USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 700 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 868 THR OG1 : rot -38:sc= -0.243 USER MOD Set 1.2: A 872 GLN : amide:sc= -3.84! C(o=-4.1!,f=-5.8!) USER MOD Single : A 833 GLN : amide:sc= -1.08 K(o=-1.1,f=-2.9!) USER MOD Single : A 835 ASN : amide:sc= -5.69! C(o=-5.7!,f=-7.7!) USER MOD Single : A 841 SER OG : rot 180:sc= 0 USER MOD Single : A 853 THR OG1 : rot 120:sc= -2.78! USER MOD Single : A 854 THR OG1 : rot 180:sc= 0 USER MOD Single : A 856 TYR OH : rot 180:sc= -2.07 USER MOD Single : A 857 MET CE :methyl -158:sc= -17! (180deg=-21.6!) USER MOD Single : A 858 THR OG1 : rot -54:sc= 0.165 USER MOD Single : A 859 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 860 TYR OH : rot 180:sc= 0 USER MOD Single : A 875 MET CE :methyl -145:sc= -0.251 (180deg=-1.64!) USER MOD Single : A 876 CYS SG : rot 180:sc= 0 USER MOD Single : A 880 MET CE :methyl -107:sc= -1.14 (180deg=-3.67) USER MOD Single : A 887 THR OG1 : rot -7:sc= 0.825 USER MOD Single : A 894 MET CE :methyl -109:sc= -4.62! (180deg=-7.91!) USER MOD Single : A 895 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 898 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 901 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 909 TYR OH : rot 180:sc= -4.09! USER MOD Single : A 914 SER OG : rot 33:sc= 1.25 USER MOD Single : A 915 TYR OH : rot 180:sc= -0.526 USER MOD Single : A 926 THR OG1 : rot 78:sc= -7.31! USER MOD ----------------------------------------------------------------- ATOM 438 N GLN A 833 6.503 -11.342 -0.652 1.00 0.00 N ATOM 439 CA GLN A 833 6.813 -11.929 -1.987 1.00 0.00 C ATOM 440 C GLN A 833 5.657 -11.665 -2.952 1.00 0.00 C ATOM 441 O GLN A 833 4.777 -12.483 -3.127 1.00 0.00 O ATOM 442 CB GLN A 833 6.977 -13.430 -1.759 1.00 0.00 C ATOM 443 CG GLN A 833 7.288 -14.096 -3.098 1.00 0.00 C ATOM 444 CD GLN A 833 7.499 -15.596 -2.891 1.00 0.00 C ATOM 445 OE1 GLN A 833 6.821 -16.406 -3.491 1.00 0.00 O ATOM 446 NE2 GLN A 833 8.417 -16.005 -2.059 1.00 0.00 N ATOM 0 HA GLN A 833 7.712 -11.492 -2.421 1.00 0.00 H new ATOM 0 HB2 GLN A 833 7.781 -13.619 -1.047 1.00 0.00 H new ATOM 0 HB3 GLN A 833 6.067 -13.849 -1.331 1.00 0.00 H new ATOM 0 HG2 GLN A 833 6.469 -13.927 -3.798 1.00 0.00 H new ATOM 0 HG3 GLN A 833 8.180 -13.651 -3.538 1.00 0.00 H new ATOM 0 HE21 GLN A 833 8.987 -15.326 -1.555 1.00 0.00 H new ATOM 0 HE22 GLN A 833 8.565 -17.004 -1.913 1.00 0.00 H new ATOM 455 N GLU A 834 5.662 -10.525 -3.573 1.00 0.00 N ATOM 456 CA GLU A 834 4.585 -10.174 -4.530 1.00 0.00 C ATOM 457 C GLU A 834 4.981 -8.885 -5.237 1.00 0.00 C ATOM 458 O GLU A 834 5.079 -7.842 -4.622 1.00 0.00 O ATOM 459 CB GLU A 834 3.338 -9.967 -3.664 1.00 0.00 C ATOM 460 CG GLU A 834 2.179 -9.462 -4.530 1.00 0.00 C ATOM 461 CD GLU A 834 0.925 -10.293 -4.245 1.00 0.00 C ATOM 462 OE1 GLU A 834 0.791 -10.767 -3.128 1.00 0.00 O ATOM 463 OE2 GLU A 834 0.121 -10.442 -5.150 1.00 0.00 O ATOM 0 H GLU A 834 6.379 -9.809 -3.456 1.00 0.00 H new ATOM 0 HA GLU A 834 4.409 -10.934 -5.291 1.00 0.00 H new ATOM 0 HB2 GLU A 834 3.061 -10.904 -3.181 1.00 0.00 H new ATOM 0 HB3 GLU A 834 3.550 -9.250 -2.871 1.00 0.00 H new ATOM 0 HG2 GLU A 834 1.986 -8.410 -4.320 1.00 0.00 H new ATOM 0 HG3 GLU A 834 2.442 -9.533 -5.585 1.00 0.00 H new ATOM 470 N ASN A 835 5.210 -8.934 -6.520 1.00 0.00 N ATOM 471 CA ASN A 835 5.598 -7.689 -7.232 1.00 0.00 C ATOM 472 C ASN A 835 4.420 -6.756 -7.199 1.00 0.00 C ATOM 473 O ASN A 835 3.344 -7.102 -7.593 1.00 0.00 O ATOM 474 CB ASN A 835 5.920 -8.044 -8.691 1.00 0.00 C ATOM 475 CG ASN A 835 6.778 -9.308 -8.757 1.00 0.00 C ATOM 476 OD1 ASN A 835 7.711 -9.458 -7.994 1.00 0.00 O ATOM 477 ND2 ASN A 835 6.508 -10.226 -9.645 1.00 0.00 N ATOM 0 H ASN A 835 5.146 -9.772 -7.098 1.00 0.00 H new ATOM 0 HA ASN A 835 6.466 -7.223 -6.766 1.00 0.00 H new ATOM 0 HB2 ASN A 835 4.995 -8.196 -9.247 1.00 0.00 H new ATOM 0 HB3 ASN A 835 6.445 -7.215 -9.166 1.00 0.00 H new ATOM 0 HD21 ASN A 835 7.080 -11.069 -9.698 1.00 0.00 H new ATOM 0 HD22 ASN A 835 5.725 -10.101 -10.286 1.00 0.00 H new ATOM 484 N VAL A 836 4.601 -5.589 -6.733 1.00 0.00 N ATOM 485 CA VAL A 836 3.445 -4.654 -6.703 1.00 0.00 C ATOM 486 C VAL A 836 3.791 -3.357 -7.413 1.00 0.00 C ATOM 487 O VAL A 836 4.812 -2.744 -7.172 1.00 0.00 O ATOM 488 CB VAL A 836 3.074 -4.420 -5.227 1.00 0.00 C ATOM 489 CG1 VAL A 836 3.775 -5.441 -4.347 1.00 0.00 C ATOM 490 CG2 VAL A 836 3.476 -3.013 -4.782 1.00 0.00 C ATOM 0 H VAL A 836 5.481 -5.224 -6.370 1.00 0.00 H new ATOM 0 HA VAL A 836 2.589 -5.076 -7.230 1.00 0.00 H new ATOM 0 HB VAL A 836 1.994 -4.527 -5.128 1.00 0.00 H new ATOM 0 HG11 VAL A 836 3.507 -5.268 -3.305 1.00 0.00 H new ATOM 0 HG12 VAL A 836 3.468 -6.445 -4.639 1.00 0.00 H new ATOM 0 HG13 VAL A 836 4.854 -5.343 -4.465 1.00 0.00 H new ATOM 0 HG21 VAL A 836 3.204 -2.871 -3.736 1.00 0.00 H new ATOM 0 HG22 VAL A 836 4.553 -2.889 -4.897 1.00 0.00 H new ATOM 0 HG23 VAL A 836 2.958 -2.276 -5.395 1.00 0.00 H new ATOM 500 N GLU A 837 2.920 -2.926 -8.264 1.00 0.00 N ATOM 501 CA GLU A 837 3.152 -1.640 -8.974 1.00 0.00 C ATOM 502 C GLU A 837 2.108 -0.664 -8.479 1.00 0.00 C ATOM 503 O GLU A 837 1.266 -1.020 -7.681 1.00 0.00 O ATOM 504 CB GLU A 837 2.978 -1.923 -10.463 1.00 0.00 C ATOM 505 CG GLU A 837 3.468 -0.721 -11.275 1.00 0.00 C ATOM 506 CD GLU A 837 3.888 -1.184 -12.671 1.00 0.00 C ATOM 507 OE1 GLU A 837 4.957 -1.759 -12.786 1.00 0.00 O ATOM 508 OE2 GLU A 837 3.133 -0.956 -13.601 1.00 0.00 O ATOM 0 H GLU A 837 2.052 -3.405 -8.504 1.00 0.00 H new ATOM 0 HA GLU A 837 4.143 -1.222 -8.797 1.00 0.00 H new ATOM 0 HB2 GLU A 837 3.538 -2.816 -10.742 1.00 0.00 H new ATOM 0 HB3 GLU A 837 1.930 -2.122 -10.686 1.00 0.00 H new ATOM 0 HG2 GLU A 837 2.678 0.026 -11.351 1.00 0.00 H new ATOM 0 HG3 GLU A 837 4.309 -0.246 -10.770 1.00 0.00 H new ATOM 515 N ILE A 838 2.137 0.554 -8.916 1.00 0.00 N ATOM 516 CA ILE A 838 1.124 1.499 -8.418 1.00 0.00 C ATOM 517 C ILE A 838 0.523 2.304 -9.558 1.00 0.00 C ATOM 518 O ILE A 838 1.161 2.616 -10.545 1.00 0.00 O ATOM 519 CB ILE A 838 1.878 2.396 -7.428 1.00 0.00 C ATOM 520 CG1 ILE A 838 1.176 2.371 -6.071 1.00 0.00 C ATOM 521 CG2 ILE A 838 1.948 3.843 -7.935 1.00 0.00 C ATOM 522 CD1 ILE A 838 1.711 1.199 -5.240 1.00 0.00 C ATOM 0 H ILE A 838 2.808 0.930 -9.586 1.00 0.00 H new ATOM 0 HA ILE A 838 0.284 0.993 -7.943 1.00 0.00 H new ATOM 0 HB ILE A 838 2.894 2.013 -7.330 1.00 0.00 H new ATOM 0 HG12 ILE A 838 1.345 3.311 -5.545 1.00 0.00 H new ATOM 0 HG13 ILE A 838 0.099 2.272 -6.208 1.00 0.00 H new ATOM 0 HG21 ILE A 838 2.488 4.456 -7.213 1.00 0.00 H new ATOM 0 HG22 ILE A 838 2.468 3.868 -8.893 1.00 0.00 H new ATOM 0 HG23 ILE A 838 0.938 4.234 -8.060 1.00 0.00 H new ATOM 0 HD11 ILE A 838 1.210 1.181 -4.272 1.00 0.00 H new ATOM 0 HD12 ILE A 838 1.519 0.263 -5.765 1.00 0.00 H new ATOM 0 HD13 ILE A 838 2.784 1.318 -5.091 1.00 0.00 H new ATOM 534 N LEU A 839 -0.706 2.639 -9.394 1.00 0.00 N ATOM 535 CA LEU A 839 -1.432 3.442 -10.419 1.00 0.00 C ATOM 536 C LEU A 839 -2.630 4.134 -9.760 1.00 0.00 C ATOM 537 O LEU A 839 -3.007 3.778 -8.661 1.00 0.00 O ATOM 538 CB LEU A 839 -1.902 2.427 -11.466 1.00 0.00 C ATOM 539 CG LEU A 839 -1.205 2.702 -12.802 1.00 0.00 C ATOM 540 CD1 LEU A 839 -0.005 1.762 -12.959 1.00 0.00 C ATOM 541 CD2 LEU A 839 -2.192 2.466 -13.948 1.00 0.00 C ATOM 0 H LEU A 839 -1.263 2.390 -8.577 1.00 0.00 H new ATOM 0 HA LEU A 839 -0.810 4.217 -10.868 1.00 0.00 H new ATOM 0 HB2 LEU A 839 -1.679 1.414 -11.130 1.00 0.00 H new ATOM 0 HB3 LEU A 839 -2.983 2.491 -11.589 1.00 0.00 H new ATOM 0 HG LEU A 839 -0.859 3.736 -12.825 1.00 0.00 H new ATOM 0 HD11 LEU A 839 0.490 1.959 -13.910 1.00 0.00 H new ATOM 0 HD12 LEU A 839 0.698 1.930 -12.143 1.00 0.00 H new ATOM 0 HD13 LEU A 839 -0.348 0.728 -12.936 1.00 0.00 H new ATOM 0 HD21 LEU A 839 -1.698 2.661 -14.900 1.00 0.00 H new ATOM 0 HD22 LEU A 839 -2.537 1.432 -13.924 1.00 0.00 H new ATOM 0 HD23 LEU A 839 -3.045 3.136 -13.838 1.00 0.00 H new ATOM 553 N PRO A 840 -3.203 5.096 -10.442 1.00 0.00 N ATOM 554 CA PRO A 840 -4.371 5.815 -9.888 1.00 0.00 C ATOM 555 C PRO A 840 -5.508 4.831 -9.620 1.00 0.00 C ATOM 556 O PRO A 840 -5.819 3.989 -10.441 1.00 0.00 O ATOM 557 CB PRO A 840 -4.734 6.792 -11.004 1.00 0.00 C ATOM 558 CG PRO A 840 -3.745 6.596 -12.171 1.00 0.00 C ATOM 559 CD PRO A 840 -2.728 5.514 -11.782 1.00 0.00 C ATOM 0 HA PRO A 840 -4.175 6.315 -8.940 1.00 0.00 H new ATOM 0 HB2 PRO A 840 -5.756 6.618 -11.341 1.00 0.00 H new ATOM 0 HB3 PRO A 840 -4.689 7.818 -10.638 1.00 0.00 H new ATOM 0 HG2 PRO A 840 -4.280 6.303 -13.074 1.00 0.00 H new ATOM 0 HG3 PRO A 840 -3.233 7.532 -12.393 1.00 0.00 H new ATOM 0 HD2 PRO A 840 -2.727 4.685 -12.489 1.00 0.00 H new ATOM 0 HD3 PRO A 840 -1.711 5.906 -11.748 1.00 0.00 H new ATOM 566 N SER A 841 -6.122 4.920 -8.472 1.00 0.00 N ATOM 567 CA SER A 841 -7.218 3.988 -8.138 1.00 0.00 C ATOM 568 C SER A 841 -8.268 4.006 -9.226 1.00 0.00 C ATOM 569 O SER A 841 -8.580 5.027 -9.807 1.00 0.00 O ATOM 570 CB SER A 841 -7.800 4.491 -6.814 1.00 0.00 C ATOM 571 OG SER A 841 -9.219 4.554 -6.904 1.00 0.00 O ATOM 0 H SER A 841 -5.904 5.607 -7.750 1.00 0.00 H new ATOM 0 HA SER A 841 -6.866 2.960 -8.052 1.00 0.00 H new ATOM 0 HB2 SER A 841 -7.507 3.826 -6.002 1.00 0.00 H new ATOM 0 HB3 SER A 841 -7.397 5.476 -6.580 1.00 0.00 H new ATOM 0 HG SER A 841 -9.587 4.875 -6.054 1.00 0.00 H new ATOM 577 N GLY A 842 -8.809 2.875 -9.486 1.00 0.00 N ATOM 578 CA GLY A 842 -9.865 2.783 -10.539 1.00 0.00 C ATOM 579 C GLY A 842 -10.136 1.327 -10.915 1.00 0.00 C ATOM 580 O GLY A 842 -11.268 0.884 -10.923 1.00 0.00 O ATOM 0 H GLY A 842 -8.577 1.996 -9.023 1.00 0.00 H new ATOM 0 HA2 GLY A 842 -10.784 3.247 -10.180 1.00 0.00 H new ATOM 0 HA3 GLY A 842 -9.552 3.339 -11.423 1.00 0.00 H new ATOM 740 N ILE A 852 -4.163 -14.240 -6.309 1.00 0.00 N ATOM 741 CA ILE A 852 -3.824 -14.448 -4.861 1.00 0.00 C ATOM 742 C ILE A 852 -3.999 -13.161 -4.057 1.00 0.00 C ATOM 743 O ILE A 852 -4.119 -13.193 -2.848 1.00 0.00 O ATOM 744 CB ILE A 852 -2.353 -14.937 -4.803 1.00 0.00 C ATOM 745 CG1 ILE A 852 -1.392 -13.766 -4.522 1.00 0.00 C ATOM 746 CG2 ILE A 852 -1.947 -15.615 -6.117 1.00 0.00 C ATOM 747 CD1 ILE A 852 -1.497 -12.713 -5.631 1.00 0.00 C ATOM 0 HA ILE A 852 -4.496 -15.184 -4.418 1.00 0.00 H new ATOM 0 HB ILE A 852 -2.285 -15.660 -3.990 1.00 0.00 H new ATOM 0 HG12 ILE A 852 -1.630 -13.314 -3.559 1.00 0.00 H new ATOM 0 HG13 ILE A 852 -0.368 -14.135 -4.457 1.00 0.00 H new ATOM 0 HG21 ILE A 852 -0.911 -15.948 -6.050 1.00 0.00 H new ATOM 0 HG22 ILE A 852 -2.594 -16.474 -6.298 1.00 0.00 H new ATOM 0 HG23 ILE A 852 -2.047 -14.906 -6.939 1.00 0.00 H new ATOM 0 HD11 ILE A 852 -0.812 -11.892 -5.419 1.00 0.00 H new ATOM 0 HD12 ILE A 852 -1.236 -13.165 -6.588 1.00 0.00 H new ATOM 0 HD13 ILE A 852 -2.517 -12.332 -5.676 1.00 0.00 H new ATOM 759 N THR A 853 -4.005 -12.030 -4.704 1.00 0.00 N ATOM 760 CA THR A 853 -4.160 -10.765 -3.976 1.00 0.00 C ATOM 761 C THR A 853 -5.406 -10.823 -3.135 1.00 0.00 C ATOM 762 O THR A 853 -6.517 -10.760 -3.615 1.00 0.00 O ATOM 763 CB THR A 853 -4.267 -9.714 -5.054 1.00 0.00 C ATOM 764 OG1 THR A 853 -5.284 -10.079 -5.975 1.00 0.00 O ATOM 765 CG2 THR A 853 -2.937 -9.634 -5.775 1.00 0.00 C ATOM 0 H THR A 853 -3.908 -11.939 -5.715 1.00 0.00 H new ATOM 0 HA THR A 853 -3.334 -10.552 -3.298 1.00 0.00 H new ATOM 0 HB THR A 853 -4.516 -8.748 -4.614 1.00 0.00 H new ATOM 0 HG1 THR A 853 -5.973 -9.382 -5.994 1.00 0.00 H new ATOM 0 HG21 THR A 853 -2.993 -8.879 -6.559 1.00 0.00 H new ATOM 0 HG22 THR A 853 -2.155 -9.363 -5.066 1.00 0.00 H new ATOM 0 HG23 THR A 853 -2.705 -10.602 -6.219 1.00 0.00 H new ATOM 773 N THR A 854 -5.217 -10.954 -1.877 1.00 0.00 N ATOM 774 CA THR A 854 -6.372 -11.024 -0.965 1.00 0.00 C ATOM 775 C THR A 854 -7.223 -9.775 -1.174 1.00 0.00 C ATOM 776 O THR A 854 -6.683 -8.694 -1.290 1.00 0.00 O ATOM 777 CB THR A 854 -5.769 -11.048 0.445 1.00 0.00 C ATOM 778 OG1 THR A 854 -5.279 -12.352 0.725 1.00 0.00 O ATOM 779 CG2 THR A 854 -6.834 -10.670 1.479 1.00 0.00 C ATOM 0 H THR A 854 -4.303 -11.017 -1.428 1.00 0.00 H new ATOM 0 HA THR A 854 -7.006 -11.895 -1.132 1.00 0.00 H new ATOM 0 HB THR A 854 -4.952 -10.328 0.497 1.00 0.00 H new ATOM 0 HG1 THR A 854 -4.892 -12.370 1.625 1.00 0.00 H new ATOM 0 HG21 THR A 854 -6.396 -10.690 2.477 1.00 0.00 H new ATOM 0 HG22 THR A 854 -7.208 -9.668 1.267 1.00 0.00 H new ATOM 0 HG23 THR A 854 -7.658 -11.382 1.430 1.00 0.00 H new ATOM 787 N PRO A 855 -8.519 -9.945 -1.196 1.00 0.00 N ATOM 788 CA PRO A 855 -9.429 -8.789 -1.358 1.00 0.00 C ATOM 789 C PRO A 855 -9.150 -7.826 -0.208 1.00 0.00 C ATOM 790 O PRO A 855 -9.960 -7.634 0.676 1.00 0.00 O ATOM 791 CB PRO A 855 -10.814 -9.437 -1.245 1.00 0.00 C ATOM 792 CG PRO A 855 -10.631 -10.954 -1.027 1.00 0.00 C ATOM 793 CD PRO A 855 -9.130 -11.280 -1.062 1.00 0.00 C ATOM 0 HA PRO A 855 -9.325 -8.223 -2.284 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -11.370 -9.000 -0.415 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -11.393 -9.252 -2.150 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -11.060 -11.253 -0.071 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -11.157 -11.513 -1.801 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -8.803 -11.787 -0.154 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -8.875 -11.929 -1.899 1.00 0.00 H new ATOM 800 N TYR A 856 -7.970 -7.262 -0.206 1.00 0.00 N ATOM 801 CA TYR A 856 -7.541 -6.353 0.881 1.00 0.00 C ATOM 802 C TYR A 856 -6.076 -6.048 0.634 1.00 0.00 C ATOM 803 O TYR A 856 -5.216 -6.875 0.865 1.00 0.00 O ATOM 804 CB TYR A 856 -7.714 -7.158 2.169 1.00 0.00 C ATOM 805 CG TYR A 856 -7.184 -6.414 3.380 1.00 0.00 C ATOM 806 CD1 TYR A 856 -5.805 -6.251 3.568 1.00 0.00 C ATOM 807 CD2 TYR A 856 -8.077 -5.913 4.334 1.00 0.00 C ATOM 808 CE1 TYR A 856 -5.325 -5.582 4.698 1.00 0.00 C ATOM 809 CE2 TYR A 856 -7.597 -5.249 5.468 1.00 0.00 C ATOM 810 CZ TYR A 856 -6.220 -5.081 5.649 1.00 0.00 C ATOM 811 OH TYR A 856 -5.746 -4.428 6.768 1.00 0.00 O ATOM 0 H TYR A 856 -7.272 -7.402 -0.936 1.00 0.00 H new ATOM 0 HA TYR A 856 -8.101 -5.419 0.935 1.00 0.00 H new ATOM 0 HB2 TYR A 856 -8.770 -7.384 2.316 1.00 0.00 H new ATOM 0 HB3 TYR A 856 -7.194 -8.111 2.073 1.00 0.00 H new ATOM 0 HD1 TYR A 856 -5.112 -6.643 2.839 1.00 0.00 H new ATOM 0 HD2 TYR A 856 -9.140 -6.039 4.194 1.00 0.00 H new ATOM 0 HE1 TYR A 856 -4.262 -5.452 4.837 1.00 0.00 H new ATOM 0 HE2 TYR A 856 -8.289 -4.866 6.203 1.00 0.00 H new ATOM 0 HH TYR A 856 -6.501 -4.143 7.325 1.00 0.00 H new ATOM 821 N MET A 857 -5.784 -4.899 0.124 1.00 0.00 N ATOM 822 CA MET A 857 -4.366 -4.571 -0.180 1.00 0.00 C ATOM 823 C MET A 857 -3.504 -4.812 1.055 1.00 0.00 C ATOM 824 O MET A 857 -4.012 -4.927 2.151 1.00 0.00 O ATOM 825 CB MET A 857 -4.348 -3.092 -0.544 1.00 0.00 C ATOM 826 CG MET A 857 -2.920 -2.671 -0.914 1.00 0.00 C ATOM 827 SD MET A 857 -2.802 -0.868 -0.995 1.00 0.00 S ATOM 828 CE MET A 857 -4.021 -0.629 -2.299 1.00 0.00 C ATOM 0 H MET A 857 -6.460 -4.168 -0.098 1.00 0.00 H new ATOM 0 HA MET A 857 -3.973 -5.188 -0.988 1.00 0.00 H new ATOM 0 HB2 MET A 857 -5.021 -2.905 -1.380 1.00 0.00 H new ATOM 0 HB3 MET A 857 -4.708 -2.496 0.295 1.00 0.00 H new ATOM 0 HG2 MET A 857 -2.217 -3.056 -0.176 1.00 0.00 H new ATOM 0 HG3 MET A 857 -2.643 -3.104 -1.875 1.00 0.00 H new ATOM 0 HE1 MET A 857 -3.849 0.330 -2.787 1.00 0.00 H new ATOM 0 HE2 MET A 857 -3.931 -1.430 -3.032 1.00 0.00 H new ATOM 0 HE3 MET A 857 -5.022 -0.642 -1.868 1.00 0.00 H new ATOM 838 N THR A 858 -2.212 -4.897 0.905 1.00 0.00 N ATOM 839 CA THR A 858 -1.373 -5.145 2.108 1.00 0.00 C ATOM 840 C THR A 858 -0.235 -4.148 2.218 1.00 0.00 C ATOM 841 O THR A 858 0.354 -3.741 1.237 1.00 0.00 O ATOM 842 CB THR A 858 -0.880 -6.571 1.933 1.00 0.00 C ATOM 843 OG1 THR A 858 -0.212 -6.697 0.684 1.00 0.00 O ATOM 844 CG2 THR A 858 -2.100 -7.488 1.972 1.00 0.00 C ATOM 0 H THR A 858 -1.710 -4.808 0.022 1.00 0.00 H new ATOM 0 HA THR A 858 -1.930 -5.020 3.037 1.00 0.00 H new ATOM 0 HB THR A 858 -0.179 -6.839 2.724 1.00 0.00 H new ATOM 0 HG1 THR A 858 -0.800 -6.384 -0.035 1.00 0.00 H new ATOM 0 HG21 THR A 858 -1.781 -8.523 1.849 1.00 0.00 H new ATOM 0 HG22 THR A 858 -2.609 -7.376 2.930 1.00 0.00 H new ATOM 0 HG23 THR A 858 -2.782 -7.220 1.165 1.00 0.00 H new ATOM 852 N LYS A 859 0.035 -3.736 3.432 1.00 0.00 N ATOM 853 CA LYS A 859 1.109 -2.732 3.714 1.00 0.00 C ATOM 854 C LYS A 859 2.213 -2.672 2.633 1.00 0.00 C ATOM 855 O LYS A 859 2.741 -1.611 2.378 1.00 0.00 O ATOM 856 CB LYS A 859 1.704 -3.168 5.054 1.00 0.00 C ATOM 857 CG LYS A 859 2.305 -4.571 4.919 1.00 0.00 C ATOM 858 CD LYS A 859 2.166 -5.321 6.246 1.00 0.00 C ATOM 859 CE LYS A 859 1.087 -6.400 6.117 1.00 0.00 C ATOM 860 NZ LYS A 859 -0.145 -5.779 6.675 1.00 0.00 N ATOM 0 H LYS A 859 -0.458 -4.063 4.263 1.00 0.00 H new ATOM 0 HA LYS A 859 0.687 -1.727 3.727 1.00 0.00 H new ATOM 0 HB2 LYS A 859 2.472 -2.462 5.369 1.00 0.00 H new ATOM 0 HB3 LYS A 859 0.932 -3.165 5.824 1.00 0.00 H new ATOM 0 HG2 LYS A 859 1.798 -5.120 4.125 1.00 0.00 H new ATOM 0 HG3 LYS A 859 3.356 -4.502 4.638 1.00 0.00 H new ATOM 0 HD2 LYS A 859 3.118 -5.776 6.520 1.00 0.00 H new ATOM 0 HD3 LYS A 859 1.905 -4.625 7.043 1.00 0.00 H new ATOM 0 HE2 LYS A 859 0.945 -6.694 5.077 1.00 0.00 H new ATOM 0 HE3 LYS A 859 1.360 -7.300 6.668 1.00 0.00 H new ATOM 0 HZ1 LYS A 859 -0.931 -6.458 6.622 1.00 0.00 H new ATOM 0 HZ2 LYS A 859 0.018 -5.515 7.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 859 -0.384 -4.929 6.126 1.00 0.00 H new ATOM 874 N TYR A 860 2.590 -3.760 1.987 1.00 0.00 N ATOM 875 CA TYR A 860 3.659 -3.621 0.953 1.00 0.00 C ATOM 876 C TYR A 860 3.146 -2.753 -0.177 1.00 0.00 C ATOM 877 O TYR A 860 3.794 -1.807 -0.570 1.00 0.00 O ATOM 878 CB TYR A 860 4.000 -5.009 0.439 1.00 0.00 C ATOM 879 CG TYR A 860 5.043 -4.895 -0.672 1.00 0.00 C ATOM 880 CD1 TYR A 860 5.817 -3.726 -0.794 1.00 0.00 C ATOM 881 CD2 TYR A 860 5.228 -5.942 -1.588 1.00 0.00 C ATOM 882 CE1 TYR A 860 6.761 -3.602 -1.815 1.00 0.00 C ATOM 883 CE2 TYR A 860 6.182 -5.813 -2.610 1.00 0.00 C ATOM 884 CZ TYR A 860 6.945 -4.646 -2.723 1.00 0.00 C ATOM 885 OH TYR A 860 7.877 -4.526 -3.733 1.00 0.00 O ATOM 0 H TYR A 860 2.217 -4.699 2.127 1.00 0.00 H new ATOM 0 HA TYR A 860 4.550 -3.155 1.374 1.00 0.00 H new ATOM 0 HB2 TYR A 860 4.384 -5.626 1.252 1.00 0.00 H new ATOM 0 HB3 TYR A 860 3.103 -5.500 0.062 1.00 0.00 H new ATOM 0 HD1 TYR A 860 5.679 -2.917 -0.091 1.00 0.00 H new ATOM 0 HD2 TYR A 860 4.639 -6.843 -1.507 1.00 0.00 H new ATOM 0 HE1 TYR A 860 7.348 -2.700 -1.902 1.00 0.00 H new ATOM 0 HE2 TYR A 860 6.328 -6.620 -3.313 1.00 0.00 H new ATOM 0 HH TYR A 860 7.879 -5.342 -4.275 1.00 0.00 H new ATOM 895 N GLU A 861 1.974 -3.036 -0.687 1.00 0.00 N ATOM 896 CA GLU A 861 1.430 -2.162 -1.765 1.00 0.00 C ATOM 897 C GLU A 861 1.658 -0.733 -1.301 1.00 0.00 C ATOM 898 O GLU A 861 2.158 0.109 -2.019 1.00 0.00 O ATOM 899 CB GLU A 861 -0.061 -2.484 -1.844 1.00 0.00 C ATOM 900 CG GLU A 861 -0.267 -3.729 -2.706 1.00 0.00 C ATOM 901 CD GLU A 861 -0.153 -4.975 -1.828 1.00 0.00 C ATOM 902 OE1 GLU A 861 0.958 -5.437 -1.630 1.00 0.00 O ATOM 903 OE2 GLU A 861 -1.180 -5.445 -1.368 1.00 0.00 O ATOM 0 H GLU A 861 1.382 -3.819 -0.409 1.00 0.00 H new ATOM 0 HA GLU A 861 1.891 -2.305 -2.742 1.00 0.00 H new ATOM 0 HB2 GLU A 861 -0.462 -2.650 -0.844 1.00 0.00 H new ATOM 0 HB3 GLU A 861 -0.604 -1.640 -2.269 1.00 0.00 H new ATOM 0 HG2 GLU A 861 -1.245 -3.696 -3.185 1.00 0.00 H new ATOM 0 HG3 GLU A 861 0.477 -3.762 -3.502 1.00 0.00 H new ATOM 910 N ARG A 862 1.351 -0.498 -0.056 1.00 0.00 N ATOM 911 CA ARG A 862 1.594 0.840 0.551 1.00 0.00 C ATOM 912 C ARG A 862 3.101 1.106 0.609 1.00 0.00 C ATOM 913 O ARG A 862 3.565 2.192 0.322 1.00 0.00 O ATOM 914 CB ARG A 862 1.046 0.744 1.970 1.00 0.00 C ATOM 915 CG ARG A 862 1.550 1.933 2.801 1.00 0.00 C ATOM 916 CD ARG A 862 2.826 1.530 3.547 1.00 0.00 C ATOM 917 NE ARG A 862 2.861 2.405 4.752 1.00 0.00 N ATOM 918 CZ ARG A 862 3.231 1.916 5.904 1.00 0.00 C ATOM 919 NH1 ARG A 862 2.786 0.753 6.294 1.00 0.00 N ATOM 920 NH2 