.676 7.047 10.228 1.00 0.00 H new ATOM 0 HE3 LYS A 471 12.077 8.539 9.402 1.00 0.00 H new ATOM 0 HZ1 LYS A 471 12.788 8.585 11.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 471 11.589 9.759 11.426 1.00 0.00 H new ATOM 0 HZ3 LYS A 471 11.200 8.313 12.227 1.00 0.00 H new ATOM 1277 N GLU A 472 5.914 8.663 5.884 1.00 0.00 N ATOM 1278 CA GLU A 472 4.509 8.934 5.662 1.00 0.00 C ATOM 1279 C GLU A 472 4.265 9.157 4.178 1.00 0.00 C ATOM 1280 O GLU A 472 5.099 9.749 3.497 1.00 0.00 O ATOM 1281 CB GLU A 472 4.114 10.187 6.448 1.00 0.00 C ATOM 1282 CG GLU A 472 4.222 10.036 7.951 1.00 0.00 C ATOM 1283 CD GLU A 472 4.176 11.340 8.677 1.00 0.00 C ATOM 1284 OE1 GLU A 472 3.073 11.798 9.049 1.00 0.00 O ATOM 1285 OE2 GLU A 472 5.248 11.931 8.927 1.00 0.00 O ATOM 0 H GLU A 472 6.534 9.393 5.533 1.00 0.00 H new ATOM 0 HA GLU A 472 3.909 8.088 5.998 1.00 0.00 H new ATOM 0 HB2 GLU A 472 4.747 11.016 6.131 1.00 0.00 H new ATOM 0 HB3 GLU A 472 3.088 10.454 6.194 1.00 0.00 H new ATOM 0 HG2 GLU A 472 3.410 9.401 8.305 1.00 0.00 H new ATOM 0 HG3 GLU A 472 5.154 9.526 8.193 1.00 0.00 H new ATOM 1292 N ALA A 473 3.160 8.660 3.680 1.00 0.00 N ATOM 1293 CA ALA A 473 2.803 8.818 2.296 1.00 0.00 C ATOM 1294 C ALA A 473 1.329 9.104 2.145 1.00 0.00 C ATOM 1295 O ALA A 473 0.484 8.343 2.637 1.00 0.00 O ATOM 1296 CB ALA A 473 3.163 7.581 1.511 1.00 0.00 C ATOM 0 H ALA A 473 2.481 8.132 4.228 1.00 0.00 H new ATOM 0 HA ALA A 473 3.364 9.666 1.904 1.00 0.00 H new ATOM 0 HB1 ALA A 473 2.885 7.720 0.466 1.00 0.00 H new ATOM 0 HB2 ALA A 473 4.236 7.405 1.581 1.00 0.00 H new ATOM 0 HB3 ALA A 473 2.628 6.723 1.918 1.00 0.00 H new ATOM 1302 N GLY A 474 1.023 10.182 1.459 1.00 0.00 N ATOM 1303 CA GLY A 474 -0.343 10.562 1.247 1.00 0.00 C ATOM 1304 C GLY A 474 -0.953 9.808 0.087 1.00 0.00 C ATOM 1305 O GLY A 474 -0.218 9.253 -0.745 1.00 0.00 O ATOM 0 H GLY A 474 1.709 10.809 1.039 1.00 0.00 H new ATOM 0 HA2 GLY A 474 -0.920 10.370 2.151 1.00 0.00 H new ATOM 0 HA3 GLY A 474 -0.398 11.634 1.056 1.00 0.00 H new ATOM 1309 N PRO A 475 -2.289 9.760 0.000 1.00 0.00 N ATOM 1310 CA PRO A 475 -2.990 9.053 -1.068 1.00 0.00 C ATOM 1311 C PRO A 475 -2.649 9.577 -2.450 1.00 0.00 C ATOM 1312 O PRO A 475 -2.275 10.760 -2.616 1.00 0.00 O ATOM 1313 CB PRO A 475 -4.468 9.277 -0.759 1.00 0.00 C ATOM 1314 CG PRO A 475 -4.497 10.449 0.153 1.00 0.00 C ATOM 1315 CD PRO A 475 -3.228 10.387 0.943 1.00 0.00 C ATOM 0 HA PRO A 475 -2.706 8.001 -1.093 1.00 0.00 H new ATOM 0 HB2 PRO A 475 -5.036 9.471 -1.669 1.00 0.00 H new ATOM 0 HB3 PRO A 475 -4.910 8.399 -0.288 1.00 0.00 H new ATOM 0 HG2 PRO A 475 -4.561 11.380 -0.410 1.00 0.00 H new ATOM 0 HG3 PRO A 475 -5.367 10.412 0.808 1.00 0.00 H new ATOM 0 HD2 PRO A 475 -2.893 11.378 1.249 1.00 0.00 H new ATOM 0 HD3 PRO A 475 -3.345 9.796 1.851 1.00 0.00 H new ATOM 1323 N SER A 476 -2.731 8.672 -3.416 1.00 0.00 N ATOM 1324 CA SER A 476 -2.461 8.917 -4.823 1.00 0.00 C ATOM 1325 C SER A 476 -0.951 9.020 -5.119 1.00 0.00 C ATOM 1326 O SER A 476 -0.542 9.279 -6.260 1.00 0.00 O ATOM 1327 CB SER A 476 -3.248 10.131 -5.346 1.00 0.00 C ATOM 1328 OG SER A 476 -4.648 9.963 -5.088 1.00 0.00 O ATOM 0 H SER A 476 -2.999 7.706 -3.230 1.00 0.00 H new ATOM 0 HA SER A 476 -2.818 8.047 -5.375 1.00 0.00 H new ATOM 0 HB2 SER A 476 -2.889 11.041 -4.865 1.00 0.00 H new ATOM 0 HB3 SER A 476 -3.080 10.249 -6.416 1.00 0.00 H new ATOM 0 HG SER A 476 -5.138 10.742 -5.424 1.00 0.00 H new ATOM 1334 N MET A 477 -0.127 8.787 -4.108 1.00 0.00 N ATOM 1335 CA MET A 477 1.310 8.837 -4.277 1.00 