USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 546 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 43 SER OG : rot 46:sc= 0.643 USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 55 LYS NZ :NH3+ -169:sc= -0.0209 (180deg=-0.217) USER MOD Single : A 58 LYS NZ :NH3+ 137:sc= -1.33 (180deg=-1.61) USER MOD Single : A 60 ASN : amide:sc= -3.61! K(o=-3.6!,f=-0.058) USER MOD Single : A 64 LYS NZ :NH3+ -144:sc= -1.71! (180deg=-3.77!) USER MOD Single : A 66 LYS NZ :NH3+ -167:sc= -0.0523 (180deg=-0.289) USER MOD Single : A 67 THR OG1 : rot 24:sc= 0.601 USER MOD Single : A 69 SER OG : rot -76:sc= 1.24 USER MOD Single : A 72 MET CE :methyl -163:sc= -0.0913 (180deg=-0.613) USER MOD Single : B 43 SER OG : rot 46:sc= 0.888 USER MOD Single : B 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 55 LYS NZ :NH3+ -170:sc=-0.00261 (180deg=-0.154) USER MOD Single : B 58 LYS NZ :NH3+ 141:sc= -0.906 (180deg=-1.13) USER MOD Single : B 60 ASN : amide:sc= -3.62! K(o=-3.6!,f=-0.068) USER MOD Single : B 64 LYS NZ :NH3+ -150:sc= -1.95! (180deg=-4.02!) USER MOD Single : B 66 LYS NZ :NH3+ -167:sc= -0.0347 (180deg=-0.298) USER MOD Single : B 67 THR OG1 : rot 25:sc= 0.671 USER MOD Single : B 69 SER OG : rot -72:sc= 1.22 USER MOD Single : B 72 MET CE :methyl -160:sc= -0.137 (180deg=-0.569) USER MOD ----------------------------------------------------------------- ATOM 581 N SER A 43 12.265 -5.684 8.765 1.00 0.00 N ATOM 582 CA SER A 43 11.485 -6.608 7.945 1.00 0.00 C ATOM 583 C SER A 43 10.242 -7.072 8.696 1.00 0.00 C ATOM 584 O SER A 43 10.266 -7.221 9.918 1.00 0.00 O ATOM 585 CB SER A 43 12.339 -7.813 7.549 1.00 0.00 C ATOM 586 OG SER A 43 11.603 -8.721 6.749 1.00 0.00 O ATOM 0 HA SER A 43 11.170 -6.085 7.042 1.00 0.00 H new ATOM 0 HB2 SER A 43 13.220 -7.474 7.003 1.00 0.00 H new ATOM 0 HB3 SER A 43 12.695 -8.320 8.446 1.00 0.00 H new ATOM 0 HG SER A 43 11.120 -8.227 6.054 1.00 0.00 H new ATOM 592 N MET A 44 9.155 -7.299 7.963 1.00 0.00 N ATOM 593 CA MET A 44 7.908 -7.736 8.574 1.00 0.00 C ATOM 594 C MET A 44 7.156 -8.709 7.671 1.00 0.00 C ATOM 595 O MET A 44 6.881 -8.409 6.509 1.00 0.00 O ATOM 596 CB MET A 44 7.028 -6.524 8.887 1.00 0.00 C ATOM 597 CG MET A 44 5.607 -6.888 9.283 1.00 0.00 C ATOM 598 SD MET A 44 4.562 -5.442 9.524 1.00 0.00 S ATOM 599 CE MET A 44 2.947 -6.211 9.552 1.00 0.00 C ATOM 0 H MET A 44 9.115 -7.188 6.950 1.00 0.00 H new ATOM 0 HA MET A 44 8.151 -8.257 9.500 1.00 0.00 H new ATOM 0 HB2 MET A 44 7.486 -5.952 9.694 1.00 0.00 H new ATOM 0 HB3 MET A 44 6.997 -5.873 8.013 1.00 0.00 H new ATOM 0 HG2 MET A 44 5.170 -7.522 8.512 1.00 0.00 H new ATOM 0 HG3 MET A 44 5.629 -7.473 10.202 1.00 0.00 H new ATOM 0 HE1 MET A 44 2.183 -5.447 9.695 1.00 0.00 H new ATOM 0 HE2 MET A 44 2.773 -6.727 8.607 1.00 0.00 H new ATOM 0 HE3 MET A 44 2.900 -6.929 10.371 1.00 0.00 H new ATOM 609 N GLU A 45 6.831 -9.875 8.219 1.00 0.00 N ATOM 610 CA GLU A 45 6.097 -10.893 7.479 1.00 0.00 C ATOM 611 C GLU A 45 4.620 -10.522 7.384 1.00 0.00 C ATOM 612 O GLU A 45 3.857 -10.732 8.327 1.00 0.00 O ATOM 613 CB GLU A 45 6.245 -12.255 8.161 1.00 0.00 C ATOM 614 CG GLU A 45 7.679 -12.603 8.522 1.00 0.00 C ATOM 615 CD GLU A 45 7.800 -13.969 9.169 1.00 0.00 C ATOM 616 OE1 GLU A 45 7.643 -14.055 10.406 1.00 0.00 O ATOM 617 OE2 GLU A 45 8.050 -14.952 8.440 1.00 0.00 O ATOM 0 H GLU A 45 7.066 -10.138 9.176 1.00 0.00 H new ATOM 0 HA GLU A 45 6.512 -10.952 6.473 1.00 0.00 H new ATOM 0 HB2 GLU A 45 5.638 -12.266 9.067 1.00 0.00 H new ATOM 0 HB3 GLU A 45 5.848 -13.027 7.502 1.00 0.00 H new ATOM 0 HG2 GLU A 45 8.294 -12.575 7.622 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.073 -11.847 9.201 1.00 0.00 H new ATOM 624 N VAL A 46 4.224 -9.963 6.246 1.00 0.00 N ATOM 625 CA VAL A 46 2.839 -9.559 6.037 1.00 0.00 C ATOM 626 C VAL A 46 1.927 -10.774 5.855 1.00 0.00 C ATOM 627 O VAL A 46 2.232 -11.674 5.073 1.00 0.00 O ATOM 628 CB VAL A 46 2.704 -8.631 4.814 1.00 0.00 C ATOM 629 CG1 VAL A 46 3.478 -7.342 5.038 1.00 0.00 C ATOM 630 CG2 VAL A 46 3.182 -9.329 3.549 1.00 0.00 C ATOM 0 H VAL A 46 4.842 -9.780 5.455 1.00 0.00 H new ATOM 0 HA VAL A 46 2.530 -9.015 6.929 1.00 0.00 H new ATOM 0 HB VAL A 46 1.650 -8.385 4.687 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.372 -6.698 4.165 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.086 -6.830 5.917 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.532 -7.573 5.193 1.00 0.00 H new ATOM 0 HG21 VAL A 46 3.077 -8.654 2.699 1.00 0.00 H new ATOM 0 HG22 VAL A 46 4.229 -9.610 3.662 1.00 0.00 H new ATOM 0 HG23 VAL A 46 2.583 -10.223 3.378 1.00 0.00 H new ATOM 640 N PRO A 47 0.796 -10.824 6.587 1.00 0.00 N ATOM 641 CA PRO A 47 -0.156 -11.917 6.505 1.00 0.00 C ATOM 642 C PRO A 47 -1.379 -11.563 5.665 1.00 0.00 C ATOM 643 O PRO A 47 -1.598 -10.400 5.328 1.00 0.00 O ATOM 644 CB PRO A 47 -0.552 -12.076 7.967 1.00 0.00 C ATOM 645 CG PRO A 47 -0.501 -10.685 8.530 1.00 0.00 C ATOM 646 CD PRO A 47 0.368 -9.854 7.606 1.00 0.00 C ATOM 0 HA PRO A 47 0.255 -12.809 6.033 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.549 -12.505 8.063 1.00 0.00 H new ATOM 0 HB3 PRO A 47 0.133 -12.741 8.493 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -1.503 -10.262 8.598 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.089 -10.694 9.539 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -0.188 -9.026 7.166 1.00 0.00 H new ATOM 0 HD3 PRO A 47 1.218 -9.422 8.133 1.00 0.00 H new ATOM 654 N ALA A 48 -2.175 -12.575 5.330 1.00 0.00 N ATOM 655 CA ALA A 48 -3.379 -12.368 4.535 1.00 0.00 C ATOM 656 C ALA A 48 -4.479 -11.712 5.372 1.00 0.00 C ATOM 657 O ALA A 48 -4.656 -12.053 6.542 1.00 0.00 O ATOM 658 CB ALA A 48 -3.864 -13.691 3.960 1.00 0.00 C ATOM 0 H ALA A 48 -2.007 -13.545 5.597 1.00 0.00 H new ATOM 0 HA ALA A 48 -3.135 -11.697 3.712 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.764 -13.523 3.368 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -3.087 -14.119 3.326 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -4.089 -14.381 4.774 1.00 0.00 H new ATOM 664 N PRO A 49 -5.234 -10.762 4.786 1.00 0.00 N ATOM 665 CA PRO A 49 -6.312 -10.064 5.498 1.00 0.00 C ATOM 666 C PRO A 49 -7.520 -10.959 5.758 1.00 0.00 C ATOM 667 O PRO A 49 -8.061 -10.979 6.864 1.00 0.00 O ATOM 668 CB PRO A 49 -6.684 -8.924 4.549 1.00 0.00 C ATOM 669 CG PRO A 49 -6.306 -9.418 3.196 1.00 0.00 C ATOM 670 CD PRO A 49 -5.099 -10.293 3.393 1.00 0.00 C ATOM 0 HA PRO A 49 -5.994 -9.730 6.486 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.748 -8.695 4.604 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.148 -8.009 4.800 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.124 -9.979 2.743 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -6.080 -8.588 2.527 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.088 -11.125 2.689 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -4.173 -9.738 3.245 1.00 0.00 H new ATOM 678 N PHE A 50 -7.940 -11.697 4.734 1.00 0.00 N ATOM 679 CA PHE A 50 -9.087 -12.591 4.857 1.00 0.00 C ATOM 680 C PHE A 50 -8.876 -13.865 4.045 1.00 0.00 C ATOM 681 O PHE A 50 -8.097 -13.882 3.091 1.00 0.00 O ATOM 682 CB PHE A 50 -10.366 -11.883 4.400 1.00 0.00 C ATOM 683 CG PHE A 50 -10.372 -11.528 2.938 1.00 0.00 C ATOM 684 CD1 PHE A 50 -9.628 -10.458 2.469 1.00 0.00 C ATOM 685 CD2 PHE A 50 -11.126 -12.262 2.036 1.00 0.00 C ATOM 686 CE1 PHE A 50 -9.631 -10.129 1.126 1.00 0.00 C ATOM 687 CE2 PHE A 50 -11.134 -11.937 0.692 1.00 0.00 C ATOM 688 CZ PHE A 50 -10.386 -10.869 0.237 1.00 0.00 C ATOM 0 H PHE A 50 -7.504 -11.694 3.812 1.00 0.00 H new ATOM 0 HA PHE A 50 -9.189 -12.866 5.907 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.221 -12.524 4.612 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -10.496 -10.973 4.986 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -9.039 -9.874 3.160 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -11.714 -13.097 2.387 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -9.044 -9.294 0.773 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -11.725 -12.518 -0.001 1.00 0.00 H new ATOM 0 HZ PHE A 50 -10.391 -10.613 -0.812 1.00 0.00 H new ATOM 698 N ALA A 51 -9.572 -14.929 4.432 1.00 0.00 N ATOM 699 CA ALA A 51 -9.464 -16.208 3.738 1.00 0.00 C ATOM 700 C ALA A 51 -10.049 -16.113 2.335 1.00 0.00 C ATOM 701 O ALA A 51 -10.898 -15.264 2.064 1.00 0.00 O ATOM 702 CB ALA A 51 -10.164 -17.299 4.533 1.00 0.00 C ATOM 0 H ALA A 51 -10.217 -14.931 5.222 1.00 0.00 H new ATOM 0 HA ALA A 51 -8.408 -16.463 3.649 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.076 -18.248 4.004 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.701 -17.387 5.516 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -11.218 -17.045 4.650 1.00 0.00 H new ATOM 708 N GLY A 52 -9.596 -16.989 1.444 1.00 0.00 N ATOM 709 CA GLY A 52 -10.092 -16.969 0.079 1.00 0.00 C ATOM 710 C GLY A 52 -9.447 -18.015 -0.805 1.00 0.00 C ATOM 711 O GLY A 52 -8.884 -18.994 -0.315 1.00 0.00 O ATOM 0 H GLY A 52 -8.899 -17.708 1.640 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -11.171 -17.126 0.089 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.917 -15.982 -0.350 1.00 0.00 H new ATOM 715 N VAL A 53 -9.539 -17.807 -2.113 1.00 0.00 N ATOM 716 CA VAL A 53 -8.962 -18.729 -3.081 1.00 0.00 C ATOM 717 C VAL A 53 -8.110 -17.976 -4.097 1.00 0.00 C ATOM 718 O VAL A 53 -8.583 -17.046 -4.749 1.00 0.00 O ATOM 719 CB VAL A 53 -10.057 -19.521 -3.824 1.00 0.00 C ATOM 720 CG1 VAL A 53 -9.441 -20.542 -4.768 1.00 0.00 C ATOM 721 CG2 VAL A 53 -10.990 -20.200 -2.831 1.00 0.00 C ATOM 0 H VAL A 53 -10.010 -17.003 -2.528 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.336 -19.430 -2.529 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.640 -18.820 -4.420 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -10.233 -21.088 -5.280 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.819 -20.030 -5.502 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.828 -21.241 -4.199 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -11.757 -20.754 -3.372 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -10.419 -20.887 -2.206 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -11.464 -19.446 -2.202 1.00 0.00 H new ATOM 731 N VAL A 54 -6.852 -18.384 -4.227 1.00 0.00 N ATOM 732 CA VAL A 54 -5.938 -17.740 -5.163 1.00 0.00 C ATOM 733 C VAL A 54 -6.300 -18.076 -6.604 1.00 0.00 C ATOM 734 O VAL A 54 -5.980 -19.155 -7.101 1.00 0.00 O ATOM 735 CB VAL A 54 -4.476 -18.152 -4.897 1.00 0.00 C ATOM 736 CG1 VAL A 54 -3.548 -17.561 -5.948 1.00 0.00 C ATOM 737 CG2 VAL A 54 -4.047 -17.721 -3.504 1.00 0.00 C ATOM 0 H VAL A 54 -6.443 -19.155 -3.698 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.035 -16.665 -5.011 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.411 -19.238 -4.959 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.522 -17.865 -5.740 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.840 -17.921 -6.935 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -3.616 -16.473 -5.923 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -3.013 -18.020 -3.333 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.131 -16.638 -3.416 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.689 -18.196 -2.762 1.00 0.00 H new ATOM 747 N LYS A 55 -6.973 -17.142 -7.269 1.00 0.00 N ATOM 748 CA LYS A 55 -7.375 -17.332 -8.657 1.00 0.00 C ATOM 749 C LYS A 55 -6.202 -17.068 -9.594 1.00 0.00 C ATOM 750 O LYS A 55 -5.861 -17.904 -10.432 1.00 0.00 O ATOM 751 CB LYS A 55 -8.538 -16.402 -9.005 1.00 0.00 C ATOM 752 CG LYS A 55 -9.065 -16.591 -10.418 1.00 0.00 C ATOM 753 CD LYS A 55 -10.193 -15.621 -10.727 1.00 0.00 C ATOM 754 CE LYS A 55 -10.760 -15.853 -12.118 1.00 0.00 C ATOM 755 NZ LYS A 55 -9.720 -15.709 -13.174 1.00 0.00 N ATOM 0 H LYS A 55 -7.251 -16.246 -6.868 1.00 0.00 H new ATOM 0 HA LYS A 55 -7.698 -18.366 -8.782 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -9.350 -16.569 -8.298 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -8.215 -15.368 -8.882 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -8.254 -16.447 -11.132 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -9.420 -17.614 -10.541 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -10.985 -15.734 -9.986 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -9.826 -14.598 -10.648 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -11.195 -16.851 -12.171 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -11.567 -15.144 -12.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -10.175 -15.689 -14.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -9.195 -14.824 -13.026 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -9.063 -16.514 -13.126 1.00 0.00 H new ATOM 769 N GLU A 56 -5.587 -15.899 -9.443 1.00 0.00 N ATOM 770 CA GLU A 56 -4.448 -15.519 -10.270 1.00 0.00 C ATOM 771 C GLU A 56 -3.694 -14.340 -9.659 1.00 0.00 C ATOM 772 O GLU A 56 -4.293 -13.449 -9.059 1.00 0.00 O ATOM 773 CB GLU A 56 -4.912 -15.175 -11.688 1.00 0.00 C ATOM 774 CG GLU A 56 -6.176 -14.329 -11.739 1.00 0.00 C ATOM 775 CD GLU A 56 -5.950 -12.901 -11.281 1.00 0.00 C ATOM 776 OE1 GLU A 56 -5.253 -12.151 -11.997 1.00 0.00 O ATOM 777 OE2 GLU A 56 -6.472 -12.532 -10.208 1.00 0.00 O ATOM 0 H GLU A 56 -5.859 -15.198 -8.754 1.00 0.00 H new ATOM 0 HA GLU A 56 -3.767 -16.368 -10.318 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -4.111 -14.644 -12.202 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -5.085 -16.101 -12.237 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -6.561 -14.321 -12.759 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.941 -14.789 -11.113 1.00 0.00 H new ATOM 784 N LEU A 57 -2.373 -14.354 -9.806 1.00 0.00 N ATOM 785 CA LEU A 57 -1.531 -13.286 -9.276 1.00 0.00 C ATOM 786 C LEU A 57 -1.025 -12.387 -10.401 1.00 0.00 C ATOM 787 O LEU A 57 -1.213 -12.687 -11.581 1.00 0.00 O ATOM 788 CB LEU A 57 -0.351 -13.871 -8.489 1.00 0.00 C ATOM 789 CG LEU A 57 0.896 -14.225 -9.311 1.00 0.00 C ATOM 790 CD1 LEU A 57 2.000 -14.737 -8.401 1.00 0.00 C ATOM 791 CD2 LEU A 57 0.575 -15.257 -10.383 1.00 0.00 C ATOM 0 H LEU A 57 -1.862 -15.093 -10.288 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.135 -12.682 -8.599 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -0.063 -13.155 -7.719 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.692 -14.771 -7.977 1.00 0.00 H new ATOM 0 HG LEU A 57 1.239 -13.318 -9.809 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.878 -14.984 -8.998 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.260 -13.967 -7.675 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.655 -15.628 -7.877 1.00 0.00 H new ATOM 0 HD21 LEU A 57 1.478 -15.487 -10.948 1.00 0.00 H new ATOM 0 HD22 LEU A 57 0.200 -16.166 -9.912 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -0.183 -14.858 -11.057 1.00 0.00 H new ATOM 803 N LYS A 58 -0.381 -11.284 -10.030 1.00 0.00 N ATOM 804 CA LYS A 58 0.152 -10.343 -11.011 1.00 0.00 C ATOM 805 C LYS A 58 1.573 -9.917 -10.656 1.00 0.00 C ATOM 806 O LYS A 58 2.148 -9.044 -11.306 1.00 0.00 O ATOM 807 CB LYS A 58 -0.747 -9.109 -11.107 1.00 0.00 C ATOM 808 CG LYS A 58 -1.013 -8.445 -9.765 1.00 0.00 C ATOM 809 CD LYS A 58 -1.400 -6.983 -9.930 1.00 0.00 C ATOM 810 CE LYS A 58 -2.721 -6.826 -10.670 1.00 0.00 C ATOM 811 NZ LYS A 58 -3.852 -7.443 -9.923 1.00 0.00 N ATOM 0 H LYS A 58 -0.216 -11.020 -9.059 1.00 0.00 H new ATOM 0 HA LYS A 58 0.176 -10.849 -11.976 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -0.285 -8.384 -11.777 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -1.698 -9.396 -11.556 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.811 -8.977 -9.247 1.00 0.00 H new ATOM 0 HG3 LYS A 58 -0.123 -8.518 -9.140 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.476 -6.514 -8.949 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -0.614 -6.459 -10.474 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -2.925 -5.767 -10.828 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -2.642 -7.286 -11.655 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 -4.675 -6.808 -9.953 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 -4.101 -8.354 -10.