ARG A 862 4.048 2.591 6.666 1.00 0.00 N ATOM 0 H ARG A 862 0.937 -1.185 0.574 1.00 0.00 H new ATOM 0 HA ARG A 862 1.125 1.641 -0.020 1.00 0.00 H new ATOM 0 HB2 ARG A 862 -0.044 0.738 1.950 1.00 0.00 H new ATOM 0 HB3 ARG A 862 1.361 -0.193 2.429 1.00 0.00 H new ATOM 0 HG2 ARG A 862 1.749 2.786 2.152 1.00 0.00 H new ATOM 0 HG3 ARG A 862 0.784 2.245 3.511 1.00 0.00 H new ATOM 0 HD2 ARG A 862 2.804 0.476 3.825 1.00 0.00 H new ATOM 0 HD3 ARG A 862 3.710 1.678 2.926 1.00 0.00 H new ATOM 0 HE ARG A 862 2.596 3.387 4.677 1.00 0.00 H new ATOM 0 HH11 ARG A 862 2.148 0.225 5.698 1.00 0.00 H new ATOM 0 HH12 ARG A 862 3.076 0.372 7.195 1.00 0.00 H new ATOM 0 HH21 ARG A 862 4.397 3.500 6.361 1.00 0.00 H new ATOM 0 HH22 ARG A 862 4.338 2.210 7.567 1.00 0.00 H new ATOM 934 N ALA A 863 3.868 0.124 0.997 1.00 0.00 N ATOM 935 CA ALA A 863 5.343 0.335 1.082 1.00 0.00 C ATOM 936 C ALA A 863 5.941 0.500 -0.318 1.00 0.00 C ATOM 937 O ALA A 863 7.002 1.077 -0.494 1.00 0.00 O ATOM 938 CB ALA A 863 5.895 -0.917 1.765 1.00 0.00 C ATOM 0 H ALA A 863 3.542 -0.807 1.257 1.00 0.00 H new ATOM 0 HA ALA A 863 5.594 1.238 1.638 1.00 0.00 H new ATOM 0 HB1 ALA A 863 6.977 -0.832 1.861 1.00 0.00 H new ATOM 0 HB2 ALA A 863 5.449 -1.018 2.755 1.00 0.00 H new ATOM 0 HB3 ALA A 863 5.652 -1.795 1.166 1.00 0.00 H new ATOM 944 N ARG A 864 5.234 0.082 -1.326 1.00 0.00 N ATOM 945 CA ARG A 864 5.742 0.285 -2.706 1.00 0.00 C ATOM 946 C ARG A 864 5.232 1.649 -3.080 1.00 0.00 C ATOM 947 O ARG A 864 5.927 2.504 -3.590 1.00 0.00 O ATOM 948 CB ARG A 864 5.129 -0.825 -3.558 1.00 0.00 C ATOM 949 CG ARG A 864 6.253 -1.719 -4.094 1.00 0.00 C ATOM 950 CD ARG A 864 6.525 -1.377 -5.562 1.00 0.00 C ATOM 951 NE ARG A 864 7.595 -0.343 -5.522 1.00 0.00 N ATOM 952 CZ ARG A 864 8.727 -0.551 -6.139 1.00 0.00 C ATOM 953 NH1 ARG A 864 9.373 -1.671 -5.957 1.00 0.00 N ATOM 954 NH2 ARG A 864 9.213 0.360 -6.937 1.00 0.00 N ATOM 0 H ARG A 864 4.332 -0.389 -1.255 1.00 0.00 H new ATOM 0 HA ARG A 864 6.824 0.241 -2.829 1.00 0.00 H new ATOM 0 HB2 ARG A 864 4.430 -1.414 -2.964 1.00 0.00 H new ATOM 0 HB3 ARG A 864 4.562 -0.396 -4.384 1.00 0.00 H new ATOM 0 HG2 ARG A 864 7.158 -1.577 -3.503 1.00 0.00 H new ATOM 0 HG3 ARG A 864 5.973 -2.768 -4.000 1.00 0.00 H new ATOM 0 HD2 ARG A 864 6.846 -2.257 -6.120 1.00 0.00 H new ATOM 0 HD3 ARG A 864 5.628 -0.999 -6.052 1.00 0.00 H new ATOM 0 HE ARG A 864 7.444 0.528 -5.013 1.00 0.00 H new ATOM 0 HH11 ARG A 864 8.993 -2.383 -5.333 1.00 0.00 H new ATOM 0 HH12 ARG A 864 10.257 -1.834 -6.439 1.00 0.00 H new ATOM 0 HH21 ARG A 864 8.709 1.235 -7.079 1.00 0.00 H new ATOM 0 HH22 ARG A 864 10.097 0.197 -7.419 1.00 0.00 H new ATOM 968 N VAL A 865 4.009 1.852 -2.700 1.00 0.00 N ATOM 969 CA VAL A 865 3.332 3.150 -2.858 1.00 0.00 C ATOM 970 C VAL A 865 4.264 4.219 -2.313 1.00 0.00 C ATOM 971 O VAL A 865 4.769 5.031 -3.025 1.00 0.00 O ATOM 972 CB VAL A 865 2.121 2.948 -1.945 1.00 0.00 C ATOM 973 CG1 VAL A 865 1.801 4.189 -1.133 1.00 0.00 C ATOM 974 CG2 VAL A 865 0.930 2.554 -2.764 1.00 0.00 C ATOM 0 H VAL A 865 3.429 1.133 -2.267 1.00 0.00 H new ATOM 0 HA VAL A 865 3.063 3.446 -3.872 1.00 0.00 H new ATOM 0 HB VAL A 865 2.369 2.153 -1.241 1.00 0.00 H new ATOM 0 HG11 VAL A 865 0.934 3.997 -0.501 1.00 0.00 H new ATOM 0 HG12 VAL A 865 2.656 4.445 -0.508 1.00 0.00 H new ATOM 0 HG13 VAL A 865 1.582 5.018 -1.806 1.00 0.00 H new ATOM 0 HG21 VAL A 865 0.070 2.411 -2.110 1.00 0.00 H new ATOM 0 HG22 VAL A 865 0.710 3.339 -3.487 1.00 0.00 H new ATOM 0 HG23 VAL A 865 1.143 1.624 -3.292 1.00 0.00 H new ATOM 984 N LEU A 866 4.508 4.160 -1.037 1.00 0.00 N ATOM 985 CA LEU A 866 5.435 5.100 -0.366 1.00 0.00 C ATOM 986 C LEU A 866 6.655 5.228 -1.254 1.00 0.00 C ATOM 987 O LEU A 866 7.191 6.296 -1.455 1.00 0.00 O ATOM 988 CB LEU A 866 5.756 4.420 0.985 1.00 0.00 C ATOM 989 CG LEU A 866 7.241 4.572 1.362 1.00 0.00 C ATOM 990 CD1 LEU A 866 7.363 4.782 2.873 1.00 0.00 C ATOM 991 CD2 LEU A 866 8.002 3.302 0.974 1.00 0.00 C ATOM 0 H LEU A 866 4.086 3.473 -0.412 1.00 0.00 H new ATOM 0 HA LEU A 866 5.043 6.103 -0.198 1.00 0.00 H new ATOM 0 HB2 LEU A 866 5.136 4.856 1.768 1.00 0.00 H new ATOM 0 HB3 LEU A 866 5.502 3.362 0.929 1.00 0.00 H new ATOM 0 HG LEU A 866 7.660 5.428 0.833 1.00 0.00 H new ATOM 0 HD11 LEU A 866 8.414 4.890 3.142 1.00 0.00 H new ATOM 0 HD12 LEU A 866 6.821 5.683 3.160 1.00 0.00 H new ATOM 0 HD13 LEU A 866 6.941 3.923 3.395 1.00 0.00 H new ATOM 0 HD21 LEU A 866 9.053 3.411 1.242 1.00 0.00 H new ATOM 0 HD22 LEU A 866 7.580 2.448 1.504 1.00 0.00 H new ATOM 0 HD23 LEU A 866 7.916 3.140 -0.101 1.00 0.00 H new ATOM 1003 N GLY A 867 7.069 4.137 -1.824 1.00 0.00 N ATOM 1004 CA GLY A 867 8.219 4.204 -2.738 1.00 0.00 C ATOM 1005 C GLY A 867 7.826 5.040 -3.944 1.00 0.00 C ATOM 1006 O GLY A 867 8.551 5.911 -4.353 1.00 0.00 O ATOM 0 H GLY A 867 6.660 3.211 -1.694 1.00 0.00 H new ATOM 0 HA2 GLY A 867 9.078 4.646 -2.234 1.00 0.00 H new ATOM 0 HA3 GLY A 867 8.513 3.202 -3.051 1.00 0.00 H new ATOM 1010 N THR A 868 6.672 4.790 -4.502 1.00 0.00 N ATOM 1011 CA THR A 868 6.228 5.590 -5.707 1.00 0.00 C ATOM 1012 C THR A 868 5.716 6.938 -5.287 1.00 0.00 C ATOM 1013 O THR A 868 5.738 7.884 -6.042 1.00 0.00 O ATOM 1014 CB THR A 868 5.093 4.809 -6.336 1.00 0.00 C ATOM 1015 OG1 THR A 868 3.895 5.020 -5.601 1.00 0.00 O ATOM 1016 CG2 THR A 868 5.459 3.354 -6.309 1.00 0.00 C ATOM 0 H THR A 868 6.015 4.076 -4.188 1.00 0.00 H new ATOM 0 HA THR A 868 7.059 5.743 -6.396 1.00 0.00 H new ATOM 0 HB THR A 868 4.931 5.139 -7.362 1.00 0.00 H new ATOM 0 HG1 THR A 868 4.101 5.056 -4.644 1.00 0.00 H new ATOM 0 HG21 THR A 868 4.656 2.769 -6.757 1.00 0.00 H new ATOM 0 HG22 THR A 868 6.379 3.200 -6.873 1.00 0.00 H new ATOM 0 HG23 THR A 868 5.608 3.035 -5.277 1.00 0.00 H new ATOM 1024 N ARG A 869 5.334 7.051 -4.065 1.00 0.00 N ATOM 1025 CA ARG A 869 4.903 8.355 -3.563 1.00 0.00 C ATOM 1026 C ARG A 869 6.197 9.088 -3.397 1.00 0.00 C ATOM 1027 O ARG A 869 6.372 10.180 -3.866 1.00 0.00 O ATOM 1028 CB ARG A 869 4.212 8.094 -2.221 1.00 0.00 C ATOM 1029 CG ARG A 869 2.803 8.700 -2.243 1.00 0.00 C ATOM 1030 CD ARG A 869 1.757 7.582 -2.298 1.00 0.00 C ATOM 1031 NE ARG A 869 2.096 6.792 -3.516 1.00 0.00 N ATOM 1032 CZ ARG A 869 1.436 6.988 -4.625 1.00 0.00 C ATOM 1033 NH1 ARG A 869 0.549 6.115 -5.019 1.00 0.00 N ATOM 1034 NH2 ARG A 869 1.663 8.056 -5.339 1.00 0.00 N ATOM 0 H ARG A 869 5.302 6.289 -3.388 1.00 0.00 H new ATOM 0 HA ARG A 869 4.211 8.914 -4.192 1.00 0.00 H new ATOM 0 HB2 ARG A 869 4.155 7.022 -2.032 1.00 0.00 H new ATOM 0 HB3 ARG A 869 4.794 8.530 -1.409 1.00 0.00 H new ATOM 0 HG2 ARG A 869 2.647 9.313 -1.355 1.00 0.00 H new ATOM 0 HG3 ARG A 869 2.693 9.356 -3.106 1.00 0.00 H new ATOM 0 HD2 ARG A 869 1.796 6.962 -1.403 1.00 0.00 H new ATOM 0 HD3 ARG A 869 0.748 7.989 -2.360 1.00 0.00 H new ATOM 0 HE ARG A 869 2.843 6.099 -3.483 1.00 0.00 H new ATOM 0 HH11 ARG A 869 0.372 5.280 -4.460 1.00 0.00 H new ATOM 0 HH12 ARG A 869 0.033 6.268 -5.885 1.00 0.00 H new ATOM 0 HH21 ARG A 869 2.356 8.738 -5.031 1.00 0.00 H new ATOM 0 HH22 ARG A 869 1.147 8.209 -6.206 1.00 0.00 H new ATOM 1048 N ALA A 870 7.130 8.424 -2.775 1.00 0.00 N ATOM 1049 CA ALA A 870 8.484 9.013 -2.596 1.00 0.00 C ATOM 1050 C ALA A 870 9.114 9.421 -3.942 1.00 0.00 C ATOM 1051 O ALA A 870 9.796 10.418 -4.015 1.00 0.00 O ATOM 1052 CB ALA A 870 9.301 7.902 -1.944 1.00 0.00 C ATOM 0 H ALA A 870 7.011 7.491 -2.380 1.00 0.00 H new ATOM 0 HA ALA A 870 8.448 9.923 -1.997 1.00 0.00 H new ATOM 0 HB1 ALA A 870 10.320 8.251 -1.774 1.00 0.00 H new ATOM 0 HB2 ALA A 870 8.848 7.628 -0.991 1.00 0.00 H new ATOM 0 HB3 ALA A 870 9.320 7.032 -2.600 1.00 0.00 H new ATOM 1058 N LEU A 871 8.886 8.699 -5.013 1.00 0.00 N ATOM 1059 CA LEU A 871 9.493 9.157 -6.318 1.00 0.00 C ATOM 1060 C LEU A 871 8.531 10.106 -6.969 1.00 0.00 C ATOM 1061 O LEU A 871 8.929 11.112 -7.531 1.00 0.00 O ATOM 1062 CB LEU A 871 9.800 7.962 -7.255 1.00 0.00 C ATOM 1063 CG LEU A 871 9.352 6.629 -6.677 1.00 0.00 C ATOM 1064 CD1 LEU A 871 8.977 5.689 -7.822 1.00 0.00 C ATOM 1065 CD2 LEU A 871 10.501 6.022 -5.866 1.00 0.00 C ATOM 0 H LEU A 871 8.330 7.845 -5.051 1.00 0.00 H new ATOM 0 HA LEU A 871 10.443 9.654 -6.121 1.00 0.00 H new ATOM 0 HB2 LEU A 871 9.306 8.122 -8.213 1.00 0.00 H new ATOM 0 HB3 LEU A 871 10.872 7.926 -7.451 1.00 0.00 H new ATOM 0 HG LEU A 871 8.488 6.775 -6.029 1.00 0.00 H new ATOM 0 HD11 LEU A 871 8.655 4.731 -7.415 1.00 0.00 H new ATOM 0 HD12 LEU A 871 8.166 6.128 -8.402 1.00 0.00 H new ATOM 0 HD13 LEU A 871 9.843 5.537 -8.466 1.00 0.00 H new ATOM 0 HD21 LEU A 871 10.186 5.066 -5.449 1.00 0.00 H new ATOM 0 HD22 LEU A 871 11.363 5.868 -6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 871 10.772 6.699 -5.056 1.00 0.00 H new ATOM 1077 N GLN A 872 7.257 9.831 -6.869 1.00 0.00 N ATOM 1078 CA GLN A 872 6.281 10.781 -7.459 1.00 0.00 C ATOM 1079 C GLN A 872 6.720 12.196 -7.060 1.00 0.00 C ATOM 1080 O GLN A 872 7.145 12.992 -7.876 1.00 0.00 O ATOM 1081 CB GLN A 872 4.945 10.402 -6.816 1.00 0.00 C ATOM 1082 CG GLN A 872 4.013 9.754 -7.855 1.00 0.00 C ATOM 1083 CD GLN A 872 4.668 8.506 -8.455 1.00 0.00 C ATOM 1084 OE1 GLN A 872 4.450 7.406 -7.987 1.00 0.00 O ATOM 1085 NE2 GLN A 872 5.453 8.628 -9.492 1.00 0.00 N ATOM 0 H GLN A 872 6.861 9.008 -6.415 1.00 0.00 H new ATOM 0 HA GLN A 872 6.210 10.746 -8.546 1.00 0.00 H new ATOM 0 HB2 GLN A 872 5.115 9.711 -5.990 1.00 0.00 H new ATOM 0 HB3 GLN A 872 4.471 11.290 -6.397 1.00 0.00 H new ATOM 0 HG2 GLN A 872 3.066 9.486 -7.386 1.00 0.00 H new ATOM 0 HG3 GLN A 872 3.786 10.469 -8.646 1.00 0.00 H new ATOM 0 HE21 GLN A 872 5.637 9.550 -9.886 1.00 0.00 H new ATOM 0 HE22 GLN A 872 5.882 7.801 -9.907 1.00 0.00 H new ATOM 1094 N ILE A 873 6.659 12.474 -5.795 1.00 0.00 N ATOM 1095 CA ILE A 873 7.103 13.798 -5.260 1.00 0.00 C ATOM 1096 C ILE A 873 8.569 14.024 -5.497 1.00 0.00 C ATOM 1097 O ILE A 873 8.997 15.138 -5.716 1.00 0.00 O ATOM 1098 CB ILE A 873 6.911 13.704 -3.762 1.00 0.00 C ATOM 1099 CG1 ILE A 873 7.263 12.282 -3.279 1.00 0.00 C ATOM 1100 CG2 ILE A 873 