USER MOD reduce.3.24.130724 H: found=0, std=0, add=704, rem=0, adj=15 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 Single : A 833 GLN : amide:sc= 0 K(o=0,f=-1.1!) USER MOD Single : A 835 ASN : amide:sc= -5.46! C(o=-5.5!,f=-7.6!) USER MOD Single : A 841 SER OG : rot 180:sc= 0 USER MOD Single : A 853 THR OG1 : rot 122:sc= -8.1! USER MOD Single : A 854 THR OG1 : rot 180:sc= -0.754 USER MOD Single : A 856 TYR OH : rot 131:sc= 1.15 USER MOD Single : A 857 MET CE :methyl -149:sc= -12.7! (180deg=-16.8!) USER MOD Single : A 858 THR OG1 : rot 27:sc= -0.111 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 868 THR OG1 : rot 180:sc= 0 USER MOD Single : A 872 GLN : amide:sc= -3.41 K(o=-3.4,f=-6.3!) USER MOD Single : A 875 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 876 CYS SG : rot 27:sc= 0.00279 USER MOD Single : A 880 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 887 THR OG1 : rot -4:sc= 0.747 USER MOD Single : A 894 MET CE :methyl -116:sc= -4.51! (180deg=-8.1!) 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= -3.2! USER MOD Single : A 914 SER OG : rot 16:sc= 0.966 USER MOD Single : A 915 TYR OH : rot 180:sc= -0.137 USER MOD Single : A 926 THR OG1 : rot 140:sc= -4.18! USER MOD ----------------------------------------------------------------- ATOM 438 N GLN A 833 7.489 -10.292 -1.339 1.00 0.00 N ATOM 439 CA GLN A 833 7.202 -11.586 -2.027 1.00 0.00 C ATOM 440 C GLN A 833 5.986 -11.437 -2.934 1.00 0.00 C ATOM 441 O GLN A 833 5.122 -12.290 -2.994 1.00 0.00 O ATOM 442 CB GLN A 833 6.916 -12.577 -0.902 1.00 0.00 C ATOM 443 CG GLN A 833 5.706 -12.087 -0.107 1.00 0.00 C ATOM 444 CD GLN A 833 5.449 -13.022 1.077 1.00 0.00 C ATOM 445 OE1 GLN A 833 5.994 -14.107 1.141 1.00 0.00 O ATOM 446 NE2 GLN A 833 4.634 -12.647 2.024 1.00 0.00 N ATOM 0 HA GLN A 833 8.029 -11.915 -2.656 1.00 0.00 H new ATOM 0 HB2 GLN A 833 6.721 -13.568 -1.313 1.00 0.00 H new ATOM 0 HB3 GLN A 833 7.784 -12.668 -0.249 1.00 0.00 H new ATOM 0 HG2 GLN A 833 5.881 -11.072 0.251 1.00 0.00 H new ATOM 0 HG3 GLN A 833 4.827 -12.051 -0.751 1.00 0.00 H new ATOM 0 HE21 GLN A 833 4.176 -11.737 1.972 1.00 0.00 H new ATOM 0 HE22 GLN A 833 4.455 -13.264 2.817 1.00 0.00 H new ATOM 455 N GLU A 834 5.927 -10.351 -3.636 1.00 0.00 N ATOM 456 CA GLU A 834 4.791 -10.095 -4.553 1.00 0.00 C ATOM 457 C GLU A 834 5.129 -8.877 -5.403 1.00 0.00 C ATOM 458 O GLU A 834 5.249 -7.778 -4.899 1.00 0.00 O ATOM 459 CB GLU A 834 3.600 -9.807 -3.635 1.00 0.00 C ATOM 460 CG GLU A 834 2.328 -9.639 -4.472 1.00 0.00 C ATOM 461 CD GLU A 834 1.208 -10.510 -3.896 1.00 0.00 C ATOM 462 OE1 GLU A 834 1.270 -10.822 -2.718 1.00 0.00 O ATOM 463 OE2 GLU A 834 0.306 -10.850 -4.644 1.00 0.00 O ATOM 0 H GLU A 834 6.632 -9.614 -3.614 1.00 0.00 H new ATOM 0 HA GLU A 834 4.577 -10.925 -5.226 1.00 0.00 H new ATOM 0 HB2 GLU A 834 3.473 -10.622 -2.923 1.00 0.00 H new ATOM 0 HB3 GLU A 834 3.787 -8.903 -3.055 1.00 0.00 H new ATOM 0 HG2 GLU A 834 2.021 -8.593 -4.478 1.00 0.00 H new ATOM 0 HG3 GLU A 834 2.523 -9.919 -5.507 1.00 0.00 H new ATOM 470 N ASN A 835 5.282 -9.051 -6.686 1.00 0.00 N ATOM 471 CA ASN A 835 5.606 -7.878 -7.538 1.00 0.00 C ATOM 472 C ASN A 835 4.403 -6.982 -7.543 1.00 0.00 C ATOM 473 O ASN A 835 3.324 -7.401 -7.844 1.00 0.00 O ATOM 474 CB ASN A 835 5.870 -8.371 -8.971 1.00 0.00 C ATOM 475 CG ASN A 835 6.721 -9.641 -8.951 1.00 0.00 C ATOM 476 OD1 ASN A 835 7.683 -9.724 -8.216 1.00 0.00 O ATOM 477 ND2 ASN A 835 6.414 -10.636 -9.738 1.00 0.00 N ATOM 0 H ASN A 835 5.198 -9.942 -7.175 1.00 0.00 H new ATOM 0 HA ASN A 835 6.482 -7.348 -7.165 1.00 0.00 H new ATOM 0 HB2 ASN A 835 4.924 -8.568 -9.474 1.00 0.00 H new ATOM 0 HB3 ASN A 835 6.379 -7.594 -9.541 1.00 0.00 H new ATOM 0 HD21 ASN A 835 6.983 -11.483 -9.735 1.00 0.00 H new ATOM 0 HD22 ASN A 835 5.605 -10.567 -10.356 1.00 0.00 H new ATOM 484 N VAL A 836 4.559 -5.769 -7.207 1.00 0.00 N ATOM 485 CA VAL A 836 3.368 -4.881 -7.215 1.00 0.00 C ATOM 486 C VAL A 836 3.626 -3.631 -8.037 1.00 0.00 C ATOM 487 O VAL A 836 4.614 -2.942 -7.877 1.00 0.00 O ATOM 488 CB VAL A 836 3.033 -4.536 -5.754 1.00 0.00 C ATOM 489 CG1 VAL A 836 3.780 -5.467 -4.818 1.00 0.00 C ATOM 490 CG2 VAL A 836 3.422 -3.091 -5.446 1.00 0.00 C ATOM 0 H VAL A 836 5.439 -5.336 -6.927 1.00 0.00 H new ATOM 0 HA VAL A 836 2.521 -5.386 -7.680 1.00 0.00 H new ATOM 0 HB VAL A 836 1.959 -4.656 -5.608 1.00 0.00 H new ATOM 0 HG11 VAL A 836 3.537 -5.216 -3.785 1.00 0.00 H new ATOM 0 HG12 VAL A 836 3.487 -6.497 -5.020 1.00 0.00 H new ATOM 0 HG13 VAL A 836 4.853 -5.357 -4.976 1.00 0.00 H new ATOM 0 HG21 VAL A 836 3.179 -2.862 -4.408 1.00 0.00 H new ATOM 0 HG22 VAL A 836 4.492 -2.961 -5.605 1.00 0.00 H new ATOM 0 HG23 VAL A 836 2.873 -2.418 -6.104 1.00 0.00 H new ATOM 500 N GLU A 837 2.703 -3.321 -8.884 1.00 0.00 N ATOM 501 CA GLU A 837 2.825 -2.086 -9.697 1.00 0.00 C ATOM 502 C GLU A 837 1.953 -1.050 -9.024 1.00 0.00 C ATOM 503 O GLU A 837 1.260 -1.361 -8.076 1.00 0.00 O ATOM 504 CB GLU A 837 2.298 -2.426 -11.084 1.00 0.00 C ATOM 505 CG GLU A 837 3.111 -1.675 -12.140 1.00 0.00 C ATOM 506 CD GLU A 837 2.210 -1.322 -13.324 1.00 0.00 C ATOM 507 OE1 GLU A 837 1.116 -0.836 -13.086 1.00 0.00 O ATOM 508 OE2 GLU A 837 2.628 -1.544 -14.449 1.00 0.00 O ATOM 0 H GLU A 837 1.861 -3.871 -9.054 1.00 0.00 H new ATOM 0 HA GLU A 837 3.845 -1.710 -9.780 1.00 0.00 H new ATOM 0 HB2 GLU A 837 2.364 -3.500 -11.256 1.00 0.00 H new ATOM 0 HB3 GLU A 837 1.245 -2.155 -11.161 1.00 0.00 H new ATOM 0 HG2 GLU A 837 3.536 -0.768 -11.710 1.00 0.00 H new ATOM 0 HG3 GLU A 837 3.946 -2.290 -12.476 1.00 0.00 H new ATOM 515 N ILE A 838 1.968 0.167 -9.462 1.00 0.00 N ATOM 516 CA ILE A 838 1.127 1.160 -8.770 1.00 0.00 C ATOM 517 C ILE A 838 0.469 2.109 -9.774 1.00 0.00 C ATOM 518 O ILE A 838 1.040 2.479 -10.779 1.00 0.00 O ATOM 519 CB ILE A 838 2.112 1.905 -7.856 1.00 0.00 C ATOM 520 CG1 ILE A 838 2.554 0.979 -6.698 1.00 0.00 C ATOM 521 CG2 ILE A 838 1.485 3.196 -7.313 1.00 0.00 C ATOM 522 CD1 ILE A 838 2.010 1.469 -5.351 1.00 0.00 C ATOM 0 H ILE A 838 2.514 0.511 -10.252 1.00 0.00 H new ATOM 0 HA ILE A 838 0.307 0.707 -8.213 1.00 0.00 H new ATOM 0 HB ILE A 838 2.990 2.183 -8.439 1.00 0.00 H new ATOM 0 HG12 ILE A 838 2.202 -0.035 -6.887 1.00 0.00 H new ATOM 0 HG13 ILE A 838 3.642 0.937 -6.659 1.00 0.00 H new ATOM 0 HG21 ILE A 838 2.202 3.705 -6.669 1.00 0.00 H new ATOM 0 HG22 ILE A 838 1.217 3.848 -8.144 1.00 0.00 H new ATOM 0 HG23 ILE A 838 0.590 2.953 -6.740 1.00 0.00 H new ATOM 0 HD11 ILE A 838 2.339 0.796 -4.559 1.00 0.00 H new ATOM 0 HD12 ILE A 838 2.383 2.474 -5.152 1.00 0.00 H new ATOM 0 HD13 ILE A 838 0.921 1.486 -5.383 1.00 0.00 H new ATOM 534 N LEU A 839 -0.732 2.498 -9.479 1.00 0.00 N ATOM 535 CA LEU A 839 -1.485 3.432 -10.376 1.00 0.00 C ATOM 536 C LEU A 839 -2.653 4.057 -9.593 1.00 0.00 C ATOM 537 O LEU A 839 -2.980 3.591 -8.523 1.00 0.00 O ATOM 538 CB LEU A 839 -2.009 2.551 -11.515 1.00 0.00 C ATOM 539 CG LEU A 839 -1.393 2.999 -12.845 1.00 0.00 C ATOM 540 CD1 LEU A 839 -0.188 2.115 -13.179 1.00 0.00 C ATOM 541 CD2 LEU A 839 -2.440 2.872 -13.956 1.00 0.00 C ATOM 0 H LEU A 839 -1.240 2.209 -8.643 1.00 0.00 H new ATOM 0 HA LEU A 839 -0.868 4.249 -10.752 1.00 0.00 H new ATOM 0 HB2 LEU A 839 -1.761 1.507 -11.323 1.00 0.00 H new ATOM 0 HB3 LEU A 839 -3.096 2.617 -11.567 1.00 0.00 H new ATOM 0 HG LEU A 839 -1.068 4.036 -12.763 1.00 0.00 H new ATOM 0 HD11 LEU A 839 0.248 2.436 -14.125 1.00 0.00 H new ATOM 0 HD12 LEU A 839 0.557 2.202 -12.388 1.00 0.00 H new ATOM 0 HD13 LEU A 839 -0.510 1.077 -13.262 1.00 0.00 H new ATOM 0 HD21 LEU A 839 -2.005 3.190 -14.904 1.00 0.00 H new ATOM 0 HD22 LEU A 839 -2.763 1.834 -14.035 1.00 0.00 H new ATOM 0 HD23 LEU A 839 -3.298 3.502 -13.721 1.00 0.00 H new ATOM 553 N PRO A 840 -3.257 5.088 -10.144 1.00 0.00 N ATOM 554 CA PRO A 840 -4.397 5.751 -9.459 1.00 0.00 C ATOM 555 C PRO A 840 -5.503 4.736 -9.166 1.00 0.00 C ATOM 556 O PRO A 840 -5.856 3.937 -10.011 1.00 0.00 O ATOM 557 CB PRO A 840 -4.852 6.789 -10.483 1.00 0.00 C ATOM 558 CG PRO A 840 -3.942 6.690 -11.725 1.00 0.00 C ATOM 559 CD PRO A 840 -2.853 5.638 -11.459 1.00 0.00 C ATOM 0 HA PRO A 840 -4.137 6.192 -8.497 1.00 0.00 H new ATOM 0 HB2 PRO A 840 -5.891 6.615 -10.761 1.00 0.00 H new ATOM 0 HB3 PRO A 840 -4.800 7.790 -10.055 1.00 0.00 H new ATOM 0 HG2 PRO A 840 -4.528 6.413 -12.601 1.00 0.00 H new ATOM 0 HG3 PRO A 840 -3.488 7.658 -11.938 1.00 0.00 H new ATOM 0 HD2 PRO A 840 -2.833 4.870 -12.232 1.00 0.00 H new ATOM 0 HD3 PRO A 840 -1.858 6.082 -11.425 1.00 0.00 H new ATOM 566 N SER A 841 -6.047 4.748 -7.974 1.00 0.00 N ATOM 567 CA SER A 841 -7.102 3.774 -7.635 1.00 0.00 C ATOM 568 C SER A 841 -8.217 3.829 -8.660 1.00 0.00 C ATOM 569 O SER A 841 -8.601 4.874 -9.150 1.00 0.00 O ATOM 570 CB SER A 841 -7.611 4.186 -6.250 1.00 0.00 C ATOM 571 OG SER A 841 -9.031 4.279 -6.265 1.00 0.00 O ATOM 0 H SER A 841 -5.798 5.396 -7.227 1.00 0.00 H new ATOM 0 HA SER A 841 -6.728 2.750 -7.633 1.00 0.00 H new ATOM 0 HB2 SER A 841 -7.293 3.457 -5.504 1.00 0.00 H new ATOM 0 HB3 SER A 841 -7.178 5.144 -5.964 1.00 0.00 H new ATOM 0 HG SER A 841 -9.351 4.541 -5.377 1.00 0.00 H new ATOM 577 N GLY A 842 -8.734 2.695 -8.965 1.00 0.00 N ATOM 578 CA GLY A 842 -9.849 2.611 -9.953 1.00 0.00 C ATOM 579 C GLY A 842 -9.303 2.298 -11.345 1.00 0.00 C ATOM 580 O GLY A 842 -9.165 3.170 -12.180 1.00 0.00 O ATOM 0 H GLY A 842 -8.438 1.801 -8.574 1.00 0.00 H new ATOM 0 HA2 GLY A 842 -10.555 1.838 -9.650 1.00 0.00 H new ATOM 0 HA3 GLY A 842 -10.397 3.553 -9.974 1.00 0.00 H new ATOM 740 N ILE A 852 -4.781 -14.171 -7.337 1.00 0.00 N ATOM 741 CA ILE A 852 -4.233 -14.617 -6.013 1.00 0.00 C ATOM 742 C ILE A 852 -4.454 -13.604 -4.895 1.00 0.00 C ATOM 743 O ILE A 852 -4.772 -13.969 -3.779 1.00 0.00 O ATOM 744 CB ILE A 852 -2.734 -14.790 -6.256 1.00 0.00 C ATOM 745 CG1 ILE A 852 -2.157 -13.486 -6.826 1.00 0.00 C ATOM 746 CG2 ILE A 852 -2.501 -15.932 -7.247 1.00 0.00 C ATOM 747 CD1 ILE A 852 -1.455 -12.706 -5.712 