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 -3.571 -7.598 -8.934 1.00 0.00 H new ATOM 825 N VAL A 59 2.135 -10.538 -9.623 1.00 0.00 N ATOM 826 CA VAL A 59 3.491 -10.218 -9.189 1.00 0.00 C ATOM 827 C VAL A 59 4.407 -11.432 -9.297 1.00 0.00 C ATOM 828 O VAL A 59 4.005 -12.556 -9.000 1.00 0.00 O ATOM 829 CB VAL A 59 3.513 -9.699 -7.738 1.00 0.00 C ATOM 830 CG1 VAL A 59 2.759 -8.384 -7.627 1.00 0.00 C ATOM 831 CG2 VAL A 59 2.930 -10.736 -6.789 1.00 0.00 C ATOM 0 H VAL A 59 1.674 -11.263 -9.073 1.00 0.00 H new ATOM 0 HA VAL A 59 3.854 -9.433 -9.852 1.00 0.00 H new ATOM 0 HB VAL A 59 4.550 -9.521 -7.454 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.786 -8.035 -6.595 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.226 -7.641 -8.274 1.00 0.00 H new ATOM 0 HG13 VAL A 59 1.723 -8.532 -7.933 1.00 0.00 H new ATOM 0 HG21 VAL A 59 2.954 -10.351 -5.770 1.00 0.00 H new ATOM 0 HG22 VAL A 59 1.899 -10.949 -7.072 1.00 0.00 H new ATOM 0 HG23 VAL A 59 3.518 -11.652 -6.845 1.00 0.00 H new ATOM 841 N ASN A 60 5.640 -11.194 -9.732 1.00 0.00 N ATOM 842 CA ASN A 60 6.621 -12.262 -9.883 1.00 0.00 C ATOM 843 C ASN A 60 7.673 -12.193 -8.781 1.00 0.00 C ATOM 844 O ASN A 60 8.007 -11.112 -8.294 1.00 0.00 O ATOM 845 CB ASN A 60 7.298 -12.177 -11.254 1.00 0.00 C ATOM 846 CG ASN A 60 6.398 -12.644 -12.385 1.00 0.00 C ATOM 847 OD1 ASN A 60 6.870 -13.190 -13.381 1.00 0.00 O ATOM 848 ND2 ASN A 60 5.095 -12.428 -12.239 1.00 0.00 N ATOM 0 H ASN A 60 5.984 -10.268 -9.987 1.00 0.00 H new ATOM 0 HA ASN A 60 6.096 -13.214 -9.804 1.00 0.00 H new ATOM 0 HB2 ASN A 60 7.603 -11.147 -11.440 1.00 0.00 H new ATOM 0 HB3 ASN A 60 8.205 -12.781 -11.244 1.00 0.00 H new ATOM 0 HD21 ASN A 60 4.445 -12.719 -12.969 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.745 -11.972 -11.397 1.00 0.00 H new ATOM 855 N VAL A 61 8.190 -13.354 -8.392 1.00 0.00 N ATOM 856 CA VAL A 61 9.204 -13.429 -7.347 1.00 0.00 C ATOM 857 C VAL A 61 10.494 -12.741 -7.786 1.00 0.00 C ATOM 858 O VAL A 61 11.101 -13.118 -8.788 1.00 0.00 O ATOM 859 CB VAL A 61 9.515 -14.891 -6.975 1.00 0.00 C ATOM 860 CG1 VAL A 61 10.531 -14.955 -5.843 1.00 0.00 C ATOM 861 CG2 VAL A 61 8.237 -15.626 -6.600 1.00 0.00 C ATOM 0 H VAL A 61 7.923 -14.256 -8.785 1.00 0.00 H new ATOM 0 HA VAL A 61 8.801 -12.917 -6.473 1.00 0.00 H new ATOM 0 HB VAL A 61 9.950 -15.383 -7.845 1.00 0.00 H new ATOM 0 HG11 VAL A 61 10.736 -15.997 -5.596 1.00 0.00 H new ATOM 0 HG12 VAL A 61 11.455 -14.468 -6.155 1.00 0.00 H new ATOM 0 HG13 VAL A 61 10.131 -14.447 -4.966 1.00 0.00 H new ATOM 0 HG21 VAL A 61 8.474 -16.658 -6.340 1.00 0.00 H new ATOM 0 HG22 VAL A 61 7.772 -15.134 -5.746 1.00 0.00 H new ATOM 0 HG23 VAL A 61 7.549 -15.614 -7.445 1.00 0.00 H new ATOM 871 N GLY A 62 10.906 -11.731 -7.026 1.00 0.00 N ATOM 872 CA GLY A 62 12.122 -11.005 -7.350 1.00 0.00 C ATOM 873 C GLY A 62 11.855 -9.556 -7.703 1.00 0.00 C ATOM 874 O GLY A 62 12.778 -8.741 -7.752 1.00 0.00 O ATOM 0 H GLY A 62 10.420 -11.402 -6.192 1.00 0.00 H new ATOM 0 HA2 GLY A 62 12.805 -11.049 -6.502 1.00 0.00 H new ATOM 0 HA3 GLY A 62 12.621 -11.494 -8.187 1.00 0.00 H new ATOM 878 N ASP A 63 10.590 -9.232 -7.951 1.00 0.00 N ATOM 879 CA ASP A 63 10.203 -7.872 -8.304 1.00 0.00 C ATOM 880 C ASP A 63 9.802 -7.078 -7.065 1.00 0.00 C ATOM 881 O ASP A 63 8.844 -7.424 -6.376 1.00 0.00 O ATOM 882 CB ASP A 63 9.047 -7.892 -9.306 1.00 0.00 C ATOM 883 CG ASP A 63 9.437 -8.534 -10.622 1.00 0.00 C ATOM 884 OD1 ASP A 63 9.338 -9.774 -10.731 1.00 0.00 O ATOM 885 OD2 ASP A 63 9.838 -7.796 -11.546 1.00 0.00 O ATOM 0 H ASP A 63 9.815 -9.894 -7.914 1.00 0.00 H new ATOM 0 HA ASP A 63 11.064 -7.385 -8.761 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.205 -8.434 -8.875 1.00 0.00 H new ATOM 0 HB3 ASP A 63 8.709 -6.872 -9.488 1.00 0.00 H new ATOM 890 N LYS A 64 10.548 -6.011 -6.792 1.00 0.00 N ATOM 891 CA LYS A 64 10.279 -5.153 -5.641 1.00 0.00 C ATOM 892 C LYS A 64 8.834 -4.666 -5.641 1.00 0.00 C ATOM 893 O LYS A 64 8.173 -4.649 -6.680 1.00 0.00 O ATOM 894 CB LYS A 64 11.233 -3.957 -5.641 1.00 0.00 C ATOM 895 CG LYS A 64 11.174 -3.132 -6.917 1.00 0.00 C ATOM 896 CD LYS A 64 12.123 -1.943 -6.866 1.00 0.00 C ATOM 897 CE LYS A 64 13.559 -2.349 -7.171 1.00 0.00 C ATOM 898 NZ LYS A 64 14.155 -3.175 -6.085 1.00 0.00 N ATOM 0 H LYS A 64 11.347 -5.719 -7.355 1.00 0.00 H new ATOM 0 HA LYS A 64 10.439 -5.742 -4.738 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.998 -3.315 -4.792 1.00 0.00 H new ATOM 0 HB3 LYS A 64 12.252 -4.316 -5.497 1.00 0.00 H new ATOM 0 HG2 LYS A 64 11.427 -3.762 -7.769 1.00 0.00 H new ATOM 0 HG3 LYS A 64 10.155 -2.777 -7.074 1.00 0.00 H new ATOM 0 HD2 LYS A 64 11.799 -1.189 -7.583 1.00 0.00 H new ATOM 0 HD3 LYS A 64 12.077 -1.484 -5.878 1.00 0.00 H new ATOM 0 HE2 LYS A 64 13.585 -2.908 -8.106 1.00 0.00 H new ATOM 0 HE3 LYS A 64 14.164 -1.454 -7.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 15.162 -2.938 -5.981 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 13.660 -2.982 -5.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 14.060 -4.183 -6.323 1.00 0.00 H new ATOM 912 N VAL A 65 8.353 -4.266 -4.468 1.00 0.00 N ATOM 913 CA VAL A 65 6.985 -3.783 -4.322 1.00 0.00 C ATOM 914 C VAL A 65 6.961 -2.308 -3.927 1.00 0.00 C ATOM 915 O VAL A 65 7.960 -1.766 -3.455 1.00 0.00 O ATOM 916 CB VAL A 65 6.219 -4.602 -3.263 1.00 0.00 C ATOM 917 CG1 VAL A 65 6.698 -4.252 -1.861 1.00 0.00 C ATOM 918 CG2 VAL A 65 4.720 -4.386 -3.393 1.00 0.00 C ATOM 0 H VAL A 65 8.893 -4.267 -3.602 1.00 0.00 H new ATOM 0 HA VAL A 65 6.497 -3.902 -5.290 1.00 0.00 H new ATOM 0 HB VAL A 65 6.424 -5.658 -3.437 1.00 0.00 H new ATOM 0 HG11 VAL A 65 6.145 -4.841 -1.130 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.762 -4.473 -1.774 1.00 0.00 H new ATOM 0 HG13 VAL A 65 6.531 -3.191 -1.674 1.00 0.00 H new ATOM 0 HG21 VAL A 65 4.201 -4.974 -2.636 1.00 0.00 H new ATOM 0 HG22 VAL A 65 4.491 -3.330 -3.253 1.00 0.00 H new ATOM 0 HG23 VAL A 65 4.392 -4.700 -4.384 1.00 0.00 H new ATOM 928 N LYS A 66 5.814 -1.668 -4.126 1.00 0.00 N ATOM 929 CA LYS A 66 5.652 -0.262 -3.783 1.00 0.00 C ATOM 930 C LYS A 66 4.278 -0.012 -3.172 1.00 0.00 C ATOM 931 O LYS A 66 3.362 -0.819 -3.330 1.00 0.00 O ATOM 932 CB LYS A 66 5.843 0.619 -5.019 1.00 0.00 C ATOM 933 CG LYS A 66 7.227 0.505 -5.638 1.00 0.00 C ATOM 934 CD LYS A 66 7.424 1.507 -6.764 1.00 0.00 C ATOM 935 CE LYS A 66 6.465 1.254 -7.918 1.00 0.00 C ATOM 936 NZ LYS A 66 6.598 -0.127 -8.458 1.00 0.00 N ATOM 0 H LYS A 66 4.982 -2.103 -4.524 1.00 0.00 H new ATOM 0 HA LYS A 66 6.414 -0.004 -3.047 1.00 0.00 H new ATOM 0 HB2 LYS A 66 5.096 0.350 -5.766 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.660 1.658 -4.746 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.983 0.667 -4.870 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.372 -0.505 -6.020 1.00 0.00 H new ATOM 0 HD2 LYS A 66 7.275 2.517 -6.382 1.00 0.00 H new ATOM 0 HD3 LYS A 66 8.451 1.451 -7.125 1.00 0.00 H new ATOM 0 HE2 LYS A 66 5.441 1.415 -7.581 1.00 0.00 H new ATOM 0 HE3 LYS A 66 6.656 1.975 -8.713 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 6.099 -0.194 -9.368 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 7.604 -0.350 -8.