0.00 C ATOM 1336 C MET A 477 1.905 7.426 -4.329 1.00 0.00 C ATOM 1337 O MET A 477 1.486 6.550 -3.562 1.00 0.00 O ATOM 1338 CB MET A 477 1.983 9.673 -3.167 1.00 0.00 C ATOM 1339 CG MET A 477 3.501 9.643 -3.246 1.00 0.00 C ATOM 1340 SD MET A 477 4.338 10.887 -2.236 1.00 0.00 S ATOM 1341 CE MET A 477 3.845 10.414 -0.599 1.00 0.00 C ATOM 0 H MET A 477 -0.434 8.561 -3.162 1.00 0.00 H new ATOM 0 HA MET A 477 1.510 9.329 -5.229 1.00 0.00 H new ATOM 0 HB2 MET A 477 1.640 10.705 -3.238 1.00 0.00 H new ATOM 0 HB3 MET A 477 1.667 9.298 -2.194 1.00 0.00 H new ATOM 0 HG2 MET A 477 3.847 8.655 -2.941 1.00 0.00 H new ATOM 0 HG3 MET A 477 3.799 9.779 -4.286 1.00 0.00 H new ATOM 0 HE1 MET A 477 4.138 11.190 0.108 1.00 0.00 H new ATOM 0 HE2 MET A 477 2.763 10.284 -0.568 1.00 0.00 H new ATOM 0 HE3 MET A 477 4.331 9.476 -0.329 1.00 0.00 H new ATOM 1351 N PRO A 478 2.846 7.167 -5.274 1.00 0.00 N ATOM 1352 CA PRO A 478 3.534 5.885 -5.361 1.00 0.00 C ATOM 1353 C PRO A 478 4.603 5.760 -4.295 1.00 0.00 C ATOM 1354 O PRO A 478 5.491 6.619 -4.188 1.00 0.00 O ATOM 1355 CB PRO A 478 4.231 5.915 -6.723 1.00 0.00 C ATOM 1356 CG PRO A 478 3.785 7.169 -7.399 1.00 0.00 C ATOM 1357 CD PRO A 478 3.292 8.088 -6.333 1.00 0.00 C ATOM 0 HA PRO A 478 2.836 5.058 -5.233 1.00 0.00 H new ATOM 0 HB2 PRO A 478 5.314 5.902 -6.605 1.00 0.00 H new ATOM 0 HB3 PRO A 478 3.964 5.039 -7.315 1.00 0.00 H new ATOM 0 HG2 PRO A 478 4.608 7.624 -7.950 1.00 0.00 H new ATOM 0 HG3 PRO A 478 2.996 6.958 -8.121 1.00 0.00 H new ATOM 0 HD2 PRO A 478 4.079 8.755 -5.981 1.00 0.00 H new ATOM 0 HD3 PRO A 478 2.476 8.717 -6.689 1.00 0.00 H new ATOM 1365 N VAL A 479 4.537 4.708 -3.538 1.00 0.00 N ATOM 1366 CA VAL A 479 5.504 4.433 -2.510 1.00 0.00 C ATOM 1367 C VAL A 479 5.781 2.962 -2.457 1.00 0.00 C ATOM 1368 O VAL A 479 4.997 2.165 -2.960 1.00 0.00 O ATOM 1369 CB VAL A 479 5.079 4.947 -1.101 1.00 0.00 C ATOM 1370 CG1 VAL A 479 5.148 6.460 -1.037 1.00 0.00 C ATOM 1371 CG2 VAL A 479 3.676 4.476 -0.744 1.00 0.00 C ATOM 0 H VAL A 479 3.802 4.005 -3.615 1.00 0.00 H new ATOM 0 HA VAL A 479 6.408 4.981 -2.777 1.00 0.00 H new ATOM 0 HB VAL A 479 5.778 4.531 -0.375 1.00 0.00 H new ATOM 0 HG11 VAL A 479 4.847 6.796 -0.045 1.00 0.00 H new ATOM 0 HG12 VAL A 479 6.169 6.786 -1.237 1.00 0.00 H new ATOM 0 HG13 VAL A 479 4.478 6.887 -1.783 1.00 0.00 H new ATOM 0 HG21 VAL A 479 3.407 4.850 0.244 1.00 0.00 H new ATOM 0 HG22 VAL A 479 2.967 4.854 -1.480 1.00 0.00 H new ATOM 0 HG23 VAL A 479 3.648 3.386 -0.740 1.00 0.00 H new ATOM 1381 N GLU A 480 6.883 2.612 -1.910 1.00 0.00 N ATOM 1382 CA GLU A 480 7.252 1.252 -1.776 1.00 0.00 C ATOM 1383 C GLU A 480 7.369 0.919 -0.306 1.00 0.00 C ATOM 1384 O GLU A 480 8.060 1.614 0.455 1.00 0.00 O ATOM 1385 CB GLU A 480 8.531 0.965 -2.563 1.00 0.00 C ATOM 1386 CG GLU A 480 8.990 -0.470 -2.520 1.00 0.00 C ATOM 1387 CD GLU A 480 10.076 -0.750 -3.520 1.00 0.00 C ATOM 1388 OE1 GLU A 480 11.235 -0.400 -3.273 1.00 0.00 O ATOM 1389 OE2 GLU A 480 9.764 -1.317 -4.593 1.00 0.00 O ATOM 0 H GLU A 480 7.566 3.271 -1.536 1.00 0.00 H new ATOM 0 HA GLU A 480 6.486 0.604 -2.202 1.00 0.00 H new ATOM 0 HB2 GLU A 480 8.373 1.250 -3.603 1.00 0.00 H new ATOM 0 HB3 GLU A 480 9.329 1.599 -2.176 1.00 0.00 H new ATOM 0 HG2 GLU A 480 9.352 -0.704 -1.519 1.00 0.00 H new ATOM 0 HG3 GLU A 480 8.142 -1.127 -2.714 1.00 0.00 H new ATOM 1396 N ILE A 481 6.646 -0.090 0.091 1.00 0.00 N ATOM 1397 CA ILE A 481 6.585 -0.518 1.468 1.00 0.00 C ATOM 1398 C ILE A 481 7.508 -1.685 1.705 1.00 0.00 C ATOM 1399 O ILE A 481 8.049 -2.273 0.767 1.00 0.00 O ATOM 1400 CB ILE A 481 5.168 -0.990 1.847 1.00 0.00 C ATOM 1401 CG1 ILE A 481 4.739 -2.140 0.921 1.00 0.00 C ATOM 1402 CG2 ILE A 481 4.186 0.171 1.789 1.00 0.00 C ATOM 1403 CD1 ILE A 481 3.488 -2.839 1.347 1.00 0.00 C ATOM 0 H ILE A 481 6.072 -0.650 -0.540 1.00 0.00 H new ATOM 0 HA ILE A 481 6.875 0.342 2.072 1.00 0.00 H new ATOM 0 HB ILE A 481 5.173 -1.361 2.872 1.00 0.00 H new ATOM 0 HG12 ILE A 481 4.597 -1.747 -0.086 1.00 0.00 H new ATOM 0 HG13 ILE A 481 5.548 -2.869 0.867 1.00 0.00 H new ATOM 0 HG21 ILE A 481 3.190 -0.181 2.060 1.00 0.00 H new ATOM 0 HG22 ILE A 481 4.499 0.947 2.487 1.00 0.00 H new ATOM 0 HG23 ILE A 481 4.164 0.579 0.779 1.00 0.00 H new ATOM 0 HD11 ILE A 481 3.257 -3.635 0.639 1.00 0.00 H new ATOM 0 HD12 ILE A 481 3.630 -3.266 2.340 1.00 0.00 H new ATOM 0 HD13 ILE A 481 2.664 -2.126 1.373 1.00 0.00 H new ATOM 1415 N THR A 482 7.623 -2.031 2.956 1.00 0.00 N ATOM 1416 CA THR A 482 8.409 -3.128 3.443 1.00 0.00 C ATOM 1417 C THR A 482 7.732 -3.603 4.714 1.00 0.00 C ATOM 1418 O THR A 482 6.919 -2.856 5.279 1.00 0.00 O ATOM 1419 CB THR A 482 9.837 -2.653 3.787 1.00 0.00 C ATOM 1420 OG1 THR A 482 9.756 -1.406 4.486 1.00 0.00 O ATOM 1421 CG2 THR A 482 10.701 -2.491 2.556 1.00 0.00 C ATOM 0 H THR A 482 7.145 -1.528 3.703 1.00 0.00 H new ATOM 0 HA THR A 482 8.481 -3.916 2.694 1.00 0.00 H new ATOM 0 HB THR A 482 10.304 -3.415 4.411 1.00 0.00 H new ATOM 0 HG1 THR A 482 9.373 -0.724 3.895 1.00 0.00 H new ATOM 0 HG21 THR A 482 11.695 -2.155 2.851 1.00 0.00 H new ATOM 0 HG22 THR A 482 10.779 -3.447 2.038 1.00 0.00 H new ATOM 0 HG23 THR A 482 10.252 -1.754 1.891 1.00 0.00 H new ATOM 1429 N GLY A 483 8.026 -4.796 5.161 1.00 0.00 N ATOM 1430 CA GLY A 483 7.460 -5.255 6.414 1.00 0.00 C ATOM 1431 C GLY A 483 6.480 -6.394 6.263 1.00 0.00 C ATOM 1432 O GLY A 483 5.795 -6.761 7.215 1.00 0.00 O ATOM 0 H GLY A 483 8.641 -5.460 4.691 1.00 0.00 H new ATOM 0 HA2 GLY A 483 8.269 -5.570 7.073 1.00 0.00 H new ATOM 0 HA3 GLY A 483 6.958 -4.420 6.902 1.00 0.00 H new ATOM 1436 N LEU A 484 6.380 -6.935 5.075 1.00 0.00 N ATOM 1437 CA LEU A 484 5.532 -8.074 4.858 1.00 0.00 C ATOM 1438 C LEU A 484 6.308 -9.352 5.083 1.00 0.00 C ATOM 1439 O LEU A 484 5.800 -10.303 5.654 1.00 0.00 O ATOM 1440 CB LEU A 484 4.984 -8.082 3.434 1.00 0.00 C ATOM 1441 CG LEU A 484 3.963 -7.013 3.060 1.00 0.00 C ATOM 1442 CD1 LEU A 484 3.509 -7.219 1.630 1.00 0.00 C ATOM 1443 CD2 LEU A 484 2.771 -7.074 3.991 1.00 0.00 C ATOM 0 H LEU A 484 6.875 -6.604 4.247 1.00 0.00 H new ATOM 0 HA LEU A 484 4.703 -8.010 5.563 1.00 0.00 H new ATOM 0 HB2 LEU A 484 5.828 -7.993 2.750 1.00 0.00 H new ATOM 0 HB3 LEU A 484 4.530 -9.057 3.255 1.00 0.00 H new ATOM 0 HG LEU A 484 4.430 -6.032 3.154 1.00 0.00 H new ATOM 0 HD11 LEU A 484 2.779 -6.453 1.366 1.00 0.00 H new ATOM 0 HD12 LEU A 484 4.367 -7.148 0.962 1.00 0.00 H new ATOM 0 HD13 LEU A 484 3.053 -8.204 1.531 1.00 0.00 H new ATOM 0 HD21 LEU A 484 2.051 -6.305 3.711 1.00 0.00 H new ATOM 0 HD22 LEU A 484 2.301 -8.055 3.917 1.00 0.00 H new ATOM 0 HD23 LEU A 484 3.101 -6.906 5.016 1.00 0.00 H new ATOM 1455 N HIS A 485 7.556 -9.344 4.610 1.00 0.00 N ATOM 1456 CA HIS A 485 8.463 -10.500 4.613 1.00 0.00 C ATOM 1457 C HIS A 485 7.848 -11.693 3.837 1.00 0.00 C ATOM 1458 O HIS A 485 8.260 -12.842 3.976 1.00 0.00 O ATOM 1459 CB HIS A 485 8.878 -10.875 6.050 1.00 0.00 C ATOM 1460 CG HIS A 485 10.038 -11.826 6.126 1.00 0.00 C ATOM 1461 ND1 HIS A 485 9.990 -13.074 6.704 1.00 0.00 N ATOM 1462 CD2 HIS A 485 11.304 -11.670 5.680 