1.00 0.00 C ATOM 0 HA ILE A 852 -4.737 -15.525 -5.683 1.00 0.00 H new ATOM 0 HB ILE A 852 -2.238 -15.026 -5.314 1.00 0.00 H new ATOM 0 HG12 ILE A 852 -1.453 -13.708 -7.628 1.00 0.00 H new ATOM 0 HG13 ILE A 852 -2.954 -12.882 -7.260 1.00 0.00 H new ATOM 0 HG21 ILE A 852 -1.431 -16.053 -7.418 1.00 0.00 H new ATOM 0 HG22 ILE A 852 -2.910 -16.857 -6.839 1.00 0.00 H new ATOM 0 HG23 ILE A 852 -2.996 -15.702 -8.191 1.00 0.00 H new ATOM 0 HD11 ILE A 852 -1.046 -11.781 -6.118 1.00 0.00 H new ATOM 0 HD12 ILE A 852 -2.172 -12.471 -4.925 1.00 0.00 H new ATOM 0 HD13 ILE A 852 -0.647 -13.310 -5.299 1.00 0.00 H new ATOM 759 N THR A 853 -4.265 -12.346 -5.165 1.00 0.00 N ATOM 760 CA THR A 853 -4.433 -11.325 -4.133 1.00 0.00 C ATOM 761 C THR A 853 -5.733 -11.526 -3.395 1.00 0.00 C ATOM 762 O THR A 853 -6.745 -11.901 -3.953 1.00 0.00 O ATOM 763 CB THR A 853 -4.472 -10.023 -4.908 1.00 0.00 C ATOM 764 OG1 THR A 853 -5.382 -10.155 -5.989 1.00 0.00 O ATOM 765 CG2 THR A 853 -3.091 -9.713 -5.463 1.00 0.00 C ATOM 0 H THR A 853 -3.996 -11.988 -6.081 1.00 0.00 H new ATOM 0 HA THR A 853 -3.640 -11.353 -3.386 1.00 0.00 H new ATOM 0 HB THR A 853 -4.787 -9.217 -4.245 1.00 0.00 H new ATOM 0 HG1 THR A 853 -6.081 -9.472 -5.913 1.00 0.00 H new ATOM 0 HG21 THR A 853 -3.124 -8.776 -6.019 1.00 0.00 H new ATOM 0 HG22 THR A 853 -2.381 -9.622 -4.641 1.00 0.00 H new ATOM 0 HG23 THR A 853 -2.777 -10.518 -6.127 1.00 0.00 H new ATOM 773 N THR A 854 -5.701 -11.248 -2.152 1.00 0.00 N ATOM 774 CA THR A 854 -6.915 -11.369 -1.336 1.00 0.00 C ATOM 775 C THR A 854 -7.600 -10.007 -1.338 1.00 0.00 C ATOM 776 O THR A 854 -6.931 -8.995 -1.360 1.00 0.00 O ATOM 777 CB THR A 854 -6.436 -11.752 0.071 1.00 0.00 C ATOM 778 OG1 THR A 854 -7.562 -11.894 0.927 1.00 0.00 O ATOM 779 CG2 THR A 854 -5.507 -10.668 0.627 1.00 0.00 C ATOM 0 H THR A 854 -4.871 -10.935 -1.649 1.00 0.00 H new ATOM 0 HA THR A 854 -7.622 -12.113 -1.704 1.00 0.00 H new ATOM 0 HB THR A 854 -5.889 -12.693 0.018 1.00 0.00 H new ATOM 0 HG1 THR A 854 -7.260 -12.140 1.826 1.00 0.00 H new ATOM 0 HG21 THR A 854 -5.174 -10.951 1.625 1.00 0.00 H new ATOM 0 HG22 THR A 854 -4.642 -10.560 -0.027 1.00 0.00 H new ATOM 0 HG23 THR A 854 -6.043 -9.721 0.679 1.00 0.00 H new ATOM 787 N PRO A 855 -8.900 -10.014 -1.319 1.00 0.00 N ATOM 788 CA PRO A 855 -9.661 -8.748 -1.313 1.00 0.00 C ATOM 789 C PRO A 855 -9.216 -7.930 -0.104 1.00 0.00 C ATOM 790 O PRO A 855 -9.931 -7.800 0.869 1.00 0.00 O ATOM 791 CB PRO A 855 -11.110 -9.233 -1.178 1.00 0.00 C ATOM 792 CG PRO A 855 -11.108 -10.776 -1.122 1.00 0.00 C ATOM 793 CD PRO A 855 -9.665 -11.271 -1.295 1.00 0.00 C ATOM 0 HA PRO A 855 -9.523 -8.112 -2.187 1.00 0.00 H new ATOM 0 HB2 PRO A 855 -11.564 -8.822 -0.276 1.00 0.00 H new ATOM 0 HB3 PRO A 855 -11.706 -8.886 -2.022 1.00 0.00 H new ATOM 0 HG2 PRO A 855 -11.515 -11.120 -0.171 1.00 0.00 H new ATOM 0 HG3 PRO A 855 -11.744 -11.184 -1.907 1.00 0.00 H new ATOM 0 HD2 PRO A 855 -9.357 -11.919 -0.474 1.00 0.00 H new ATOM 0 HD3 PRO A 855 -9.539 -11.841 -2.215 1.00 0.00 H new ATOM 800 N TYR A 856 -8.019 -7.395 -0.159 1.00 0.00 N ATOM 801 CA TYR A 856 -7.484 -6.608 0.977 1.00 0.00 C ATOM 802 C TYR A 856 -6.036 -6.276 0.675 1.00 0.00 C ATOM 803 O TYR A 856 -5.153 -7.094 0.845 1.00 0.00 O ATOM 804 CB TYR A 856 -7.560 -7.512 2.202 1.00 0.00 C ATOM 805 CG TYR A 856 -7.068 -6.789 3.446 1.00 0.00 C ATOM 806 CD1 TYR A 856 -5.694 -6.594 3.661 1.00 0.00 C ATOM 807 CD2 TYR A 856 -7.989 -6.338 4.402 1.00 0.00 C ATOM 808 CE1 TYR A 856 -5.250 -5.956 4.825 1.00 0.00 C ATOM 809 CE2 TYR A 856 -7.541 -5.696 5.563 1.00 0.00 C ATOM 810 CZ TYR A 856 -6.174 -5.507 5.776 1.00 0.00 C ATOM 811 OH TYR A 856 -5.737 -4.878 6.926 1.00 0.00 O ATOM 0 H TYR A 856 -7.389 -7.476 -0.957 1.00 0.00 H new ATOM 0 HA TYR A 856 -8.039 -5.685 1.142 1.00 0.00 H new ATOM 0 HB2 TYR A 856 -8.588 -7.842 2.352 1.00 0.00 H new ATOM 0 HB3 TYR A 856 -6.960 -8.406 2.036 1.00 0.00 H new ATOM 0 HD1 TYR A 856 -4.979 -6.937 2.927 1.00 0.00 H new ATOM 0 HD2 TYR A 856 -9.047 -6.486 4.243 1.00 0.00 H new ATOM 0 HE1 TYR A 856 -4.193 -5.810 4.990 1.00 0.00 H new ATOM 0 HE2 TYR A 856 -8.254 -5.346 6.295 1.00 0.00 H new ATOM 0 HH TYR A 856 -6.242 -4.048 7.057 1.00 0.00 H new ATOM 821 N MET A 857 -5.794 -5.105 0.190 1.00 0.00 N ATOM 822 CA MET A 857 -4.409 -4.709 -0.168 1.00 0.00 C ATOM 823 C MET A 857 -3.429 -5.107 0.938 1.00 0.00 C ATOM 824 O MET A 857 -3.826 -5.432 2.038 1.00 0.00 O ATOM 825 CB MET A 857 -4.447 -3.183 -0.291 1.00 0.00 C ATOM 826 CG MET A 857 -3.010 -2.637 -0.382 1.00 0.00 C ATOM 827 SD MET A 857 -3.010 -0.852 -0.675 1.00 0.00 S ATOM 828 CE MET A 857 -4.053 -0.864 -2.141 1.00 0.00 C ATOM 0 H MET A 857 -6.503 -4.391 0.022 1.00 0.00 H new ATOM 0 HA MET A 857 -4.079 -5.197 -1.085 1.00 0.00 H new ATOM 0 HB2 MET A 857 -5.014 -2.893 -1.176 1.00 0.00 H new ATOM 0 HB3 MET A 857 -4.957 -2.751 0.570 1.00 0.00 H new ATOM 0 HG2 MET A 857 -2.475 -2.857 0.542 1.00 0.00 H new ATOM 0 HG3 MET A 857 -2.476 -3.141 -1.188 1.00 0.00 H new ATOM 0 HE1 MET A 857 -3.770 -0.040 -2.796 1.00 0.00 H new ATOM 0 HE2 MET A 857 -3.926 -1.808 -2.670 1.00 0.00 H new ATOM 0 HE3 MET A 857 -5.096 -0.751 -1.846 1.00 0.00 H new ATOM 838 N THR A 858 -2.156 -5.062 0.667 1.00 0.00 N ATOM 839 CA THR A 858 -1.183 -5.423 1.725 1.00 0.00 C ATOM 840 C THR A 858 -0.112 -4.355 1.838 1.00 0.00 C ATOM 841 O THR A 858 0.448 -3.915 0.856 1.00 0.00 O ATOM 842 CB THR A 858 -0.625 -6.768 1.291 1.00 0.00 C ATOM 843 OG1 THR A 858 -0.130 -6.677 -0.039 1.00 0.00 O ATOM 844 CG2 THR A 858 -1.764 -7.782 1.359 1.00 0.00 C ATOM 0 H THR A 858 -1.753 -4.794 -0.231 1.00 0.00 H new ATOM 0 HA THR A 858 -1.630 -5.490 2.717 1.00 0.00 H new ATOM 0 HB THR A 858 0.196 -7.074 1.940 1.00 0.00 H new ATOM 0 HG1 THR A 858 0.142 -5.754 -0.224 1.00 0.00 H new ATOM 0 HG21 THR A 858 -1.398 -8.762 1.053 1.00 0.00 H new ATOM 0 HG22 THR A 858 -2.141 -7.838 2.380 1.00 0.00 H new ATOM 0 HG23 THR A 858 -2.568 -7.471 0.692 1.00 0.00 H new ATOM 852 N LYS A 859 0.126 -3.918 3.048 1.00 0.00 N ATOM 853 CA LYS A 859 1.130 -2.837 3.321 1.00 0.00 C ATOM 854 C LYS A 859 2.169 -2.649 2.190 1.00 0.00 C ATOM 855 O LYS A 859 2.557 -1.537 1.911 1.00 0.00 O ATOM 856 CB LYS A 859 1.827 -3.269 4.614 1.00 0.00 C ATOM 857 CG LYS A 859 2.531 -4.611 4.395 1.00 0.00 C ATOM 858 CD LYS A 859 2.771 -5.290 5.745 1.00 0.00 C ATOM 859 CE LYS A 859 3.892 -6.322 5.606 1.00 0.00 C ATOM 860 NZ LYS A 859 3.664 -7.291 6.714 1.00 0.00 N ATOM 0 H LYS A 859 -0.344 -4.272 3.881 1.00 0.00 H new ATOM 0 HA LYS A 859 0.629 -1.872 3.396 1.00 0.00 H new ATOM 0 HB2 LYS A 859 2.551 -2.513 4.919 1.00 0.00 H new ATOM 0 HB3 LYS A 859 1.098 -3.356 5.420 1.00 0.00 H new ATOM 0 HG2 LYS A 859 1.923 -5.252 3.757 1.00 0.00 H new ATOM 0 HG3 LYS A 859 3.479 -4.456 3.881 1.00 0.00 H new ATOM 0 HD2 LYS A 859 3.038 -4.546 6.496 1.00 0.00 H new ATOM 0 HD3 LYS A 859 1.857 -5.775 6.088 1.00 0.00 H new ATOM 0 HE2 LYS A 859 3.855 -6.817 4.635 1.00 0.00 H new ATOM 0 HE3 LYS A 859 4.873 -5.853 5.687 1.00 0.00 H new ATOM 0 HZ1 LYS A 859 4.395 -8.030 6.684 1.00 0.00 H new ATOM 0 HZ2 LYS A 859 3.712 -6.793 7.626 1.00 0.00 H new ATOM 0 HZ3 LYS A 859 2.726 -7.727 6.606 1.00 0.00 H new ATOM 874 N TYR A 860 2.636 -3.690 1.527 1.00 0.00 N ATOM 875 CA TYR A 860 3.633 -3.437 0.442 1.00 0.00 C ATOM 876 C TYR A 860 3.001 -2.556 -0.625 1.00 0.00 C ATOM 877 O TYR A 860 3.556 -1.544 -0.992 1.00 0.00 O ATOM 878 CB TYR A 860 4.034 -4.786 -0.138 1.00 0.00 C ATOM 879 CG TYR A 860 5.041 -4.580 -1.266 1.00 0.00 C ATOM 880 CD1 TYR A 860 5.669 -3.332 -1.440 1.00 0.00 C ATOM 881 CD2 TYR A 860 5.339 -5.628 -2.149 1.00 0.00 C ATOM 882 CE1 TYR A 860 6.578 -3.132 -2.479 1.00 0.00 C ATOM 883 CE2 TYR A 860 6.254 -5.422 -3.191 1.00 0.00 C ATOM 884 CZ TYR A 860 6.871 -4.177 -3.357 1.00 0.00 C ATOM 885 OH TYR A 860 7.771 -3.983 -4.385 1.00 0.00 O ATOM 0 H TYR A 860 2.379 -4.664 1.685 1.00 0.00 H new ATOM 0 HA TYR A 860 4.515 -2.924 0.826 1.00 0.00 H new ATOM 0 HB2 TYR A 860 4.468 -5.413 0.641 1.00 0.00 H new ATOM 0 HB3 TYR A 860 3.154 -5.308 -0.514 1.00 0.00 H new ATOM 0 HD1 TYR A 860 5.445 -2.522 -0.762 1.00 0.00 H new ATOM 0 HD2 TYR A 860 4.865 -6.591 -2.027 1.00 0.00 H new ATOM 0 HE1 TYR A 860 7.054 -2.171 -2.604 1.00 0.00 H new ATOM 0 HE2 TYR A 860 6.484 -6.230 -3.870 1.00 0.00 H new ATOM 0 HH TYR A 860 7.861 -4.811 -4.901 1.00 0.00 H new ATOM 895 N GLU A 861 1.833 -2.898 -1.106 1.00 0.00 N ATOM 896 CA GLU A 861 1.178 -2.011 -2.117 1.00 0.00 C ATOM 897 C GLU A 861 1.334 -0.580 -1.603 1.00 0.00 C ATOM 898 O GLU A 861 1.647 0.342 -2.330 1.00 0.00 O ATOM 899 CB GLU A 861 -0.291 -2.438 -2.148 1.00 0.00 C ATOM 900 CG GLU A 861 -0.400 -3.843 -2.750 1.00 0.00 C ATOM 901 CD GLU A 861 -1.833 -4.098 -3.228 1.00 0.00 C ATOM 902 OE1 GLU A 861 -2.192 -3.588 -4.272 1.00 0.00 O ATOM 903 OE2 GLU A 861 -2.547 -4.805 -2.538 1.00 0.00 O ATOM 0 H GLU A 861 1.312 -3.736 -0.849 1.00 0.00 H new ATOM 0 HA GLU A 861 1.602 -2.076 -3.119 1.00 0.00 H new ATOM 0 HB2 GLU A 861 -0.705 -2.429 -1.140 1.00 0.00 H new ATOM 0 HB3 GLU A 861 -0.874 -1.731 -2.738 1.00 0.00 H new ATOM 0 HG2 GLU A 861 0.294 -3.945 -3.584 1.00 0.00 H new ATOM 0 HG3 GLU A 861 -0.117 -4.589 -2.007 1.00 0.00 H new ATOM 910 N ARG A 862 1.181 -0.432 -0.314 1.00 0.00 N ATOM 911 CA ARG A 862 1.382 0.893 0.342 1.00 0.00 C ATOM 912 C ARG A 862 2.878 1.228 0.331 1.00 0.00 C ATOM 913 O ARG A 862 3.280 2.343 0.057 1.00 0.00 O ATOM 914 CB ARG A 862 0.908 0.700 1.780 1.00 0.00 C ATOM 915 CG ARG A 862 1.504 1.791 2.687 1.00 0.00 C ATOM 916 CD ARG A 862 2.587 1.179 3.584 1.00 0.00 C ATOM 917 NE ARG A 862 3.836 1.920 3.249 1.00 0.00 N ATOM 918 CZ ARG A 862 4.738 2.125 4.169 1.00 0.00 C ATOM 919 NH1 ARG A 862 4.380 2.544 5.353 1.00 0.00 N ATOM 920 NH2 ARG A 862 5.998 1.913 3.907 1.00 0.00 N ATOM 0 H ARG A 862 0.921 -1.186 0.322 1.00 0.00 H new ATOM 0 HA ARG A 862 0.845 1.698 -0.159 1.00 0.00 H new ATOM 0 HB2 ARG A 862 -0.181 0.738 1.820 1.00 0.00 H new ATOM 0 HB3 ARG A 862 1.206 -0.285 2.140 