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 6.184 -0.804 -7.786 1.00 0.00 H new ATOM 950 N THR A 67 4.142 1.109 -2.472 1.00 0.00 N ATOM 951 CA THR A 67 2.879 1.461 -1.835 1.00 0.00 C ATOM 952 C THR A 67 1.846 1.903 -2.865 1.00 0.00 C ATOM 953 O THR A 67 2.044 2.889 -3.575 1.00 0.00 O ATOM 954 CB THR A 67 3.069 2.582 -0.797 1.00 0.00 C ATOM 955 OG1 THR A 67 3.545 3.771 -1.439 1.00 0.00 O ATOM 956 CG2 THR A 67 4.052 2.155 0.281 1.00 0.00 C ATOM 0 H THR A 67 4.890 1.788 -2.332 1.00 0.00 H new ATOM 0 HA THR A 67 2.519 0.565 -1.329 1.00 0.00 H new ATOM 0 HB THR A 67 2.104 2.784 -0.331 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.286 3.758 -2.384 1.00 0.00 H new ATOM 0 HG21 THR A 67 4.172 2.962 1.004 1.00 0.00 H new ATOM 0 HG22 THR A 67 3.674 1.267 0.787 1.00 0.00 H new ATOM 0 HG23 THR A 67 5.016 1.930 -0.174 1.00 0.00 H new ATOM 964 N GLY A 68 0.743 1.164 -2.940 1.00 0.00 N ATOM 965 CA GLY A 68 -0.309 1.490 -3.885 1.00 0.00 C ATOM 966 C GLY A 68 -0.434 0.465 -4.993 1.00 0.00 C ATOM 967 O GLY A 68 -1.311 0.572 -5.852 1.00 0.00 O ATOM 0 H GLY A 68 0.559 0.344 -2.362 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.258 1.564 -3.355 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.110 2.469 -4.321 1.00 0.00 H new ATOM 971 N SER A 69 0.446 -0.532 -4.979 1.00 0.00 N ATOM 972 CA SER A 69 0.429 -1.580 -5.993 1.00 0.00 C ATOM 973 C SER A 69 -0.218 -2.852 -5.455 1.00 0.00 C ATOM 974 O SER A 69 0.114 -3.316 -4.364 1.00 0.00 O ATOM 975 CB SER A 69 1.850 -1.881 -6.471 1.00 0.00 C ATOM 976 OG SER A 69 2.654 -2.364 -5.409 1.00 0.00 O ATOM 0 H SER A 69 1.179 -0.636 -4.277 1.00 0.00 H new ATOM 0 HA SER A 69 -0.163 -1.222 -6.836 1.00 0.00 H new ATOM 0 HB2 SER A 69 1.819 -2.619 -7.272 1.00 0.00 H new ATOM 0 HB3 SER A 69 2.296 -0.978 -6.887 1.00 0.00 H new ATOM 0 HG SER A 69 2.917 -1.617 -4.832 1.00 0.00 H new ATOM 982 N LEU A 70 -1.145 -3.411 -6.228 1.00 0.00 N ATOM 983 CA LEU A 70 -1.839 -4.632 -5.831 1.00 0.00 C ATOM 984 C LEU A 70 -0.884 -5.820 -5.830 1.00 0.00 C ATOM 985 O LEU A 70 0.248 -5.719 -6.304 1.00 0.00 O ATOM 986 CB LEU A 70 -3.009 -4.910 -6.778 1.00 0.00 C ATOM 987 CG LEU A 70 -4.042 -3.786 -6.890 1.00 0.00 C ATOM 988 CD1 LEU A 70 -5.079 -4.123 -7.950 1.00 0.00 C ATOM 989 CD2 LEU A 70 -4.714 -3.537 -5.547 1.00 0.00 C ATOM 0 H LEU A 70 -1.433 -3.038 -7.133 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.222 -4.491 -4.820 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -2.610 -5.115 -7.771 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -3.517 -5.816 -6.446 1.00 0.00 H new ATOM 0 HG LEU A 70 -3.525 -2.873 -7.188 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.806 -3.314 -8.018 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -4.586 -4.249 -8.914 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.589 -5.048 -7.679 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.444 -2.734 -5.649 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.217 -4.446 -5.218 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -3.962 -3.252 -4.811 1.00 0.00 H new ATOM 1001 N ILE A 71 -1.348 -6.946 -5.298 1.00 0.00 N ATOM 1002 CA ILE A 71 -0.534 -8.152 -5.239 1.00 0.00 C ATOM 1003 C ILE A 71 -1.339 -9.385 -5.643 1.00 0.00 C ATOM 1004 O ILE A 71 -0.912 -10.158 -6.501 1.00 0.00 O ATOM 1005 CB ILE A 71 0.063 -8.364 -3.832 1.00 0.00 C ATOM 1006 CG1 ILE A 71 -1.018 -8.203 -2.758 1.00 0.00 C ATOM 1007 CG2 ILE A 71 1.205 -7.386 -3.597 1.00 0.00 C ATOM 1008 CD1 ILE A 71 -0.533 -8.504 -1.355 1.00 0.00 C ATOM 0 H ILE A 71 -2.283 -7.047 -4.902 1.00 0.00 H new ATOM 0 HA ILE A 71 0.283 -8.016 -5.948 1.00 0.00 H new ATOM 0 HB ILE A 71 0.455 -9.379 -3.767 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.400 -7.183 -2.790 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.853 -8.863 -2.994 1.00 0.00 H new ATOM 0 HG21 ILE A 71 1.620 -7.543 -2.601 1.00 0.00 H new ATOM 0 HG22 ILE A 71 1.982 -7.548 -4.344 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.832 -6.365 -3.677 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.353 -8.369 -0.650 1.00 0.00 H new ATOM 0 HD12 ILE A 71 -0.178 -9.533 -1.306 1.00 0.00 H new ATOM 0 HD13 ILE A 71 0.282 -7.827 -1.099 1.00 0.00 H new ATOM 1020 N MET A 72 -2.503 -9.561 -5.024 1.00 0.00 N ATOM 1021 CA MET A 72 -3.365 -10.700 -5.325 1.00 0.00 C ATOM 1022 C MET A 72 -4.832 -10.335 -5.128 1.00 0.00 C ATOM 1023 O MET A 72 -5.152 -9.320 -4.511 1.00 0.00 O ATOM 1024 CB MET A 72 -3.004 -11.898 -4.443 1.00 0.00 C ATOM 1025 CG MET A 72 -1.666 -12.533 -4.791 1.00 0.00 C ATOM 1026 SD MET A 72 -1.268 -13.943 -3.740 1.00 0.00 S ATOM 1027 CE MET A 72 -1.143 -13.150 -2.140 1.00 0.00 C ATOM 0 H MET A 72 -2.871 -8.930 -4.312 1.00 0.00 H new ATOM 0 HA MET A 72 -3.209 -10.972 -6.369 1.00 0.00 H new ATOM 0 HB2 MET A 72 -2.984 -11.578 -3.401 1.00 0.00 H new ATOM 0 HB3 MET A 72 -3.787 -12.651 -4.530 1.00 0.00 H new ATOM 0 HG2 MET A 72 -1.681 -12.855 -5.832 1.00 0.00 H new ATOM 0 HG3 MET A 72 -0.879 -11.784 -4.700 1.00 0.00 H new ATOM 0 HE1 MET A 72 -0.617 -13.808 -1.448 1.00 0.00 H new ATOM 0 HE2 MET A 72 -0.593 -12.214 -2.240 1.00 0.00 H new ATOM 0 HE3 MET A 72 -2.142 -12.945 -1.757 1.00 0.00 H new ATOM 1037 N ILE A 73 -5.718 -11.168 -5.662 1.00 0.00 N ATOM 1038 CA ILE A 73 -7.153 -10.938 -5.543 1.00 0.00 C ATOM 1039 C ILE A 73 -7.873 -12.228 -5.170 1.00 0.00 C ATOM 1040 O ILE A 73 -7.667 -13.267 -5.798 1.00 0.00 O ATOM 1041 CB ILE A 73 -7.759 -10.393 -6.855 1.00 0.00 C ATOM 1042 CG1 ILE A 73 -6.900 -9.258 -7.419 1.00 0.00 C ATOM 1043 CG2 ILE A 73 -9.184 -9.915 -6.618 1.00 0.00 C ATOM 1044 CD1 ILE A 73 -5.770 -9.735 -8.306 1.00 0.00 C ATOM 0 H ILE A 73 -5.468 -12.009 -6.182 1.00 0.00 H new ATOM 0 HA ILE A 73 -7.289 -10.193 -4.759 1.00 0.00 H new ATOM 0 HB ILE A 73 -7.778 -11.200 -7.587 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -7.536 -8.581 -7.989 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -6.483 -8.684 -6.592 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -9.600 -9.533 -7.551 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -9.793 -10.747 -6.263 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -9.182 -9.122 -5.870 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -5.205 -8.876 -8.669 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -5.110 -10.389 -7.735 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -6.180 -10.284 -9.154 1.00 0.00 H new ATOM 1056 N PHE A 74 -8.713 -12.162 -4.143 1.00 0.00 N ATOM 1057 CA PHE A 74 -9.457 -13.332 -3.691 1.00 0.00 C ATOM 1058 C PHE A 74 -10.938 -13.217 -4.025 1.00 0.00 C ATOM 1059 O PHE A 74 -11.596 -12.246 -3.648 1.00 0.00 O ATOM 1060 CB PHE A 74 -9.291 -13.514 -2.184 1.00 0.00 C ATOM 1061 CG PHE A 74 -7.866 -13.699 -1.760 1.00 0.00 C ATOM 1062 CD1 PHE A 74 -7.221 -14.906 -1.967 1.00 0.00 C ATOM 1063 CD2 PHE A 74 -7.172 -12.667 -1.153 1.00 0.00 C ATOM 1064 CE1 PHE A 74 -5.910 -15.082 -1.575 1.00 0.00 C ATOM 1065 CE2 PHE A 74 -5.861 -12.836 -0.758 1.00 0.00 C ATOM 1066 CZ PHE A 74 -5.227 -14.044 -0.970 1.00 0.00 C ATOM 0 H PHE A 74 -8.896 -11.313 -3.609 1.00 0.00 H new ATOM 0 HA PHE A 74 -9.053 -14.199 -4.214 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -9.704 -12.645 -1.673 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.873 -14.378 -1.864 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.750 -15.720 -2.441 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.662 -11.719 -0.987 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -5.418 -16.029 -1.741 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -5.331 -12.024 -0.283 1.00 0.00 H new ATOM 0 HZ PHE A 74 -4.200 -14.177 -0.664 1.00 0.00 H new ATOM 1076 N GLU A 75 -11.458 -14.216 -4.729 1.00 0.00 N ATOM 1077 CA GLU A 75 -12.866 -14.234 -5.098 1.00 0.00 C ATOM 1078 C GLU A 75 -13.676 -14.957 -4.029 1.00 0.00 C ATOM 1079 O GLU A 75 -13.821 -16.180 -4.064 1.00 0.00 O ATOM 1080 CB GLU A 75 -13.059 -14.918 -6.453 1.00 0.00 C ATOM 1081 CG GLU A 75 -14.485 -14.835 -6.976 1.00 0.00 C ATOM 1082 CD GLU A 75 -14.694 -15.658 -8.233 1.00 0.00 C ATOM 1083 OE1 GLU A 75 -14.469 -15.124 -9.338 1.00 0.00 O ATOM 1084 OE2 GLU A 75 -15.084 -16.838 -8.108 1.00 0.00 O ATOM 0 H GLU A 75 -10.925 -15.023 -5.055 1.00 0.00 H new ATOM 0 HA GLU A 75 -13.216 -13.205 -5.177 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -12.387 -14.463 -7.180 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -12.772 -15.966 -6.366 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -15.172 -15.179 -6.203 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -14.732 -13.794 -7.183 1.00 0.00 H new ATOM 1091 N VAL A 76 -14.195 -14.194 -3.073 1.00 0.00 N ATOM 1092 CA VAL A 76 -14.985 -14.757 -1.989 1.00 0.00 C ATOM 1093 C VAL A 76 -16.473 -14.714 -2.320 1.00 0.00 C ATOM 1094 O VAL A 76 -16.939 -13.805 -3.004 1.00 0.00 O ATOM 1095 CB VAL A 76 -14.726 -14.004 -0.667 1.00 0.00 C ATOM 1096 CG1 VAL A 76 -15.032 -12.524 -0.826 1.00 0.00 C ATOM 1097 CG2 VAL A 76 -15.541 -14.607 0.469 1.00 0.00 C ATOM 0 H VAL A 76 -14.081 -13.181 -3.029 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.680 -15.796 -1.867 1.00 0.00 H new ATOM 0 HB VAL A 76 -13.671 -14.109 -0.416 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -14.843 -12.010 0.117 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -14.395 -12.102 -1.603 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.078 -12.397 -1.106 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -15.342 -14.060 1.390 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -16.602 -14.541 0.230 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -15.263 -15.653 0.601 1.00 0.00 H new ATOM 1853 N SER B 43 -15.470 -10.056 -3.895 1.00 0.00 N ATOM 1854 CA SER B 43 -14.037 -10.129 -4.168 1.00 0.00 C ATOM 1855 C SER B 43 -13.378 -8.771 -3.950 1.00 0.00 C ATOM 1856 O SER B 43 -13.961 -7.733 -4.261 1.00 0.00 O ATOM 1857 CB SER B 43 -13.792 -10.606 -5.601 1.00 0.00 C ATOM 1858 OG SER B 43 -12.405 -10.703 -5.877 1.00 0.00 O ATOM 0 HA SER B 43 -13.594 -10.846 -3.476 1.00 0.00 H new ATOM 0 HB2 SER B 43 -14.264 -11.577 -5.750 1.00 0.00 H new ATOM 0 HB3 SER B 43 -14.258 -9.914 -6.303 1.00 0.00 H new ATOM 0 HG SER B 43 -11.954 -11.155 -5.133 1.00 0.00 H new ATOM 1864 N MET B 44 -12.160 -8.784 -3.415 1.00 0.00 N ATOM 1865 CA MET B 44 -11.432 -7.549 -3.155 1.00 0.00 C ATOM 1866 C MET B 44 -9.952 -7.700 -3.494 1.00 0.00 C ATOM 1867 O MET B 44 -9.301 -8.658 -3.073 1.00 0.00 O ATOM 1868 CB MET B 44 -11.595 -7.147 -1.687 1.00 0.00 C ATOM 1869 CG MET B 44 -10.688 -6.006 -1.259 1.00 0.00 C ATOM 1870 SD MET B 44 -10.809 -5.646 0.501 1.00 0.00 S ATOM 1871 CE MET B 44 -9.339 -4.653 0.733 1.00 0.00 C ATOM 0 H MET B 44 -11.659 -9.634 -3.154 1.00 0.00 H new ATOM 0 HA MET B 44 -11.847 -6.768 -3.792 1.00 0.00 H new ATOM 0 HB2 MET B 44 -12.632 -6.860 -1.512 1.00 0.00 H new ATOM 0 HB3 MET B 44 -11.394 -8.014 -1.058 1.00 0.00 H new ATOM 0 HG2 MET B 44 -9.656 -6.256 -1.505 1.00 0.00 H new ATOM 0 HG3 MET B 44 -10.943 -5.111 -1.827 1.00 0.00 H new ATOM 0 HE1 MET B 44 -9.267 -4.348 1.777 1.00 0.00 H new ATOM 0 HE2 MET B 44 -8.459 -5.237 0.464 1.00 0.00 H new ATOM 0 HE3 MET B 44 -9.394 -3.768 0.099 1.00 0.00 H new ATOM 1881 N GLU B 45 -9.430 -6.746 -4.260 1.00 0.00 N ATOM 1882 CA GLU B 45 -8.025 -6.759 -4.651 1.00 0.00 C ATOM 1883 C GLU B 45 -7.158 -6.212 -3.523 1.00 0.00 C ATOM 1884 O GLU B 45 -7.089 -5.000 -3.315 1.00 0.00 O ATOM 1885 CB GLU B 45 -7.817 -5.928 -5.919 1.00 0.00 C ATOM 1886 CG GLU B 45 -8.776 -6.283 -7.044 1.00 0.00 C ATOM 1887 CD GLU B 45 -8.531 -5.463 -8.295 1.00 0.00 C ATOM 1888 OE1 GLU B 45 -9.129 -4.374 -8.417 1.00 0.00 O ATOM 1889 OE2 GLU B 45 -7.741 -5.911 -9.153 1.00 0.00 O ATOM 0 H GLU B 45 -9.960 -5.954 -4.622 1.00 0.00 H new ATOM 0 HA GLU B 45 -7.732 -7.789 -4.854 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -7.932 -4.872 -5.674 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -6.794 -6.064 -6.269 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.676 -7.342 -7.282 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -9.801 -6.128 -6.706 1.00 0.00 H new ATOM 1896 N VAL B 46 -6.502 -7.107 -2.792 1.00 0.00 N ATOM 1897 CA VAL B 46 -5.652 -6.705 -1.680 1.00 0.00 C ATOM 1898 C VAL B 46 -4.340 -6.090 -2.170 1.00 0.00 C ATOM 1899 O VAL B 46 -3.667 -6.657 -3.031 1.00 0.00 O ATOM 1900 CB VAL B 46 -5.345 -7.892 -0.745 1.00 0.00 C ATOM 1901 CG1 VAL B 46 -6.628 -8.420 -0.123 1.00 0.00 C ATOM 1902 CG2 VAL B 46 -4.617 -8.999 -1.492 1.00 0.00 C ATOM 0 H VAL B 46 -6.543 -8.114 -2.950 1.00 0.00 H new ATOM 0 HA VAL B 46 -6.206 -5.951 -1.121 1.00 0.00 H new ATOM 0 HB VAL B 46 -4.691 -7.538 0.052 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -6.396 -9.258 0.535 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -7.106 -7.628 0.453 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -7.304 -8.754 -0.911 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -4.412 -9.824 -0.810 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -5.239 -9.353 -2.314 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -3.677 -8.614 -1.888 1.00 0.00 H new ATOM 1912 N PRO B 47 -3.963 -4.910 -1.638 1.00 0.00 N ATOM 1913 CA PRO B 47 -2.740 -4.224 -2.009 1.00 0.00 C ATOM 1914 C PRO B 47 -1.635 -4.404 -0.974 1.00 0.00 C ATOM 1915 O PRO B 47 -1.879 -4.890 0.131 1.00 0.00 O ATOM 1916 CB PRO B 47 -3.208 -2.772 -2.031 1.00 0.00 C ATOM 1917 CG PRO B 47 -4.251 -2.689 -0.954 1.00 0.00 C ATOM 1918 CD PRO B 47 -4.721 -4.104 -0.670 1.00 0.00 C ATOM 0 HA PRO B 47 -2.309 -4.589 -2.941 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -2.383 -2.087 -1.836 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -3.621 -2.504 -3.003 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -3.838 -2.233 -0.054 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -5.085 -2.064 -1.274 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -4.507 -4.401 0.357 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -5.796 -4.208 -0.814 1.00 0.00 H new ATOM 1926 N ALA B 48 -0.419 -4.011 -1.337 1.00 0.00 N ATOM 1927 CA ALA B 48 0.720 -4.127 -0.436 1.00 0.00 C ATOM 1928 C ALA B 48 0.663 -3.055 0.653 1.00 0.00 C ATOM 1929 O ALA B 48 0.306 -1.909 0.379 1.00 0.00 O ATOM 1930 CB ALA B 48 2.022 -4.025 -1.216 1.00 0.00 C ATOM 0 H ALA B 48 -0.198 -3.610 -2.248 1.00 0.00 H new ATOM 0 HA ALA B 48 0.678 -5.103 0.047 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.865 -4.113 -0.530 1.00 0.00 H new ATOM 0 HB2 ALA B 48 2.068 -4.827 -1.953 1.00 0.00 H new ATOM 0 HB3 ALA B 48 2.067 -3.062 -1.724 1.00 0.00 H new ATOM 1936 N PRO B 49 1.013 -3.409 1.903 1.00 0.00 N ATOM 1937 CA PRO B 49 0.989 -2.462 3.023 1.00 0.00 C ATOM 1938 C PRO B 49 2.101 -1.420 2.935 1.00 0.00 C ATOM 1939 O PRO B 49 1.866 -0.232 3.156 1.00 0.00 O ATOM 1940 CB PRO B 49 1.187 -3.354 4.249 1.00 0.00 C ATOM 1941 CG PRO B 49 1.927 -4.541 3.739 1.00 0.00 C ATOM 1942 CD PRO B 49 1.456 -4.753 2.326 1.00 0.00 C ATOM 0 HA PRO B 49 0.065 -1.885 3.043 1.00 0.00 H new ATOM 0 HB2 PRO B 49 1.752 -2.839 5.026 1.00 0.00 H new ATOM 0 HB3 PRO B 49 0.231 -3.642 4.688 1.00 0.00 H new ATOM 0 HG2 PRO B 49 3.003 -4.371 3.769 1.00 0.00 H new ATOM 0 HG3 PRO B 49 1.725 -5.419 4.353 1.00 0.00 H new ATOM 0 HD2 PRO B 49 2.256 -5.131 1.689 1.00 0.00 H new ATOM 0 HD3 PRO B 49 0.642 -5.477 2.279 1.00 0.00 H new ATOM 1950 N PHE B 50 3.310 -1.870 2.612 1.00 0.00 N ATOM 1951 CA PHE B 50 4.451 -0.968 2.501 1.00 0.00 C ATOM 1952 C PHE B 50 5.403 -1.420 1.399 1.00 0.00 C ATOM 1953 O PHE B 50 5.419 -2.592 1.020 1.00 0.00 O ATOM 1954 CB PHE B 50 5.197 -0.884 3.836 1.00 0.00 C ATOM 1955 CG PHE B 50 5.837 -2.180 4.253 1.00 0.00 C ATOM 1956 CD1 PHE B 50 5.070 -3.212 4.770 1.00 0.00 C ATOM 1957 CD2 PHE B 50 7.204 -2.365 4.127 1.00 