5.473 14.052 -3.463 1.00 0.00 C ATOM 1101 CD1 ILE A 873 8.467 12.319 -2.348 1.00 0.00 C ATOM 0 H ILE A 873 6.312 11.828 -5.086 1.00 0.00 H new ATOM 0 HA ILE A 873 6.545 14.603 -5.739 1.00 0.00 H new ATOM 0 HB ILE A 873 7.568 14.396 -3.235 1.00 0.00 H new ATOM 0 HG12 ILE A 873 6.409 11.845 -2.762 1.00 0.00 H new ATOM 0 HG13 ILE A 873 7.478 11.643 -4.136 1.00 0.00 H new ATOM 0 HG21 ILE A 873 5.300 13.994 -2.388 1.00 0.00 H new ATOM 0 HG22 ILE A 873 5.264 15.064 -3.810 1.00 0.00 H new ATOM 0 HG23 ILE A 873 4.815 13.350 -3.975 1.00 0.00 H new ATOM 0 HD11 ILE A 873 8.702 11.308 -2.017 1.00 0.00 H new ATOM 0 HD12 ILE A 873 9.324 12.735 -2.878 1.00 0.00 H new ATOM 0 HD13 ILE A 873 8.239 12.941 -1.482 1.00 0.00 H new ATOM 1113 N ALA A 874 9.357 12.990 -5.452 1.00 0.00 N ATOM 1114 CA ALA A 874 10.806 13.200 -5.673 1.00 0.00 C ATOM 1115 C ALA A 874 10.983 13.921 -6.997 1.00 0.00 C ATOM 1116 O ALA A 874 11.999 14.534 -7.257 1.00 0.00 O ATOM 1117 CB ALA A 874 11.437 11.820 -5.666 1.00 0.00 C ATOM 0 H ALA A 874 9.067 12.028 -5.275 1.00 0.00 H new ATOM 0 HA ALA A 874 11.281 13.814 -4.908 1.00 0.00 H new ATOM 0 HB1 ALA A 874 12.511 11.910 -5.825 1.00 0.00 H new ATOM 0 HB2 ALA A 874 11.252 11.340 -4.705 1.00 0.00 H new ATOM 0 HB3 ALA A 874 11.002 11.217 -6.463 1.00 0.00 H new ATOM 1123 N MET A 875 9.953 13.926 -7.796 1.00 0.00 N ATOM 1124 CA MET A 875 10.023 14.700 -9.055 1.00 0.00 C ATOM 1125 C MET A 875 9.427 16.065 -8.724 1.00 0.00 C ATOM 1126 O MET A 875 10.097 17.079 -8.705 1.00 0.00 O ATOM 1127 CB MET A 875 9.153 13.941 -10.059 1.00 0.00 C ATOM 1128 CG MET A 875 9.848 13.913 -11.425 1.00 0.00 C ATOM 1129 SD MET A 875 8.807 14.735 -12.659 1.00 0.00 S ATOM 1130 CE MET A 875 7.345 13.690 -12.454 1.00 0.00 C ATOM 0 H MET A 875 9.076 13.432 -7.630 1.00 0.00 H new ATOM 0 HA MET A 875 11.025 14.824 -9.465 1.00 0.00 H new ATOM 0 HB2 MET A 875 8.978 12.924 -9.708 1.00 0.00 H new ATOM 0 HB3 MET A 875 8.178 14.420 -10.146 1.00 0.00 H new ATOM 0 HG2 MET A 875 10.815 14.411 -11.362 1.00 0.00 H new ATOM 0 HG3 MET A 875 10.039 12.883 -11.725 1.00 0.00 H new ATOM 0 HE1 MET A 875 6.853 13.560 -13.418 1.00 0.00 H new ATOM 0 HE2 MET A 875 7.645 12.717 -12.066 1.00 0.00 H new ATOM 0 HE3 MET A 875 6.655 14.163 -11.755 1.00 0.00 H new ATOM 1140 N CYS A 876 8.170 16.057 -8.398 1.00 0.00 N ATOM 1141 CA CYS A 876 7.461 17.300 -7.977 1.00 0.00 C ATOM 1142 C CYS A 876 6.567 16.957 -6.787 1.00 0.00 C ATOM 1143 O CYS A 876 6.918 17.164 -5.644 1.00 0.00 O ATOM 1144 CB CYS A 876 6.639 17.739 -9.191 1.00 0.00 C ATOM 1145 SG CYS A 876 7.603 18.907 -10.182 1.00 0.00 S ATOM 0 H CYS A 876 7.586 15.221 -8.405 1.00 0.00 H new ATOM 0 HA CYS A 876 8.133 18.101 -7.669 1.00 0.00 H new ATOM 0 HB2 CYS A 876 6.368 16.872 -9.793 1.00 0.00 H new ATOM 0 HB3 CYS A 876 5.709 18.204 -8.865 1.00 0.00 H new ATOM 0 HG CYS A 876 6.906 19.278 -11.215 1.00 0.00 H new ATOM 1151 N ALA A 877 5.421 16.394 -7.061 1.00 0.00 N ATOM 1152 CA ALA A 877 4.495 15.992 -5.958 1.00 0.00 C ATOM 1153 C ALA A 877 3.170 15.370 -6.459 1.00 0.00 C ATOM 1154 O ALA A 877 2.122 15.684 -5.930 1.00 0.00 O ATOM 1155 CB ALA A 877 4.219 17.261 -5.169 1.00 0.00 C ATOM 0 H ALA A 877 5.084 16.194 -8.003 1.00 0.00 H new ATOM 0 HA ALA A 877 4.960 15.212 -5.355 1.00 0.00 H new ATOM 0 HB1 ALA A 877 3.544 17.036 -4.343 1.00 0.00 H new ATOM 0 HB2 ALA A 877 5.156 17.656 -4.775 1.00 0.00 H new ATOM 0 HB3 ALA A 877 3.759 18.003 -5.822 1.00 0.00 H new ATOM 1161 N PRO A 878 3.245 14.457 -7.409 1.00 0.00 N ATOM 1162 CA PRO A 878 2.025 13.749 -7.889 1.00 0.00 C ATOM 1163 C PRO A 878 1.392 12.999 -6.711 1.00 0.00 C ATOM 1164 O PRO A 878 0.275 12.524 -6.769 1.00 0.00 O ATOM 1165 CB PRO A 878 2.590 12.749 -8.890 1.00 0.00 C ATOM 1166 CG PRO A 878 4.118 12.909 -8.932 1.00 0.00 C ATOM 1167 CD PRO A 878 4.518 14.087 -8.051 1.00 0.00 C ATOM 0 HA PRO A 878 1.265 14.405 -8.313 1.00 0.00 H new ATOM 0 HB2 PRO A 878 2.324 11.732 -8.601 1.00 0.00 H new ATOM 0 HB3 PRO A 878 2.164 12.921 -9.878 1.00 0.00 H new ATOM 0 HG2 PRO A 878 4.602 11.997 -8.583 1.00 0.00 H new ATOM 0 HG3 PRO A 878 4.451 13.075 -9.956 1.00 0.00 H new ATOM 0 HD2 PRO A 878 5.275 13.806 -7.318 1.00 0.00 H new ATOM 0 HD3 PRO A 878 4.930 14.909 -8.636 1.00 0.00 H new ATOM 1174 N VAL A 879 2.139 12.895 -5.650 1.00 0.00 N ATOM 1175 CA VAL A 879 1.687 12.188 -4.422 1.00 0.00 C ATOM 1176 C VAL A 879 0.332 12.746 -3.978 1.00 0.00 C ATOM 1177 O VAL A 879 -0.233 13.615 -4.614 1.00 0.00 O ATOM 1178 CB VAL A 879 2.834 12.516 -3.435 1.00 0.00 C ATOM 1179 CG1 VAL A 879 2.411 12.490 -1.956 1.00 0.00 C ATOM 1180 CG2 VAL A 879 3.982 11.516 -3.656 1.00 0.00 C ATOM 0 H VAL A 879 3.079 13.286 -5.582 1.00 0.00 H new ATOM 0 HA VAL A 879 1.524 11.115 -4.526 1.00 0.00 H new ATOM 0 HB VAL A 879 3.148 13.539 -3.645 1.00 0.00 H new ATOM 0 HG11 VAL A 879 3.269 12.730 -1.328 1.00 0.00 H new ATOM 0 HG12 VAL A 879 1.623 13.225 -1.790 1.00 0.00 H new ATOM 0 HG13 VAL A 879 2.041 11.497 -1.701 1.00 0.00 H new ATOM 0 HG21 VAL A 879 4.796 11.738 -2.966 1.00 0.00 H new ATOM 0 HG22 VAL A 879 3.621 10.503 -3.478 1.00 0.00 H new ATOM 0 HG23 VAL A 879 4.343 11.598 -4.681 1.00 0.00 H new ATOM 1190 N MET A 880 -0.206 12.224 -2.922 1.00 0.00 N ATOM 1191 CA MET A 880 -1.551 12.685 -2.461 1.00 0.00 C ATOM 1192 C MET A 880 -1.419 13.814 -1.444 1.00 0.00 C ATOM 1193 O MET A 880 -2.308 14.063 -0.654 1.00 0.00 O ATOM 1194 CB MET A 880 -2.198 11.455 -1.823 1.00 0.00 C ATOM 1195 CG MET A 880 -3.246 10.873 -2.778 1.00 0.00 C ATOM 1196 SD MET A 880 -2.624 9.333 -3.503 1.00 0.00 S ATOM 1197 CE MET A 880 -1.807 10.071 -4.939 1.00 0.00 C ATOM 0 H MET A 880 0.222 11.495 -2.351 1.00 0.00 H new ATOM 0 HA MET A 880 -2.148 13.080 -3.283 1.00 0.00 H new ATOM 0 HB2 MET A 880 -1.438 10.706 -1.600 1.00 0.00 H new ATOM 0 HB3 MET A 880 -2.665 11.727 -0.876 1.00 0.00 H new ATOM 0 HG2 MET A 880 -4.176 10.684 -2.241 1.00 0.00 H new ATOM 0 HG3 MET A 880 -3.473 11.591 -3.566 1.00 0.00 H new ATOM 0 HE1 MET A 880 -2.386 9.856 -5.837 1.00 0.00 H new ATOM 0 HE2 MET A 880 -1.736 11.150 -4.803 1.00 0.00 H new ATOM 0 HE3 MET A 880 -0.806 9.652 -5.043 1.00 0.00 H new ATOM 1207 N VAL A 881 -0.332 14.521 -1.499 1.00 0.00 N ATOM 1208 CA VAL A 881 -0.109 15.666 -0.599 1.00 0.00 C ATOM 1209 C VAL A 881 0.858 16.601 -1.323 1.00 0.00 C ATOM 1210 O VAL A 881 1.465 16.231 -2.309 1.00 0.00 O ATOM 1211 CB VAL A 881 0.486 15.099 0.700 1.00 0.00 C ATOM 1212 CG1 VAL A 881 -0.583 14.285 1.455 1.00 0.00 C ATOM 1213 CG2 VAL A 881 1.676 14.194 0.374 1.00 0.00 C ATOM 0 H VAL A 881 0.431 14.343 -2.152 1.00 0.00 H new ATOM 0 HA VAL A 881 -1.013 16.222 -0.350 1.00 0.00 H new ATOM 0 HB VAL A 881 0.820 15.926 1.326 1.00 0.00 H new ATOM 0 HG11 VAL A 881 -0.154 13.886 2.374 1.00 0.00 H new ATOM 0 HG12 VAL A 881 -1.427 14.930 1.698 1.00 0.00 H new ATOM 0 HG13 VAL A 881 -0.924 13.462 0.827 1.00 0.00 H new ATOM 0 HG21 VAL A 881 2.094 13.795 1.298 1.00 0.00 H new ATOM 0 HG22 VAL A 881 1.345 13.371 -0.259 1.00 0.00 H new ATOM 0 HG23 VAL A 881 2.439 14.770 -0.150 1.00 0.00 H new ATOM 1223 N GLU A 882 0.975 17.803 -0.878 1.00 0.00 N ATOM 1224 CA GLU A 882 1.872 18.774 -1.579 1.00 0.00 C ATOM 1225 C GLU A 882 2.914 19.365 -0.628 1.00 0.00 C ATOM 1226 O GLU A 882 2.822 20.511 -0.232 1.00 0.00 O ATOM 1227 CB GLU A 882 0.935 19.873 -2.087 1.00 0.00 C ATOM 1228 CG GLU A 882 0.161 20.480 -0.913 1.00 0.00 C ATOM 1229 CD GLU A 882 -1.286 19.983 -0.941 1.00 0.00 C ATOM 1230 OE1 GLU A 882 -1.479 18.780 -0.882 1.00 0.00 O ATOM 1231 OE2 GLU A 882 -2.177 20.813 -1.018 1.00 0.00 O ATOM 0 H GLU A 882 0.493 18.170 -0.058 1.00 0.00 H new ATOM 0 HA GLU A 882 2.432 18.293 -2.381 1.00 0.00 H new ATOM 0 HB2 GLU A 882 1.510 20.648 -2.595 1.00 0.00 H new ATOM 0 HB3 GLU A 882 0.240 19.461 -2.819 1.00 0.00 H new ATOM 0 HG2 GLU A 882 0.633 20.203 0.029 1.00 0.00 H new ATOM 0 HG3 GLU A 882 0.184 21.568 -0.973 1.00 0.00 H new ATOM 1238 N LEU A 883 3.911 18.604 -0.263 1.00 0.00 N ATOM 1239 CA LEU A 883 4.952 19.146 0.655 1.00 0.00 C ATOM 1240 C LEU A 883 5.651 20.360 0.015 1.00 0.00 C ATOM 1241 O LEU A 883 5.254 21.488 0.234 1.00 0.00 O ATOM 1242 CB LEU A 883 5.934 17.989 0.870 1.00 0.00 C ATOM 1243 CG LEU A 883 7.061 18.439 1.803 1.00 0.00 C ATOM 1244 CD1 LEU A 883 6.555 18.453 3.246 1.00 0.00 C ATOM 1245 CD2 LEU A 883 8.236 17.466 1.686 1.00 0.00 C ATOM 0 H LEU A 883 4.049 17.638 -0.559 1.00 0.00 H new ATOM 0 HA LEU A 883 4.533 19.496 1.599 1.00 0.00 H new ATOM 0 HB2 LEU A 883 5.414 17.132 1.298 1.00 0.00 H new ATOM 0 HB3 LEU A 883 6.347 17.666 -0.086 1.00 0.00 H new ATOM 0 HG LEU A 883 7.387 19.441 1.523 1.00 0.00 H new ATOM 0 HD11 LEU A 883 7.358 18.773 3.910 1.00 0.00 H new ATOM 0 HD12 LEU A 883 5.716 19.144 3.331 1.00 0.00 H new ATOM 0 HD13 LEU A 883 6.230 17.451 3.527 1.00 0.00 H new ATOM 0 HD21 LEU A 883 9.040 17.785 2.350 1.00 0.00 H new ATOM 0 HD22 LEU A 883 7.909 16.465 1.967 1.00 0.00 H new ATOM 0 HD23 LEU A 883 8.598 17.454 0.658 1.00 0.00 H new ATOM 1257 N GLU A 884 6.687 20.150 -0.765 1.00 0.00 N ATOM 1258 CA GLU A 884 7.391 21.314 -1.394 1.00 0.00 C ATOM 1259 C GLU A 884 7.907 20.987 -2.807 1.00 0.00 C ATOM 1260 O GLU A 884 8.532 21.815 -3.442 1.00 0.00 O ATOM 1261 CB GLU A 884 8.568 21.599 -0.461 1.00 0.00 C ATOM 1262 CG GLU A 884 8.458 23.023 0.090 1.00 0.00 C ATOM 1263 CD GLU A 884 8.681 24.028 -1.042 1.00 0.00 C ATOM 1264 OE1 GLU A 884 9.782 24.065 -1.566 1.00 0.00 O ATOM 1265 OE2 GLU A 884 7.748 24.744 -1.365 1.00 0.00 O ATOM 0 H GLU A 884 7.072 19.233 -0.991 1.00 0.00 H new ATOM 0 HA GLU A 884 6.718 22.164 -1.513 1.00 0.00 H new ATOM 0 HB2 GLU A 884 8.576 20.881 0.359 1.00 0.00 H new ATOM 0 HB3 GLU A 884 9.508 21.479 -0.999 1.00 0.00 H new ATOM 0 HG2 GLU A 884 7.476 23.176 0.538 1.00 0.00 H new ATOM 0 HG3 GLU A 884 9.195 23.177 0.878 1.00 0.00 H new ATOM 1272 N GLY A 885 7.691 19.795 -3.294 1.00 0.00 N ATOM 1273 CA GLY A 885 8.212 19.434 -4.640 1.00 0.00 C ATOM 1274 C GLY A 885 9.161 18.242 -4.482 1.00 0.00 C ATOM 1275 O GLY A 885 9.348 17.464 -5.391 1.00 0.00 O ATOM 0 H GLY A 885 7.175 