1.00 0.00 C ATOM 1463 CE1 HIS A 485 11.202 -13.624 6.597 1.00 0.00 C ATOM 1464 NE2 HIS A 485 12.043 -12.809 5.976 1.00 0.00 N ATOM 0 H HIS A 485 7.978 -8.510 4.202 1.00 0.00 H new ATOM 0 HA HIS A 485 9.376 -10.223 4.087 1.00 0.00 H new ATOM 0 HB2 HIS A 485 9.133 -9.964 6.592 1.00 0.00 H new ATOM 0 HB3 HIS A 485 8.023 -11.320 6.559 1.00 0.00 H new ATOM 0 HD2 HIS A 485 11.683 -10.795 5.172 1.00 0.00 H new ATOM 0 HE1 HIS A 485 11.463 -14.604 6.968 1.00 0.00 H new ATOM 0 HE2 HIS A 485 13.025 -12.981 5.761 1.00 0.00 H new ATOM 1472 N ASP A 486 6.913 -11.387 2.981 1.00 0.00 N ATOM 1473 CA ASP A 486 6.272 -12.372 2.145 1.00 0.00 C ATOM 1474 C ASP A 486 6.400 -11.868 0.734 1.00 0.00 C ATOM 1475 O ASP A 486 6.973 -10.796 0.524 1.00 0.00 O ATOM 1476 CB ASP A 486 4.797 -12.536 2.498 1.00 0.00 C ATOM 1477 CG ASP A 486 4.230 -13.885 2.086 1.00 0.00 C ATOM 1478 OD1 ASP A 486 3.957 -14.108 0.888 1.00 0.00 O ATOM 1479 OD2 ASP A 486 4.065 -14.759 2.961 1.00 0.00 O ATOM 0 H ASP A 486 6.569 -10.437 2.840 1.00 0.00 H new ATOM 0 HA ASP A 486 6.740 -13.347 2.281 1.00 0.00 H new ATOM 0 HB2 ASP A 486 4.671 -12.409 3.573 1.00 0.00 H new ATOM 0 HB3 ASP A 486 4.224 -11.745 2.014 1.00 0.00 H new ATOM 1484 N VAL A 487 5.872 -12.585 -0.204 1.00 0.00 N ATOM 1485 CA VAL A 487 5.996 -12.236 -1.591 1.00 0.00 C ATOM 1486 C VAL A 487 4.774 -11.424 -2.019 1.00 0.00 C ATOM 1487 O VAL A 487 3.653 -11.950 -2.056 1.00 0.00 O ATOM 1488 CB VAL A 487 6.112 -13.505 -2.480 1.00 0.00 C ATOM 1489 CG1 VAL A 487 6.291 -13.134 -3.949 1.00 0.00 C ATOM 1490 CG2 VAL A 487 7.262 -14.386 -2.007 1.00 0.00 C ATOM 0 H VAL A 487 5.337 -13.437 -0.033 1.00 0.00 H new ATOM 0 HA VAL A 487 6.903 -11.645 -1.718 1.00 0.00 H new ATOM 0 HB VAL A 487 5.183 -14.067 -2.386 1.00 0.00 H new ATOM 0 HG11 VAL A 487 6.369 -14.042 -4.547 1.00 0.00 H new ATOM 0 HG12 VAL A 487 5.433 -12.552 -4.284 1.00 0.00 H new ATOM 0 HG13 VAL A 487 7.199 -12.543 -4.067 1.00 0.00 H new ATOM 0 HG21 VAL A 487 7.328 -15.270 -2.641 1.00 0.00 H new ATOM 0 HG22 VAL A 487 8.196 -13.827 -2.065 1.00 0.00 H new ATOM 0 HG23 VAL A 487 7.086 -14.692 -0.976 1.00 0.00 H new ATOM 1500 N PRO A 488 4.943 -10.127 -2.288 1.00 0.00 N ATOM 1501 CA PRO A 488 3.867 -9.296 -2.775 1.00 0.00 C ATOM 1502 C PRO A 488 3.746 -9.434 -4.291 1.00 0.00 C ATOM 1503 O PRO A 488 4.714 -9.807 -4.973 1.00 0.00 O ATOM 1504 CB PRO A 488 4.294 -7.868 -2.397 1.00 0.00 C ATOM 1505 CG PRO A 488 5.698 -7.971 -1.866 1.00 0.00 C ATOM 1506 CD PRO A 488 6.186 -9.362 -2.147 1.00 0.00 C ATOM 0 HA PRO A 488 2.898 -9.566 -2.354 1.00 0.00 H new ATOM 0 HB2 PRO A 488 4.254 -7.208 -3.264 1.00 0.00 H new ATOM 0 HB3 PRO A 488 3.625 -7.448 -1.646 1.00 0.00 H new ATOM 0 HG2 PRO A 488 6.344 -7.234 -2.344 1.00 0.00 H new ATOM 0 HG3 PRO A 488 5.719 -7.766 -0.796 1.00 0.00 H new ATOM 0 HD2 PRO A 488 6.789 -9.402 -3.054 1.00 0.00 H new ATOM 0 HD3 PRO A 488 6.805 -9.744 -1.335 1.00 0.00 H new ATOM 1514 N GLN A 489 2.588 -9.154 -4.828 1.00 0.00 N ATOM 1515 CA GLN A 489 2.392 -9.301 -6.246 1.00 0.00 C ATOM 1516 C GLN A 489 1.980 -8.002 -6.879 1.00 0.00 C ATOM 1517 O GLN A 489 1.138 -7.264 -6.345 1.00 0.00 O ATOM 1518 CB GLN A 489 1.386 -10.401 -6.556 1.00 0.00 C ATOM 1519 CG GLN A 489 1.819 -11.758 -6.043 1.00 0.00 C ATOM 1520 CD GLN A 489 0.852 -12.858 -6.390 1.00 0.00 C ATOM 1521 OE1 GLN A 489 -0.349 -12.635 -6.530 1.00 0.00 O ATOM 1522 NE2 GLN A 489 1.356 -14.055 -6.500 1.00 0.00 N ATOM 0 H GLN A 489 1.773 -8.826 -4.311 1.00 0.00 H new ATOM 0 HA GLN A 489 3.349 -9.594 -6.678 1.00 0.00 H new ATOM 