1.00 0.00 H new ATOM 0 HG2 ARG A 862 1.929 2.590 2.080 1.00 0.00 H new ATOM 0 HG3 ARG A 862 0.720 2.238 3.299 1.00 0.00 H new ATOM 0 HD2 ARG A 862 2.334 1.290 4.638 1.00 0.00 H new ATOM 0 HD3 ARG A 862 2.699 0.112 3.394 1.00 0.00 H new ATOM 0 HE ARG A 862 3.985 2.267 2.301 1.00 0.00 H new ATOM 0 HH11 ARG A 862 3.395 2.711 5.559 1.00 0.00 H new ATOM 0 HH12 ARG A 862 5.085 2.704 6.072 1.00 0.00 H new ATOM 0 HH21 ARG A 862 6.279 1.587 2.982 1.00 0.00 H new ATOM 0 HH22 ARG A 862 6.703 2.074 4.627 1.00 0.00 H new ATOM 934 N ALA A 863 3.706 0.269 0.636 1.00 0.00 N ATOM 935 CA ALA A 863 5.172 0.544 0.637 1.00 0.00 C ATOM 936 C ALA A 863 5.660 0.787 -0.795 1.00 0.00 C ATOM 937 O ALA A 863 6.691 1.397 -1.023 1.00 0.00 O ATOM 938 CB ALA A 863 5.821 -0.705 1.232 1.00 0.00 C ATOM 0 H ALA A 863 3.437 -0.684 0.882 1.00 0.00 H new ATOM 0 HA ALA A 863 5.425 1.434 1.213 1.00 0.00 H new ATOM 0 HB1 ALA A 863 6.903 -0.573 1.264 1.00 0.00 H new ATOM 0 HB2 ALA A 863 5.445 -0.864 2.243 1.00 0.00 H new ATOM 0 HB3 ALA A 863 5.579 -1.570 0.615 1.00 0.00 H new ATOM 944 N ARG A 864 4.889 0.390 -1.766 1.00 0.00 N ATOM 945 CA ARG A 864 5.280 0.666 -3.175 1.00 0.00 C ATOM 946 C ARG A 864 4.688 2.026 -3.466 1.00 0.00 C ATOM 947 O ARG A 864 5.284 2.895 -4.066 1.00 0.00 O ATOM 948 CB ARG A 864 4.652 -0.446 -4.017 1.00 0.00 C ATOM 949 CG ARG A 864 5.758 -1.153 -4.811 1.00 0.00 C ATOM 950 CD ARG A 864 5.618 -0.815 -6.298 1.00 0.00 C ATOM 951 NE ARG A 864 6.658 -1.638 -6.976 1.00 0.00 N ATOM 952 CZ ARG A 864 7.728 -1.067 -7.459 1.00 0.00 C ATOM 953 NH1 ARG A 864 8.848 -1.113 -6.792 1.00 0.00 N ATOM 954 NH2 ARG A 864 7.677 -0.451 -8.608 1.00 0.00 N ATOM 0 H ARG A 864 4.009 -0.111 -1.647 1.00 0.00 H new ATOM 0 HA ARG A 864 6.350 0.679 -3.380 1.00 0.00 H new ATOM 0 HB2 ARG A 864 4.135 -1.159 -3.375 1.00 0.00 H new ATOM 0 HB3 ARG A 864 3.908 -0.030 -4.696 1.00 0.00 H new ATOM 0 HG2 ARG A 864 6.737 -0.841 -4.447 1.00 0.00 H new ATOM 0 HG3 ARG A 864 5.692 -2.231 -4.665 1.00 0.00 H new ATOM 0 HD2 ARG A 864 4.621 -1.056 -6.666 1.00 0.00 H new ATOM 0 HD3 ARG A 864 5.776 0.248 -6.478 1.00 0.00 H new ATOM 0 HE ARG A 864 6.534 -2.647 -7.063 1.00 0.00 H new ATOM 0 HH11 ARG A 864 8.887 -1.595 -5.894 1.00 0.00 H new ATOM 0 HH12 ARG A 864 9.685 -0.667 -7.169 1.00 0.00 H new ATOM 0 HH21 ARG A 864 6.801 -0.415 -9.129 1.00 0.00 H new ATOM 0 HH22 ARG A 864 8.513 -0.005 -8.985 1.00 0.00 H new ATOM 968 N VAL A 865 3.525 2.201 -2.921 1.00 0.00 N ATOM 969 CA VAL A 865 2.791 3.482 -2.974 1.00 0.00 C ATOM 970 C VAL A 865 3.733 4.580 -2.510 1.00 0.00 C ATOM 971 O VAL A 865 4.075 5.490 -3.227 1.00 0.00 O ATOM 972 CB VAL A 865 1.698 3.202 -1.949 1.00 0.00 C ATOM 973 CG1 VAL A 865 1.437 4.388 -1.044 1.00 0.00 C ATOM 974 CG2 VAL A 865 0.441 2.804 -2.666 1.00 0.00 C ATOM 0 H VAL A 865 3.030 1.466 -2.415 1.00 0.00 H new ATOM 0 HA VAL A 865 2.408 3.796 -3.945 1.00 0.00 H new ATOM 0 HB VAL A 865 2.038 2.388 -1.308 1.00 0.00 H new ATOM 0 HG11 VAL A 865 0.650 4.137 -0.333 1.00 0.00 H new ATOM 0 HG12 VAL A 865 2.349 4.640 -0.503 1.00 0.00 H new ATOM 0 HG13 VAL A 865 1.124 5.242 -1.645 1.00 0.00 H new ATOM 0 HG21 VAL A 865 -0.345 2.602 -1.938 1.00 0.00 H new ATOM 0 HG22 VAL A 865 0.126 3.613 -3.325 1.00 0.00 H new ATOM 0 HG23 VAL A 865 0.627 1.907 -3.257 1.00 0.00 H new ATOM 984 N LEU A 866 4.180 4.427 -1.309 1.00 0.00 N ATOM 985 CA LEU A 866 5.153 5.359 -0.705 1.00 0.00 C ATOM 986 C LEU A 866 6.300 5.471 -1.687 1.00 0.00 C ATOM 987 O LEU A 866 6.880 6.514 -1.876 1.00 0.00 O ATOM 988 CB LEU A 866 5.565 4.675 0.620 1.00 0.00 C ATOM 989 CG LEU A 866 7.085 4.755 0.860 1.00 0.00 C ATOM 990 CD1 LEU A 866 7.354 4.936 2.356 1.00 0.00 C ATOM 991 CD2 LEU A 866 7.748 3.457 0.391 1.00 0.00 C ATOM 0 H LEU A 866 3.899 3.662 -0.695 1.00 0.00 H new ATOM 0 HA LEU A 866 4.786 6.365 -0.503 1.00 0.00 H new ATOM 0 HB2 LEU A 866 5.041 5.148 1.451 1.00 0.00 H new ATOM 0 HB3 LEU A 866 5.255 3.630 0.601 1.00 0.00 H new ATOM 0 HG LEU A 866 7.493 5.599 0.304 1.00 0.00 H new ATOM 0 HD11 LEU A 866 8.429 4.993 2.528 1.00 0.00 H new ATOM 0 HD12 LEU A 866 6.882 5.856 2.702 1.00 0.00 H new ATOM 0 HD13 LEU A 866 6.943 4.089 2.905 1.00 0.00 H new ATOM 0 HD21 LEU A 866 8.823 3.515 0.561 1.00 0.00 H new ATOM 0 HD22 LEU A 866 7.337 2.616 0.950 1.00 0.00 H new ATOM 0 HD23 LEU A 866 7.557 3.314 -0.673 1.00 0.00 H new ATOM 1003 N GLY A 867 6.602 4.390 -2.339 1.00 0.00 N ATOM 1004 CA GLY A 867 7.675 4.427 -3.342 1.00 0.00 C ATOM 1005 C GLY A 867 7.231 5.297 -4.506 1.00 0.00 C ATOM 1006 O GLY A 867 7.939 6.188 -4.918 1.00 0.00 O ATOM 0 H GLY A 867 6.148 3.485 -2.216 1.00 0.00 H new ATOM 0 HA2 GLY A 867 8.589 4.825 -2.901 1.00 0.00 H new ATOM 0 HA3 GLY A 867 7.901 3.419 -3.690 1.00 0.00 H new ATOM 1010 N THR A 868 6.058 5.065 -5.035 1.00 0.00 N ATOM 1011 CA THR A 868 5.621 5.921 -6.186 1.00 0.00 C ATOM 1012 C THR A 868 5.217 7.309 -5.691 1.00 0.00 C ATOM 1013 O THR A 868 5.209 8.268 -6.442 1.00 0.00 O ATOM 1014 CB THR A 868 4.466 5.213 -6.903 1.00 0.00 C ATOM 1015 OG1 THR A 868 4.625 5.393 -8.304 1.00 0.00 O ATOM 1016 CG2 THR A 868 3.126 5.816 -6.474 1.00 0.00 C ATOM 0 H THR A 868 5.400 4.346 -4.735 1.00 0.00 H new ATOM 0 HA THR A 868 6.441 6.061 -6.890 1.00 0.00 H new ATOM 0 HB THR A 868 4.477 4.154 -6.647 1.00 0.00 H new ATOM 0 HG1 THR A 868 3.894 4.944 -8.777 1.00 0.00 H new ATOM 0 HG21 THR A 868 2.314 5.304 -6.991 1.00 0.00 H new ATOM 0 HG22 THR A 868 3.002 5.698 -5.397 1.00 0.00 H new ATOM 0 HG23 THR A 868 3.106 6.876 -6.728 1.00 0.00 H new ATOM 1024 N ARG A 869 4.948 7.440 -4.425 1.00 0.00 N ATOM 1025 CA ARG A 869 4.619 8.775 -3.885 1.00 0.00 C ATOM 1026 C ARG A 869 5.952 9.438 -3.642 1.00 0.00 C ATOM 1027 O ARG A 869 6.189 10.568 -4.012 1.00 0.00 O ATOM 1028 CB ARG A 869 3.873 8.528 -2.572 1.00 0.00 C ATOM 1029 CG ARG A 869 2.392 8.882 -2.750 1.00 0.00 C ATOM 1030 CD ARG A 869 1.584 7.605 -3.004 1.00 0.00 C ATOM 1031 NE ARG A 869 0.779 7.894 -4.223 1.00 0.00 N ATOM 1032 CZ ARG A 869 0.700 7.010 -5.181 1.00 0.00 C ATOM 1033 NH1 ARG A 869 0.647 5.737 -4.892 1.00 0.00 N ATOM 1034 NH2 ARG A 869 0.671 7.396 -6.427 1.00 0.00 N ATOM 0 H ARG A 869 4.943 6.679 -3.746 1.00 0.00 H new ATOM 0 HA ARG A 869 4.004 9.397 -4.535 1.00 0.00 H new ATOM 0 HB2 ARG A 869 3.975 7.484 -2.274 1.00 0.00 H new ATOM 0 HB3 ARG A 869 4.309 9.131 -1.775 1.00 0.00 H new ATOM 0 HG2 ARG A 869 2.020 9.389 -1.860 1.00 0.00 H new ATOM 0 HG3 ARG A 869 2.271 9.573 -3.584 1.00 0.00 H new ATOM 0 HD2 ARG A 869 2.239 6.748 -3.158 1.00 0.00 H new ATOM 0 HD3 ARG A 869 0.943 7.368 -2.155 1.00 0.00 H new ATOM 0 HE ARG A 869 0.288 8.784 -4.310 1.00 0.00 H new ATOM 0 HH11 ARG A 869 0.667 5.434 -3.918 1.00 0.00 H new ATOM 0 HH12 ARG A 869 0.585 5.046 -5.640 1.00 0.00 H new ATOM 0 HH21 ARG A 869 0.710 8.390 -6.654 1.00 0.00 H new ATOM 0 HH22 ARG A 869 0.609 6.704 -7.174 1.00 0.00 H new ATOM 1048 N ALA A 870 6.841 8.698 -3.043 1.00 0.00 N ATOM 1049 CA ALA A 870 8.210 9.224 -2.779 1.00 0.00 C ATOM 1050 C ALA A 870 8.870 9.776 -4.050 1.00 0.00 C ATOM 1051 O ALA A 870 9.684 10.668 -3.977 1.00 0.00 O ATOM 1052 CB ALA A 870 8.991 8.014 -2.283 1.00 0.00 C ATOM 0 H ALA A 870 6.678 7.744 -2.722 1.00 0.00 H new ATOM 0 HA ALA A 870 8.185 10.049 -2.067 1.00 0.00 H new ATOM 0 HB1 ALA A 870 10.017 8.309 -2.062 1.00 0.00 H new ATOM 0 HB2 ALA A 870 8.523 7.624 -1.379 1.00 0.00 H new ATOM 0 HB3 ALA A 870 8.993 7.242 -3.052 1.00 0.00 H new ATOM 1058 N LEU A 871 8.534 9.280 -5.213 1.00 0.00 N ATOM 1059 CA LEU A 871 9.186 9.854 -6.453 1.00 0.00 C ATOM 1060 C LEU A 871 8.371 11.026 -6.928 1.00 0.00 C ATOM 1061 O LEU A 871 8.904 12.026 -7.379 1.00 0.00 O ATOM 1062 CB LEU A 871 9.294 8.781 -7.562 1.00 0.00 C ATOM 1063 CG LEU A 871 8.693 7.445 -7.141 1.00 0.00 C ATOM 1064 CD1 LEU A 871 8.141 6.741 -8.376 1.00 0.00 C ATOM 1065 CD2 LEU A 871 9.786 6.586 -6.498 1.00 0.00 C ATOM 0 H LEU A 871 7.862 8.529 -5.368 1.00 0.00 H new ATOM 0 HA LEU A 871 10.197 10.183 -6.214 1.00 0.00 H new ATOM 0 HB2 LEU A 871 8.787 9.137 -8.459 1.00 0.00 H new ATOM 0 HB3 LEU A 871 10.342 8.638 -7.824 1.00 0.00 H new ATOM 0 HG LEU A 871 7.889 7.602 -6.423 1.00 0.00 H new ATOM 0 HD11 LEU A 871 7.708 5.783 -8.086 1.00 0.00 H new ATOM 0 HD12 LEU A 871 7.372 7.362 -8.836 1.00 0.00 H new ATOM 0 HD13 LEU A 871 8.947 6.573 -9.090 1.00 0.00 H new ATOM 0 HD21 LEU A 871 9.364 5.628 -6.194 1.00 0.00 H new ATOM 0 HD22 LEU A 871 10.587 6.418 -7.218 1.00 0.00 H new ATOM 0 HD23 LEU A 871 10.186 7.100 -5.624 1.00 0.00 H new ATOM 1077 N GLN A 872 7.083 10.934 -6.793 1.00 0.00 N ATOM 1078 CA GLN A 872 6.226 12.068 -7.195 1.00 0.00 C ATOM 1079 C GLN A 872 6.839 13.332 -6.597 1.00 0.00 C ATOM 1080 O GLN A 872 7.348 14.195 -7.284 1.00 0.00 O ATOM 1081 CB GLN A 872 4.873 11.736 -6.562 1.00 0.00 C ATOM 1082 CG GLN A 872 3.909 11.219 -7.635 1.00 0.00 C ATOM 1083 CD GLN A 872 3.047 10.099 -7.050 1.00 0.00 C ATOM 1084 OE1 GLN A 872 2.981 9.017 -7.600 1.00 0.00 O ATOM 1085 NE2 GLN A 872 2.380 10.314 -5.950 1.00 0.00 N ATOM 0 H GLN A 872 6.589 10.122 -6.422 1.00 0.00 H new ATOM 0 HA GLN A 872 6.129 12.224 -8.269 1.00 0.00 H new ATOM 0 HB2 GLN A 872 5.001 10.985 -5.783 1.00 0.00 H new ATOM 0 HB3 GLN A 872 4.458 12.623 -6.084 1.00 0.00 H new ATOM 0 HG2 GLN A 872 3.276 12.031 -7.992 1.00 0.00 H new ATOM 0 HG3 GLN A 872 4.469 10.850 -8.495 1.00 0.00 H new ATOM 0 HE21 GLN A 872 2.436 11.222 -5.489 1.00 0.00 H new ATOM 0 HE22 GLN A 872 1.803 9.574 -5.551 1.00 0.00 H new ATOM 1094 N ILE A 873 6.821 13.400 -5.307 1.00 0.00 N ATOM 1095 CA ILE A 873 7.425 14.546 -4.570 1.00 0.00 C ATOM 1096 C ILE A 873 8.911 14.616 -4.791 1.00 0.00 C ATOM 1097 O ILE A 873 9.484 15.685 -4.832 1.00 0.00 O ATOM 1098 CB ILE A 873 7.201 14.228 -3.109 1.00 0.00 C ATOM 1099 CG1 ILE A 873 7.334 12.704 -2.877 1.00 0.00 C ATOM 1100 CG2 ILE A 873 5.821 14.726 -2.750 1.00 0.00 C ATOM 1101 CD1 ILE A 873 8.542 12.413 -1.996 1.00 0.00 C ATOM 0 H ILE A 873 6.401 12.690 -4.707 1.00 0.00 H new ATOM 0 HA ILE A 873 6.986 15.488 -4.898 1.00 