19.056 -2.816 1.00 0.00 H new ATOM 0 HA2 GLY A 885 7.391 19.180 -5.310 1.00 0.00 H new ATOM 0 HA3 GLY A 885 8.736 20.280 -5.085 1.00 0.00 H new ATOM 1279 N GLU A 886 9.749 18.113 -3.308 1.00 0.00 N ATOM 1280 CA GLU A 886 10.702 16.993 -2.989 1.00 0.00 C ATOM 1281 C GLU A 886 11.692 17.485 -1.941 1.00 0.00 C ATOM 1282 O GLU A 886 12.349 18.492 -2.125 1.00 0.00 O ATOM 1283 CB GLU A 886 11.455 16.633 -4.275 1.00 0.00 C ATOM 1284 CG GLU A 886 12.666 15.750 -3.947 1.00 0.00 C ATOM 1285 CD GLU A 886 13.484 15.511 -5.218 1.00 0.00 C ATOM 1286 OE1 GLU A 886 13.666 16.456 -5.967 1.00 0.00 O ATOM 1287 OE2 GLU A 886 13.912 14.387 -5.420 1.00 0.00 O ATOM 0 H GLU A 886 9.601 18.760 -2.534 1.00 0.00 H new ATOM 0 HA GLU A 886 10.170 16.121 -2.609 1.00 0.00 H new ATOM 0 HB2 GLU A 886 10.789 16.110 -4.961 1.00 0.00 H new ATOM 0 HB3 GLU A 886 11.784 17.541 -4.780 1.00 0.00 H new ATOM 0 HG2 GLU A 886 13.285 16.230 -3.189 1.00 0.00 H new ATOM 0 HG3 GLU A 886 12.334 14.799 -3.532 1.00 0.00 H new ATOM 1294 N THR A 887 11.815 16.787 -0.855 1.00 0.00 N ATOM 1295 CA THR A 887 12.764 17.210 0.192 1.00 0.00 C ATOM 1296 C THR A 887 12.952 16.027 1.109 1.00 0.00 C ATOM 1297 O THR A 887 14.051 15.637 1.452 1.00 0.00 O ATOM 1298 CB THR A 887 12.058 18.362 0.915 1.00 0.00 C ATOM 1299 OG1 THR A 887 12.045 19.509 0.077 1.00 0.00 O ATOM 1300 CG2 THR A 887 12.793 18.692 2.217 1.00 0.00 C ATOM 0 H THR A 887 11.293 15.935 -0.649 1.00 0.00 H new ATOM 0 HA THR A 887 13.739 17.528 -0.176 1.00 0.00 H new ATOM 0 HB THR A 887 11.035 18.064 1.147 1.00 0.00 H new ATOM 0 HG1 THR A 887 12.591 19.339 -0.719 1.00 0.00 H new ATOM 0 HG21 THR A 887 12.284 19.512 2.724 1.00 0.00 H new ATOM 0 HG22 THR A 887 12.800 17.814 2.863 1.00 0.00 H new ATOM 0 HG23 THR A 887 13.818 18.985 1.992 1.00 0.00 H new ATOM 1308 N ASP A 888 11.858 15.450 1.493 1.00 0.00 N ATOM 1309 CA ASP A 888 11.901 14.280 2.374 1.00 0.00 C ATOM 1310 C ASP A 888 11.992 12.985 1.558 1.00 0.00 C ATOM 1311 O ASP A 888 11.415 12.895 0.492 1.00 0.00 O ATOM 1312 CB ASP A 888 10.588 14.350 3.118 1.00 0.00 C ATOM 1313 CG ASP A 888 10.745 13.725 4.506 1.00 0.00 C ATOM 1314 OD1 ASP A 888 10.556 12.526 4.619 1.00 0.00 O ATOM 1315 OD2 ASP A 888 11.050 14.458 5.432 1.00 0.00 O ATOM 0 H ASP A 888 10.921 15.751 1.224 1.00 0.00 H new ATOM 0 HA ASP A 888 12.767 14.280 3.036 1.00 0.00 H new ATOM 0 HB2 ASP A 888 10.267 15.387 3.210 1.00 0.00 H new ATOM 0 HB3 ASP A 888 9.814 13.825 2.558 1.00 0.00 H new ATOM 1320 N PRO A 889 12.695 12.011 2.081 1.00 0.00 N ATOM 1321 CA PRO A 889 12.822 10.716 1.380 1.00 0.00 C ATOM 1322 C PRO A 889 11.481 9.963 1.372 1.00 0.00 C ATOM 1323 O PRO A 889 11.340 8.960 0.699 1.00 0.00 O ATOM 1324 CB PRO A 889 13.850 9.969 2.239 1.00 0.00 C ATOM 1325 CG PRO A 889 14.261 10.873 3.417 1.00 0.00 C ATOM 1326 CD PRO A 889 13.408 12.147 3.375 1.00 0.00 C ATOM 0 HA PRO A 889 13.114 10.818 0.335 1.00 0.00 H new ATOM 0 HB2 PRO A 889 13.426 9.036 2.609 1.00 0.00 H new ATOM 0 HB3 PRO A 889 14.723 9.707 1.641 1.00 0.00 H new ATOM 0 HG2 PRO A 889 14.116 10.351 4.363 1.00 0.00 H new ATOM 0 HG3 PRO A 889 15.320 11.124 3.350 1.00 0.00 H new ATOM 0 HD2 PRO A 889 12.717 12.201 4.216 1.00 0.00 H new ATOM 0 HD3 PRO A 889 14.021 13.048 3.408 1.00 0.00 H new ATOM 1333 N LEU A 890 10.494 10.425 2.116 1.00 0.00 N ATOM 1334 CA LEU A 890 9.187 9.715 2.145 1.00 0.00 C ATOM 1335 C LEU A 890 8.157 10.426 3.045 1.00 0.00 C ATOM 1336 O LEU A 890 7.098 9.885 3.282 1.00 0.00 O ATOM 1337 CB LEU A 890 9.488 8.295 2.683 1.00 0.00 C ATOM 1338 CG LEU A 890 9.909 8.304 4.174 1.00 0.00 C ATOM 1339 CD1 LEU A 890 11.001 9.342 4.436 1.00 0.00 C ATOM 1340 CD2 LEU A 890 8.702 8.610 5.065 1.00 0.00 C ATOM 0 H LEU A 890 10.547 11.261 2.699 1.00 0.00 H new ATOM 0 HA LEU A 890 8.745 9.692 1.149 1.00 0.00 H new ATOM 0 HB2 LEU A 890 8.604 7.669 2.562 1.00 0.00 H new ATOM 0 HB3 LEU A 890 10.282 7.845 2.087 1.00 0.00 H new ATOM 0 HG LEU A 890 10.301 7.315 4.411 1.00 0.00 H new ATOM 0 HD11 LEU A 890 11.275 9.324 5.491 1.00 0.00 H new ATOM 0 HD12 LEU A 890 11.877 9.110 3.830 1.00 0.00 H new ATOM 0 HD13 LEU A 890 10.631 10.333 4.174 1.00 0.00 H new ATOM 0 HD21 LEU A 890 9.013 8.613 6.110 1.00 0.00 H new ATOM 0 HD22 LEU A 890 8.296 9.587 4.804 1.00 0.00 H new ATOM 0 HD23 LEU A 890 7.937 7.848 4.916 1.00 0.00 H new ATOM 1352 N LEU A 891 8.418 11.627 3.535 1.00 0.00 N ATOM 1353 CA LEU A 891 7.385 12.318 4.387 1.00 0.00 C ATOM 1354 C LEU A 891 6.059 12.138 3.713 1.00 0.00 C ATOM 1355 O LEU A 891 5.039 11.916 4.310 1.00 0.00 O ATOM 1356 CB LEU A 891 7.791 13.799 4.403 1.00 0.00 C ATOM 1357 CG LEU A 891 6.576 14.763 4.366 1.00 0.00 C ATOM 1358 CD1 LEU A 891 5.882 14.761 2.987 1.00 0.00 C ATOM 1359 CD2 LEU A 891 5.567 14.391 5.460 1.00 0.00 C ATOM 0 H LEU A 891 9.283 12.147 3.385 1.00 0.00 H new ATOM 0 HA LEU A 891 7.319 11.928 5.403 1.00 0.00 H new ATOM 0 HB2 LEU A 891 8.379 13.999 5.299 1.00 0.00 H new ATOM 0 HB3 LEU A 891 8.435 14.002 3.547 1.00 0.00 H new ATOM 0 HG LEU A 891 6.953 15.769 4.548 1.00 0.00 H new ATOM 0 HD11 LEU A 891 5.037 15.449 3.004 1.00 0.00 H new ATOM 0 HD12 LEU A 891 6.592 15.077 2.222 1.00 0.00 H new ATOM 0 HD13 LEU A 891 5.527 13.756 2.760 1.00 0.00 H new ATOM 0 HD21 LEU A 891 4.720 15.076 5.422 1.00 0.00 H new ATOM 0 HD22 LEU A 891 5.217 13.371 5.300 1.00 0.00 H new ATOM 0 HD23 LEU A 891 6.047 14.461 6.436 1.00 0.00 H new ATOM 1371 N ILE A 892 6.125 12.250 2.448 1.00 0.00 N ATOM 1372 CA ILE A 892 4.944 12.101 1.583 1.00 0.00 C ATOM 1373 C ILE A 892 4.493 10.663 1.593 1.00 0.00 C ATOM 1374 O ILE A 892 3.324 10.369 1.698 1.00 0.00 O ATOM 1375 CB ILE A 892 5.481 12.448 0.216 1.00 0.00 C ATOM 1376 CG1 ILE A 892 5.120 13.879 -0.110 1.00 0.00 C ATOM 1377 CG2 ILE A 892 4.913 11.511 -0.839 1.00 0.00 C ATOM 1378 CD1 ILE A 892 6.312 14.510 -0.786 1.00 0.00 C ATOM 0 H ILE A 892 6.989 12.449 1.943 1.00 0.00 H new ATOM 0 HA ILE A 892 4.097 12.715 1.890 1.00 0.00 H new ATOM 0 HB ILE A 892 6.565 12.335 0.220 1.00 0.00 H new ATOM 0 HG12 ILE A 892 4.247 13.914 -0.762 1.00 0.00 H new ATOM 0 HG13 ILE A 892 4.862 14.425 0.798 1.00 0.00 H new ATOM 0 HG21 ILE A 892 5.313 11.779 -1.817 1.00 0.00 H new ATOM 0 HG22 ILE A 892 5.192 10.484 -0.602 1.00 0.00 H new ATOM 0 HG23 ILE A 892 3.827 11.597 -0.855 1.00 0.00 H new ATOM 0 HD11 ILE A 892 6.083 15.546 -1.035 1.00 0.00 H new ATOM 0 HD12 ILE A 892 7.170 14.479 -0.114 1.00 0.00 H new ATOM 0 HD13 ILE A 892 6.546 13.961 -1.698 1.00 0.00 H new ATOM 1390 N ALA A 893 5.427 9.770 1.461 1.00 0.00 N ATOM 1391 CA ALA A 893 5.045 8.322 1.433 1.00 0.00 C ATOM 1392 C ALA A 893 4.540 7.926 2.819 1.00 0.00 C ATOM 1393 O ALA A 893 3.752 7.006 3.002 1.00 0.00 O ATOM 1394 CB ALA A 893 6.322 7.566 1.106 1.00 0.00 C ATOM 0 H ALA A 893 6.424 9.967 1.372 1.00 0.00 H new ATOM 0 HA ALA A 893 4.262 8.107 0.705 1.00 0.00 H new ATOM 0 HB1 ALA A 893 6.113 6.497 1.070 1.00 0.00 H new ATOM 0 HB2 ALA A 893 6.702 7.894 0.138 1.00 0.00 H new ATOM 0 HB3 ALA A 893 7.069 7.764 1.875 1.00 0.00 H new ATOM 1400 N MET A 894 4.922 8.696 3.775 1.00 0.00 N ATOM 1401 CA MET A 894 4.451 8.489 5.163 1.00 0.00 C ATOM 1402 C MET A 894 3.164 9.268 5.313 1.00 0.00 C ATOM 1403 O MET A 894 2.170 8.768 5.754 1.00 0.00 O ATOM 1404 CB MET A 894 5.560 9.085 6.034 1.00 0.00 C ATOM 1405 CG MET A 894 5.053 9.325 7.461 1.00 0.00 C ATOM 1406 SD MET A 894 6.394 9.997 8.481 1.00 0.00 S ATOM 1407 CE MET A 894 6.698 11.513 7.532 1.00 0.00 C ATOM 0 H MET A 894 5.559 9.484 3.656 1.00 0.00 H new ATOM 0 HA MET A 894 4.261 7.450 5.431 1.00 0.00 H new ATOM 0 HB2 MET A 894 6.416 8.411 6.055 1.00 0.00 H new ATOM 0 HB3 MET A 894 5.905 10.024 5.602 1.00 0.00 H new ATOM 0 HG2 MET A 894 4.212 10.018 7.447 1.00 0.00 H new ATOM 0 HG3 MET A 894 4.690 8.391 7.890 1.00 0.00 H new ATOM 0 HE1 MET A 894 7.652 11.431 7.011 1.00 0.00 H new ATOM 0 HE2 MET A 894 5.898 11.654 6.805 1.00 0.00 H new ATOM 0 HE3 MET A 894 6.727 12.367 8.209 1.00 0.00 H new ATOM 1417 N LYS A 895 3.196 10.492 4.901 1.00 0.00 N ATOM 1418 CA LYS A 895 1.989 11.351 4.955 1.00 0.00 C ATOM 1419 C LYS A 895 0.866 10.643 4.208 1.00 0.00 C ATOM 1420 O LYS A 895 -0.229 10.499 4.710 1.00 0.00 O ATOM 1421 CB LYS A 895 2.408 12.643 4.247 1.00 0.00 C ATOM 1422 CG LYS A 895 1.185 13.515 3.966 1.00 0.00 C ATOM 1423 CD LYS A 895 1.015 14.538 5.092 1.00 0.00 C ATOM 1424 CE LYS A 895 -0.009 14.020 6.105 1.00 0.00 C ATOM 1425 NZ LYS A 895 0.011 15.014 7.213 1.00 0.00 N ATOM 0 H LYS A 895 4.025 10.947 4.520 1.00 0.00 H new ATOM 0 HA LYS A 895 1.631 11.556 5.964 1.00 0.00 H new ATOM 0 HB2 LYS A 895 3.119 13.191 4.866 1.00 0.00 H new ATOM 0 HB3 LYS A 895 2.916 12.405 3.312 1.00 0.00 H new ATOM 0 HG2 LYS A 895 1.302 14.027 3.011 1.00 0.00 H new ATOM 0 HG3 LYS A 895 0.293 12.894 3.888 1.00 0.00 H new ATOM 0 HD2 LYS A 895 1.971 14.715 5.584 1.00 0.00 H new ATOM 0 HD3 LYS A 895 0.686 15.493 4.683 1.00 0.00 H new ATOM 0 HE2 LYS A 895 -1.001 13.944 5.660 1.00 0.00 H new ATOM 0 HE3 LYS A 895 0.257 13.025 6.462 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 -0.667 14.728 7.948 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 0.966 15.059 7.