0 HB2 GLN A 489 0.424 -10.141 -6.114 1.00 0.00 H new ATOM 0 HB3 GLN A 489 1.237 -10.457 -7.634 1.00 0.00 H new ATOM 0 HG2 GLN A 489 2.798 -12.000 -6.456 1.00 0.00 H new ATOM 0 HG3 GLN A 489 1.933 -11.711 -4.960 1.00 0.00 H new ATOM 0 HE21 GLN A 489 2.358 -14.200 -6.377 1.00 0.00 H new ATOM 0 HE22 GLN A 489 0.748 -14.847 -6.709 1.00 0.00 H new ATOM 1531 N ALA A 490 2.602 -7.706 -7.987 1.00 0.00 N ATOM 1532 CA ALA A 490 2.312 -6.515 -8.748 1.00 0.00 C ATOM 1533 C ALA A 490 0.934 -6.620 -9.379 1.00 0.00 C ATOM 1534 O ALA A 490 0.642 -7.588 -10.094 1.00 0.00 O ATOM 1535 CB ALA A 490 3.365 -6.326 -9.823 1.00 0.00 C ATOM 0 H ALA A 490 3.333 -8.289 -8.394 1.00 0.00 H new ATOM 0 HA ALA A 490 2.325 -5.654 -8.080 1.00 0.00 H new ATOM 0 HB1 ALA A 490 3.143 -5.426 -10.396 1.00 0.00 H new ATOM 0 HB2 ALA A 490 4.346 -6.227 -9.358 1.00 0.00 H new ATOM 0 HB3 ALA A 490 3.364 -7.189 -10.489 1.00 0.00 H new ATOM 1541 N GLY A 491 0.096 -5.648 -9.104 1.00 0.00 N ATOM 1542 CA GLY A 491 -1.235 -5.634 -9.650 1.00 0.00 C ATOM 1543 C GLY A 491 -2.269 -6.118 -8.668 1.00 0.00 C ATOM 1544 O GLY A 491 -3.459 -6.159 -8.987 1.00 0.00 O ATOM 0 H GLY A 491 0.317 -4.855 -8.502 1.00 0.00 H new ATOM 0 HA2 GLY A 491 -1.484 -4.620 -9.964 1.00 0.00 H new ATOM 0 HA3 GLY A 491 -1.265 -6.260 -10.541 1.00 0.00 H new ATOM 1548 N ASP A 492 -1.845 -6.491 -7.470 1.00 0.00 N ATOM 1549 CA ASP A 492 -2.810 -6.952 -6.484 1.00 0.00 C ATOM 1550 C ASP A 492 -3.424 -5.741 -5.792 1.00 0.00 C ATOM 1551 O ASP A 492 -3.031 -4.589 -6.042 1.00 0.00 O ATOM 1552 CB ASP A 492 -2.189 -7.891 -5.430 1.00 0.00 C ATOM 1553 CG ASP A 492 -3.206 -8.873 -4.848 1.00 0.00 C ATOM 1554 OD1 ASP A 492 -4.064 -8.459 -4.070 1.00 0.00 O ATOM 1555 OD2 ASP A 492 -3.153 -10.072 -5.173 1.00 0.00 O ATOM 0 H ASP A 492 -0.872 -6.485 -7.163 1.00 0.00 H new ATOM 0 HA ASP A 492 -3.570 -7.528 -7.011 1.00 0.00 H new ATOM 0 HB2 ASP A 492 -1.369 -8.448 -5.883 1.00 0.00 H new ATOM 0 HB3 ASP A 492 -1.762 -7.295 -4.624 1.00 0.00 H new ATOM 1560 N ARG A 493 -4.321 -6.006 -4.912 1.00 0.00 N ATOM 1561 CA ARG A 493 -5.078 -5.030 -4.215 1.00 0.00 C ATOM 1562 C ARG A 493 -4.624 -5.041 -2.765 1.00 0.00 C ATOM 1563 O ARG A 493 -4.548 -6.110 -2.144 1.00 0.00 O ATOM 1564 CB ARG A 493 -6.574 -5.401 -4.247 1.00 0.00 C ATOM 1565 CG ARG A 493 -7.309 -5.373 -5.615 1.00 0.00 C ATOM 1566 CD ARG A 493 -6.851 -6.472 -6.589 1.00 0.00 C ATOM 1567 NE ARG A 493 -7.729 -6.567 -7.776 1.00 0.00 N ATOM 1568 CZ ARG A 493 -7.351 -6.928 -9.019 1.00 0.00 C ATOM 1569 NH1 ARG A 493 -6.069 -7.063 -9.326 1.00 0.00 N ATOM 1570 NH2 ARG A 493 -8.271 -7.100 -9.963 1.00 0.00 N ATOM 0 H ARG A 493 -4.559 -6.961 -4.645 1.00 0.00 H new ATOM 0 HA ARG A 493 -4.934 -4.053 -4.676 1.00 0.00 H new ATOM 0 HB2 ARG A 493 -6.677 -6.405 -3.835 1.00 0.00 H new ATOM 0 HB3 ARG A 493 -7.099 -4.724 -3.573 1.00 0.00 H new ATOM 0 HG2 ARG A 493 -8.380 -5.476 -5.443 1.00 0.00 H new ATOM 0 HG3 ARG A 493 -7.153 -4.400 -6.081 1.00 0.00 H new ATOM 0 HD2 ARG A 493 -5.829 -6.268 -6.910 1.00 0.00 H new ATOM 0 HD3 ARG A 493 -6.837 -7.431 -6.072 1.00 0.00 H new ATOM 0 HE ARG A 493 -8.714 -6.338 -7.641 1.00 0.00 H new ATOM 0 HH11 ARG A 493 -5.354 -6.893 -8.618 1.00 0.00 H new ATOM 0 HH12 ARG A 493 -5.797 -7.337 -10.270 1.00 0.00 H new ATOM 0 HH21 ARG A 493 -9.257 -6.959 -9.745 1.00 0.00 H new ATOM 0 HH22 ARG A 493 -7.990 -7.373 -10.905 1.00 0.00 H new ATOM 1584 N PHE A 494 -4.321 -3.908 -2.223 1.00 0.00 N ATOM 1585 CA PHE A 494 -3.934 -3.858 -0.837 1.00 0.00 C ATOM 1586 C PHE A 494 -4.798 -2.875 -0.124 