0.00 C ATOM 1958 CE1 PHE B 50 5.654 -4.405 5.151 1.00 0.00 C ATOM 1959 CE2 PHE B 50 7.794 -3.555 4.507 1.00 0.00 C ATOM 1960 CZ PHE B 50 7.019 -4.576 5.020 1.00 0.00 C ATOM 0 H PHE B 50 3.524 -2.849 2.423 1.00 0.00 H new ATOM 0 HA PHE B 50 4.072 0.021 2.242 1.00 0.00 H new ATOM 0 HB2 PHE B 50 5.967 -0.115 3.764 1.00 0.00 H new ATOM 0 HB3 PHE B 50 4.501 -0.567 4.612 1.00 0.00 H new ATOM 0 HD1 PHE B 50 4.003 -3.082 4.876 1.00 0.00 H new ATOM 0 HD2 PHE B 50 7.816 -1.570 3.727 1.00 0.00 H new ATOM 0 HE1 PHE B 50 5.045 -5.202 5.550 1.00 0.00 H new ATOM 0 HE2 PHE B 50 8.861 -3.687 4.403 1.00 0.00 H new ATOM 0 HZ PHE B 50 7.479 -5.507 5.318 1.00 0.00 H new ATOM 1970 N ALA B 51 6.195 -0.482 0.889 1.00 0.00 N ATOM 1971 CA ALA B 51 7.152 -0.778 -0.169 1.00 0.00 C ATOM 1972 C ALA B 51 8.313 -1.613 0.360 1.00 0.00 C ATOM 1973 O ALA B 51 8.645 -1.554 1.544 1.00 0.00 O ATOM 1974 CB ALA B 51 7.670 0.513 -0.786 1.00 0.00 C ATOM 0 H ALA B 51 6.192 0.492 1.193 1.00 0.00 H new ATOM 0 HA ALA B 51 6.640 -1.358 -0.937 1.00 0.00 H new ATOM 0 HB1 ALA B 51 8.384 0.278 -1.575 1.00 0.00 H new ATOM 0 HB2 ALA B 51 6.836 1.075 -1.207 1.00 0.00 H new ATOM 0 HB3 ALA B 51 8.161 1.112 -0.019 1.00 0.00 H new ATOM 1980 N GLY B 52 8.930 -2.390 -0.525 1.00 0.00 N ATOM 1981 CA GLY B 52 10.048 -3.226 -0.127 1.00 0.00 C ATOM 1982 C GLY B 52 10.596 -4.052 -1.274 1.00 0.00 C ATOM 1983 O GLY B 52 10.427 -3.695 -2.441 1.00 0.00 O ATOM 0 H GLY B 52 8.676 -2.456 -1.511 1.00 0.00 H new ATOM 0 HA2 GLY B 52 10.842 -2.597 0.275 1.00 0.00 H new ATOM 0 HA3 GLY B 52 9.731 -3.891 0.676 1.00 0.00 H new ATOM 1987 N VAL B 53 11.253 -5.159 -0.943 1.00 0.00 N ATOM 1988 CA VAL B 53 11.830 -6.038 -1.954 1.00 0.00 C ATOM 1989 C VAL B 53 11.426 -7.488 -1.715 1.00 0.00 C ATOM 1990 O VAL B 53 11.580 -8.012 -0.611 1.00 0.00 O ATOM 1991 CB VAL B 53 13.368 -5.939 -1.971 1.00 0.00 C ATOM 1992 CG1 VAL B 53 13.952 -6.788 -3.091 1.00 0.00 C ATOM 1993 CG2 VAL B 53 13.807 -4.489 -2.108 1.00 0.00 C ATOM 0 H VAL B 53 11.399 -5.469 0.018 1.00 0.00 H new ATOM 0 HA VAL B 53 11.442 -5.711 -2.919 1.00 0.00 H new ATOM 0 HB VAL B 53 13.746 -6.324 -1.024 1.00 0.00 H new ATOM 0 HG11 VAL B 53 15.039 -6.703 -3.084 1.00 0.00 H new ATOM 0 HG12 VAL B 53 13.669 -7.830 -2.943 1.00 0.00 H new ATOM 0 HG13 VAL B 53 13.567 -6.440 -4.050 1.00 0.00 H new ATOM 0 HG21 VAL B 53 14.896 -4.438 -2.118 1.00 0.00 H new ATOM 0 HG22 VAL B 53 13.416 -4.077 -3.038 1.00 0.00 H new ATOM 0 HG23 VAL B 53 13.425 -3.912 -1.266 1.00 0.00 H new ATOM 2003 N VAL B 54 10.907 -8.131 -2.757 1.00 0.00 N ATOM 2004 CA VAL B 54 10.482 -9.523 -2.661 1.00 0.00 C ATOM 2005 C VAL B 54 11.684 -10.461 -2.613 1.00 0.00 C ATOM 2006 O VAL B 54 12.301 -10.749 -3.640 1.00 0.00 O ATOM 2007 CB VAL B 54 9.577 -9.915 -3.848 1.00 0.00 C ATOM 2008 CG1 VAL B 54 9.259 -11.404 -3.818 1.00 0.00 C ATOM 2009 CG2 VAL B 54 8.296 -9.096 -3.832 1.00 0.00 C ATOM 0 H VAL B 54 10.771 -7.711 -3.676 1.00 0.00 H new ATOM 0 HA VAL B 54 9.914 -9.621 -1.736 1.00 0.00 H new ATOM 0 HB VAL B 54 10.114 -9.701 -4.772 1.00 0.00 H new ATOM 0 HG11 VAL B 54 8.620 -11.657 -4.664 1.00 0.00 H new ATOM 0 HG12 VAL B 54 10.185 -11.975 -3.880 1.00 0.00 H new ATOM 0 HG13 VAL B 54 8.744 -11.647 -2.889 1.00 0.00 H new ATOM 0 HG21 VAL B 54 7.669 -9.385 -4.676 1.00 0.00 H new ATOM 0 HG22 VAL B 54 7.759 -9.279 -2.901 1.00 0.00 H new ATOM 0 HG23 VAL B 54 8.541 -8.036 -3.908 1.00 0.00 H new ATOM 2019 N LYS B 55 12.016 -10.929 -1.415 1.00 0.00 N ATOM 2020 CA LYS B 55 13.142 -11.840 -1.236 1.00 0.00 C ATOM 2021 C LYS B 55 12.740 -13.266 -1.593 1.00 0.00 C ATOM 2022 O LYS B 55 13.396 -13.923 -2.403 1.00 0.00 O ATOM 2023 CB LYS B 55 13.652 -11.787 0.206 1.00 0.00 C ATOM 2024 CG LYS B 55 14.882 -12.648 0.445 1.00 0.00 C ATOM 2025 CD LYS B 55 15.316 -12.611 1.901 1.00 0.00 C ATOM 2026 CE LYS B 55 16.585 -13.419 2.125 1.00 0.00 C ATOM 2027 NZ LYS B 55 16.395 -14.856 1.786 1.00 0.00 N ATOM 0 H LYS B 55 11.523 -10.693 -0.554 1.00 0.00 H new ATOM 0 HA LYS B 55 13.943 -11.524 -1.904 1.00 0.00 H new ATOM 0 HB2 LYS B 55 13.886 -10.754 0.463 1.00 0.00 H new ATOM 0 HB3 LYS B 55 12.856 -12.110 0.877 1.00 0.00 H new ATOM 0 HG2 LYS B 55 14.669 -13.677 0.154 1.00 0.00 H new ATOM 0 HG3 LYS B 55 15.699 -12.301 -0.188 1.00 0.00 H new ATOM 0 HD2 LYS B 55 15.483 -11.578 2.206 1.00 0.00 H new ATOM 0 HD3 LYS B 55 14.517 -13.004 2.530 1.00 0.00 H new ATOM 0 HE2 LYS B 55 17.390 -13.006 1.517 1.00 0.00 H new ATOM 0 HE3 LYS B 55 16.893 -13.329 3.167 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 17.220 -15.401 2.109 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 15.539 -15.213 2.256 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 16.293 -14.959 0.756 1.00 0.00 H new ATOM 2041 N GLU B 56 11.660 -13.739 -0.980 1.00 0.00 N ATOM 2042 CA GLU B 56 11.166 -15.086 -1.233 1.00 0.00 C ATOM 2043 C GLU B 56 9.732 -15.246 -0.735 1.00 0.00 C ATOM 2044 O GLU B 56 9.339 -14.648 0.266 1.00 0.00 O ATOM 2045 CB GLU B 56 12.080 -16.126 -0.574 1.00 0.00 C ATOM 2046 CG GLU B 56 12.520 -15.763 0.839 1.00 0.00 C ATOM 2047 CD GLU B 56 11.390 -15.836 1.847 1.00 0.00 C ATOM 2048 OE1 GLU B 56 10.951 -16.961 2.168 1.00 0.00 O ATOM 2049 OE2 GLU B 56 10.946 -14.768 2.321 1.00 0.00 O ATOM 0 H GLU B 56 11.110 -13.208 -0.304 1.00 0.00 H new ATOM 0 HA GLU B 56 11.171 -15.250 -2.311 1.00 0.00 H new ATOM 0 HB2 GLU B 56 11.561 -17.084 -0.546 1.00 0.00 H new ATOM 0 HB3 GLU B 56 12.965 -16.261 -1.195 1.00 0.00 H new ATOM 0 HG2 GLU B 56 13.320 -16.435 1.149 1.00 0.00 H new ATOM 0 HG3 GLU B 56 12.934 -14.755 0.837 1.00 0.00 H new ATOM 2056 N LEU B 57 8.951 -16.049 -1.451 1.00 0.00 N ATOM 2057 CA LEU B 57 7.560 -16.292 -1.085 1.00 0.00 C ATOM 2058 C LEU B 57 7.382 -17.704 -0.534 1.00 0.00 C ATOM 2059 O LEU B 57 8.296 -18.527 -0.604 1.00 0.00 O ATOM 2060 CB LEU B 57 6.641 -16.071 -2.295 1.00 0.00 C ATOM 2061 CG LEU B 57 6.415 -17.290 -3.199 1.00 0.00 C ATOM 2062 CD1 LEU B 57 5.419 -16.956 -4.298 1.00 0.00 C ATOM 2063 CD2 LEU B 57 7.725 -17.776 -3.802 1.00 0.00 C ATOM 0 H LEU B 57 9.258 -16.543 -2.289 1.00 0.00 H new ATOM 0 HA LEU B 57 7.285 -15.583 -0.304 1.00 0.00 H new ATOM 0 HB2 LEU B 57 5.672 -15.728 -1.932 1.00 0.00 H new ATOM 0 HB3 LEU B 57 7.058 -15.266 -2.901 1.00 0.00 H new ATOM 0 HG LEU B 57 6.007 -18.094 -2.586 1.00 0.00 H new ATOM 0 HD11 LEU B 57 5.269 -17.830 -4.931 1.00 0.00 H new ATOM 0 HD12 LEU B 57 4.469 -16.664 -3.851 1.00 0.00 H new ATOM 0 HD13 LEU B 57 5.804 -16.134 -4.901 1.00 0.00 H new ATOM 0 HD21 LEU B 57 7.534 -18.641 -4.438 1.00 0.00 H new ATOM 0 HD22 LEU B 57 8.169 -16.979 -4.398 1.00 0.00 H new ATOM 0 HD23 LEU B 57 8.411 -18.058 -3.003 1.00 0.00 H new ATOM 2075 N LYS B 58 6.203 -17.980 0.015 1.00 0.00 N ATOM 2076 CA LYS B 58 5.914 -19.295 0.578 1.00 0.00 C ATOM 2077 C LYS B 58 4.558 -19.813 0.109 1.00 0.00 C ATOM 2078 O LYS B 58 4.090 -20.854 0.570 1.00 0.00 O ATOM 2079 CB LYS B 58 5.944 -19.237 2.106 1.00 0.00 C ATOM 2080 CG LYS B 58 5.044 -18.162 2.694 1.00 0.00 C ATOM 2081 CD LYS B 58 4.661 -18.478 4.132 1.00 0.00 C ATOM 2082 CE LYS B 58 5.872 -18.476 5.052 1.00 0.00 C ATOM 2083 NZ LYS B 58 6.539 -17.145 5.093 1.00 0.00 N ATOM 0 H LYS B 58 5.434 -17.313 0.082 1.00 0.00 H new ATOM 0 HA LYS B 58 6.684 -19.982 0.227 1.00 0.00 H new ATOM 0 HB2 LYS B 58 5.645 -20.207 2.504 1.00 0.00 H new ATOM 0 HB3 LYS B 58 6.968 -19.060 2.434 1.00 0.00 H new ATOM 0 HG2 LYS B 58 5.553 -17.199 2.656 1.00 0.00 H new ATOM 0 HG3 LYS B 58 4.142 -18.070 2.088 1.00 0.00 H new ATOM 0 HD2 LYS B 58 3.935 -17.745 4.484 1.00 0.00 H new ATOM 0 HD3 LYS B 58 4.175 -19.453 4.173 1.00 0.00 H new ATOM 0 HE2 LYS B 58 5.563 -18.758 6.059 1.00 0.00 H new ATOM 0 HE3 LYS B 58 6.585 -19.229 4.715 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 6.851 -16.943 6.064 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 7.363 -17.150 