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 -0.253 15.950 6.844 1.00 0.00 H new ATOM 1439 N GLU A 896 1.137 10.180 3.015 1.00 0.00 N ATOM 1440 CA GLU A 896 0.074 9.452 2.256 1.00 0.00 C ATOM 1441 C GLU A 896 -0.475 8.316 3.104 1.00 0.00 C ATOM 1442 O GLU A 896 -1.671 8.235 3.316 1.00 0.00 O ATOM 1443 CB GLU A 896 0.709 8.891 0.979 1.00 0.00 C ATOM 1444 CG GLU A 896 2.051 8.241 1.271 1.00 0.00 C ATOM 1445 CD GLU A 896 1.960 6.727 1.059 1.00 0.00 C ATOM 1446 OE1 GLU A 896 1.021 6.131 1.556 1.00 0.00 O ATOM 1447 OE2 GLU A 896 2.838 6.190 0.406 1.00 0.00 O ATOM 0 H GLU A 896 2.034 10.272 2.538 1.00 0.00 H new ATOM 0 HA GLU A 896 -0.747 10.125 2.007 1.00 0.00 H new ATOM 0 HB2 GLU A 896 0.039 8.160 0.528 1.00 0.00 H new ATOM 0 HB3 GLU A 896 0.841 9.693 0.253 1.00 0.00 H new ATOM 0 HG2 GLU A 896 2.817 8.662 0.620 1.00 0.00 H new ATOM 0 HG3 GLU A 896 2.352 8.455 2.297 1.00 0.00 H new ATOM 1454 N LEU A 897 0.355 7.435 3.616 1.00 0.00 N ATOM 1455 CA LEU A 897 -0.245 6.355 4.447 1.00 0.00 C ATOM 1456 C LEU A 897 -0.740 6.955 5.750 1.00 0.00 C ATOM 1457 O LEU A 897 -1.846 6.716 6.189 1.00 0.00 O ATOM 1458 CB LEU A 897 0.838 5.319 4.711 1.00 0.00 C ATOM 1459 CG LEU A 897 0.227 4.151 5.501 1.00 0.00 C ATOM 1460 CD1 LEU A 897 0.454 4.383 6.996 1.00 0.00 C ATOM 1461 CD2 LEU A 897 -1.288 4.059 5.227 1.00 0.00 C ATOM 0 H LEU A 897 1.368 7.417 3.501 1.00 0.00 H new ATOM 0 HA LEU A 897 -1.088 5.885 3.940 1.00 0.00 H new ATOM 0 HB2 LEU A 897 1.254 4.961 3.770 1.00 0.00 H new ATOM 0 HB3 LEU A 897 1.658 5.766 5.273 1.00 0.00 H new ATOM 0 HG LEU A 897 0.703 3.221 5.189 1.00 0.00 H new ATOM 0 HD11 LEU A 897 0.023 3.557 7.562 1.00 0.00 H new ATOM 0 HD12 LEU A 897 1.524 4.441 7.197 1.00 0.00 H new ATOM 0 HD13 LEU A 897 -0.022 5.316 7.296 1.00 0.00 H new ATOM 0 HD21 LEU A 897 -1.710 3.228 5.792 1.00 0.00 H new ATOM 0 HD22 LEU A 897 -1.770 4.988 5.533 1.00 0.00 H new ATOM 0 HD23 LEU A 897 -1.456 3.896 4.162 1.00 0.00 H new ATOM 1473 N LYS A 898 0.061 7.780 6.334 1.00 0.00 N ATOM 1474 CA LYS A 898 -0.344 8.484 7.582 1.00 0.00 C ATOM 1475 C LYS A 898 -1.705 9.094 7.356 1.00 0.00 C ATOM 1476 O LYS A 898 -2.505 9.258 8.256 1.00 0.00 O ATOM 1477 CB LYS A 898 0.674 9.600 7.735 1.00 0.00 C ATOM 1478 CG LYS A 898 0.322 10.475 8.943 1.00 0.00 C ATOM 1479 CD LYS A 898 0.221 9.607 10.200 1.00 0.00 C ATOM 1480 CE LYS A 898 0.882 10.329 11.380 1.00 0.00 C ATOM 1481 NZ LYS A 898 2.004 9.441 11.796 1.00 0.00 N ATOM 0 H LYS A 898 0.998 8.006 6.000 1.00 0.00 H new ATOM 0 HA LYS A 898 -0.384 7.830 8.453 1.00 0.00 H new ATOM 0 HB2 LYS A 898 1.671 9.178 7.861 1.00 0.00 H new ATOM 0 HB3 LYS A 898 0.697 10.208 6.831 1.00 0.00 H new ATOM 0 HG2 LYS A 898 1.082 11.244 9.081 1.00 0.00 H new ATOM 0 HG3 LYS A 898 -0.623 10.989 8.768 1.00 0.00 H new ATOM 0 HD2 LYS A 898 -0.825 9.400 10.427 1.00 0.00 H new ATOM 0 HD3 LYS A 898 0.707 8.646 10.030 1.00 0.00 H new ATOM 0 HE2 LYS A 898 1.246 11.314 11.086 1.00 0.00 H new ATOM 0 HE3 LYS A 898 0.175 10.481 12.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 898 2.505 9.869 12.601 1.00 0.00 H new ATOM 0 HZ2 LYS A 898 1.627 8.513 12.076 1.00 0.00 H new ATOM 0 HZ3 LYS A 898 2.664 9.320 11.002 1.00 0.00 H new ATOM 1495 N ALA A 899 -1.962 9.400 6.128 1.00 0.00 N ATOM 1496 CA ALA A 899 -3.267 9.974 5.767 1.00 0.00 C ATOM 1497 C ALA A 899 -4.195 8.803 5.477 1.00 0.00 C ATOM 1498 O ALA A 899 -5.378 8.849 5.742 1.00 0.00 O ATOM 1499 CB ALA A 899 -2.991 10.825 4.518 1.00 0.00 C ATOM 0 H ALA A 899 -1.314 9.275 5.350 1.00 0.00 H new ATOM 0 HA ALA A 899 -3.732 10.590 6.537 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -3.918 11.290 4.183 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -2.263 11.599 4.759 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -2.596 10.190 3.725 1.00 0.00 H new ATOM 1505 N ARG A 900 -3.644 7.749 4.916 1.00 0.00 N ATOM 1506 CA ARG A 900 -4.446 6.547 4.575 1.00 0.00 C ATOM 1507 C ARG A 900 -5.590 7.032 3.734 1.00 0.00 C ATOM 1508 O ARG A 900 -6.680 6.493 3.717 1.00 0.00 O ATOM 1509 CB ARG A 900 -4.878 5.931 5.924 1.00 0.00 C ATOM 1510 CG ARG A 900 -6.352 6.228 6.231 1.00 0.00 C ATOM 1511 CD ARG A 900 -6.611 6.044 7.730 1.00 0.00 C ATOM 1512 NE ARG A 900 -7.703 5.036 7.812 1.00 0.00 N ATOM 1513 CZ ARG A 900 -7.464 3.851 8.304 1.00 0.00 C ATOM 1514 NH1 ARG A 900 -6.375 3.214 7.968 1.00 0.00 N ATOM 1515 NH2 ARG A 900 -8.311 3.304 9.132 1.00 0.00 N ATOM 0 H ARG A 900 -2.654 7.679 4.680 1.00 0.00 H new ATOM 0 HA ARG A 900 -3.921 5.779 4.007 1.00 0.00 H new ATOM 0 HB2 ARG A 900 -4.720 4.853 5.900 1.00 0.00 H new ATOM 0 HB3 ARG A 900 -4.252 6.327 6.723 1.00 0.00 H new ATOM 0 HG2 ARG A 900 -6.598 7.247 5.931 1.00 0.00 H new ATOM 0 HG3 ARG A 900 -6.995 5.562 5.656 1.00 0.00 H new ATOM 0 HD2 ARG A 900 -5.715 5.698 8.246 1.00 0.00 H new ATOM 0 HD3 ARG A 900 -6.905 6.983 8.198 1.00 0.00 H new ATOM 0 HE ARG A 900 -8.639 5.272 7.483 1.00 0.00 H new ATOM 0 HH11 ARG A 900 -5.712 3.643 7.322 1.00 0.00 H new ATOM 0 HH12 ARG A 900 -6.187 2.288 8.352 1.00 0.00 H new ATOM 0 HH21 ARG A 900 -9.161 3.803 9.395 1.00 0.00 H new ATOM 0 HH22 ARG A 900 -8.123 2.378 9.516 1.00 0.00 H new ATOM 1529 N LYS A 901 -5.319 8.081 3.032 1.00 0.00 N ATOM 1530 CA LYS A 901 -6.356 8.665 2.182 1.00 0.00 C ATOM 1531 C LYS A 901 -5.995 8.461 0.724 1.00 0.00 C ATOM 1532 O LYS A 901 -6.830 8.559 -0.149 1.00 0.00 O ATOM 1533 CB LYS A 901 -6.383 10.152 2.538 1.00 0.00 C ATOM 1534 CG LYS A 901 -7.491 10.849 1.744 1.00 0.00 C ATOM 1535 CD LYS A 901 -6.885 11.547 0.524 1.00 0.00 C ATOM 1536 CE LYS A 901 -7.672 12.824 0.223 1.00 0.00 C ATOM 1537 NZ LYS A 901 -6.893 13.917 0.872 1.00 0.00 N ATOM 0 H LYS A 901 -4.417 8.558 3.014 1.00 0.00 H new ATOM 0 HA LYS A 901 -7.332 8.205 2.337 1.00 0.00 H new ATOM 0 HB2 LYS A 901 -6.554 10.277 3.607 1.00 0.00 H new ATOM 0 HB3 LYS A 901 -5.419 10.608 2.313 1.00 0.00 H new ATOM 0 HG2 LYS A 901 -8.238 10.121 1.426 1.00 0.00 H new ATOM 0 HG3 LYS A 901 -8.003 11.576 2.375 1.00 0.00 H new ATOM 0 HD2 LYS A 901 -5.839 11.788 0.712 1.00 0.00 H new ATOM 0 HD3 LYS A 901 -6.909 10.881 -0.338 1.00 0.00 H new ATOM 0 HE2 LYS A 901 -7.763 12.988 -0.851 1.00 0.00 H new ATOM 0 HE3 LYS A 901 -8.684 12.768 0.624 1.00 0.00 H new ATOM 0 HZ1 LYS A 901 -7.370 14.827 0.710 1.00 0.00 H new ATOM 0 HZ2 LYS A 901 -6.828 13.737 1.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 901 -5.936 13.950 0.465 1.00 0.00 H new ATOM 1551 N ILE A 902 -4.748 8.184 0.462 1.00 0.00 N ATOM 1552 CA ILE A 902 -4.305 7.983 -0.957 1.00 0.00 C ATOM 1553 C ILE A 902 -5.170 6.946 -1.698 1.00 0.00 C ATOM 1554 O ILE A 902 -4.991 5.759 -1.520 1.00 0.00 O ATOM 1555 CB ILE A 902 -2.874 7.481 -0.837 1.00 0.00 C ATOM 1556 CG1 ILE A 902 -2.865 6.198 0.026 1.00 0.00 C ATOM 1557 CG2 ILE A 902 -2.028 8.593 -0.208 1.00 0.00 C ATOM 1558 CD1 ILE A 902 -1.593 6.107 0.868 1.00 0.00 C ATOM 0 H ILE A 902 -4.014 8.087 1.163 1.00 0.00 H new ATOM 0 HA ILE A 902 -4.394 8.904 -1.533 1.00 0.00 H new ATOM 0 HB ILE A 902 -2.455 7.233 -1.812 1.00 0.00 H new ATOM 0 HG12 ILE A 902 -3.738 6.190 0.679 1.00 0.00 H new ATOM 0 HG13 ILE A 902 -2.941 5.322 -0.619 1.00 0.00 H new ATOM 0 HG21 ILE A 902 -0.996 8.255 -0.112 1.00 0.00 H new ATOM 0 HG22 ILE A 902 -2.062 9.479 -0.842 1.00 0.00 H new ATOM 0 HG23 ILE A 902 -2.423 8.837 0.778 1.00 0.00 H new ATOM 0 HD11 ILE A 902 -1.616 5.195 1.464 1.00 0.00 H new ATOM 0 HD12 ILE A 902 -0.723 6.090 0.212 1.00 0.00 H new ATOM 0 HD13 ILE A 902 -1.532 6.971 1.530 1.00 0.00 H new ATOM 1570 N PRO A 903 -6.074 7.422 -2.530 1.00 0.00 N ATOM 1571 CA PRO A 903 -6.942 6.511 -3.315 1.00 0.00 C ATOM 1572 C PRO A 903 -6.158 5.990 -4.519 1.00 0.00 C ATOM 1573 O PRO A 903 -5.982 6.705 -5.487 1.00 0.00 O ATOM 1574 CB PRO A 903 -8.051 7.457 -3.795 1.00 0.00 C ATOM 1575 CG PRO A 903 -7.736 8.876 -3.278 1.00 0.00 C ATOM 1576 CD PRO A 903 -6.303 8.871 -2.732 1.00 0.00 C ATOM 0 HA PRO A 903 -7.307 5.647 -2.760 1.00 0.00 H new ATOM 0 HB2 PRO A 903 -8.108 7.454 -4.884 1.00 0.00 H new ATOM 0 HB3 PRO A 903 -9.020 7.124 -3.424 1.00 0.00 H new ATOM 0 HG2 PRO A 903 -7.836 9.606 -4.082 1.00 0.00 H new ATOM 0 HG3 PRO A 903 -8.441 9.163 -2.498 1.00 0.00 H new ATOM 0 HD2 PRO A 903 -5.593 9.305 -3.436 1.00 0.00 H new ATOM 0 HD3 PRO A 903 -6.215 9.434 -1.803 1.00 0.00 H new ATOM 1583 N ILE A 904 -5.675 4.774 -4.494 1.00 0.00 N ATOM 1584 CA ILE A 904 -4.918 4.301 -5.671 1.00 0.00 C ATOM 1585 C ILE A 904 -4.887 2.779 -5.781 1.00 0.00 C ATOM 1586 O ILE A 904 -4.875 2.051 -4.809 1.00 0.00 O ATOM 1587 CB ILE A 904 -3.518 4.922 -5.530 1.00 0.00 C ATOM 1588 CG1 ILE A 904 -3.330 5.958 -6.639 1.00 0.00 C ATOM 1589 CG2 ILE A 904 -2.432 3.859 -5.664 1.00 0.00 C ATOM 1590 CD1 ILE A 904 -2.625 7.193 -6.077 1.00 0.00 C ATOM 0 H ILE A 904 -5.773 4.109 -3.726 1.00 0.00 H new ATOM 0 HA ILE A 904 -5.394 4.612 -6.601 1.00 0.00 H new ATOM 0 HB ILE A 904 -3.436 5.382 -4.545 1.00 0.00 H new ATOM 0 HG12 ILE A 904 -2.743 5.531 -7.453 1.00 0.00 H new ATOM 0 HG13 ILE A 904 -4.297 6.238 -7.056 1.00 0.00 H new ATOM 0 HG21 ILE A 904 -1.452 4.325 -5.560 1.00 0.00 H new ATOM 0 HG22 ILE A 904 -2.561 3.107 -4.885 1.00 0.00 H new ATOM 0 HG23 ILE A 904 -2.506 3.384 -6.642 1.00 0.00 H new ATOM 0 HD11 ILE A 904 -2.493 7.929 -6.870 1.00 0.00 H new ATOM 0 HD12 ILE A 904 -3.228 7.625 -5.278 1.00 0.00 H new ATOM 0 HD13 ILE A 904 -1.650 6.907 -5.681 1.00 0.00 H new ATOM 1602 N ILE A 905 -4.867 2.321 -6.998 1.00 0.00 N ATOM 1603 CA ILE A 905 -4.826 0.871 -7.291 1.00 0.00 C ATOM 1604 C ILE A 905 -3.371 0.379 -7.233 1.00 0.00 C ATOM 1605 O ILE A 905 -2.448 1.125 -7.497 1.00 0.00 O ATOM 1606 CB ILE A 905 -5.375 0.754 -8.717 1.00 0.00 C ATOM 1607 CG1 ILE A 905 -5.468 -0.721 -9.110 1.00 0.00 C ATOM 1608 CG2 ILE A 905 -4.453 1.482 -9.702 1.00 0.00 C ATOM 1609 CD1 ILE A 905 -6.908 -1.046 -9.497 1.00 0.00 C ATOM 0 H ILE A 905 -4.878 2.915 -7.827 1.00 0.00 H new ATOM 0 HA ILE A 905 -5.399 0.275 -6.581 1.00 0.00 H new ATOM 0 HB ILE A 905 -6.365 1.209 -8.751 1.00 0.00 H new ATOM 0 HG12 ILE A 905 -4.798 -0.931 -9.944 1.00 0.00 H new ATOM 0 HG13 ILE A 905 -5.150 -1.352 -8.280 1.00 0.00 H new ATOM 0 HG21 ILE A 905 -4.854 1.391 -10.711 1.00 0.00 H new ATOM 0 HG22 ILE A 905 -4.390 2.536 -9.430 1.00 0.00 H new ATOM 0 HG23 ILE A 905 -3.458 1.038 -9.666 1.00 0.00 H new ATOM 0 HD11 ILE A 905 -6.981 -2.097 -9.778 1.00 0.00 H new ATOM 0 HD12 ILE A 905 -7.565 -0.851 -8.650 1.00 0.00 H new ATOM 0 HD13 ILE A 905 -7.208 -0.423 -10.340 1.00 0.00 H new ATOM 1621 N ILE A 906 -3.162 -0.863 -6.904 1.00 0.00 N ATOM 1622 CA ILE A 906 -1.776 -1.407 -6.838 1.00 0.00 C ATOM 1623 C ILE A 906 -1.736 -2.754 -7.561 1.00 0.00 C ATOM 1624 O ILE A 906 -2.605 -3.580 -7.387 1.00 0.00 O ATOM 1625 CB ILE A 906 -1.474 -1.624 -5.347 1.00 0.00 C ATOM 1626 CG1 ILE A 906 -2.068 -0.489 -4.503 1.00 0.00 C ATOM 1627 CG2 ILE A 906 0.040 -1.670 -5.137 1.00 0.00 C ATOM 1628 CD1 ILE A 906 -1.508 0.853 -4.963 1.00 0.00 C ATOM 0 H ILE A 906 -3.898 -1.532 -6.676 1.00 0.00 