1.00 0.00 C ATOM 1587 O PHE A 494 -5.310 -1.936 -0.724 1.00 0.00 O ATOM 1588 CB PHE A 494 -2.455 -3.471 -0.641 1.00 0.00 C ATOM 1589 CG PHE A 494 -2.124 -2.037 -0.954 1.00 0.00 C ATOM 1590 CD1 PHE A 494 -1.922 -1.624 -2.250 1.00 0.00 C ATOM 1591 CD2 PHE A 494 -2.029 -1.097 0.069 1.00 0.00 C ATOM 1592 CE1 PHE A 494 -1.632 -0.310 -2.526 1.00 0.00 C ATOM 1593 CE2 PHE A 494 -1.738 0.216 -0.205 1.00 0.00 C ATOM 1594 CZ PHE A 494 -1.541 0.608 -1.506 1.00 0.00 C ATOM 0 H PHE A 494 -4.331 -3.009 -2.705 1.00 0.00 H new ATOM 0 HA PHE A 494 -4.061 -4.860 -0.428 1.00 0.00 H new ATOM 0 HB2 PHE A 494 -2.176 -3.675 0.393 1.00 0.00 H new ATOM 0 HB3 PHE A 494 -1.840 -4.115 -1.270 1.00 0.00 H new ATOM 0 HD1 PHE A 494 -1.992 -2.338 -3.057 1.00 0.00 H new ATOM 0 HD2 PHE A 494 -2.186 -1.405 1.092 1.00 0.00 H new ATOM 0 HE1 PHE A 494 -1.475 0.003 -3.548 1.00 0.00 H new ATOM 0 HE2 PHE A 494 -1.665 0.936 0.597 1.00 0.00 H new ATOM 0 HZ PHE A 494 -1.314 1.640 -1.729 1.00 0.00 H new ATOM 1604 N MET A 495 -4.937 -3.057 1.123 1.00 0.00 N ATOM 1605 CA MET A 495 -5.689 -2.141 1.912 1.00 0.00 C ATOM 1606 C MET A 495 -4.772 -1.566 2.945 1.00 0.00 C ATOM 1607 O MET A 495 -4.076 -2.315 3.649 1.00 0.00 O ATOM 1608 CB MET A 495 -6.895 -2.814 2.582 1.00 0.00 C ATOM 1609 CG MET A 495 -7.807 -1.827 3.312 1.00 0.00 C ATOM 1610 SD MET A 495 -9.245 -2.603 4.094 1.00 0.00 S ATOM 1611 CE MET A 495 -8.451 -3.639 5.330 1.00 0.00 C ATOM 0 H MET A 495 -4.538 -3.841 1.639 1.00 0.00 H new ATOM 0 HA MET A 495 -6.088 -1.357 1.268 1.00 0.00 H new ATOM 0 HB2 MET A 495 -7.475 -3.343 1.825 1.00 0.00 H new ATOM 0 HB3 MET A 495 -6.538 -3.562 3.291 1.00 0.00 H new ATOM 0 HG2 MET A 495 -7.227 -1.306 4.074 1.00 0.00 H new ATOM 0 HG3 MET A 495 -8.152 -1.074 2.604 1.00 0.00 H new ATOM 0 HE1 MET A 495 -9.192 -3.970 6.058 1.00 0.00 H new ATOM 0 HE2 MET A 495 -8.006 -4.508 4.845 1.00 0.00 H new ATOM 0 HE3 MET A 495 -7.673 -3.069 5.838 1.00 0.00 H new ATOM 1621 N VAL A 496 -4.718 -0.263 3.018 1.00 0.00 N ATOM 1622 CA VAL A 496 -3.902 0.355 4.010 1.00 0.00 C ATOM 1623 C VAL A 496 -4.737 0.470 5.268 1.00 0.00 C ATOM 1624 O VAL A 496 -5.862 0.994 5.247 1.00 0.00 O ATOM 1625 CB VAL A 496 -3.307 1.743 3.565 1.00 0.00 C ATOM 1626 CG1 VAL A 496 -4.361 2.826 3.401 1.00 0.00 C ATOM 1627 CG2 VAL A 496 -2.227 2.185 4.526 1.00 0.00 C ATOM 0 H VAL A 496 -5.225 0.378 2.408 1.00 0.00 H new ATOM 0 HA VAL A 496 -3.022 -0.263 4.184 1.00 0.00 H new ATOM 0 HB VAL A 496 -2.872 1.593 2.577 1.00 0.00 H new ATOM 0 HG11 VAL A 496 -3.883 3.756 3.093 1.00 0.00 H new ATOM 0 HG12 VAL A 496 -5.082 2.520 2.642 1.00 0.00 H new ATOM 0 HG13 VAL A 496 -4.876 2.979 4.350 1.00 0.00 H new ATOM 0 HG21 VAL A 496 -1.825 3.146 4.205 1.00 0.00 H new ATOM 0 HG22 VAL A 496 -2.648 2.284 5.526 1.00 0.00 H new ATOM 0 HG23 VAL A 496 -1.427 1.444 4.540 1.00 0.00 H new ATOM 1684 N GLU A 500 -4.975 4.482 14.657 1.00 0.00 N ATOM 1685 CA GLU A 500 -5.478 5.703 15.281 1.00 0.00 C ATOM 1686 C GLU A 500 -6.632 6.360 14.545 1.00 0.00 C ATOM 1687 O GLU A 500 -7.525 6.914 15.185 1.00 0.00 O ATOM 1688 CB GLU A 500 -4.377 6.712 15.466 1.00 0.00 C ATOM 1689 CG GLU A 500 -3.210 6.229 16.301 1.00 0.00 C ATOM 1690 CD GLU A 500 -2.203 7.320 16.546 1.00 0.00 C ATOM 1691 OE1 GLU A 500 -1.374 7.606 15.650 1.00 0.00 O ATOM 1692 OE2 GLU A 500 -2.227 7.934 17.631 1.00 0.00 O ATOM 0 HA GLU A 500 -5.865 5.376 16.246 1.00 0.00 H new ATOM 0 HB2 GLU A 500 -4.006 7.009 14.485 1.00 0.00 H new ATOM 0 HB3 GLU A 500 -4.795 7.604 15.932 1.00 0.00 H new ATOM 0 HG2 GLU A 500 -3.578 