0.00 H new ATOM 0 HB ILE A 873 7.944 14.714 -2.477 1.00 0.00 H new ATOM 0 HG12 ILE A 873 6.429 12.320 -2.406 1.00 0.00 H new ATOM 0 HG13 ILE A 873 7.439 12.190 -3.833 1.00 0.00 H new ATOM 0 HG21 ILE A 873 5.620 14.515 -1.700 1.00 0.00 H new ATOM 0 HG22 ILE A 873 5.766 15.801 -2.921 1.00 0.00 H new ATOM 0 HG23 ILE A 873 5.080 14.222 -3.370 1.00 0.00 H new ATOM 0 HD11 ILE A 873 8.627 11.338 -1.839 1.00 0.00 H new ATOM 0 HD12 ILE A 873 9.445 12.781 -2.483 1.00 0.00 H new ATOM 0 HD13 ILE A 873 8.420 12.912 -1.035 1.00 0.00 H new ATOM 1113 N ALA A 874 9.553 13.495 -4.935 1.00 0.00 N ATOM 1114 CA ALA A 874 11.017 13.547 -5.152 1.00 0.00 C ATOM 1115 C ALA A 874 11.284 14.425 -6.361 1.00 0.00 C ATOM 1116 O ALA A 874 12.373 14.929 -6.555 1.00 0.00 O ATOM 1117 CB ALA A 874 11.464 12.112 -5.362 1.00 0.00 C ATOM 0 H ALA A 874 9.137 12.564 -4.912 1.00 0.00 H new ATOM 0 HA ALA A 874 11.568 13.975 -4.314 1.00 0.00 H new ATOM 0 HB1 ALA A 874 12.541 12.087 -5.528 1.00 0.00 H new ATOM 0 HB2 ALA A 874 11.219 11.522 -4.479 1.00 0.00 H new ATOM 0 HB3 ALA A 874 10.953 11.695 -6.230 1.00 0.00 H new ATOM 1123 N MET A 875 10.262 14.682 -7.128 1.00 0.00 N ATOM 1124 CA MET A 875 10.430 15.614 -8.264 1.00 0.00 C ATOM 1125 C MET A 875 10.003 16.978 -7.736 1.00 0.00 C ATOM 1126 O MET A 875 10.788 17.894 -7.592 1.00 0.00 O ATOM 1127 CB MET A 875 9.479 15.116 -9.356 1.00 0.00 C ATOM 1128 CG MET A 875 10.237 14.993 -10.679 1.00 0.00 C ATOM 1129 SD MET A 875 10.509 16.643 -11.373 1.00 0.00 S ATOM 1130 CE MET A 875 10.697 16.136 -13.099 1.00 0.00 C ATOM 0 H MET A 875 9.328 14.289 -7.015 1.00 0.00 H new ATOM 0 HA MET A 875 11.442 15.674 -8.664 1.00 0.00 H new ATOM 0 HB2 MET A 875 9.060 14.150 -9.074 1.00 0.00 H new ATOM 0 HB3 MET A 875 8.643 15.807 -9.467 1.00 0.00 H new ATOM 0 HG2 MET A 875 11.192 14.492 -10.518 1.00 0.00 H new ATOM 0 HG3 MET A 875 9.670 14.381 -11.380 1.00 0.00 H new ATOM 0 HE1 MET A 875 10.877 17.014 -13.719 1.00 0.00 H new ATOM 0 HE2 MET A 875 11.540 15.451 -13.187 1.00 0.00 H new ATOM 0 HE3 MET A 875 9.787 15.637 -13.433 1.00 0.00 H new ATOM 1140 N CYS A 876 8.756 17.070 -7.387 1.00 0.00 N ATOM 1141 CA CYS A 876 8.202 18.314 -6.783 1.00 0.00 C ATOM 1142 C CYS A 876 7.290 17.916 -5.625 1.00 0.00 C ATOM 1143 O CYS A 876 7.689 17.891 -4.479 1.00 0.00 O ATOM 1144 CB CYS A 876 7.424 19.008 -7.904 1.00 0.00 C ATOM 1145 SG CYS A 876 8.522 20.145 -8.785 1.00 0.00 S ATOM 0 H CYS A 876 8.077 16.317 -7.497 1.00 0.00 H new ATOM 0 HA CYS A 876 8.966 18.983 -6.388 1.00 0.00 H new ATOM 0 HB2 CYS A 876 7.021 18.267 -8.594 1.00 0.00 H new ATOM 0 HB3 CYS A 876 6.576 19.553 -7.489 1.00 0.00 H new ATOM 0 HG CYS A 876 9.749 19.727 -8.687 1.00 0.00 H new ATOM 1151 N ALA A 877 6.066 17.569 -5.931 1.00 0.00 N ATOM 1152 CA ALA A 877 5.118 17.133 -4.859 1.00 0.00 C ATOM 1153 C ALA A 877 3.698 16.815 -5.380 1.00 0.00 C ATOM 1154 O ALA A 877 2.730 17.276 -4.810 1.00 0.00 O ATOM 1155 CB ALA A 877 5.071 18.281 -3.861 1.00 0.00 C ATOM 0 H ALA A 877 5.681 17.568 -6.876 1.00 0.00 H new ATOM 0 HA ALA A 877 5.469 16.200 -4.417 1.00 0.00 H new ATOM 0 HB1 ALA A 877 4.392 18.027 -3.046 1.00 0.00 H new ATOM 0 HB2 ALA A 877 6.069 18.456 -3.460 1.00 0.00 H new ATOM 0 HB3 ALA A 877 4.717 19.183 -4.360 1.00 0.00 H new ATOM 1161 N PRO A 878 3.599 15.990 -6.402 1.00 0.00 N ATOM 1162 CA PRO A 878 2.264 15.574 -6.913 1.00 0.00 C ATOM 1163 C PRO A 878 1.554 14.780 -5.813 1.00 0.00 C ATOM 1164 O PRO A 878 0.369 14.516 -5.863 1.00 0.00 O ATOM 1165 CB PRO A 878 2.621 14.651 -8.072 1.00 0.00 C ATOM 1166 CG PRO A 878 4.152 14.556 -8.170 1.00 0.00 C ATOM 1167 CD PRO A 878 4.777 15.441 -7.093 1.00 0.00 C ATOM 0 HA PRO A 878 1.613 16.398 -7.207 1.00 0.00 H new ATOM 0 HB2 PRO A 878 2.190 13.662 -7.915 1.00 0.00 H new ATOM 0 HB3 PRO A 878 2.205 15.035 -9.003 1.00 0.00 H new ATOM 0 HG2 PRO A 878 4.474 13.523 -8.041 1.00 0.00 H new ATOM 0 HG3 PRO A 878 4.486 14.873 -9.158 1.00 0.00 H new ATOM 0 HD2 PRO A 878 5.413 14.869 -6.417 1.00 0.00 H new ATOM 0 HD3 PRO A 878 5.397 16.227 -7.524 1.00 0.00 H new ATOM 1174 N VAL A 879 2.313 14.398 -4.826 1.00 0.00 N ATOM 1175 CA VAL A 879 1.793 13.609 -3.677 1.00 0.00 C ATOM 1176 C VAL A 879 0.583 14.326 -3.069 1.00 0.00 C ATOM 1177 O VAL A 879 0.168 15.372 -3.529 1.00 0.00 O ATOM 1178 CB VAL A 879 3.021 13.589 -2.734 1.00 0.00 C ATOM 1179 CG1 VAL A 879 2.663 13.383 -1.256 1.00 0.00 C ATOM 1180 CG2 VAL A 879 3.979 12.473 -3.180 1.00 0.00 C ATOM 0 H VAL A 879 3.309 14.609 -4.768 1.00 0.00 H new ATOM 0 HA VAL A 879 1.434 12.607 -3.914 1.00 0.00 H new ATOM 0 HB VAL A 879 3.488 14.571 -2.808 1.00 0.00 H new ATOM 0 HG11 VAL A 879 3.574 13.380 -0.658 1.00 0.00 H new ATOM 0 HG12 VAL A 879 2.013 14.192 -0.923 1.00 0.00 H new ATOM 0 HG13 VAL A 879 2.147 12.430 -1.136 1.00 0.00 H new ATOM 0 HG21 VAL A 879 4.846 12.453 -2.520 1.00 0.00 H new ATOM 0 HG22 VAL A 879 3.466 11.513 -3.134 1.00 0.00 H new ATOM 0 HG23 VAL A 879 4.305 12.661 -4.203 1.00 0.00 H new ATOM 1190 N MET A 880 -0.003 13.747 -2.069 1.00 0.00 N ATOM 1191 CA MET A 880 -1.220 14.359 -1.446 1.00 0.00 C ATOM 1192 C MET A 880 -0.842 15.262 -0.273 1.00 0.00 C ATOM 1193 O MET A 880 -1.678 15.661 0.512 1.00 0.00 O ATOM 1194 CB MET A 880 -2.054 13.174 -0.963 1.00 0.00 C ATOM 1195 CG MET A 880 -3.527 13.417 -1.293 1.00 0.00 C ATOM 1196 SD MET A 880 -3.763 13.345 -3.087 1.00 0.00 S ATOM 1197 CE MET A 880 -5.551 13.067 -3.070 1.00 0.00 C ATOM 0 H MET A 880 0.303 12.870 -1.647 1.00 0.00 H new ATOM 0 HA MET A 880 -1.763 14.986 -2.152 1.00 0.00 H new ATOM 0 HB2 MET A 880 -1.710 12.256 -1.440 1.00 0.00 H new ATOM 0 HB3 MET A 880 -1.928 13.042 0.112 1.00 0.00 H new ATOM 0 HG2 MET A 880 -4.149 12.668 -0.803 1.00 0.00 H new ATOM 0 HG3 MET A 880 -3.840 14.389 -0.913 1.00 0.00 H new ATOM 0 HE1 MET A 880 -5.917 12.990 -4.094 1.00 0.00 H new ATOM 0 HE2 MET A 880 -5.770 12.143 -2.536 1.00 0.00 H new ATOM 0 HE3 MET A 880 -6.044 13.901 -2.570 1.00 0.00 H new ATOM 1207 N VAL A 881 0.402 15.621 -0.188 1.00 0.00 N ATOM 1208 CA VAL A 881 0.869 16.528 0.870 1.00 0.00 C ATOM 1209 C VAL A 881 1.904 17.435 0.213 1.00 0.00 C ATOM 1210 O VAL A 881 2.350 17.177 -0.889 1.00 0.00 O ATOM 1211 CB VAL A 881 1.467 15.646 1.983 1.00 0.00 C ATOM 1212 CG1 VAL A 881 0.349 14.845 2.675 1.00 0.00 C ATOM 1213 CG2 VAL A 881 2.487 14.670 1.395 1.00 0.00 C ATOM 0 H VAL A 881 1.131 15.310 -0.830 1.00 0.00 H new ATOM 0 HA VAL A 881 0.090 17.147 1.316 1.00 0.00 H new ATOM 0 HB VAL A 881 1.961 16.293 2.708 1.00 0.00 H new ATOM 0 HG11 VAL A 881 0.779 14.224 3.461 1.00 0.00 H new ATOM 0 HG12 VAL A 881 -0.375 15.533 3.112 1.00 0.00 H new ATOM 0 HG13 VAL A 881 -0.150 14.210 1.943 1.00 0.00 H new ATOM 0 HG21 VAL A 881 2.902 14.053 2.192 1.00 0.00 H new ATOM 0 HG22 VAL A 881 1.998 14.032 0.659 1.00 0.00 H new ATOM 0 HG23 VAL A 881 3.290 15.229 0.914 1.00 0.00 H new ATOM 1223 N GLU A 882 2.251 18.505 0.835 1.00 0.00 N ATOM 1224 CA GLU A 882 3.219 19.451 0.198 1.00 0.00 C ATOM 1225 C GLU A 882 4.370 19.819 1.139 1.00 0.00 C ATOM 1226 O GLU A 882 4.413 20.911 1.673 1.00 0.00 O ATOM 1227 CB GLU A 882 2.387 20.692 -0.131 1.00 0.00 C ATOM 1228 CG GLU A 882 1.747 21.245 1.149 1.00 0.00 C ATOM 1229 CD GLU A 882 0.224 21.118 1.058 1.00 0.00 C ATOM 1230 OE1 GLU A 882 -0.286 20.073 1.422 1.00 0.00 O ATOM 1231 OE2 GLU A 882 -0.404 22.071 0.625 1.00 0.00 O ATOM 0 H GLU A 882 1.915 18.780 1.758 1.00 0.00 H new ATOM 0 HA GLU A 882 3.687 19.005 -0.680 1.00 0.00 H new ATOM 0 HB2 GLU A 882 3.018 21.453 -0.590 1.00 0.00 H new ATOM 0 HB3 GLU A 882 1.613 20.440 -0.856 1.00 0.00 H new ATOM 0 HG2 GLU A 882 2.116 20.699 2.017 1.00 0.00 H new ATOM 0 HG3 GLU A 882 2.027 22.289 1.286 1.00 0.00 H new ATOM 1238 N LEU A 883 5.310 18.935 1.334 1.00 0.00 N ATOM 1239 CA LEU A 883 6.455 19.268 2.227 1.00 0.00 C ATOM 1240 C LEU A 883 7.215 20.489 1.672 1.00 0.00 C ATOM 1241 O LEU A 883 6.946 21.612 2.050 1.00 0.00 O ATOM 1242 CB LEU A 883 7.339 18.015 2.229 1.00 0.00 C ATOM 1243 CG LEU A 883 8.592 18.271 3.068 1.00 0.00 C ATOM 1244 CD1 LEU A 883 8.209 18.349 4.547 1.00 0.00 C ATOM 1245 CD2 LEU A 883 9.585 17.124 2.860 1.00 0.00 C ATOM 0 H LEU A 883 5.335 18.004 0.917 1.00 0.00 H new ATOM 0 HA LEU A 883 6.138 19.530 3.236 1.00 0.00 H new ATOM 0 HB2 LEU A 883 6.785 17.168 2.634 1.00 0.00 H new ATOM 0 HB3 LEU A 883 7.620 17.754 1.209 1.00 0.00 H new ATOM 0 HG LEU A 883 9.050 19.211 2.761 1.00 0.00 H new ATOM 0 HD11 LEU A 883 9.102 18.531 5.145 1.00 0.00 H new ATOM 0 HD12 LEU A 883 7.500 19.163 4.697 1.00 0.00 H new ATOM 0 HD13 LEU A 883 7.752 17.408 4.855 1.00 0.00 H new ATOM 0 HD21 LEU A 883 10.479 17.304 3.457 1.00 0.00 H new ATOM 0 HD22 LEU A 883 9.126 16.185 3.168 1.00 0.00 H new ATOM 0 HD23 LEU A 883 9.858 17.066 1.806 1.00 0.00 H new ATOM 1257 N GLU A 884 8.161 20.284 0.784 1.00 0.00 N ATOM 1258 CA GLU A 884 8.924 21.447 0.227 1.00 0.00 C ATOM 1259 C GLU A 884 9.286 21.244 -1.255 1.00 0.00 C ATOM 1260 O GLU A 884 9.945 22.074 -1.852 1.00 0.00 O ATOM 1261 CB GLU A 884 10.197 21.511 1.073 1.00 0.00 C ATOM 1262 CG GLU A 884 10.284 22.869 1.773 1.00 0.00 C ATOM 1263 CD GLU A 884 10.749 23.931 0.774 1.00 0.00 C ATOM 1264 OE1 GLU A 884 9.914 24.432 0.040 1.00 0.00 O ATOM 1265 OE2 GLU A 884 11.932 24.226 0.762 1.00 0.00 O ATOM 0 H GLU A 884 8.435 19.370 0.424 1.00 0.00 H new ATOM 0 HA GLU A 884 8.334 22.363 0.267 1.00 0.00 H new ATOM 0 HB2 GLU A 884 10.195 20.710 1.812 1.00 0.00 H new ATOM 0 HB3 GLU A 884 11.073 21.360 0.442 1.00 0.00 H new ATOM 0 HG2 GLU A 884 9.311 23.141 2.183 1.00 0.00 H new ATOM 0 HG3 GLU A 884 10.979 22.814 2.611 1.00 0.00 H new ATOM 1272 N GLY A 885 8.902 20.143 -1.845 1.00 0.00 N ATOM 1273 CA GLY A 885 9.268 19.885 -3.264 1.00 0.00 C ATOM 1274 C GLY A 885 10.074 18.582 -3.314 1.00 0.00 C ATOM 1275 O GLY A 885 10.144 17.924 -4.329 1.00 0.00 O ATOM 0 H GLY A 885 8.349 19.410 -1.401 1.00 0.00 H new ATOM 0 HA2 GLY A 885 8.373 19.803 -3.880 1.00 0.00 H new ATOM 0 HA3 GLY A 885 9.855 20.712 -3.663 1.00 0.00 H new ATOM 