H new ATOM 0 HA ILE A 906 -1.053 -0.735 -7.301 1.00 0.00 H new ATOM 0 HB ILE A 906 -1.924 -2.566 -5.034 1.00 0.00 H new ATOM 0 HG12 ILE A 906 -3.154 -0.489 -4.593 1.00 0.00 H new ATOM 0 HG13 ILE A 906 -1.835 -0.648 -3.450 1.00 0.00 H new ATOM 0 HG21 ILE A 906 0.256 -1.824 -4.080 1.00 0.00 H new ATOM 0 HG22 ILE A 906 0.463 -2.490 -5.717 1.00 0.00 H new ATOM 0 HG23 ILE A 906 0.481 -0.729 -5.464 1.00 0.00 H new ATOM 0 HD11 ILE A 906 -1.936 1.652 -4.358 1.00 0.00 H new ATOM 0 HD12 ILE A 906 -0.424 0.853 -4.850 1.00 0.00 H new ATOM 0 HD13 ILE A 906 -1.764 1.014 -6.010 1.00 0.00 H new ATOM 1640 N ARG A 907 -0.748 -2.995 -8.367 1.00 0.00 N ATOM 1641 CA ARG A 907 -0.711 -4.315 -9.076 1.00 0.00 C ATOM 1642 C ARG A 907 0.154 -5.302 -8.332 1.00 0.00 C ATOM 1643 O ARG A 907 1.360 -5.215 -8.347 1.00 0.00 O ATOM 1644 CB ARG A 907 -0.111 -4.053 -10.440 1.00 0.00 C ATOM 1645 CG ARG A 907 -1.168 -3.400 -11.324 1.00 0.00 C ATOM 1646 CD ARG A 907 -1.518 -2.002 -10.797 1.00 0.00 C ATOM 1647 NE ARG A 907 -1.671 -1.159 -12.017 1.00 0.00 N ATOM 1648 CZ ARG A 907 -2.706 -1.316 -12.797 1.00 0.00 C ATOM 1649 NH1 ARG A 907 -2.590 -1.989 -13.909 1.00 0.00 N ATOM 1650 NH2 ARG A 907 -3.857 -0.800 -12.465 1.00 0.00 N ATOM 0 H ARG A 907 0.023 -2.358 -8.569 1.00 0.00 H new ATOM 0 HA ARG A 907 -1.713 -4.739 -9.145 1.00 0.00 H new ATOM 0 HB2 ARG A 907 0.760 -3.404 -10.351 1.00 0.00 H new ATOM 0 HB3 ARG A 907 0.231 -4.986 -10.887 1.00 0.00 H new ATOM 0 HG2 ARG A 907 -0.801 -3.328 -12.348 1.00 0.00 H new ATOM 0 HG3 ARG A 907 -2.064 -4.021 -11.349 1.00 0.00 H new ATOM 0 HD2 ARG A 907 -2.437 -2.019 -10.211 1.00 0.00 H new ATOM 0 HD3 ARG A 907 -0.733 -1.617 -10.147 1.00 0.00 H new ATOM 0 HE ARG A 907 -0.965 -0.458 -12.243 1.00 0.00 H new ATOM 0 HH11 ARG A 907 -1.690 -2.393 -14.169 1.00 0.00 H new ATOM 0 HH12 ARG A 907 -3.399 -2.111 -14.518 1.00 0.00 H new ATOM 0 HH21 ARG A 907 -3.948 -0.274 -11.596 1.00 0.00 H new ATOM 0 HH22 ARG A 907 -4.666 -0.923 -13.074 1.00 0.00 H new ATOM 1664 N ARG A 908 -0.453 -6.265 -7.716 1.00 0.00 N ATOM 1665 CA ARG A 908 0.355 -7.286 -6.999 1.00 0.00 C ATOM 1666 C ARG A 908 0.642 -8.449 -7.956 1.00 0.00 C ATOM 1667 O ARG A 908 -0.120 -9.392 -8.039 1.00 0.00 O ATOM 1668 CB ARG A 908 -0.472 -7.802 -5.792 1.00 0.00 C ATOM 1669 CG ARG A 908 -1.540 -6.791 -5.315 1.00 0.00 C ATOM 1670 CD ARG A 908 -2.128 -7.252 -3.952 1.00 0.00 C ATOM 1671 NE ARG A 908 -0.948 -7.388 -3.052 1.00 0.00 N ATOM 1672 CZ ARG A 908 -1.039 -8.093 -1.957 1.00 0.00 C ATOM 1673 NH1 ARG A 908 -2.118 -8.029 -1.226 1.00 0.00 N ATOM 1674 NH2 ARG A 908 -0.049 -8.862 -1.593 1.00 0.00 N ATOM 0 H ARG A 908 -1.464 -6.393 -7.675 1.00 0.00 H new ATOM 0 HA ARG A 908 1.296 -6.859 -6.652 1.00 0.00 H new ATOM 0 HB2 ARG A 908 -0.961 -8.736 -6.067 1.00 0.00 H new ATOM 0 HB3 ARG A 908 0.203 -8.026 -4.966 1.00 0.00 H new ATOM 0 HG2 ARG A 908 -1.097 -5.800 -5.214 1.00 0.00 H new ATOM 0 HG3 ARG A 908 -2.335 -6.711 -6.056 1.00 0.00 H new ATOM 0 HD2 ARG A 908 -2.840 -6.524 -3.563 1.00 0.00 H new ATOM 0 HD3 ARG A 908 -2.661 -8.198 -4.051 1.00 0.00 H new ATOM 0 HE ARG A 908 -0.069 -6.930 -3.292 1.00 0.00 H new ATOM 0 HH11 ARG A 908 -2.891 -7.428 -1.510 1.00 0.00 H new ATOM 0 HH12 ARG A 908 -2.188 -8.580 -0.371 1.00 0.00 H new ATOM 0 HH21 ARG A 908 0.795 -8.912 -2.164 1.00 0.00 H new ATOM 0 HH22 ARG A 908 -0.119 -9.413 -0.738 1.00 0.00 H new ATOM 1688 N TYR A 909 1.752 -8.412 -8.651 1.00 0.00 N ATOM 1689 CA TYR A 909 2.093 -9.528 -9.551 1.00 0.00 C ATOM 1690 C TYR A 909 2.752 -10.601 -8.710 1.00 0.00 C ATOM 1691 O TYR A 909 2.942 -10.438 -7.521 1.00 0.00 O ATOM 1692 CB TYR A 909 3.099 -9.027 -10.597 1.00 0.00 C ATOM 1693 CG TYR A 909 2.848 -7.591 -11.007 1.00 0.00 C ATOM 1694 CD1 TYR A 909 3.440 -6.537 -10.303 1.00 0.00 C ATOM 1695 CD2 TYR A 909 2.058 -7.318 -12.124 1.00 0.00 C ATOM 1696 CE1 TYR A 909 3.243 -5.225 -10.709 1.00 0.00 C ATOM 1697 CE2 TYR A 909 1.855 -6.004 -12.530 1.00 0.00 C ATOM 1698 CZ TYR A 909 2.446 -4.952 -11.829 1.00 0.00 C ATOM 1699 OH TYR A 909 2.245 -3.654 -12.247 1.00 0.00 O ATOM 0 H TYR A 909 2.430 -7.651 -8.626 1.00 0.00 H new ATOM 0 HA TYR A 909 1.206 -9.915 -10.052 1.00 0.00 H new ATOM 0 HB2 TYR A 909 4.109 -9.115 -10.196 1.00 0.00 H new ATOM 0 HB3 TYR A 909 3.050 -9.666 -11.478 1.00 0.00 H new ATOM 0 HD1 TYR A 909 4.054 -6.746 -9.439 1.00 0.00 H new ATOM 0 HD2 TYR A 909 1.603 -8.129 -12.674 1.00 0.00 H new ATOM 0 HE1 TYR A 909 3.703 -4.415 -10.163 1.00 0.00 H new ATOM 0 HE2 TYR A 909 1.237 -5.797 -13.391 1.00 0.00 H new ATOM 0 HH TYR A 909 1.668 -3.651 -13.039 1.00 0.00 H new ATOM 1709 N LEU A 910 3.107 -11.687 -9.302 1.00 0.00 N ATOM 1710 CA LEU A 910 3.751 -12.761 -8.527 1.00 0.00 C ATOM 1711 C LEU A 910 4.948 -13.344 -9.275 1.00 0.00 C ATOM 1712 O LEU A 910 4.782 -14.004 -10.282 1.00 0.00 O ATOM 1713 CB LEU A 910 2.650 -13.805 -8.360 1.00 0.00 C ATOM 1714 CG LEU A 910 1.467 -13.214 -7.588 1.00 0.00 C ATOM 1715 CD1 LEU A 910 0.421 -14.307 -7.361 1.00 0.00 C ATOM 1716 CD2 LEU A 910 1.935 -12.667 -6.236 1.00 0.00 C ATOM 0 H LEU A 910 2.979 -11.881 -10.295 1.00 0.00 H new ATOM 0 HA LEU A 910 4.145 -12.407 -7.574 1.00 0.00 H new ATOM 0 HB2 LEU A 910 2.317 -14.152 -9.338 1.00 0.00 H new ATOM 0 HB3 LEU A 910 3.041 -14.674 -7.830 1.00 0.00 H new ATOM 0 HG LEU A 910 1.034 -12.398 -8.166 1.00 0.00 H new ATOM 0 HD11 LEU A 910 -0.424 -13.893 -6.812 1.00 0.00 H new ATOM 0 HD12 LEU A 910 0.077 -14.687 -8.323 1.00 0.00 H new ATOM 0 HD13 LEU A 910 0.864 -15.121 -6.786 1.00 0.00 H new ATOM 0 HD21 LEU A 910 1.084 -12.250 -5.698 1.00 0.00 H new ATOM 0 HD22 LEU A 910 2.375 -13.474 -5.650 1.00 0.00 H new ATOM 0 HD23 LEU A 910 2.680 -11.888 -6.397 1.00 0.00 H new ATOM 1728 N PRO A 911 6.124 -13.124 -8.732 1.00 0.00 N ATOM 1729 CA PRO A 911 7.348 -13.687 -9.337 1.00 0.00 C ATOM 1730 C PRO A 911 7.241 -15.211 -9.293 1.00 0.00 C ATOM 1731 O PRO A 911 8.006 -15.925 -9.912 1.00 0.00 O ATOM 1732 CB PRO A 911 8.453 -13.190 -8.399 1.00 0.00 C ATOM 1733 CG PRO A 911 7.806 -12.363 -7.273 1.00 0.00 C ATOM 1734 CD PRO A 911 6.290 -12.314 -7.506 1.00 0.00 C ATOM 0 HA PRO A 911 7.523 -13.399 -10.374 1.00 0.00 H new ATOM 0 HB2 PRO A 911 9.002 -14.034 -7.981 1.00 0.00 H new ATOM 0 HB3 PRO A 911 9.172 -12.583 -8.949 1.00 0.00 H new ATOM 0 HG2 PRO A 911 8.025 -12.809 -6.303 1.00 0.00 H new ATOM 0 HG3 PRO A 911 8.219 -11.354 -7.260 1.00 0.00 H new ATOM 0 HD2 PRO A 911 5.737 -12.734 -6.665 1.00 0.00 H new ATOM 0 HD3 PRO A 911 5.934 -11.293 -7.644 1.00 0.00 H new ATOM 1741 N ASP A 912 6.271 -15.705 -8.563 1.00 0.00 N ATOM 1742 CA ASP A 912 6.071 -17.172 -8.463 1.00 0.00 C ATOM 1743 C ASP A 912 5.434 -17.672 -9.750 1.00 0.00 C ATOM 1744 O ASP A 912 5.722 -18.756 -10.218 1.00 0.00 O ATOM 1745 CB ASP A 912 5.110 -17.361 -7.290 1.00 0.00 C ATOM 1746 CG ASP A 912 5.906 -17.661 -6.018 1.00 0.00 C ATOM 1747 OD1 ASP A 912 6.982 -17.105 -5.872 1.00 0.00 O ATOM 1748 OD2 ASP A 912 5.426 -18.442 -5.213 1.00 0.00 O ATOM 0 H ASP A 912 5.607 -15.144 -8.030 1.00 0.00 H new ATOM 0 HA ASP A 912 7.002 -17.719 -8.314 1.00 0.00 H new ATOM 0 HB2 ASP A 912 4.508 -16.463 -7.151 1.00 0.00 H new ATOM 0 HB3 ASP A 912 4.420 -18.178 -7.500 1.00 0.00 H new ATOM 1753 N GLY A 913 4.570 -16.883 -10.332 1.00 0.00 N ATOM 1754 CA GLY A 913 3.923 -17.327 -11.604 1.00 0.00 C ATOM 1755 C GLY A 913 2.453 -16.955 -11.590 1.00 0.00 C ATOM 1756 O GLY A 913 1.578 -17.754 -11.859 1.00 0.00 O ATOM 0 H GLY A 913 4.287 -15.965 -9.990 1.00 0.00 H new ATOM 0 HA2 GLY A 913 4.417 -16.861 -12.456 1.00 0.00 H new ATOM 0 HA3 GLY A 913 4.034 -18.405 -11.722 1.00 0.00 H new ATOM 1760 N SER A 914 2.197 -15.734 -11.282 1.00 0.00 N ATOM 1761 CA SER A 914 0.801 -15.226 -11.237 1.00 0.00 C ATOM 1762 C SER A 914 0.842 -13.718 -11.109 1.00 0.00 C ATOM 1763 O SER A 914 1.881 -13.106 -11.258 1.00 0.00 O ATOM 1764 CB SER A 914 0.180 -15.856 -9.996 1.00 0.00 C ATOM 1765 OG SER A 914 -0.471 -17.066 -10.359 1.00 0.00 O ATOM 0 H SER A 914 2.909 -15.040 -11.052 1.00 0.00 H new ATOM 0 HA SER A 914 0.227 -15.474 -12.130 1.00 0.00 H new ATOM 0 HB2 SER A 914 0.950 -16.054 -9.250 1.00 0.00 H new ATOM 0 HB3 SER A 914 -0.533 -15.168 -9.543 1.00 0.00 H new ATOM 0 HG SER A 914 0.015 -17.491 -11.096 1.00 0.00 H new ATOM 1771 N TYR A 915 -0.268 -13.115 -10.821 1.00 0.00 N ATOM 1772 CA TYR A 915 -0.294 -11.644 -10.670 1.00 0.00 C ATOM 1773 C TYR A 915 -1.752 -11.161 -10.584 1.00 0.00 C ATOM 1774 O TYR A 915 -2.647 -11.753 -11.154 1.00 0.00 O ATOM 1775 CB TYR A 915 0.397 -11.094 -11.939 1.00 0.00 C ATOM 1776 CG TYR A 915 -0.303 -9.854 -12.469 1.00 0.00 C ATOM 1777 CD1 TYR A 915 -0.452 -8.716 -11.662 1.00 0.00 C ATOM 1778 CD2 TYR A 915 -0.789 -9.841 -13.783 1.00 0.00 C ATOM 1779 CE1 TYR A 915 -1.084 -7.575 -12.168 1.00 0.00 C ATOM 1780 CE2 TYR A 915 -1.418 -8.697 -14.288 1.00 0.00 C ATOM 1781 CZ TYR A 915 -1.565 -7.566 -13.482 1.00 0.00 C ATOM 1782 OH TYR A 915 -2.187 -6.439 -13.981 1.00 0.00 O ATOM 0 H TYR A 915 -1.165 -13.581 -10.683 1.00 0.00 H new ATOM 0 HA TYR A 915 0.210 -11.305 -9.765 1.00 0.00 H new ATOM 0 HB2 TYR A 915 1.436 -10.856 -11.713 1.00 0.00 H new ATOM 0 HB3 TYR A 915 0.407 -11.864 -12.711 1.00 0.00 H new ATOM 0 HD1 TYR A 915 -0.078 -8.721 -10.649 1.00 0.00 H new ATOM 0 HD2 TYR A 915 -0.678 -10.715 -14.407 1.00 0.00 H new ATOM 0 HE1 TYR A 915 -1.201 -6.701 -11.544 1.00 0.00 H new ATOM 0 HE2 TYR A 915 -1.790 -8.689 -15.302 1.00 0.00 H new ATOM 0 HH TYR A 915 -2.460 -6.600 -14.908 1.00 0.00 H new ATOM 1792 N GLU A 916 -1.983 -10.079 -9.906 1.00 0.00 N ATOM 1793 CA GLU A 916 -3.364 -9.524 -9.802 1.00 0.00 C ATOM 1794 C GLU A 916 -3.292 -8.002 -9.671 1.00 0.00 C ATOM 1795 O GLU A 916 -2.400 -7.466 -9.043 1.00 0.00 O ATOM 1796 CB GLU A 916 -3.963 -10.146 -8.545 1.00 0.00 C ATOM 1797 CG GLU A 916 -5.353 -10.694 -8.866 1.00 0.00 C ATOM 1798 CD GLU A 916 -6.405 -9.623 -8.571 1.00 0.00 C ATOM 1799 OE1 GLU A 916 -6.150 -8.470 -8.879 1.00 0.00 O ATOM 1800 OE2 GLU A 916 -7.447 -9.973 -8.043 1.00 0.00 O ATOM 0 H GLU A 916 -1.268 -9.545 -9.411 1.00 0.00 H new ATOM 0 HA GLU A 