5.854 17.256 1.00 0.00 H new ATOM 0 HG3 GLU A 500 -2.724 5.394 15.797 1.00 0.00 H new ATOM 1699 N LYS A 501 -6.637 6.292 13.226 1.00 0.00 N ATOM 1700 CA LYS A 501 -7.702 6.952 12.467 1.00 0.00 C ATOM 1701 C LYS A 501 -9.032 6.260 12.662 1.00 0.00 C ATOM 1702 O LYS A 501 -10.062 6.902 12.872 1.00 0.00 O ATOM 1703 CB LYS A 501 -7.374 7.042 10.998 1.00 0.00 C ATOM 1704 CG LYS A 501 -6.241 7.986 10.676 1.00 0.00 C ATOM 1705 CD LYS A 501 -6.069 8.116 9.187 1.00 0.00 C ATOM 1706 CE LYS A 501 -4.961 9.080 8.841 1.00 0.00 C ATOM 1707 NZ LYS A 501 -4.838 9.259 7.386 1.00 0.00 N ATOM 0 H LYS A 501 -5.940 5.803 12.664 1.00 0.00 H new ATOM 0 HA LYS A 501 -7.780 7.966 12.858 1.00 0.00 H new ATOM 0 HB2 LYS A 501 -7.119 6.047 10.632 1.00 0.00 H new ATOM 0 HB3 LYS A 501 -8.264 7.362 10.457 1.00 0.00 H new ATOM 0 HG2 LYS A 501 -6.441 8.965 11.112 1.00 0.00 H new ATOM 0 HG3 LYS A 501 -5.317 7.620 11.124 1.00 0.00 H new ATOM 0 HD2 LYS A 501 -5.849 7.138 8.758 1.00 0.00 H new ATOM 0 HD3 LYS A 501 -7.003 8.457 8.740 1.00 0.00 H new ATOM 0 HE2 LYS A 501 -5.155 10.044 9.312 1.00 0.00 H new ATOM 0 HE3 LYS A 501 -4.018 8.712 9.245 1.00 0.00 H new ATOM 0 HZ1 LYS A 501 -3.968 9.788 7.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 501 -4.798 8.328 6.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 501 -5.660 9.787 7.030 1.00 0.00 H new ATOM 1721 N LYS A 502 -9.014 4.962 12.595 1.00 0.00 N ATOM 1722 CA LYS A 502 -10.214 4.195 12.797 1.00 0.00 C ATOM 1723 C LYS A 502 -10.525 4.045 14.273 1.00 0.00 C ATOM 1724 O LYS A 502 -11.693 4.010 14.665 1.00 0.00 O ATOM 1725 CB LYS A 502 -10.132 2.840 12.100 1.00 0.00 C ATOM 1726 CG LYS A 502 -10.152 2.934 10.582 1.00 0.00 C ATOM 1727 CD LYS A 502 -10.029 1.565 9.943 1.00 0.00 C ATOM 1728 CE LYS A 502 -10.148 1.623 8.422 1.00 0.00 C ATOM 1729 NZ LYS A 502 -9.158 2.532 7.812 1.00 0.00 N ATOM 0 H LYS A 502 -8.180 4.408 12.401 1.00 0.00 H new ATOM 0 HA LYS A 502 -11.039 4.743 12.342 1.00 0.00 H new ATOM 0 HB2 LYS A 502 -9.218 2.335 12.412 1.00 0.00 H new ATOM 0 HB3 LYS A 502 -10.967 2.221 12.428 1.00 0.00 H new ATOM 0 HG2 LYS A 502 -11.079 3.407 10.257 1.00 0.00 H new ATOM 0 HG3 LYS A 502 -9.334 3.570 10.244 1.00 0.00 H new ATOM 0 HD2 LYS A 502 -9.069 1.125 10.214 1.00 0.00 H new ATOM 0 HD3 LYS A 502 -10.804 0.910 10.341 1.00 0.00 H new ATOM 0 HE2 LYS A 502 -10.018 0.621 8.012 1.00 0.00 H new ATOM 0 HE3 LYS A 502 -11.152 1.950 8.152 1.00 0.00 H new ATOM 0 HZ1 LYS A 502 -9.189 2.434 6.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 502 -9.380 3.514 8.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 502 -8.207 2.289 8.155 1.00 0.00 H new ATOM 1743 N ALA A 503 -9.476 4.025 15.097 1.00 0.00 N ATOM 1744 CA ALA A 503 -9.623 3.854 16.528 1.00 0.00 C ATOM 1745 C ALA A 503 -10.325 5.038 17.136 1.00 0.00 C ATOM 1746 O ALA A 503 -11.207 4.873 17.978 1.00 0.00 O ATOM 1747 CB ALA A 503 -8.274 3.640 17.191 1.00 0.00 C ATOM 0 H ALA A 503 -8.510 4.127 14.786 1.00 0.00 H new ATOM 0 HA ALA A 503 -10.232 2.966 16.699 1.00 0.00 H new ATOM 0 HB1 ALA A 503 -8.412 3.514 18.265 1.00 0.00 H new ATOM 0 HB2 ALA A 503 -7.804 2.747 16.779 1.00 0.00 H new ATOM 0 HB3 ALA A 503 -7.636 4.504 17.006 1.00 0.00 H new ATOM 1753 N ARG A 504 -9.956 6.228 16.680 1.00 0.00 N ATOM 1754 CA ARG A 504 -10.547 7.481 17.151 1.00 0.00 C ATOM 1755 C ARG A 504 -12.043 7.480 16.889 1.00 0.00 C ATOM 1756 O ARG A 504 -12.841 7.855 17.738 1.00 0.00 O ATOM 1757 CB ARG A 504 -9.911 8.652 16.413 1.00 0.00 C ATOM 1758 CG ARG A 504 -10.369 10.026 16.874 1.00 