1279 N GLU A 886 10.671 18.225 -2.194 1.00 0.00 N ATOM 1280 CA GLU A 886 11.493 16.974 -2.064 1.00 0.00 C ATOM 1281 C GLU A 886 12.543 17.203 -0.986 1.00 0.00 C ATOM 1282 O GLU A 886 13.313 18.141 -1.050 1.00 0.00 O ATOM 1283 CB GLU A 886 12.184 16.720 -3.406 1.00 0.00 C ATOM 1284 CG GLU A 886 13.281 15.660 -3.239 1.00 0.00 C ATOM 1285 CD GLU A 886 14.072 15.529 -4.541 1.00 0.00 C ATOM 1286 OE1 GLU A 886 14.330 16.549 -5.159 1.00 0.00 O ATOM 1287 OE2 GLU A 886 14.407 14.413 -4.898 1.00 0.00 O ATOM 0 H GLU A 886 10.618 18.772 -1.335 1.00 0.00 H new ATOM 0 HA GLU A 886 10.871 16.119 -1.797 1.00 0.00 H new ATOM 0 HB2 GLU A 886 11.454 16.386 -4.143 1.00 0.00 H new ATOM 0 HB3 GLU A 886 12.617 17.647 -3.783 1.00 0.00 H new ATOM 0 HG2 GLU A 886 13.948 15.938 -2.423 1.00 0.00 H new ATOM 0 HG3 GLU A 886 12.836 14.701 -2.974 1.00 0.00 H new ATOM 1294 N THR A 887 12.587 16.360 -0.002 1.00 0.00 N ATOM 1295 CA THR A 887 13.585 16.529 1.071 1.00 0.00 C ATOM 1296 C THR A 887 13.637 15.221 1.822 1.00 0.00 C ATOM 1297 O THR A 887 14.684 14.664 2.087 1.00 0.00 O ATOM 1298 CB THR A 887 13.020 17.649 1.951 1.00 0.00 C ATOM 1299 OG1 THR A 887 13.159 18.892 1.278 1.00 0.00 O ATOM 1300 CG2 THR A 887 13.775 17.703 3.281 1.00 0.00 C ATOM 0 H THR A 887 11.968 15.556 0.103 1.00 0.00 H new ATOM 0 HA THR A 887 14.589 16.778 0.729 1.00 0.00 H new ATOM 0 HB THR A 887 11.966 17.452 2.148 1.00 0.00 H new ATOM 0 HG1 THR A 887 13.646 18.757 0.439 1.00 0.00 H new ATOM 0 HG21 THR A 887 13.366 18.502 3.899 1.00 0.00 H new ATOM 0 HG22 THR A 887 13.666 16.751 3.800 1.00 0.00 H new ATOM 0 HG23 THR A 887 14.831 17.895 3.092 1.00 0.00 H new ATOM 1308 N ASP A 888 12.484 14.728 2.147 1.00 0.00 N ATOM 1309 CA ASP A 888 12.396 13.455 2.863 1.00 0.00 C ATOM 1310 C ASP A 888 12.335 12.285 1.876 1.00 0.00 C ATOM 1311 O ASP A 888 11.712 12.397 0.838 1.00 0.00 O ATOM 1312 CB ASP A 888 11.103 13.569 3.638 1.00 0.00 C ATOM 1313 CG ASP A 888 11.199 12.751 4.927 1.00 0.00 C ATOM 1314 OD1 ASP A 888 10.961 11.557 4.866 1.00 0.00 O ATOM 1315 OD2 ASP A 888 11.510 13.333 5.953 1.00 0.00 O ATOM 0 H ASP A 888 11.587 15.168 1.939 1.00 0.00 H new ATOM 0 HA ASP A 888 13.258 13.268 3.504 1.00 0.00 H new ATOM 0 HB2 ASP A 888 10.900 14.614 3.873 1.00 0.00 H new ATOM 0 HB3 ASP A 888 10.271 13.212 3.031 1.00 0.00 H new ATOM 1320 N PRO A 889 12.961 11.190 2.223 1.00 0.00 N ATOM 1321 CA PRO A 889 12.939 10.003 1.344 1.00 0.00 C ATOM 1322 C PRO A 889 11.531 9.388 1.291 1.00 0.00 C ATOM 1323 O PRO A 889 11.278 8.495 0.507 1.00 0.00 O ATOM 1324 CB PRO A 889 13.916 9.050 2.041 1.00 0.00 C ATOM 1325 CG PRO A 889 14.452 9.733 3.313 1.00 0.00 C ATOM 1326 CD PRO A 889 13.732 11.076 3.486 1.00 0.00 C ATOM 0 HA PRO A 889 13.207 10.225 0.311 1.00 0.00 H new ATOM 0 HB2 PRO A 889 13.415 8.116 2.296 1.00 0.00 H new ATOM 0 HB3 PRO A 889 14.739 8.798 1.372 1.00 0.00 H new ATOM 0 HG2 PRO A 889 14.284 9.098 4.183 1.00 0.00 H new ATOM 0 HG3 PRO A 889 15.528 9.888 3.235 1.00 0.00 H new ATOM 0 HD2 PRO A 889 13.081 11.078 4.361 1.00 0.00 H new ATOM 0 HD3 PRO A 889 14.434 11.900 3.609 1.00 0.00 H new ATOM 1333 N LEU A 890 10.611 9.844 2.121 1.00 0.00 N ATOM 1334 CA LEU A 890 9.242 9.260 2.108 1.00 0.00 C ATOM 1335 C LEU A 890 8.304 9.937 3.126 1.00 0.00 C ATOM 1336 O LEU A 890 7.206 9.467 3.325 1.00 0.00 O ATOM 1337 CB LEU A 890 9.418 7.760 2.445 1.00 0.00 C ATOM 1338 CG LEU A 890 9.886 7.530 3.903 1.00 0.00 C ATOM 1339 CD1 LEU A 890 11.087 8.415 4.249 1.00 0.00 C ATOM 1340 CD2 LEU A 890 8.746 7.831 4.878 1.00 0.00 C ATOM 0 H LEU A 890 10.758 10.591 2.799 1.00 0.00 H new ATOM 0 HA LEU A 890 8.776 9.411 1.134 1.00 0.00 H new ATOM 0 HB2 LEU A 890 8.473 7.242 2.284 1.00 0.00 H new ATOM 0 HB3 LEU A 890 10.143 7.320 1.760 1.00 0.00 H new ATOM 0 HG LEU A 890 10.184 6.485 3.992 1.00 0.00 H new ATOM 0 HD11 LEU A 890 11.391 8.229 5.279 1.00 0.00 H new ATOM 0 HD12 LEU A 890 11.915 8.183 3.579 1.00 0.00 H new ATOM 0 HD13 LEU A 890 10.811 9.463 4.135 1.00 0.00 H new ATOM 0 HD21 LEU A 890 9.088 7.665 5.900 1.00 0.00 H new ATOM 0 HD22 LEU A 890 8.434 8.869 4.763 1.00 0.00 H new ATOM 0 HD23 LEU A 890 7.903 7.173 4.666 1.00 0.00 H new ATOM 1352 N LEU A 891 8.686 11.032 3.766 1.00 0.00 N ATOM 1353 CA LEU A 891 7.733 11.683 4.736 1.00 0.00 C ATOM 1354 C LEU A 891 6.392 11.736 4.069 1.00 0.00 C ATOM 1355 O LEU A 891 5.365 11.446 4.625 1.00 0.00 O ATOM 1356 CB LEU A 891 8.280 13.101 4.975 1.00 0.00 C ATOM 1357 CG LEU A 891 7.156 14.150 5.180 1.00 0.00 C ATOM 1358 CD1 LEU A 891 6.448 14.494 3.853 1.00 0.00 C ATOM 1359 CD2 LEU A 891 6.129 13.634 6.197 1.00 0.00 C ATOM 0 H LEU A 891 9.591 11.490 3.661 1.00 0.00 H new ATOM 0 HA LEU A 891 7.639 11.150 5.682 1.00 0.00 H new ATOM 0 HB2 LEU A 891 8.928 13.093 5.851 1.00 0.00 H new ATOM 0 HB3 LEU A 891 8.896 13.396 4.126 1.00 0.00 H new ATOM 0 HG LEU A 891 7.621 15.060 5.560 1.00 0.00 H new ATOM 0 HD11 LEU A 891 5.667 15.232 4.038 1.00 0.00 H new ATOM 0 HD12 LEU A 891 7.173 14.902 3.149 1.00 0.00 H new ATOM 0 HD13 LEU A 891 6.003 13.592 3.434 1.00 0.00 H new ATOM 0 HD21 LEU A 891 5.345 14.379 6.332 1.00 0.00 H new ATOM 0 HD22 LEU A 891 5.689 12.707 5.831 1.00 0.00 H new ATOM 0 HD23 LEU A 891 6.623 13.449 7.151 1.00 0.00 H new ATOM 1371 N ILE A 892 6.450 12.114 2.858 1.00 0.00 N ATOM 1372 CA ILE A 892 5.247 12.217 2.017 1.00 0.00 C ATOM 1373 C ILE A 892 4.665 10.845 1.817 1.00 0.00 C ATOM 1374 O ILE A 892 3.476 10.635 1.915 1.00 0.00 O ATOM 1375 CB ILE A 892 5.796 12.717 0.701 1.00 0.00 C ATOM 1376 CG1 ILE A 892 5.607 14.214 0.614 1.00 0.00 C ATOM 1377 CG2 ILE A 892 5.096 12.031 -0.464 1.00 0.00 C ATOM 1378 CD1 ILE A 892 6.812 14.786 -0.093 1.00 0.00 C ATOM 0 H ILE A 892 7.316 12.370 2.384 1.00 0.00 H new ATOM 0 HA ILE A 892 4.470 12.854 2.440 1.00 0.00 H new ATOM 0 HB ILE A 892 6.859 12.483 0.647 1.00 0.00 H new ATOM 0 HG12 ILE A 892 4.694 14.454 0.069 1.00 0.00 H new ATOM 0 HG13 ILE A 892 5.507 14.646 1.610 1.00 0.00 H new ATOM 0 HG21 ILE A 892 5.504 12.403 -1.404 1.00 0.00 H new ATOM 0 HG22 ILE A 892 5.254 10.954 -0.401 1.00 0.00 H new ATOM 0 HG23 ILE A 892 4.028 12.244 -0.423 1.00 0.00 H new ATOM 0 HD11 ILE A 892 6.707 15.868 -0.173 1.00 0.00 H new ATOM 0 HD12 ILE A 892 7.713 14.549 0.474 1.00 0.00 H new ATOM 0 HD13 ILE A 892 6.887 14.354 -1.091 1.00 0.00 H new ATOM 1390 N ALA A 893 5.509 9.915 1.504 1.00 0.00 N ATOM 1391 CA ALA A 893 4.992 8.542 1.257 1.00 0.00 C ATOM 1392 C ALA A 893 4.518 7.945 2.576 1.00 0.00 C ATOM 1393 O ALA A 893 3.663 7.090 2.624 1.00 0.00 O ATOM 1394 CB ALA A 893 6.180 7.758 0.722 1.00 0.00 C ATOM 0 H ALA A 893 6.517 10.036 1.408 1.00 0.00 H new ATOM 0 HA ALA A 893 4.154 8.526 0.560 1.00 0.00 H new ATOM 0 HB1 ALA A 893 5.876 6.732 0.516 1.00 0.00 H new ATOM 0 HB2 ALA A 893 6.538 8.222 -0.197 1.00 0.00 H new ATOM 0 HB3 ALA A 893 6.979 7.757 1.463 1.00 0.00 H new ATOM 1400 N MET A 894 5.013 8.470 3.642 1.00 0.00 N ATOM 1401 CA MET A 894 4.578 8.021 4.990 1.00 0.00 C ATOM 1402 C MET A 894 3.330 8.804 5.329 1.00 0.00 C ATOM 1403 O MET A 894 2.273 8.258 5.549 1.00 0.00 O ATOM 1404 CB MET A 894 5.740 8.394 5.922 1.00 0.00 C ATOM 1405 CG MET A 894 5.254 8.511 7.372 1.00 0.00 C ATOM 1406 SD MET A 894 6.653 8.923 8.450 1.00 0.00 S ATOM 1407 CE MET A 894 7.012 10.564 7.771 1.00 0.00 C ATOM 0 H MET A 894 5.717 9.208 3.645 1.00 0.00 H new ATOM 0 HA MET A 894 4.354 6.957 5.066 1.00 0.00 H new ATOM 0 HB2 MET A 894 6.523 7.639 5.855 1.00 0.00 H new ATOM 0 HB3 MET A 894 6.180 9.339 5.603 1.00 0.00 H new ATOM 0 HG2 MET A 894 4.485 9.280 7.448 1.00 0.00 H new ATOM 0 HG3 MET A 894 4.800 7.573 7.691 1.00 0.00 H new ATOM 0 HE1 MET A 894 8.004 10.562 7.319 1.00 0.00 H new ATOM 0 HE2 MET A 894 6.269 10.815 7.014 1.00 0.00 H new ATOM 0 HE3 MET A 894 6.980 11.304 8.571 1.00 0.00 H new ATOM 1417 N LYS A 895 3.456 10.096 5.315 1.00 0.00 N ATOM 1418 CA LYS A 895 2.293 10.974 5.575 1.00 0.00 C ATOM 1419 C LYS A 895 1.159 10.507 4.675 1.00 0.00 C ATOM 1420 O LYS A 895 0.046 10.358 5.097 1.00 0.00 O ATOM 1421 CB LYS A 895 2.771 12.380 5.191 1.00 0.00 C ATOM 1422 CG LYS A 895 1.574 13.293 4.918 1.00 0.00 C ATOM 1423 CD LYS A 895 0.826 13.569 6.225 1.00 0.00 C ATOM 1424 CE LYS A 895 1.258 14.926 6.786 1.00 0.00 C ATOM 1425 NZ LYS A 895 1.292 14.739 8.264 1.00 0.00 N ATOM 0 H LYS A 895 4.331 10.587 5.131 1.00 0.00 H new ATOM 0 HA LYS A 895 1.937 10.957 6.605 1.00 0.00 H new ATOM 0 HB2 LYS A 895 3.379 12.797 5.994 1.00 0.00 H new ATOM 0 HB3 LYS A 895 3.405 12.327 4.306 1.00 0.00 H new ATOM 0 HG2 LYS A 895 1.913 14.230 4.477 1.00 0.00 H new ATOM 0 HG3 LYS A 895 0.904 12.825 4.197 1.00 0.00 H new ATOM 0 HD2 LYS A 895 -0.250 13.563 6.049 1.00 0.00 H new ATOM 0 HD3 LYS A 895 1.035 12.781 6.949 1.00 0.00 H new ATOM 0 HE2 LYS A 895 2.236 15.219 6.403 1.00 0.00 H new ATOM 0 HE3 LYS A 895 0.557 15.711 6.