916 -3.970 -9.749 -10.680 1.00 0.00 H new ATOM 0 HB2 GLU A 916 -3.320 -10.946 -8.179 1.00 0.00 H new ATOM 0 HB3 GLU A 916 -4.027 -9.401 -7.752 1.00 0.00 H new ATOM 0 HG2 GLU A 916 -5.405 -10.991 -9.913 1.00 0.00 H new ATOM 0 HG3 GLU A 916 -5.550 -11.586 -8.271 1.00 0.00 H new ATOM 1807 N ASP A 917 -4.228 -7.303 -10.249 1.00 0.00 N ATOM 1808 CA ASP A 917 -4.217 -5.822 -10.144 1.00 0.00 C ATOM 1809 C ASP A 917 -5.449 -5.350 -9.406 1.00 0.00 C ATOM 1810 O ASP A 917 -6.491 -5.975 -9.421 1.00 0.00 O ATOM 1811 CB ASP A 917 -4.191 -5.288 -11.566 1.00 0.00 C ATOM 1812 CG ASP A 917 -5.474 -5.664 -12.313 1.00 0.00 C ATOM 1813 OD1 ASP A 917 -6.191 -6.525 -11.829 1.00 0.00 O ATOM 1814 OD2 ASP A 917 -5.719 -5.081 -13.357 1.00 0.00 O ATOM 0 H ASP A 917 -4.999 -7.695 -10.789 1.00 0.00 H new ATOM 0 HA ASP A 917 -3.352 -5.463 -9.587 1.00 0.00 H new ATOM 0 HB2 ASP A 917 -4.079 -4.204 -11.550 1.00 0.00 H new ATOM 0 HB3 ASP A 917 -3.326 -5.690 -12.094 1.00 0.00 H new ATOM 1819 N TRP A 918 -5.283 -4.246 -8.757 1.00 0.00 N ATOM 1820 CA TRP A 918 -6.330 -3.586 -7.919 1.00 0.00 C ATOM 1821 C TRP A 918 -5.661 -3.073 -6.661 1.00 0.00 C ATOM 1822 O TRP A 918 -4.495 -3.312 -6.440 1.00 0.00 O ATOM 1823 CB TRP A 918 -7.447 -4.568 -7.553 1.00 0.00 C ATOM 1824 CG TRP A 918 -6.976 -5.884 -6.998 1.00 0.00 C ATOM 1825 CD1 TRP A 918 -5.715 -6.380 -6.932 1.00 0.00 C ATOM 1826 CD2 TRP A 918 -7.824 -6.869 -6.400 1.00 0.00 C ATOM 1827 NE1 TRP A 918 -5.775 -7.674 -6.429 1.00 0.00 N ATOM 1828 CE2 TRP A 918 -7.068 -7.999 -6.043 1.00 0.00 C ATOM 1829 CE3 TRP A 918 -9.189 -6.863 -6.155 1.00 0.00 C ATOM 1830 CZ2 TRP A 918 -7.674 -9.111 -5.455 1.00 0.00 C ATOM 1831 CZ3 TRP A 918 -9.805 -7.942 -5.551 1.00 0.00 C ATOM 1832 CH2 TRP A 918 -9.056 -9.079 -5.196 1.00 0.00 C ATOM 0 H TRP A 918 -4.402 -3.732 -8.770 1.00 0.00 H new ATOM 0 HA TRP A 918 -6.784 -2.768 -8.479 1.00 0.00 H new ATOM 0 HB2 TRP A 918 -8.102 -4.095 -6.821 1.00 0.00 H new ATOM 0 HB3 TRP A 918 -8.048 -4.759 -8.442 1.00 0.00 H new ATOM 0 HD1 TRP A 918 -4.816 -5.857 -7.222 1.00 0.00 H new ATOM 0 HE1 TRP A 918 -4.975 -8.302 -6.353 1.00 0.00 H new ATOM 0 HE3 TRP A 918 -9.778 -6.004 -6.440 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 -7.090 -9.983 -5.203 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 -10.866 -7.913 -5.350 1.00 0.00 H new ATOM 0 HH2 TRP A 918 -9.540 -9.923 -4.727 1.00 0.00 H new ATOM 1843 N GLY A 919 -6.358 -2.360 -5.837 1.00 0.00 N ATOM 1844 CA GLY A 919 -5.682 -1.842 -4.625 1.00 0.00 C ATOM 1845 C GLY A 919 -6.683 -1.258 -3.668 1.00 0.00 C ATOM 1846 O GLY A 919 -7.082 -1.872 -2.703 1.00 0.00 O ATOM 0 H GLY A 919 -7.343 -2.116 -5.942 1.00 0.00 H new ATOM 0 HA2 GLY A 919 -5.132 -2.647 -4.137 1.00 0.00 H new ATOM 0 HA3 GLY A 919 -4.953 -1.082 -4.906 1.00 0.00 H new ATOM 1850 N VAL A 920 -7.095 -0.071 -3.925 1.00 0.00 N ATOM 1851 CA VAL A 920 -8.080 0.554 -3.026 1.00 0.00 C ATOM 1852 C VAL A 920 -9.365 0.767 -3.798 1.00 0.00 C ATOM 1853 O VAL A 920 -10.372 1.177 -3.253 1.00 0.00 O ATOM 1854 CB VAL A 920 -7.449 1.872 -2.603 1.00 0.00 C ATOM 1855 CG1 VAL A 920 -8.396 2.622 -1.664 1.00 0.00 C ATOM 1856 CG2 VAL A 920 -6.136 1.573 -1.879 1.00 0.00 C ATOM 0 H VAL A 920 -6.796 0.498 -4.717 1.00 0.00 H new ATOM 0 HA VAL A 920 -8.324 -0.050 -2.152 1.00 0.00 H new ATOM 0 HB VAL A 920 -7.259 2.491 -3.480 1.00 0.00 H new ATOM 0 HG11 VAL A 920 -7.939 3.565 -1.364 1.00 0.00 H new ATOM 0 HG12 VAL A 920 -9.336 2.821 -2.178 1.00 0.00 H new ATOM 0 HG13 VAL A 920 -8.588 2.014 -0.780 1.00 0.00 H new ATOM 0 HG21 VAL A 920 -5.670 2.508 -1.569 1.00 0.00 H new ATOM 0 HG22 VAL A 920 -6.336 0.959 -1.001 1.00 0.00 H new ATOM 0 HG23 VAL A 920 -5.464 1.038 -2.550 1.00 0.00 H new ATOM 1866 N ASP A 921 -9.346 0.468 -5.071 1.00 0.00 N ATOM 1867 CA ASP A 921 -10.586 0.640 -5.864 1.00 0.00 C ATOM 1868 C ASP A 921 -11.432 -0.618 -5.763 1.00 0.00 C ATOM 1869 O ASP A 921 -12.626 -0.607 -5.989 1.00 0.00 O ATOM 1870 CB ASP A 921 -10.130 0.898 -7.299 1.00 0.00 C ATOM 1871 CG ASP A 921 -11.354 1.120 -8.189 1.00 0.00 C ATOM 1872 OD1 ASP A 921 -11.914 0.139 -8.649 1.00 0.00 O ATOM 1873 OD2 ASP A 921 -11.713 2.268 -8.393 1.00 0.00 O ATOM 0 H ASP A 921 -8.537 0.118 -5.584 1.00 0.00 H new ATOM 0 HA ASP A 921 -11.201 1.465 -5.505 1.00 0.00 H new ATOM 0 HB2 ASP A 921 -9.478 1.771 -7.334 1.00 0.00 H new ATOM 0 HB3 ASP A 921 -9.549 0.052 -7.665 1.00 0.00 H new ATOM 1878 N GLU A 922 -10.809 -1.700 -5.428 1.00 0.00 N ATOM 1879 CA GLU A 922 -11.536 -2.977 -5.303 1.00 0.00 C ATOM 1880 C GLU A 922 -11.276 -3.584 -3.920 1.00 0.00 C ATOM 1881 O GLU A 922 -11.964 -4.487 -3.483 1.00 0.00 O ATOM 1882 CB GLU A 922 -10.916 -3.819 -6.404 1.00 0.00 C ATOM 1883 CG GLU A 922 -11.873 -4.948 -6.795 1.00 0.00 C ATOM 1884 CD GLU A 922 -13.134 -4.353 -7.426 1.00 0.00 C ATOM 1885 OE1 GLU A 922 -12.997 -3.524 -8.310 1.00 0.00 O ATOM 1886 OE2 GLU A 922 -14.216 -4.739 -7.014 1.00 0.00 O ATOM 0 H GLU A 922 -9.809 -1.754 -5.232 1.00 0.00 H new ATOM 0 HA GLU A 922 -12.619 -2.891 -5.397 1.00 0.00 H new ATOM 0 HB2 GLU A 922 -10.699 -3.196 -7.272 1.00 0.00 H new ATOM 0 HB3 GLU A 922 -9.967 -4.235 -6.066 1.00 0.00 H new ATOM 0 HG2 GLU A 922 -11.386 -5.624 -7.498 1.00 0.00 H new ATOM 0 HG3 GLU A 922 -12.136 -5.537 -5.916 1.00 0.00 H new ATOM 1893 N LEU A 923 -10.274 -3.093 -3.237 1.00 0.00 N ATOM 1894 CA LEU A 923 -9.941 -3.636 -1.883 1.00 0.00 C ATOM 1895 C LEU A 923 -9.333 -2.570 -0.946 1.00 0.00 C ATOM 1896 O LEU A 923 -9.629 -1.394 -1.017 1.00 0.00 O ATOM 1897 CB LEU A 923 -8.958 -4.793 -2.123 1.00 0.00 C ATOM 1898 CG LEU A 923 -7.909 -4.402 -3.161 1.00 0.00 C ATOM 1899 CD1 LEU A 923 -6.502 -4.428 -2.580 1.00 0.00 C ATOM 1900 CD2 LEU A 923 -7.964 -5.406 -4.260 1.00 0.00 C ATOM 0 H LEU A 923 -9.669 -2.337 -3.559 1.00 0.00 H new ATOM 0 HA LEU A 923 -10.846 -3.971 -1.376 1.00 0.00 H new ATOM 0 HB2 LEU A 923 -8.468 -5.061 -1.187 1.00 0.00 H new ATOM 0 HB3 LEU A 923 -9.502 -5.675 -2.462 1.00 0.00 H new ATOM 0 HG LEU A 923 -8.123 -3.391 -3.507 1.00 0.00 H new ATOM 0 HD11 LEU A 923 -5.785 -4.144 -3.350 1.00 0.00 H new ATOM 0 HD12 LEU A 923 -6.439 -3.726 -1.749 1.00 0.00 H new ATOM 0 HD13 LEU A 923 -6.274 -5.433 -2.225 1.00 0.00 H new ATOM 0 HD21 LEU A 923 -7.224 -5.154 -5.020 1.00 0.00 H new ATOM 0 HD22 LEU A 923 -7.750 -6.397 -3.859 1.00 0.00 H new ATOM 0 HD23 LEU A 923 -8.958 -5.403 -4.706 1.00 0.00 H new ATOM 1912 N ILE A 924 -8.536 -3.036 -0.031 1.00 0.00 N ATOM 1913 CA ILE A 924 -7.897 -2.186 1.027 1.00 0.00 C ATOM 1914 C ILE A 924 -6.697 -1.389 0.551 1.00 0.00 C ATOM 1915 O ILE A 924 -6.175 -1.569 -0.518 1.00 0.00 O ATOM 1916 CB ILE A 924 -7.485 -3.185 2.124 1.00 0.00 C ATOM 1917 CG1 ILE A 924 -8.615 -3.236 3.129 1.00 0.00 C ATOM 1918 CG2 ILE A 924 -6.169 -2.809 2.824 1.00 0.00 C ATOM 1919 CD1 ILE A 924 -9.677 -4.161 2.560 1.00 0.00 C ATOM 0 H ILE A 924 -8.285 -4.022 0.035 1.00 0.00 H new ATOM 0 HA ILE A 924 -8.597 -1.422 1.366 1.00 0.00 H new ATOM 0 HB ILE A 924 -7.306 -4.157 1.664 1.00 0.00 H new ATOM 0 HG12 ILE A 924 -8.259 -3.604 4.091 1.00 0.00 H new ATOM 0 HG13 ILE A 924 -9.023 -2.240 3.300 1.00 0.00 H new ATOM 0 HG21 ILE A 924 -5.936 -3.553 3.585 1.00 0.00 H new ATOM 0 HG22 ILE A 924 -5.363 -2.776 2.091 1.00 0.00 H new ATOM 0 HG23 ILE A 924 -6.273 -1.831 3.293 1.00 0.00 H new ATOM 0 HD11 ILE A 924 -10.513 -4.226 3.256 1.00 0.00 H new ATOM 0 HD12 ILE A 924 -10.029 -3.768 1.606 1.00 0.00 H new ATOM 0 HD13 ILE A 924 -9.252 -5.153 2.409 1.00 0.00 H new ATOM 1931 N ILE A 925 -6.272 -0.514 1.406 1.00 0.00 N ATOM 1932 CA ILE A 925 -5.074 0.328 1.158 1.00 0.00 C ATOM 1933 C ILE A 925 -3.888 -0.342 1.864 1.00 0.00 C ATOM 1934 O ILE A 925 -3.622 -1.511 1.679 1.00 0.00 O ATOM 1935 CB ILE A 925 -5.424 1.695 1.777 1.00 0.00 C ATOM 1936 CG1 ILE A 925 -5.770 1.524 3.263 1.00 0.00 C ATOM 1937 CG2 ILE A 925 -6.628 2.296 1.046 1.00 0.00 C ATOM 1938 CD1 ILE A 925 -5.080 2.618 4.080 1.00 0.00 C ATOM 0 H ILE A 925 -6.723 -0.339 2.304 1.00 0.00 H new ATOM 0 HA ILE A 925 -4.808 0.447 0.108 1.00 0.00 H new ATOM 0 HB ILE A 925 -4.565 2.359 1.680 1.00 0.00 H new ATOM 0 HG12 ILE A 925 -6.850 1.577 3.404 1.00 0.00 H new ATOM 0 HG13 ILE A 925 -5.451 0.541 3.610 1.00 0.00 H new ATOM 0 HG21 ILE A 925 -6.875 3.263 1.485 1.00 0.00 H new ATOM 0 HG22 ILE A 925 -6.385 2.427 -0.008 1.00 0.00 H new ATOM 0 HG23 ILE A 925 -7.483 1.626 1.141 1.00 0.00 H new ATOM 0 HD11 ILE A 925 -5.327 2.495 5.135 1.00 0.00 H new ATOM 0 HD12 ILE A 925 -4.000 2.544 3.949 1.00 0.00 H new ATOM 0 HD13 ILE A 925 -5.420 3.596 3.739 1.00 0.00 H new ATOM 1950 N THR A 926 -3.192 0.374 2.671 1.00 0.00 N ATOM 1951 CA THR A 926 -2.033 -0.216 3.400 1.00 0.00 C ATOM 1952 C THR A 926 -2.519 -1.307 4.356 1.00 0.00 C ATOM 1953 O THR A 926 -1.848 -2.294 4.583 1.00 0.00 O ATOM 1954 CB THR A 926 -1.458 0.951 4.201 1.00 0.00 C ATOM 1955 OG1 THR A 926 -1.154 2.023 3.320 1.00 0.00 O ATOM 1956 CG2 THR A 926 -0.196 0.501 4.940 1.00 0.00 C ATOM 0 H THR A 926 -3.368 1.359 2.869 1.00 0.00 H new ATOM 0 HA THR A 926 -1.303 -0.669 2.729 1.00 0.00 H new ATOM 0 HB THR A 926 -2.192 1.287 4.934 1.00 0.00 H new ATOM 0 HG1 THR A 926 -1.979 2.495 3.083 1.00 0.00 H new ATOM 0 HG21 THR A 926 0.210 1.337 5.509 1.00 0.00 H new ATOM 0 HG22 THR A 926 -0.444 -0.315 5.619 1.00 0.00 H new ATOM 0 HG23 THR A 926 0.546 0.160 4.218 1.00 0.00 H new ATOM 1964 N ASP A 927 -3.687 -1.135 4.907 1.00 0.00 N ATOM 1965 CA ASP A 927 -4.246 -2.157 5.848 1.00 0.00 C ATOM 1966 C ASP A 927 -5.645 -1.733 6.311 1.00 0.00 C ATOM 1967 O ASP A 927 -6.564 -1.831 5.516 1.00 0.00 O ATOM 1968 CB ASP A 927 -3.275 -2.200 7.035 1.00 0.00 C ATOM 1969 CG ASP A 927 -3.087 -0.794 7.615 1.00 0.00 C ATOM 1970 OD1 ASP A 927 -3.771 0.112 7.166 1.00 0.00 O ATOM 1971 OD2 ASP A 927 -2.260 -0.647 8.499 1.00 0.00 O ATOM 1972 OXT ASP A 927 -5.773 -1.320 7.452 1.00 0.00 O ATOM 0 H ASP A 927 -4.287 -0.325 4.747 1.00 0.00 H new ATOM 0 HA ASP A 927 -4.345 -3.135 5.378 1.00 0.00 H new ATOM 0 HB2 ASP A 927 -3.659 -2.870 7.804 1.00 0.00 H new ATOM 0 HB3 ASP A 927 -2.314 -2.600 6.714 1.00 0.00 H new