0.00 C ATOM 1759 CD ARG A 504 -9.858 11.097 15.930 1.00 0.00 C ATOM 1760 NE ARG A 504 -10.416 10.929 14.574 1.00 0.00 N ATOM 1761 CZ ARG A 504 -9.709 10.893 13.426 1.00 0.00 C ATOM 1762 NH1 ARG A 504 -8.377 10.853 13.445 1.00 0.00 N ATOM 1763 NH2 ARG A 504 -10.341 10.849 12.263 1.00 0.00 N ATOM 0 H ARG A 504 -9.235 6.355 15.970 1.00 0.00 H new ATOM 0 HA ARG A 504 -10.368 7.578 18.222 1.00 0.00 H new ATOM 0 HB2 ARG A 504 -8.829 8.589 16.527 1.00 0.00 H new ATOM 0 HB3 ARG A 504 -10.126 8.552 15.349 1.00 0.00 H new ATOM 0 HG2 ARG A 504 -11.458 10.058 16.916 1.00 0.00 H new ATOM 0 HG3 ARG A 504 -10.005 10.218 17.883 1.00 0.00 H new ATOM 0 HD2 ARG A 504 -10.124 12.081 16.315 1.00 0.00 H new ATOM 0 HD3 ARG A 504 -8.770 11.056 15.885 1.00 0.00 H new ATOM 0 HE ARG A 504 -11.428 10.831 14.498 1.00 0.00 H new ATOM 0 HH11 ARG A 504 -7.880 10.849 14.335 1.00 0.00 H new ATOM 0 HH12 ARG A 504 -7.855 10.826 12.569 1.00 0.00 H new ATOM 0 HH21 ARG A 504 -11.361 10.842 12.237 1.00 0.00 H new ATOM 0 HH22 ARG A 504 -9.808 10.822 11.394 1.00 0.00 H new ATOM 1777 N GLN A 505 -12.404 7.000 15.723 1.00 0.00 N ATOM 1778 CA GLN A 505 -13.782 6.950 15.283 1.00 0.00 C ATOM 1779 C GLN A 505 -14.582 5.920 16.115 1.00 0.00 C ATOM 1780 O GLN A 505 -15.783 6.074 16.338 1.00 0.00 O ATOM 1781 CB GLN A 505 -13.799 6.585 13.794 1.00 0.00 C ATOM 1782 CG GLN A 505 -15.147 6.714 13.110 1.00 0.00 C ATOM 1783 CD GLN A 505 -15.660 8.144 13.078 1.00 0.00 C ATOM 1784 OE1 GLN A 505 -14.877 9.108 13.053 1.00 0.00 O ATOM 1785 NE2 GLN A 505 -16.950 8.298 13.032 1.00 0.00 N ATOM 0 H GLN A 505 -11.742 6.628 15.042 1.00 0.00 H new ATOM 0 HA GLN A 505 -14.255 7.921 15.428 1.00 0.00 H new ATOM 0 HB2 GLN A 505 -13.083 7.221 13.273 1.00 0.00 H new ATOM 0 HB3 GLN A 505 -13.451 5.558 13.685 1.00 0.00 H new ATOM 0 HG2 GLN A 505 -15.068 6.339 12.090 1.00 0.00 H new ATOM 0 HG3 GLN A 505 -15.872 6.085 13.626 1.00 0.00 H new ATOM 0 HE21 GLN A 505 -17.562 7.482 13.055 1.00 0.00 H new ATOM 0 HE22 GLN A 505 -17.350 9.234 12.973 1.00 0.00 H new ATOM 1794 N ILE A 506 -13.899 4.892 16.581 1.00 0.00 N ATOM 1795 CA ILE A 506 -14.529 3.840 17.368 1.00 0.00 C ATOM 1796 C ILE A 506 -14.642 4.224 18.852 1.00 0.00 C ATOM 1797 O ILE A 506 -15.735 4.200 19.420 1.00 0.00 O ATOM 1798 CB ILE A 506 -13.771 2.480 17.231 1.00 0.00 C ATOM 1799 CG1 ILE A 506 -13.803 2.001 15.773 1.00 0.00 C ATOM 1800 CG2 ILE A 506 -14.375 1.416 18.158 1.00 0.00 C ATOM 1801 CD1 ILE A 506 -13.004 0.738 15.515 1.00 0.00 C ATOM 0 H ILE A 506 -12.899 4.759 16.428 1.00 0.00 H new ATOM 0 HA ILE A 506 -15.535 3.719 16.966 1.00 0.00 H new ATOM 0 HB ILE A 506 -12.734 2.636 17.529 1.00 0.00 H new ATOM 0 HG12 ILE A 506 -14.839 1.828 15.482 1.00 0.00 H new ATOM 0 HG13 ILE A 506 -13.421 2.796 15.133 1.00 0.00 H new ATOM 0 HG21 ILE A 506 -13.829 0.480 18.042 1.00 0.00 H new ATOM 0 HG22 ILE A 506 -14.304 1.752 19.192 1.00 0.00 H new ATOM 0 HG23 ILE A 506 -15.422 1.259 17.898 1.00 0.00 H new ATOM 0 HD11 ILE A 506 -13.079 0.469 14.462 1.00 0.00 H new ATOM 0 HD12 ILE A 506 -11.959 0.910 15.772 1.00 0.00 H new ATOM 0 HD13 ILE A 506 -13.399 -0.074 16.126 1.00 0.00 H new ATOM 1813 N GLY A 507 -13.547 4.630 19.461 1.00 0.00 N ATOM 1814 CA GLY A 507 -13.574 4.867 20.886 1.00 0.00 C ATOM 1815 C GLY A 507 -12.345 5.568 21.403 1.00 0.00 C ATOM 1816 O GLY A 507 -12.373 6.126 22.498 1.00 0.00 O ATOM 0 H GLY A 507 -12.650 4.799 19.005 1.00 0.00 H new ATOM 0 HA2 GLY A 507 -14.453 5.464 21.130 1.00 0.00 H new ATOM 0 HA3 GLY A 507 -13.683 3.913 21.403 1.00 0.00 H new