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 895 1.580 15.628 8.720 1.00 0.00 H new ATOM 0 HZ2 LYS A 895 0.346 14.468 8.601 1.00 0.00 H new ATOM 0 HZ3 LYS A 895 1.973 13.990 8.504 1.00 0.00 H new ATOM 1439 N GLU A 896 1.454 10.265 3.431 1.00 0.00 N ATOM 1440 CA GLU A 896 0.396 9.788 2.492 1.00 0.00 C ATOM 1441 C GLU A 896 -0.346 8.561 3.061 1.00 0.00 C ATOM 1442 O GLU A 896 -1.558 8.533 3.090 1.00 0.00 O ATOM 1443 CB GLU A 896 1.142 9.430 1.207 1.00 0.00 C ATOM 1444 CG GLU A 896 1.289 10.677 0.337 1.00 0.00 C ATOM 1445 CD GLU A 896 0.159 10.714 -0.693 1.00 0.00 C ATOM 1446 OE1 GLU A 896 -0.956 10.376 -0.331 1.00 0.00 O ATOM 1447 OE2 GLU A 896 0.427 11.080 -1.825 1.00 0.00 O ATOM 0 H GLU A 896 2.381 10.376 3.020 1.00 0.00 H new ATOM 0 HA GLU A 896 -0.369 10.546 2.324 1.00 0.00 H new ATOM 0 HB2 GLU A 896 2.124 9.023 1.446 1.00 0.00 H new ATOM 0 HB3 GLU A 896 0.600 8.656 0.663 1.00 0.00 H new ATOM 0 HG2 GLU A 896 1.260 11.572 0.958 1.00 0.00 H new ATOM 0 HG3 GLU A 896 2.255 10.670 -0.167 1.00 0.00 H new ATOM 1454 N LEU A 897 0.355 7.558 3.537 1.00 0.00 N ATOM 1455 CA LEU A 897 -0.373 6.355 4.126 1.00 0.00 C ATOM 1456 C LEU A 897 -0.827 6.760 5.483 1.00 0.00 C ATOM 1457 O LEU A 897 -1.983 6.680 5.844 1.00 0.00 O ATOM 1458 CB LEU A 897 0.634 5.224 4.276 1.00 0.00 C ATOM 1459 CG LEU A 897 1.910 5.614 3.584 1.00 0.00 C ATOM 1460 CD1 LEU A 897 2.952 4.539 3.800 1.00 0.00 C ATOM 1461 CD2 LEU A 897 1.592 5.812 2.100 1.00 0.00 C ATOM 0 H LEU A 897 1.374 7.506 3.550 1.00 0.00 H new ATOM 0 HA LEU A 897 -1.207 6.037 3.501 1.00 0.00 H new ATOM 0 HB2 LEU A 897 0.823 5.025 5.331 1.00 0.00 H new ATOM 0 HB3 LEU A 897 0.236 4.305 3.844 1.00 0.00 H new ATOM 0 HG LEU A 897 2.316 6.541 3.988 1.00 0.00 H new ATOM 0 HD11 LEU A 897 3.877 4.823 3.298 1.00 0.00 H new ATOM 0 HD12 LEU A 897 3.139 4.423 4.868 1.00 0.00 H new ATOM 0 HD13 LEU A 897 2.592 3.595 3.391 1.00 0.00 H new ATOM 0 HD21 LEU A 897 2.500 6.097 1.568 1.00 0.00 H new ATOM 0 HD22 LEU A 897 1.204 4.882 1.684 1.00 0.00 H new ATOM 0 HD23 LEU A 897 0.845 6.598 1.990 1.00 0.00 H new ATOM 1473 N LYS A 898 0.107 7.260 6.209 1.00 0.00 N ATOM 1474 CA LYS A 898 -0.187 7.791 7.558 1.00 0.00 C ATOM 1475 C LYS A 898 -1.408 8.683 7.467 1.00 0.00 C ATOM 1476 O LYS A 898 -2.114 8.914 8.429 1.00 0.00 O ATOM 1477 CB LYS A 898 1.013 8.654 7.877 1.00 0.00 C ATOM 1478 CG LYS A 898 0.892 9.209 9.296 1.00 0.00 C ATOM 1479 CD LYS A 898 2.242 9.777 9.737 1.00 0.00 C ATOM 1480 CE LYS A 898 2.015 10.942 10.703 1.00 0.00 C ATOM 1481 NZ LYS A 898 3.382 11.402 11.079 1.00 0.00 N ATOM 0 H LYS A 898 1.084 7.328 5.925 1.00 0.00 H new ATOM 0 HA LYS A 898 -0.368 7.012 8.299 1.00 0.00 H new ATOM 0 HB2 LYS A 898 1.928 8.069 7.783 1.00 0.00 H new ATOM 0 HB3 LYS A 898 1.083 9.473 7.161 1.00 0.00 H new ATOM 0 HG2 LYS A 898 0.129 9.987 9.330 1.00 0.00 H new ATOM 0 HG3 LYS A 898 0.575 8.422 9.980 1.00 0.00 H new ATOM 0 HD2 LYS A 898 2.835 9.000 10.220 1.00 0.00 H new ATOM 0 HD3 LYS A 898 2.807 10.116 8.869 1.00 0.00 H new ATOM 0 HE2 LYS A 898 1.445 11.742 10.230 1.00 0.00 H new ATOM 0 HE3 LYS A 898 1.450 10.624 11.579 1.00 0.00 H new ATOM 0 HZ1 LYS A 898 3.310 12.201 11.741 1.00 0.00 H new ATOM 0 HZ2 LYS A 898 3.898 10.622 11.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 898 3.893 11.705 10.226 1.00 0.00 H new ATOM 1495 N ALA A 899 -1.646 9.187 6.292 1.00 0.00 N ATOM 1496 CA ALA A 899 -2.823 10.082 6.103 1.00 0.00 C ATOM 1497 C ALA A 899 -3.899 9.348 5.306 1.00 0.00 C ATOM 1498 O ALA A 899 -4.992 9.842 5.111 1.00 0.00 O ATOM 1499 CB ALA A 899 -2.286 11.301 5.341 1.00 0.00 C ATOM 0 H ALA A 899 -1.083 9.021 5.458 1.00 0.00 H new ATOM 0 HA ALA A 899 -3.282 10.385 7.044 1.00 0.00 H new ATOM 0 HB1 ALA A 899 -3.098 12.007 5.165 1.00 0.00 H new ATOM 0 HB2 ALA A 899 -1.507 11.784 5.930 1.00 0.00 H new ATOM 0 HB3 ALA A 899 -1.871 10.979 4.386 1.00 0.00 H new ATOM 1505 N ARG A 900 -3.582 8.172 4.825 1.00 0.00 N ATOM 1506 CA ARG A 900 -4.551 7.393 4.019 1.00 0.00 C ATOM 1507 C ARG A 900 -4.807 8.198 2.758 1.00 0.00 C ATOM 1508 O ARG A 900 -5.834 8.107 2.114 1.00 0.00 O ATOM 1509 CB ARG A 900 -5.796 7.223 4.919 1.00 0.00 C ATOM 1510 CG ARG A 900 -7.030 7.852 4.273 1.00 0.00 C ATOM 1511 CD ARG A 900 -8.185 7.874 5.278 1.00 0.00 C ATOM 1512 NE ARG A 900 -8.707 9.267 5.235 1.00 0.00 N ATOM 1513 CZ ARG A 900 -9.176 9.823 6.317 1.00 0.00 C ATOM 1514 NH1 ARG A 900 -10.163 9.265 6.963 1.00 0.00 N ATOM 1515 NH2 ARG A 900 -8.658 10.938 6.756 1.00 0.00 N ATOM 0 H ARG A 900 -2.679 7.719 4.963 1.00 0.00 H new ATOM 0 HA ARG A 900 -4.216 6.403 3.710 1.00 0.00 H new ATOM 0 HB2 ARG A 900 -5.976 6.163 5.100 1.00 0.00 H new ATOM 0 HB3 ARG A 900 -5.614 7.685 5.889 1.00 0.00 H new ATOM 0 HG2 ARG A 900 -6.803 8.866 3.943 1.00 0.00 H new ATOM 0 HG3 ARG A 900 -7.317 7.286 3.387 1.00 0.00 H new ATOM 0 HD2 ARG A 900 -8.958 7.155 5.007 1.00 0.00 H new ATOM 0 HD3 ARG A 900 -7.842 7.612 6.279 1.00 0.00 H new ATOM 0 HE ARG A 900 -8.698 9.787 4.358 1.00 0.00 H new ATOM 0 HH11 ARG A 900 -10.568 8.393 6.622 1.00 0.00 H new ATOM 0 HH12 ARG A 900 -10.529 9.700 7.809 1.00 0.00 H new ATOM 0 HH21 ARG A 900 -7.886 11.375 6.252 1.00 0.00 H new ATOM 0 HH22 ARG A 900 -9.025 11.372 7.603 1.00 0.00 H new ATOM 1529 N LYS A 901 -3.838 8.991 2.402 1.00 0.00 N ATOM 1530 CA LYS A 901 -3.974 9.818 1.201 1.00 0.00 C ATOM 1531 C LYS A 901 -3.458 9.061 -0.004 1.00 0.00 C ATOM 1532 O LYS A 901 -3.260 9.610 -1.070 1.00 0.00 O ATOM 1533 CB LYS A 901 -3.153 11.069 1.476 1.00 0.00 C ATOM 1534 CG LYS A 901 -3.761 11.791 2.673 1.00 0.00 C ATOM 1535 CD LYS A 901 -5.230 12.102 2.383 1.00 0.00 C ATOM 1536 CE LYS A 901 -5.578 13.494 2.914 1.00 0.00 C ATOM 1537 NZ LYS A 901 -6.730 13.945 2.084 1.00 0.00 N ATOM 0 H LYS A 901 -2.956 9.094 2.903 1.00 0.00 H new ATOM 0 HA LYS A 901 -5.010 10.076 0.983 1.00 0.00 H new ATOM 0 HB2 LYS A 901 -2.115 10.804 1.680 1.00 0.00 H new ATOM 0 HB3 LYS A 901 -3.150 11.720 0.602 1.00 0.00 H new ATOM 0 HG2 LYS A 901 -3.678 11.172 3.566 1.00 0.00 H new ATOM 0 HG3 LYS A 901 -3.215 12.713 2.872 1.00 0.00 H new ATOM 0 HD2 LYS A 901 -5.417 12.055 1.310 1.00 0.00 H new ATOM 0 HD3 LYS A 901 -5.869 11.354 2.851 1.00 0.00 H new ATOM 0 HE2 LYS A 901 -5.843 13.459 3.971 1.00 0.00 H new ATOM 0 HE3 LYS A 901 -4.733 14.175 2.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 901 -7.027 14.894 2.389 1.00 0.00 H new ATOM 0 HZ2 LYS A 901 -6.446 13.975 1.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 901 -7.522 13.281 2.199 1.00 0.00 H new ATOM 1551 N ILE A 902 -3.231 7.793 0.173 1.00 0.00 N ATOM 1552 CA ILE A 902 -2.717 6.960 -0.965 1.00 0.00 C ATOM 1553 C ILE A 902 -3.794 6.054 -1.631 1.00 0.00 C ATOM 1554 O ILE A 902 -3.480 4.933 -1.977 1.00 0.00 O ATOM 1555 CB ILE A 902 -1.581 6.094 -0.378 1.00 0.00 C ATOM 1556 CG1 ILE A 902 -2.132 4.878 0.403 1.00 0.00 C ATOM 1557 CG2 ILE A 902 -0.709 6.942 0.546 1.00 0.00 C ATOM 1558 CD1 ILE A 902 -2.887 5.327 1.657 1.00 0.00 C ATOM 0 H ILE A 902 -3.376 7.291 1.049 1.00 0.00 H new ATOM 0 HA ILE A 902 -2.381 7.621 -1.764 1.00 0.00 H new ATOM 0 HB ILE A 902 -0.987 5.718 -1.211 1.00 0.00 H new ATOM 0 HG12 ILE A 902 -2.797 4.300 -0.239 1.00 0.00 H new ATOM 0 HG13 ILE A 902 -1.310 4.220 0.685 1.00 0.00 H new ATOM 0 HG21 ILE A 902 0.091 6.326 0.958 1.00 0.00 H new ATOM 0 HG22 ILE A 902 -0.277 7.768 -0.019 1.00 0.00 H new ATOM 0 HG23 ILE A 902 -1.318 7.337 1.359 1.00 0.00 H new ATOM 0 HD11 ILE A 902 -3.264 4.453 2.187 1.00 0.00 H new ATOM 0 HD12 ILE A 902 -2.213 5.884 2.308 1.00 0.00 H new ATOM 0 HD13 ILE A 902 -3.723 5.965 1.370 1.00 0.00 H new ATOM 1570 N PRO A 903 -5.010 6.539 -1.855 1.00 0.00 N ATOM 1571 CA PRO A 903 -6.020 5.693 -2.538 1.00 0.00 C ATOM 1572 C PRO A 903 -5.513 5.351 -3.928 1.00 0.00 C ATOM 1573 O PRO A 903 -5.570 6.169 -4.826 1.00 0.00 O ATOM 1574 CB PRO A 903 -7.236 6.608 -2.640 1.00 0.00 C ATOM 1575 CG PRO A 903 -6.886 7.961 -1.996 1.00 0.00 C ATOM 1576 CD PRO A 903 -5.446 7.899 -1.468 1.00 0.00 C ATOM 0 HA PRO A 903 -6.235 4.758 -2.021 1.00 0.00 H new ATOM 0 HB2 PRO A 903 -7.518 6.747 -3.684 1.00 0.00 H new ATOM 0 HB3 PRO A 903 -8.091 6.159 -2.135 1.00 0.00 H new ATOM 0 HG2 PRO A 903 -6.986 8.764 -2.726 1.00 0.00 H new ATOM 0 HG3 PRO A 903 -7.577 8.182 -1.183 1.00 0.00 H new ATOM 0 HD2 PRO A 903 -4.818 8.668 -1.917 1.00 0.00 H new ATOM 0 HD3 PRO A 903 -5.405 8.045 -0.389 1.00 0.00 H new ATOM 1583 N ILE A 904 -5.001 4.175 -4.127 1.00 0.00 N ATOM 1584 CA ILE A 904 -4.491 3.852 -5.465 1.00 0.00 C ATOM 1585 C ILE A 904 -4.465 2.349 -5.719 1.00 0.00 C ATOM 1586 O ILE A 904 -4.298 1.538 -4.831 1.00 0.00 O ATOM 1587 CB ILE A 904 -3.098 4.506 -5.506 1.00 0.00 C ATOM 1588 CG1 ILE A 904 -3.139 5.685 -6.473 1.00 0.00 C ATOM 1589 CG2 ILE A 904 -2.028 3.525 -5.976 1.00 0.00 C ATOM 1590 CD1 ILE A 904 -2.324 6.850 -5.908 1.00 0.00 C ATOM 0 H ILE A 904 -4.917 3.438 -3.427 1.00 0.00 H new ATOM 0 HA ILE A 904 -5.129 4.231 -6.263 1.00 0.00 H new ATOM 0 HB ILE A 904 -2.844 4.831 -4.497 1.00 0.00 H new ATOM 0 HG12 ILE A 904 -2.739 5.386 -7.442 1.00 0.00 H new ATOM 0 HG13 ILE A 904 -4.171 5.997 -6.636 1.00 0.00 H new ATOM 0 HG21 ILE A 904 -1.059 4.024 -5.992 1.00 0.00 H new ATOM 0 HG22 ILE A 904 -1.988 2.676 -5.294 1.00 0.00 H new ATOM 0 HG23 ILE A 904 -2.272 3.174 -6.979 1.00 0.00 H new ATOM 0 HD11 ILE A 904 -2.357 7.689 -6.604 1.00 0.00 H new ATOM 0 HD12 ILE A 904 -2.743 7.156 -4.950 1.00 0.00 H new ATOM 0 HD13 ILE A 904 -1.290 6.536 -5.768 1.00 0.00 H new ATOM 1602 N ILE A 905 -4.629 2.004 -6.958 1.00 0.00 N ATOM 1603 CA ILE A 905 -4.624 0.584 -7.375 1.00 0.00 C ATOM 1604 C ILE A 905 -3.180 0.108 -7.539 1.00 0.00 C ATOM 1605 O ILE A 905 -2.318 0.847 -7.973 1.00 0.00 O ATOM 1606 CB ILE A 905 -5.340 0.568 -8.729 1.00 0.00 C ATOM 1607 CG1 ILE A 905 -5.443 -0.874 -9.231 1.00 0.00 C ATOM 1608 CG2 ILE A 905 -4.554 1.397 -9.749 1.00 0.00 C ATOM 1609 CD1 ILE A 905 -6.908 -1.217 -9.478 1.00 0.00 C ATOM 0 H ILE A 905 -4.770 2.667 -7.720 1.00 0.00 H new ATOM 0 HA ILE A 905 -5.109 -0.069 -6.649 1.00 0.00 H new ATOM 0 HB ILE A 905 -6.336 0.994 -8.609 1.00 0.00 H new ATOM 0 HG12 ILE A 905 -4.869 -0.993 -10.150 1.00 0.00 H new ATOM 0 HG13 ILE A 905 -5.016 -1.558 -8.498 1.00 0.00 H new ATOM 0 HG21 ILE A 905 -5.071 1.379 -10.708 1.00 0.00 H new ATOM 0 HG22 ILE A 905 -4.475 2.426 -9.398 1.00 0.00 H new ATOM 0 HG23 ILE A 905 -3.555 0.977 -9.867 1.00 0.00 H new ATOM 0 HD11 ILE A 905 -6.986 -2.244 -9.836 1.00 0.00 H new ATOM 0 HD12 ILE A 905 -7.468 -1.113 -8.548 1.00 0.00 H new ATOM 0 HD13 ILE A 905 -7.319 -0.540 -10.227 1.00 0.00 H new ATOM 1621 N ILE A 906 -2.916 -1.119 -7.211 1.00 0.00 N ATOM 1622 CA ILE A 906 -1.540 -1.658 -7.353 1.00 0.00 C ATOM 1623 C ILE A 906 -1.626 -3.050 -7.966 1.00 0.00 C ATOM 1624 O ILE A 906 -2.514 -3.819 -7.662 1.00 0.00 O ATOM 1625 CB ILE A 906 -0.979 -1.732 -5.923 1.00 0.00 C ATOM 1626 CG1 ILE A 906 -0.283 -0.421 -5.576 1.00 0.00 C ATOM 1627 CG2 ILE A 906 0.037 -2.875 -5.808 1.00 0.00 C ATOM 1628 CD1 ILE A 906 -1.329 0.636 -5.241 1.00 0.00 C ATOM 0 H ILE A 906 -3.602 -1.780 -6.846 1.00 0.00 H new ATOM 0 HA ILE A 906 -0.906 -1.044 -7.992 1.00 0.00 H new ATOM 0 HB ILE A 906 -1.806 -1.911 -5.236 1.00 0.00 H new ATOM 0 HG12 ILE A 906 0.387 -0.566 -4.729 1.00 0.00 H new ATOM 0 HG13 ILE A 906 0.330 -0.089 -6.414 1.00 0.00 H new ATOM 0 HG21 ILE A 906 0.426 -2.915 -4.790 1.00 0.00 H new ATOM 0 HG22 ILE A 906 -0.450 -3.820 -6.048 1.00 0.00 H new ATOM 0 HG23 ILE A 906 0.858 -2.703 -6.504 1.00 0.00 H new ATOM 0 HD11 ILE A 906 -0.832 1.574 -4.993 1.00 0.00 H new ATOM 0 HD12 ILE A 906 -1.981 0.788 -6.101 1.00 0.00 H new ATOM 0 HD13 ILE A 906 -1.923 0.303 -4.389 1.00 0.00 H new ATOM 1640 N ARG A 907 -0.720 -3.386 -8.821 1.00 0.00 N ATOM 1641 CA ARG A 907 -0.787 -4.754 -9.430 1.00 0.00 C ATOM 1642 C ARG A 907 0.069 -5.718 -8.648 1.00 0.00 C ATOM 1643 O ARG A 907 1.275 -5.709 -8.749 1.00 0.00 O ATOM 1644 CB ARG A 907 -0.263 -4.625 -10.843 1.00 0.00 C ATOM 1645 CG ARG A 907 -1.365 -4.049 -11.731 1.00 0.00 C ATOM 1646 CD ARG A 907 -1.806 -2.671 -11.213 1.00 0.00 C ATOM 1647 NE ARG A 907 -2.205 -1.912 -12.432 1.00 0.00 N ATOM 1648 CZ ARG A 907 -3.295 -2.233 -13.076 1.00 0.00 C ATOM 1649 NH1 ARG A 907 -4.394 -2.480 -12.416 1.00 0.00 N ATOM 1650 NH2 ARG A 907 -3.286 -2.307 -14.379 1.00 0.00 N ATOM 0 H ARG A 907 0.054 -2.797 -9.129 1.00 0.00 H new ATOM 0 HA ARG A 907 -1.808 -5.136 -9.420 1.00 0.00 H new ATOM 0 HB2 ARG A 907 0.613 -3.977 -10.862 1.00 0.00 H new ATOM 0 HB3 ARG A 907 0.052 -5.599 -11.218 1.00 0.00 H new ATOM 0 HG2 ARG A 907 -1.006 -3.961 -12.756 1.00 0.00 H new ATOM 0 HG3 ARG A 907 -2.218 -4.728 -11.749 1.00 0.00 H new ATOM 0 HD2 ARG A 907 -2.637 -2.760 -10.513 1.00 0.00 H new ATOM 0 HD3 ARG A 907 -0.995 -2.170 -10.684 1.00 0.00 H new ATOM 0 HE ARG A 907 -1.626 -1.141 -12.764 1.00 0.00 H new ATOM 0 HH11 ARG A 907 -4.401 -2.422 -11.398 1.00 0.00 H new ATOM 0 HH12 ARG A 907 -5.245 -2.731 -12.919 1.00 0.00 H new ATOM 0 HH21 ARG A 907 -2.427 -2.114 -14.895 1.00 0.00 H new ATOM 0 HH22 ARG A 907 -4.137 -2.558 -14.881 1.00 0.00 H new ATOM 1664 N ARG A 908 -0.547 -6.566 -7.888 1.00 0.00 N ATOM 1665 CA ARG A 908 0.253 -7.547 -7.111 1.00 0.00 C ATOM 1666 C ARG A 908 0.551 -8.766 -7.993 1.00 0.00 C ATOM 1667 O ARG A 908 -0.204 -9.719 -8.007 1.00 0.00 O ATOM 1668 CB ARG A 908 -0.602 -7.998 -5.897 1.00 0.00 C ATOM 1669 CG ARG A 908 -1.455 -6.852 -5.302 1.00 0.00 C ATOM 1670 CD ARG A 908 -2.031 -7.285 -3.922 1.00 0.00 C ATOM 1671 NE ARG A 908 -1.042 -6.806 -2.909 1.00 0.00 N ATOM 1672 CZ ARG A 908 0.199 -7.212 -2.947 1.00 0.00 C ATOM 1673 NH1 ARG A 908 0.554 -8.284 -2.293 1.00 0.00 N ATOM 1674 NH2 ARG A 908 1.083 -6.544 -3.636 1.00 0.00 N ATOM 0 H ARG A 908 -1.558 -6.626 -7.769 1.00 0.00 H new ATOM 0 HA ARG A 908 1.191 -7.102 -6.780 1.00 0.00 H new ATOM 0 HB2 ARG A 908 -1.259 -8.812 -6.204 1.00 0.00 H new ATOM 0 HB3 ARG A 908 0.055 -8.394 -5.123 1.00 0.00 H new ATOM 0 HG2 ARG A 908 -0.846 -5.955 -5.187 1.00 0.00 H new ATOM 0 HG3 ARG A 908 -2.268 -6.600 -5.983 1.00 0.00 H new ATOM 0 HD2 ARG A 908 -3.013 -6.844 -3.751 1.00 0.00 H new ATOM 0 HD3 ARG A 908 -2.154 -8.367 -3.870 1.00 0.00 H new ATOM 0 HE ARG A 908 -1.339 -6.156 -2.181 1.00 0.00 H new ATOM 0 HH11 ARG A 908 -0.137 -8.804 -1.753 1.00 0.00 H new ATOM 0 HH12 ARG A 908 1.523 -8.602 -2.322 1.00 0.00 H new ATOM 0 HH21 ARG A 908 0.805 -5.705 -4.145 1.00 0.00 H new ATOM 0 HH22 ARG A 908 2.052 -6.861 -3.666 1.00 0.00 H new ATOM 1688 N TYR A 909 1.663 -8.777 -8.690 1.00 0.00 N ATOM 1689 CA TYR A 909 1.999 -9.962 -9.500 1.00 0.00 C ATOM 1690 C TYR A 909 2.717 -10.938 -8.594 1.00 0.00 C ATOM 1691 O TYR A 909 2.977 -10.654 -7.442 1.00 0.00 O ATOM 1692 CB TYR A 909 2.962 -9.559 -10.625 1.00 0.00 C ATOM 1693 CG TYR A 909 2.691 -8.184 -11.194 1.00 0.00 C ATOM 1694 CD1 TYR A 909 3.284 -7.050 -10.627 1.00 0.00 C ATOM 1695 CD2 TYR A 909 1.896 -8.053 -12.332 1.00 0.00 C ATOM 1696 CE1 TYR A 909 3.082 -5.796 -11.195 1.00 0.00 C ATOM 1697 CE2 TYR A 909 1.683 -6.799 -12.896 1.00 0.00 C ATOM 1698 CZ TYR A 909 2.276 -5.668 -12.335 1.00 0.00 C ATOM 1699 OH TYR A 909 2.073 -4.432 -12.913 1.00 0.00 O ATOM 0 H TYR A 909 2.341 -8.015 -8.725 1.00 0.00 H new ATOM 0 HA TYR A 909 1.096 -10.397 -9.929 1.00 0.00 H new ATOM 0 HB2 TYR A 909 3.983 -9.591 -10.246 1.00 0.00 H new ATOM 0 HB3 TYR A 909 2.897 -10.294 -11.427 1.00 0.00 H new ATOM 0 HD1 TYR A 909 3.900 -7.149 -9.746 1.00 0.00 H new ATOM 0 HD2 TYR A 909 1.444 -8.927 -12.777 1.00 0.00 H new ATOM 0 HE1 TYR A 909 3.545 -4.923 -10.759 1.00 0.00 H new ATOM 0 HE2 TYR A 909 1.057 -6.701 -13.770 1.00 0.00 H new ATOM 0 HH TYR A 909 1.490 -4.528 -13.695 1.00 0.00 H new ATOM 1709 N LEU A 910 3.056 -12.072 -9.099 1.00 0.00 N ATOM 1710 CA LEU A 910 3.763 -13.059 -8.268 1.00 0.00 C ATOM 1711 C LEU A 910 4.927 -13.689 -9.031 1.00 0.00 C ATOM 1712 O LEU A 910 4.718 -14.422 -9.976 1.00 0.00 O ATOM 1713 CB LEU A 910 2.702 -14.106 -7.950 1.00 0.00 C ATOM 1714 CG LEU A 910 1.564 -13.494 -7.135 1.00 0.00 C ATOM 1715 CD1 LEU A 910 0.624 -14.616 -6.707 1.00 0.00 C ATOM 1716 CD2 LEU A 910 2.108 -12.787 -5.893 1.00 0.00 C ATOM 0 H LEU A 910 2.873 -12.362 -10.060 1.00 0.00 H new ATOM 0 HA LEU A 910 4.196 -12.611 -7.374 1.00 0.00 H new ATOM 0 HB2 LEU A 910 2.308 -14.524 -8.876 1.00 0.00 H new ATOM 0 HB3 LEU A 910 3.152 -14.929 -7.395 1.00 0.00 H new ATOM 0 HG LEU A 910 1.037 -12.760 -7.744 1.00 0.00 H new ATOM 0 HD11 LEU A 910 -0.197 -14.200 -6.123 1.00 0.00 H new ATOM 0 HD12 LEU A 910 0.225 -15.113 -7.591 1.00 0.00 H new ATOM 0 HD13 LEU A 910 1.171 -15.338 -6.101 1.00 0.00 H new ATOM 0 HD21 LEU A 910 1.281 -12.358 -5.327 1.00 0.00 H new ATOM 0 HD22 LEU A 910 2.641 -13.505 -5.270 1.00 0.00 H new ATOM 0 HD23 LEU A 910 2.790 -11.993 -6.196 1.00 0.00 H new ATOM 1728 N PRO A 911 6.126 -13.425 -8.565 1.00 0.00 N ATOM 1729 CA PRO A 911 7.322 -14.027 -9.186 1.00 0.00 C ATOM 1730 C PRO A 911 7.229 -15.544 -9.024 1.00 0.00 C ATOM 1731 O PRO A 911 7.963 -16.299 -9.630 1.00 0.00 O ATOM 1732 CB PRO A 911 8.468 -13.456 -8.344 1.00 0.00 C ATOM 1733 CG PRO A 911 7.871 -12.550 -7.250 1.00 0.00 C ATOM 1734 CD PRO A 911 6.345 -12.526 -7.411 1.00 0.00 C ATOM 0 HA PRO A 911 7.444 -13.818 -10.249 1.00 0.00 H new ATOM 0 HB2 PRO A 911 9.045 -14.264 -7.893 1.00 0.00 H new ATOM 0 HB3 PRO A 911 9.153 -12.888 -8.973 1.00 0.00 H new ATOM 0 HG2 PRO A 911 8.141 -12.922 -6.262 1.00 0.00 H new ATOM 0 HG3 PRO A 911 8.276 -11.541 -7.332 1.00 0.00 H new ATOM 0 HD2 PRO A 911 5.838 -12.885 -6.516 1.00 0.00 H new ATOM 0 HD3 PRO A 911 5.974 -11.520 -7.605 1.00 0.00 H new ATOM 1741 N ASP A 912 6.305 -15.985 -8.203 1.00 0.00 N ATOM 1742 CA ASP A 912 6.123 -17.441 -7.981 1.00 0.00 C ATOM 1743 C ASP A 912 5.412 -18.043 -9.185 1.00 0.00 C ATOM 1744 O ASP A 912 5.701 -19.147 -9.600 1.00 0.00 O ATOM 1745 CB ASP A 912 5.239 -17.544 -6.739 1.00 0.00 C ATOM 1746 CG ASP A 912 6.115 -17.734 -5.499 1.00 0.00 C ATOM 1747 OD1 ASP A 912 6.986 -16.907 -5.281 1.00 0.00 O ATOM 1748 OD2 ASP A 912 5.901 -18.702 -4.790 1.00 0.00 O ATOM 0 H ASP A 912 5.668 -15.387 -7.676 1.00 0.00 H new ATOM 0 HA ASP A 912 7.067 -17.971 -7.851 1.00 0.00 H new ATOM 0 HB2 ASP A 912 4.635 -16.643 -6.635 1.00 0.00 H new ATOM 0 HB3 ASP A 912 4.548 -18.381 -6.840 1.00 0.00 H new ATOM 1753 N GLY A 913 4.484 -17.320 -9.756 1.00 0.00 N ATOM 1754 CA GLY A 913 3.767 -17.871 -10.948 1.00 0.00 C ATOM 1755 C GLY A 913 2.294 -17.512 -10.887 1.00 0.00 C ATOM 1756 O GLY A 913 1.419 -18.337 -11.059 1.00 0.00 O ATOM 0 H GLY A 913 4.194 -16.389 -9.457 1.00 0.00 H new ATOM 0 HA2 GLY A 913 4.208 -17.474 -11.862 1.00 0.00 H new ATOM 0 HA3 GLY A 913 3.883 -18.954 -10.983 1.00 0.00 H new ATOM 1760 N SER A 914 2.036 -16.276 -10.655 1.00 0.00 N ATOM 1761 CA SER A 914 0.637 -15.774 -10.580 1.00 0.00 C ATOM 1762 C SER A 914 0.676 -14.260 -10.566 1.00 0.00 C ATOM 1763 O SER A 914 1.716 -13.665 -10.773 1.00 0.00 O ATOM 1764 CB SER A 914 0.074 -16.314 -9.270 1.00 0.00 C ATOM 1765 OG SER A 914 -0.304 -17.673 -9.442 1.00 0.00 O ATOM 0 H SER A 914 2.749 -15.562 -10.508 1.00 0.00 H new ATOM 0 HA SER A 914 0.023 -16.091 -11.423 1.00 0.00 H new ATOM 0 HB2 SER A 914 0.819 -16.230 -8.479 1.00 0.00 H new ATOM 0 HB3 SER A 914 -0.787 -15.722 -8.960 1.00 0.00 H new ATOM 0 HG SER A 914 0.108 -18.026 -10.258 1.00 0.00 H new ATOM 1771 N TYR A 915 -0.429 -13.626 -10.317 1.00 0.00 N ATOM 1772 CA TYR A 915 -0.430 -12.147 -10.283 1.00 0.00 C ATOM 1773 C TYR A 915 -1.883 -11.625 -10.222 1.00 0.00 C ATOM 1774 O TYR A 915 -2.794 -12.245 -10.733 1.00 0.00 O ATOM 1775 CB TYR A 915 0.244 -11.720 -11.607 1.00 0.00 C ATOM 1776 CG TYR A 915 -0.438 -10.512 -12.229 1.00 0.00 C ATOM 1777 CD1 TYR A 915 -0.557 -9.308 -11.518 1.00 0.00 C ATOM 1778 CD2 TYR A 915 -0.933 -10.596 -13.538 1.00 0.00 C ATOM 1779 CE1 TYR A 915 -1.165 -8.198 -12.114 1.00 0.00 C ATOM 1780 CE2 TYR A 915 -1.544 -9.486 -14.130 1.00 0.00 C ATOM 1781 CZ TYR A 915 -1.658 -8.287 -13.421 1.00 0.00 C ATOM 1782 OH TYR A 915 -2.257 -7.191 -14.008 1.00 0.00 O ATOM 0 H TYR A 915 -1.330 -14.069 -10.136 1.00 0.00 H new ATOM 0 HA TYR A 915 0.092 -11.748 -9.413 1.00 0.00 H new ATOM 0 HB2 TYR A 915 1.293 -11.489 -11.422 1.00 0.00 H new ATOM 0 HB3 TYR A 915 0.220 -12.552 -12.311 1.00 0.00 H new ATOM 0 HD1 TYR A 915 -0.179 -9.238 -10.509 1.00 0.00 H new ATOM 0 HD2 TYR A 915 -0.842 -11.520 -14.090 1.00 0.00 H new ATOM 0 HE1 TYR A 915 -1.254 -7.272 -11.565 1.00 0.00 H new ATOM 0 HE2 TYR A 915 -1.928 -9.555 -15.137 1.00 0.00 H new ATOM 0 HH TYR A 915 -2.542 -7.422 -14.917 1.00 0.00 H new ATOM 1792 N GLU A 916 -2.091 -10.480 -9.634 1.00 0.00 N ATOM 1793 CA GLU A 916 -3.468 -9.887 -9.568 1.00 0.00 C ATOM 1794 C GLU A 916 -3.388 -8.358 -9.543 1.00 0.00 C ATOM 1795 O GLU A 916 -2.494 -7.785 -8.956 1.00 0.00 O ATOM 1796 CB GLU A 916 -4.072 -10.399 -8.271 1.00 0.00 C ATOM 1797 CG GLU A 916 -5.506 -10.871 -8.521 1.00 0.00 C ATOM 1798 CD GLU A 916 -6.474 -9.696 -8.363 1.00 0.00 C ATOM 1799 OE1 GLU A 916 -6.077 -8.584 -8.656 1.00 0.00 O ATOM 1800 OE2 GLU A 916 -7.598 -9.931 -7.951 1.00 0.00 O ATOM 0 H GLU A 916 -1.363 -9.920 -9.191 1.00 0.00 H new ATOM 0 HA GLU A 916 -4.068 -10.166 -10.434 1.00 0.00 H new ATOM 0 HB2 GLU A 916 -3.472 -11.220 -7.878 1.00 0.00 H new ATOM 0 HB3 GLU A 916 -4.064 -9.610 -7.519 1.00 0.00 H new ATOM 0 HG2 GLU A 916 -5.591 -11.291 -9.523 1.00 0.00 H new ATOM 0 HG3 GLU A 916 -5.765 -11.664 -7.820 1.00 0.00 H new ATOM 1807 N ASP A 917 -4.330 -7.696 -10.160 1.00 0.00 N ATOM 1808 CA ASP A 917 -4.323 -6.206 -10.156 1.00 0.00 C ATOM 1809 C ASP A 917 -5.516 -5.673 -9.384 1.00 0.00 C ATOM 1810 O ASP A 917 -6.557 -6.290 -9.300 1.00 0.00 O ATOM 1811 CB ASP A 917 -4.384 -5.782 -11.610 1.00 0.00 C ATOM 1812 CG ASP A 917 -5.736 -6.157 -12.233 1.00 0.00 C ATOM 1813 OD1 ASP A 917 -6.459 -6.927 -11.624 1.00 0.00 O ATOM 1814 OD2 ASP A 917 -6.022 -5.664 -13.311 1.00 0.00 O ATOM 0 H ASP A 917 -5.105 -8.124 -10.667 1.00 0.00 H new ATOM 0 HA ASP A 917 -3.431 -5.810 -9.670 1.00 0.00 H new ATOM 0 HB2 ASP A 917 -4.230 -4.706 -11.686 1.00 0.00 H new ATOM 0 HB3 ASP A 917 -3.578 -6.259 -12.166 1.00 0.00 H new ATOM 1819 N TRP A 918 -5.319 -4.518 -8.827 1.00 0.00 N ATOM 1820 CA TRP A 918 -6.328 -3.791 -7.984 1.00 0.00 C ATOM 1821 C TRP A 918 -5.612 -3.231 -6.767 1.00 0.00 C ATOM 1822 O TRP A 918 -4.431 -3.440 -6.597 1.00 0.00 O ATOM 1823 CB TRP A 918 -7.455 -4.737 -7.547 1.00 0.00 C ATOM 1824 CG TRP A 918 -6.981 -6.017 -6.919 1.00 0.00 C ATOM 1825 CD1 TRP A 918 -5.717 -6.496 -6.841 1.00 0.00 C ATOM 1826 CD2 TRP A 918 -7.812 -6.975 -6.251 1.00 0.00 C ATOM 1827 NE1 TRP A 918 -5.756 -7.752 -6.262 1.00 0.00 N ATOM 1828 CE2 TRP A 918 -7.034 -8.071 -5.839 1.00 0.00 C ATOM 1829 CE3 TRP A 918 -9.174 -6.981 -5.986 1.00 0.00 C ATOM 1830 CZ2 TRP A 918 -7.612 -9.157 -5.174 1.00 0.00 C ATOM 1831 CZ3 TRP A 918 -9.764 -8.037 -5.310 1.00 0.00 C ATOM 1832 CH2 TRP A 918 -8.989 -9.136 -4.898 1.00 0.00 C ATOM 0 H TRP A 918 -4.441 -4.008 -8.925 1.00 0.00 H new ATOM 0 HA TRP A 918 -6.779 -2.985 -8.563 1.00 0.00 H new ATOM 0 HB2 TRP A 918 -8.097 -4.215 -6.838 1.00 0.00 H new ATOM 0 HB3 TRP A 918 -8.068 -4.978 -8.415 1.00 0.00 H new ATOM 0 HD1 TRP A 918 -4.827 -5.983 -7.175 1.00 0.00 H new ATOM 0 HE1 TRP A 918 -4.946 -8.364 -6.160 1.00 0.00 H new ATOM 0 HE3 TRP A 918 -9.783 -6.151 -6.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 918 -7.007 -10.001 -4.876 1.00 0.00 H new ATOM 0 HZ3 TRP A 918 -10.823 -8.016 -5.099 1.00 0.00 H new ATOM 0 HH2 TRP A 918 -9.450 -9.959 -4.372 1.00 0.00 H new ATOM 1843 N GLY A 919 -6.284 -2.510 -5.917 1.00 0.00 N ATOM 1844 CA GLY A 919 -5.554 -1.957 -4.745 1.00 0.00 C ATOM 1845 C GLY A 919 -6.509 -1.439 -3.702 1.00 0.00 C ATOM 1846 O GLY A 919 -6.777 -2.078 -2.708 1.00 0.00 O ATOM 0 H GLY A 919 -7.277 -2.284 -5.977 1.00 0.00 H new ATOM 0 HA2 GLY A 919 -4.921 -2.730 -4.310 1.00 0.00 H new ATOM 0 HA3 GLY A 919 -4.895 -1.152 -5.071 1.00 0.00 H new ATOM 1850 N VAL A 920 -7.017 -0.279 -3.913 1.00 0.00 N ATOM 1851 CA VAL A 920 -7.960 0.285 -2.928 1.00 0.00 C ATOM 1852 C VAL A 920 -9.296 0.480 -3.608 1.00 0.00 C ATOM 1853 O VAL A 920 -10.277 0.839 -2.988 1.00 0.00 O ATOM 1854 CB VAL A 920 -7.355 1.620 -2.509 1.00 0.00 C ATOM 1855 CG1 VAL A 920 -8.304 2.345 -1.551 1.00 0.00 C ATOM 1856 CG2 VAL A 920 -6.028 1.352 -1.806 1.00 0.00 C ATOM 0 H VAL A 920 -6.824 0.309 -4.724 1.00 0.00 H new ATOM 0 HA VAL A 920 -8.117 -0.356 -2.060 1.00 0.00 H new ATOM 0 HB VAL A 920 -7.196 2.245 -3.387 1.00 0.00 H new ATOM 0 HG11 VAL A 920 -7.865 3.298 -1.256 1.00 0.00 H new ATOM 0 HG12 VAL A 920 -9.257 2.523 -2.049 1.00 0.00 H new ATOM 0 HG13 VAL A 920 -8.466 1.731 -0.665 1.00 0.00 H new ATOM 0 HG21 VAL A 920 -5.581 2.298 -1.499 1.00 0.00 H new ATOM 0 HG22 VAL A 920 -6.201 0.730 -0.927 1.00 0.00 H new ATOM 0 HG23 VAL A 920 -5.352 0.836 -2.488 1.00 0.00 H new ATOM 1866 N ASP A 921 -9.347 0.228 -4.888 1.00 0.00 N ATOM 1867 CA ASP A 921 -10.640 0.393 -5.591 1.00 0.00 C ATOM 1868 C ASP A 921 -11.451 -0.884 -5.480 1.00 0.00 C ATOM 1869 O ASP A 921 -12.651 -0.896 -5.673 1.00 0.00 O ATOM 1870 CB ASP A 921 -10.288 0.688 -7.045 1.00 0.00 C ATOM 1871 CG ASP A 921 -11.578 0.916 -7.835 1.00 0.00 C ATOM 1872 OD1 ASP A 921 -12.300 1.840 -7.498 1.00 0.00 O ATOM 1873 OD2 ASP A 921 -11.823 0.162 -8.762 1.00 0.00 O ATOM 0 H ASP A 921 -8.563 -0.079 -5.464 1.00 0.00 H new ATOM 0 HA ASP A 921 -11.241 1.195 -5.163 1.00 0.00 H new ATOM 0 HB2 ASP A 921 -9.649 1.569 -7.106 1.00 0.00 H new ATOM 0 HB3 ASP A 921 -9.727 -0.143 -7.472 1.00 0.00 H new ATOM 1878 N GLU A 922 -10.797 -1.961 -5.185 1.00 0.00 N ATOM 1879 CA GLU A 922 -11.506 -3.249 -5.075 1.00 0.00 C ATOM 1880 C GLU A 922 -11.215 -3.901 -3.718 1.00 0.00 C ATOM 1881 O GLU A 922 -11.812 -4.894 -3.352 1.00 0.00 O ATOM 1882 CB GLU A 922 -10.907 -4.044 -6.219 1.00 0.00 C ATOM 1883 CG GLU A 922 -11.856 -5.179 -6.613 1.00 0.00 C ATOM 1884 CD GLU A 922 -11.574 -5.603 -8.056 1.00 0.00 C ATOM 1885 OE1 GLU A 922 -11.804 -4.801 -8.945 1.00 0.00 O ATOM 1886 OE2 GLU A 922 -11.133 -6.725 -8.246 1.00 0.00 O ATOM 0 H GLU A 922 -9.792 -2.003 -5.014 1.00 0.00 H new ATOM 0 HA GLU A 922 -12.592 -3.172 -5.132 1.00 0.00 H new ATOM 0 HB2 GLU A 922 -10.730 -3.392 -7.074 1.00 0.00 H new ATOM 0 HB3 GLU A 922 -9.940 -4.452 -5.924 1.00 0.00 H new ATOM 0 HG2 GLU A 922 -11.724 -6.027 -5.941 1.00 0.00 H new ATOM 0 HG3 GLU A 922 -12.891 -4.852 -6.515 1.00 0.00 H new ATOM 1893 N LEU A 923 -10.287 -3.351 -2.980 1.00 0.00 N ATOM 1894 CA LEU A 923 -9.933 -3.937 -1.650 1.00 0.00 C ATOM 1895 C LEU A 923 -9.371 -2.884 -0.681 1.00 0.00 C ATOM 1896 O LEU A 923 -9.717 -1.719 -0.710 1.00 0.00 O ATOM 1897 CB LEU A 923 -8.885 -5.022 -1.938 1.00 0.00 C ATOM 1898 CG LEU A 923 -7.890 -4.510 -2.966 1.00 0.00 C ATOM 1899 CD1 LEU A 923 -6.448 -4.719 -2.520 1.00 0.00 C ATOM 1900 CD2 LEU A 923 -8.107 -5.299 -4.199 1.00 0.00 C ATOM 0 H LEU A 923 -9.757 -2.519 -3.240 1.00 0.00 H new ATOM 0 HA LEU A 923 -10.820 -4.342 -1.162 1.00 0.00 H new ATOM 0 HB2 LEU A 923 -8.366 -5.294 -1.019 1.00 0.00 H new ATOM 0 HB3 LEU A 923 -9.373 -5.924 -2.307 1.00 0.00 H new ATOM 0 HG LEU A 923 -8.044 -3.441 -3.110 1.00 0.00 H new ATOM 0 HD11 LEU A 923 -5.772 -4.338 -3.285 1.00 0.00 H new ATOM 0 HD12 LEU A 923 -6.275 -4.186 -1.585 1.00 0.00 H new ATOM 0 HD13 LEU A 923 -6.264 -5.783 -2.370 1.00 0.00 H new ATOM 0 HD21 LEU A 923 -7.412 -4.967 -4.971 1.00 0.00 H new ATOM 0 HD22 LEU A 923 -7.938 -6.355 -3.989 1.00 0.00 H new ATOM 0 HD23 LEU A 923 -9.130 -5.157 -4.546 1.00 0.00 H new ATOM 1912 N ILE A 924 -8.548 -3.345 0.210 1.00 0.00 N ATOM 1913 CA ILE A 924 -7.943 -2.500 1.281 1.00 0.00 C ATOM 1914 C ILE A 924 -6.847 -1.567 0.811 1.00 0.00 C ATOM 1915 O ILE A 924 -6.340 -1.630 -0.284 1.00 0.00 O ATOM 1916 CB ILE A 924 -7.414 -3.494 2.345 1.00 0.00 C ATOM 1917 CG1 ILE A 924 -8.276 -3.336 3.572 1.00 0.00 C ATOM 1918 CG2 ILE A 924 -5.935 -3.289 2.721 1.00 0.00 C ATOM 1919 CD1 ILE A 924 -9.633 -3.908 3.221 1.00 0.00 C ATOM 0 H ILE A 924 -8.253 -4.321 0.244 1.00 0.00 H new ATOM 0 HA ILE A 924 -8.700 -1.821 1.673 1.00 0.00 H new ATOM 0 HB ILE A 924 -7.468 -4.497 1.922 1.00 0.00 H new ATOM 0 HG12 ILE A 924 -7.841 -3.862 4.422 1.00 0.00 H new ATOM 0 HG13 ILE A 924 -8.359 -2.287 3.855 1.00 0.00 H new ATOM 0 HG21 ILE A 924 -5.645 -4.025 3.471 1.00 0.00 H new ATOM 0 HG22 ILE A 924 -5.314 -3.411 1.834 1.00 0.00 H new ATOM 0 HG23 ILE A 924 -5.798 -2.286 3.125 1.00 0.00 H new ATOM 0 HD11 ILE A 924 -10.299 -3.818 4.079 1.00 0.00 H new ATOM 0 HD12 ILE A 924 -10.052 -3.359 2.378 1.00 0.00 H new ATOM 0 HD13 ILE A 924 -9.526 -4.959 2.953 1.00 0.00 H new ATOM 1931 N ILE A 925 -6.497 -0.717 1.712 1.00 0.00 N ATOM 1932 CA ILE A 925 -5.409 0.265 1.523 1.00 0.00 C ATOM 1933 C ILE A 925 -4.147 -0.382 2.110 1.00 0.00 C ATOM 1934 O ILE A 925 -3.915 -1.561 1.940 1.00 0.00 O ATOM 1935 CB ILE A 925 -5.902 1.480 2.332 1.00 0.00 C ATOM 1936 CG1 ILE A 925 -5.043 2.720 2.026 1.00 0.00 C ATOM 1937 CG2 ILE A 925 -5.870 1.155 3.834 1.00 0.00 C ATOM 1938 CD1 ILE A 925 -4.998 3.638 3.255 1.00 0.00 C ATOM 0 H ILE A 925 -6.946 -0.658 2.626 1.00 0.00 H new ATOM 0 HA ILE A 925 -5.178 0.559 0.499 1.00 0.00 H new ATOM 0 HB ILE A 925 -6.929 1.702 2.043 1.00 0.00 H new ATOM 0 HG12 ILE A 925 -4.033 2.415 1.751 1.00 0.00 H new ATOM 0 HG13 ILE A 925 -5.456 3.259 1.173 1.00 0.00 H new ATOM 0 HG21 ILE A 925 -6.220 2.018 4.401 1.00 0.00 H new ATOM 0 HG22 ILE A 925 -6.518 0.302 4.036 1.00 0.00 H new ATOM 0 HG23 ILE A 925 -4.850 0.914 4.133 1.00 0.00 H new ATOM 0 HD11 ILE A 925 -4.389 4.514 3.033 1.00 0.00 H new ATOM 0 HD12 ILE A 925 -6.009 3.955 3.510 1.00 0.00 H new ATOM 0 HD13 ILE A 925 -4.564 3.098 4.097 1.00 0.00 H new ATOM 1950 N THR A 926 -3.358 0.345 2.813 1.00 0.00 N ATOM 1951 CA THR A 926 -2.140 -0.252 3.425 1.00 0.00 C ATOM 1952 C THR A 926 -2.568 -1.325 4.428 1.00 0.00 C ATOM 1953 O THR A 926 -1.849 -2.266 4.697 1.00 0.00 O ATOM 1954 CB THR A 926 -1.475 0.912 4.160 1.00 0.00 C ATOM 1955 OG1 THR A 926 -1.251 1.977 3.249 1.00 0.00 O ATOM 1956 CG2 THR A 926 -0.148 0.453 4.770 1.00 0.00 C ATOM 0 H THR A 926 -3.494 1.338 3.000 1.00 0.00 H new ATOM 0 HA THR A 926 -1.474 -0.715 2.697 1.00 0.00 H new ATOM 0 HB THR A 926 -2.128 1.256 4.962 1.00 0.00 H new ATOM 0 HG1 THR A 926 -1.449 2.830 3.688 1.00 0.00 H new ATOM 0 HG21 THR A 926 0.320 1.287 5.292 1.00 0.00 H new ATOM 0 HG22 THR A 926 -0.333 -0.358 5.474 1.00 0.00 H new ATOM 0 HG23 THR A 926 0.514 0.103 3.978 1.00 0.00 H new ATOM 1964 N ASP A 927 -3.755 -1.191 4.962 1.00 0.00 N ATOM 1965 CA ASP A 927 -4.280 -2.203 5.937 1.00 0.00 C ATOM 1966 C ASP A 927 -5.612 -1.722 6.518 1.00 0.00 C ATOM 1967 O ASP A 927 -6.203 -2.463 7.286 1.00 0.00 O ATOM 1968 CB ASP A 927 -3.221 -2.303 7.043 1.00 0.00 C ATOM 1969 CG ASP A 927 -2.545 -3.677 6.995 1.00 0.00 C ATOM 1970 OD1 ASP A 927 -2.545 -4.283 5.936 1.00 0.00 O ATOM 1971 OD2 ASP A 927 -2.038 -4.101 8.021 1.00 0.00 O ATOM 1972 OXT ASP A 927 -6.017 -0.620 6.184 1.00 0.00 O ATOM 0 H ASP A 927 -4.391 -0.418 4.764 1.00 0.00 H new ATOM 0 HA ASP A 927 -4.458 -3.170 5.466 1.00 0.00 H new ATOM 0 HB2 ASP A 927 -2.476 -1.517 6.918 1.00 0.00 H new ATOM 0 HB3 ASP A 927 -3.685 -2.150 8.017 1.00 0.00 H new