4.458 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 5.869 -16.411 4.785 1.00 0.00 H new ATOM 2097 N VAL B 59 3.929 -19.084 -0.807 1.00 0.00 N ATOM 2098 CA VAL B 59 2.625 -19.479 -1.328 1.00 0.00 C ATOM 2099 C VAL B 59 2.676 -19.724 -2.833 1.00 0.00 C ATOM 2100 O VAL B 59 3.332 -18.991 -3.571 1.00 0.00 O ATOM 2101 CB VAL B 59 1.553 -18.414 -1.025 1.00 0.00 C ATOM 2102 CG1 VAL B 59 1.350 -18.275 0.475 1.00 0.00 C ATOM 2103 CG2 VAL B 59 1.933 -17.076 -1.644 1.00 0.00 C ATOM 0 H VAL B 59 4.299 -18.220 -1.203 1.00 0.00 H new ATOM 0 HA VAL B 59 2.356 -20.408 -0.826 1.00 0.00 H new ATOM 0 HB VAL B 59 0.612 -18.738 -1.470 1.00 0.00 H new ATOM 0 HG11 VAL B 59 0.590 -17.519 0.671 1.00 0.00 H new ATOM 0 HG12 VAL B 59 1.027 -19.230 0.888 1.00 0.00 H new ATOM 0 HG13 VAL B 59 2.288 -17.976 0.943 1.00 0.00 H new ATOM 0 HG21 VAL B 59 1.163 -16.339 -1.418 1.00 0.00 H new ATOM 0 HG22 VAL B 59 2.886 -16.743 -1.233 1.00 0.00 H new ATOM 0 HG23 VAL B 59 2.023 -17.187 -2.725 1.00 0.00 H new ATOM 2113 N ASN B 60 1.980 -20.765 -3.279 1.00 0.00 N ATOM 2114 CA ASN B 60 1.939 -21.109 -4.698 1.00 0.00 C ATOM 2115 C ASN B 60 0.590 -20.736 -5.302 1.00 0.00 C ATOM 2116 O ASN B 60 -0.435 -20.760 -4.621 1.00 0.00 O ATOM 2117 CB ASN B 60 2.204 -22.604 -4.896 1.00 0.00 C ATOM 2118 CG ASN B 60 3.662 -22.977 -4.687 1.00 0.00 C ATOM 2119 OD1 ASN B 60 4.172 -23.901 -5.322 1.00 0.00 O ATOM 2120 ND2 ASN B 60 4.340 -22.266 -3.793 1.00 0.00 N ATOM 0 H ASN B 60 1.436 -21.386 -2.679 1.00 0.00 H new ATOM 0 HA ASN B 60 2.719 -20.543 -5.207 1.00 0.00 H new ATOM 0 HB2 ASN B 60 1.585 -23.173 -4.202 1.00 0.00 H new ATOM 0 HB3 ASN B 60 1.901 -22.892 -5.903 1.00 0.00 H new ATOM 0 HD21 ASN B 60 5.321 -22.478 -3.611 1.00 0.00 H new ATOM 0 HD22 ASN B 60 3.880 -21.508 -3.288 1.00 0.00 H new ATOM 2127 N VAL B 61 0.598 -20.391 -6.585 1.00 0.00 N ATOM 2128 CA VAL B 61 -0.623 -20.010 -7.283 1.00 0.00 C ATOM 2129 C VAL B 61 -1.581 -21.192 -7.397 1.00 0.00 C ATOM 2130 O VAL B 61 -1.238 -22.231 -7.962 1.00 0.00 O ATOM 2131 CB VAL B 61 -0.313 -19.470 -8.692 1.00 0.00 C ATOM 2132 CG1 VAL B 61 -1.584 -18.990 -9.379 1.00 0.00 C ATOM 2133 CG2 VAL B 61 0.716 -18.353 -8.617 1.00 0.00 C ATOM 0 H VAL B 61 1.438 -20.368 -7.163 1.00 0.00 H new ATOM 0 HA VAL B 61 -1.096 -19.222 -6.697 1.00 0.00 H new ATOM 0 HB VAL B 61 0.104 -20.282 -9.287 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -1.341 -18.613 -10.372 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -2.285 -19.820 -9.468 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -2.037 -18.193 -8.790 1.00 0.00 H new ATOM 0 HG21 VAL B 61 0.924 -17.982 -9.621 1.00 0.00 H new ATOM 0 HG22 VAL B 61 0.327 -17.540 -8.003 1.00 0.00 H new ATOM 0 HG23 VAL B 61 1.636 -18.735 -8.173 1.00 0.00 H new ATOM 2143 N GLY B 62 -2.784 -21.024 -6.854 1.00 0.00 N ATOM 2144 CA GLY B 62 -3.775 -22.082 -6.901 1.00 0.00 C ATOM 2145 C GLY B 62 -4.132 -22.604 -5.522 1.00 0.00 C ATOM 2146 O GLY B 62 -5.131 -23.304 -5.356 1.00 0.00 O ATOM 0 H GLY B 62 -3.089 -20.173 -6.382 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -4.676 -21.711 -7.390 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -3.397 -22.903 -7.510 1.00 0.00 H new ATOM 2150 N ASP B 63 -3.312 -22.262 -4.532 1.00 0.00 N ATOM 2151 CA ASP B 63 -3.544 -22.699 -3.159 1.00 0.00 C ATOM 2152 C ASP B 63 -4.361 -21.664 -2.392 1.00 0.00 C ATOM 2153 O ASP B 63 -3.946 -20.513 -2.250 1.00 0.00 O ATOM 2154 CB ASP B 63 -2.212 -22.944 -2.449 1.00 0.00 C ATOM 2155 CG ASP B 63 -1.399 -24.039 -3.108 1.00 0.00 C ATOM 2156 OD1 ASP B 63 -0.646 -23.730 -4.055 1.00 0.00 O ATOM 2157 OD2 ASP B 63 -1.513 -25.206 -2.676 1.00 0.00 O ATOM 0 H ASP B 63 -2.481 -21.684 -4.655 1.00 0.00 H new ATOM 0 HA ASP B 63 -4.108 -23.631 -3.189 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -1.633 -22.021 -2.440 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -2.401 -23.211 -1.409 1.00 0.00 H new ATOM 2162 N LYS B 64 -5.522 -22.083 -1.897 1.00 0.00 N ATOM 2163 CA LYS B 64 -6.403 -21.197 -1.143 1.00 0.00 C ATOM 2164 C LYS B 64 -5.679 -20.588 0.054 1.00 0.00 C ATOM 2165 O LYS B 64 -4.677 -21.125 0.527 1.00 0.00 O ATOM 2166 CB LYS B 64 -7.642 -21.962 -0.673 1.00 0.00 C ATOM 2167 CG LYS B 64 -7.318 -23.198 0.152 1.00 0.00 C ATOM 2168 CD LYS B 64 -8.577 -23.930 0.592 1.00 0.00 C ATOM 2169 CE LYS B 64 -9.162 -24.778 -0.529 1.00 0.00 C ATOM 2170 NZ LYS B 64 -9.726 -23.949 -1.629 1.00 0.00 N ATOM 0 H LYS B 64 -5.875 -23.034 -2.005 1.00 0.00 H new ATOM 0 HA LYS B 64 -6.711 -20.385 -1.802 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -8.268 -21.294 -0.081 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -8.227 -22.259 -1.543 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -6.692 -23.872 -0.433 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -6.741 -22.908 1.030 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -8.347 -24.567 1.446 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -9.320 -23.206 0.925 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -8.387 -25.431 -0.930 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -9.943 -25.422 -0.125 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -10.514 -24.458 -2.079 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -10.072 -23.048 -1.242 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -8.987 -23.761 -2.336 1.00 0.00 H new ATOM 2184 N VAL B 65 -6.195 -19.462 0.538 1.00 0.00 N ATOM 2185 CA VAL B 65 -5.603 -18.772 1.680 1.00 0.00 C ATOM 2186 C VAL B 65 -6.537 -18.814 2.887 1.00 0.00 C ATOM 2187 O VAL B 65 -7.724 -19.109 2.753 1.00 0.00 O ATOM 2188 CB VAL B 65 -5.289 -17.301 1.337 1.00 0.00 C ATOM 2189 CG1 VAL B 65 -6.565 -16.470 1.315 1.00 0.00 C ATOM 2190 CG2 VAL B 65 -4.283 -16.720 2.316 1.00 0.00 C ATOM 0 H VAL B 65 -7.024 -19.007 0.156 1.00 0.00 H new ATOM 0 HA VAL B 65 -4.675 -19.289 1.924 1.00 0.00 H new ATOM 0 HB VAL B 65 -4.846 -17.271 0.342 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -6.322 -15.436 1.071 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -7.246 -16.869 0.564 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -7.042 -16.509 2.294 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -4.078 -15.682 2.054 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -4.690 -16.765 3.326 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -3.358 -17.295 2.272 1.00 0.00 H new ATOM 2200 N LYS B 66 -5.993 -18.518 4.062 1.00 0.00 N ATOM 2201 CA LYS B 66 -6.780 -18.510 5.289 1.00 0.00 C ATOM 2202 C LYS B 66 -6.325 -17.391 6.218 1.00 0.00 C ATOM 2203 O LYS B 66 -5.227 -16.855 6.068 1.00 0.00 O ATOM 2204 CB LYS B 66 -6.676 -19.858 6.001 1.00 0.00 C ATOM 2205 CG LYS B 66 -7.217 -21.020 5.183 1.00 0.00 C ATOM 2206 CD LYS B 66 -7.251 -22.308 5.993 1.00 0.00 C ATOM 2207 CE LYS B 66 -5.857 -22.740 6.423 1.00 0.00 C ATOM 2208 NZ LYS B 66 -4.946 -22.922 5.260 1.00 0.00 N ATOM 0 H LYS B 66 -5.009 -18.280 4.191 1.00 0.00 H new ATOM 0 HA LYS B 66 -7.822 -18.334 5.020 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -5.631 -20.051 6.245 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -7.219 -19.804 6.945 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -8.222 -20.783 4.833 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -6.597 -21.162 4.298 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -7.876 -22.167 6.875 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -7.710 -23.099 5.400 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -5.438 -21.994 7.098 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -5.923 -23.674 6.981 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -4.087 -23.421 5.567 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -5.427 -23.480 4.526 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -4.687 -21.992 4.873 1.00 0.00 H new ATOM 2222 N THR B 67 -7.176 -17.042 7.177 1.00 0.00 N ATOM 2223 CA THR B 67 -6.861 -15.983 8.129 1.00 0.00 C ATOM 2224 C THR B 67 -5.820 -16.444 9.144 1.00 0.00 C ATOM 2225 O THR B 67 -6.055 -17.382 9.907 1.00 0.00 O ATOM 2226 CB THR B 67 -8.123 -15.511 8.874 1.00 0.00 C ATOM 2227 OG1 THR B 67 -8.662 -16.583 9.657 1.00 0.00 O ATOM 2228 CG2 THR B 67 -9.176 -15.017 7.893 1.00 0.00 C ATOM 0 H THR B 67 -8.088 -17.477 7.316 1.00 0.00 H new ATOM 0 HA THR B 67 -6.453 -15.150 7.556 1.00 0.00 H new ATOM 0 HB THR B 67 -7.843 -14.687 9.531 1.00 0.00 H new ATOM 0 HG1 THR B 67 -7.950 -17.222 9.871 1.00 0.00 H new ATOM 0 HG21 THR B 67 -10.059 -14.689 8.442 1.00 0.00 H new ATOM 0 HG22 THR B 67 -8.775 -14.182 7.318 1.00 0.00 H new ATOM 0 HG23 THR B 67 -9.450 -15.826 7.215 1.00 0.00 H new ATOM 2236 N GLY B 68 -4.667 -15.778 9.146 1.00 0.00 N ATOM 2237 CA GLY B 68 -3.605 -16.130 10.072 1.00 0.00 C ATOM 2238 C GLY B 68 -2.407 -16.750 9.379 1.00 0.00 C ATOM 2239 O GLY B 68 -1.420 -17.099 10.027 1.00 0.00 O ATOM 0 H GLY B 68 -4.450 -15.001 8.522 1.00 0.00 H new ATOM 0 HA2 GLY B 68 -3.287 -15.237 10.610 1.00 0.00 H new ATOM 0 HA3 GLY B 68 -3.992 -16.828 10.814 1.00 0.00 H new ATOM 2243 N SER B 69 -2.492 -16.888 8.058 1.00 0.00 N ATOM 2244 CA SER B 69 -1.405 -17.471 7.280 1.00 0.00 C ATOM 2245 C SER B 69 -0.632 -16.392 6.530 1.00 0.00 C ATOM 2246 O SER B 69 -1.222 -15.543 5.861 1.00 0.00 O ATOM 2247 CB SER B 69 -1.951 -18.502 6.290 1.00 0.00 C ATOM 2248 OG SER B 69 -2.838 -17.899 5.365 1.00 0.00 O ATOM 0 H SER B 69 -3.301 -16.604 7.506 1.00 0.00 H new ATOM 0 HA SER B 69 -0.725 -17.967 7.972 1.00 0.00 H new ATOM 0 HB2 SER B 69 -1.125 -18.970 5.755 1.00 0.00 H new ATOM 0 HB3 SER B 69 -2.468 -19.293 6.832 1.00 0.00 H new ATOM 0 HG SER B 69 -3.674 -17.664 5.819 1.00 0.00 H new ATOM 2254 N LEU B 70 0.692 -16.430 6.646 1.00 0.00 N ATOM 2255 CA LEU B 70 1.547 -15.456 5.980 1.00 0.00 C ATOM 2256 C LEU B 70 1.502 -15.641 4.467 1.00 0.00 C ATOM 2257 O LEU B 70 0.953 -16.623 3.969 1.00 0.00 O ATOM 2258 CB LEU B 70 2.988 -15.586 6.478 1.00 0.00 C ATOM 2259 CG LEU B 70 3.172 -15.436 7.989 1.00 0.00 C ATOM 2260 CD1 LEU B 70 4.617 -15.713 8.378 1.00 0.00 C ATOM 2261 CD2 LEU B 70 2.755 -14.045 8.443 1.00 0.00 C ATOM 0 H LEU B 70 1.196 -17.126 7.196 1.00 0.00 H new ATOM 0 HA LEU B 70 1.176 -14.459 6.219 1.00 0.00 H new ATOM 0 HB2 LEU B 70 3.373 -16.560 6.176 1.00 0.00 H new ATOM 0 HB3 LEU B 70 3.597 -14.834 5.978 1.00 0.00 H new ATOM 0 HG LEU B 70 2.534 -16.165 8.488 1.00 0.00 H new ATOM 0 HD11 LEU B 70 4.731 -15.602 9.456 1.00 0.00 H new ATOM 0 HD12 LEU B 70 4.884 -16.729 8.088 1.00 0.00 H new ATOM 0 HD13 LEU B 70 5.273 -15.006 7.869 1.00 0.00 H new ATOM 0 HD21 LEU B 70 2.893 -13.957 9.521 1.00 0.00 H new ATOM 0 HD22 LEU B 70 3.367 -13.298 7.937 1.00 0.00 H new ATOM 0 HD23 LEU B 70 1.706 -13.881 8.197 1.00 0.00 H new ATOM 2273 N ILE B 71 2.084 -14.690 3.742 1.00 0.00 N ATOM 2274 CA ILE B 71 2.112 -14.750 2.286 1.00 0.00 C ATOM 2275 C ILE B 71 3.489 -14.373 1.743 1.00 0.00 C ATOM 2276 O ILE B 71 4.070 -15.106 0.942 1.00 0.00 O ATOM 2277 CB ILE B 71 1.043 -13.829 1.663 1.00 0.00 C ATOM 2278 CG1 ILE B 71 1.093 -12.436 2.300 1.00 0.00 C ATOM 2279 CG2 ILE B 71 -0.341 -14.444 1.827 1.00 0.00 C ATOM 2280 CD1 ILE B 71 0.138 -11.444 1.670 1.00 0.00 C ATOM 0 H ILE B 71 2.542 -13.870 4.140 1.00 0.00 H new ATOM 0 HA ILE B 71 1.892 -15.780 2.007 1.00 0.00 H new ATOM 0 HB ILE B 71 1.253 -13.724 0.599 1.00 0.00 H new ATOM 0 HG12 ILE B 71 0.864 -12.523 3.362 1.00 0.00 H new ATOM 0 HG13 ILE B 71 2.109 -12.048 2.224 1.00 0.00 H new ATOM 0 HG21 ILE B 71 -1.087 -13.785 1.383 1.00 0.00 H new ATOM 0 HG22 ILE B 71 -0.370 -15.413 1.328 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -0.557 -14.575 2.887 1.00 0.00 H new ATOM 0 HD11 ILE B 71 0.230 -10.481 2.173 1.00 0.00 H new ATOM 0 HD12 ILE B 71 0.380 -11.326 0.614 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -0.884 -11.809 1.769 1.00 0.00 H new ATOM 2292 N MET B 72 4.006 -13.229 2.184 1.00 0.00 N ATOM 2293 CA MET B 72 5.317 -12.758 1.745 1.00 0.00 C ATOM 2294 C MET B 72 5.995 -11.940 2.839 1.00 0.00 C ATOM 2295 O MET B 72 5.357 -11.530 3.808 1.00 0.00 O ATOM 2296 CB MET B 72 5.185 -11.911 0.475 1.00 0.00 C ATOM 2297 CG MET B 72 4.783 -12.706 -0.756 1.00 0.00 C ATOM 2298 SD MET B 72 4.646 -11.680 -2.233 1.00 0.00 S ATOM 2299 CE MET B 72 3.293 -10.601 -1.775 1.00 0.00 C ATOM 0 H MET B 72 3.537 -12.611 2.846 1.00 0.00 H new ATOM 0 HA MET B 72 5.932 -13.632 1.529 1.00 0.00 H new ATOM 0 HB2 MET B 72 4.446 -11.128 0.647 1.00 0.00 H new ATOM 0 HB3 MET B 72 6.136 -11.415 0.281 1.00 0.00 H new ATOM 0 HG2 MET B 72 5.517 -13.492 -0.932 1.00 0.00 H new ATOM 0 HG3 MET B 72 3.828 -13.198 -0.570 1.00 0.00 H new ATOM 0 HE1 MET B 72 2.856 -10.164 -2.673 1.00 0.00 H new ATOM 0 HE2 MET B 72 2.533 -11.175 -1.244 1.00 0.00 H new ATOM 0 HE3 MET B 72 3.664 -9.806 -1.128 1.00 0.00 H new ATOM 2309 N ILE B 73 7.295 -11.711 2.677 1.00 0.00 N ATOM 2310 CA ILE B 73 8.065 -10.936 3.645 1.00 0.00 C ATOM 2311 C ILE B 73 8.966 -9.941 2.925 1.00 0.00 C ATOM 2312 O ILE B 73 9.614 -10.283 1.935 1.00 0.00 O ATOM 2313 CB ILE B 73 8.931 -11.838 4.553 1.00 0.00 C ATOM 2314 CG1 ILE B 73 8.125 -13.039 5.054 1.00 0.00 C ATOM 2315 CG2 ILE B 73 9.473 -11.041 5.730 1.00 0.00 C ATOM 2316 CD1 ILE B 73 8.131 -14.219 4.105 1.00 0.00 C ATOM 0 H ILE B 73 7.838 -12.052 1.883 1.00 0.00 H new ATOM 0 HA ILE B 73 7.349 -10.407 4.274 1.00 0.00 H new ATOM 0 HB ILE B 73 9.770 -12.209 3.964 1.00 0.00 H new ATOM 0 HG12 ILE B 73 8.525 -13.357 6.017 1.00 0.00 H new ATOM 0 HG13 ILE B 73 7.095 -12.727 5.225 1.00 0.00 H new ATOM 0 HG21 ILE B 73 10.081 -11.690 6.360 1.00 0.00 H new ATOM 0 HG22 ILE B 73 10.084 -10.218 5.361 1.00 0.00 H new ATOM 0 HG23 ILE B 73 8.643 -10.643 6.313 1.00 0.00 H new ATOM 0 HD11 ILE B 73 7.539 -15.030 4.529 1.00 0.00 H new ATOM 0 HD12 ILE B 73 7.703 -13.919 3.149 1.00 0.00 H new ATOM 0 HD13 ILE B 73 9.156 -14.559 3.953 1.00 0.00 H new ATOM 2328 N PHE B 74 9.005 -8.707 3.421 1.00 0.00 N ATOM 2329 CA PHE B 74 9.823 -7.669 2.804 1.00 0.00 C ATOM 2330 C PHE B 74 10.939 -7.219 3.736 1.00 0.00 C ATOM 2331 O PHE B 74 10.683 -6.780 4.858 1.00 0.00 O ATOM 2332 CB PHE B 74 8.960 -6.465 2.423 1.00 0.00 C ATOM 2333 CG PHE B 74 7.826 -6.799 1.497 1.00 0.00 C ATOM 2334 CD1 PHE B 74 8.063 -7.077 0.160 1.00 0.00 C ATOM 2335 CD2 PHE B 74 6.521 -6.827 1.962 1.00 0.00 C ATOM 2336 CE1 PHE B 74 7.021 -7.377 -0.695 1.00 0.00 C ATOM 2337 CE2 PHE B 74 5.475 -7.127 1.112 1.00 0.00 C ATOM 2338 CZ PHE B 74 5.724 -7.402 -0.217 1.00 0.00 C ATOM 0 H PHE B 74 8.483 -8.404 4.243 1.00 0.00 H new ATOM 0 HA PHE B 74 10.271 -8.093 1.905 1.00 0.00 H new ATOM 0 HB2 PHE B 74 8.555 -6.018 3.331 1.00 0.00 H new ATOM 0 HB3 PHE B 74 9.592 -5.712 1.952 1.00 0.00 H new ATOM 0 HD1 PHE B 74 9.075 -7.059 -0.218 1.00 0.00 H new ATOM 0 HD2 PHE B 74 6.320 -6.612 3.001 1.00 0.00 H new ATOM 0 HE1 PHE B 74 7.219 -7.592 -1.735 1.00 0.00 H new ATOM 0 HE2 PHE B 74 4.462 -7.146 1.487 1.00 0.00 H new ATOM 0 HZ PHE B 74 4.907 -7.636 -0.883 1.00 0.00 H new ATOM 2348 N GLU B 75 12.177 -7.331 3.266 1.00 0.00 N ATOM 2349 CA GLU B 75 13.328 -6.916 4.056 1.00 0.00 C ATOM 2350 C GLU B 75 13.630 -5.447 3.798 1.00 0.00 C ATOM 2351 O GLU B 75 14.355 -5.103 2.864 1.00 0.00 O ATOM 2352 CB GLU B 75 14.550 -7.772 3.719 1.00 0.00 C ATOM 2353 CG GLU B 75 15.692 -7.613 4.709 1.00 0.00 C ATOM 2354 CD GLU B 75 16.978 -8.246 4.216 1.00 0.00 C ATOM 2355 OE1 GLU B 75 17.728 -7.570 3.480 1.00 0.00 O ATOM 2356 OE2 GLU B 75 17.235 -9.419 4.563 1.00 0.00 O ATOM 0 H GLU B 75 12.407 -7.704 2.345 1.00 0.00 H new ATOM 0 HA GLU B 75 13.094 -7.053 5.112 1.00 0.00 H new ATOM 0 HB2 GLU B 75 14.252 -8.820 3.685 1.00 0.00 H new ATOM 0 HB3 GLU B 75 14.904 -7.509 2.722 1.00 0.00 H new ATOM 0 HG2 GLU B 75 15.861 -6.553 4.897 1.00 0.00 H new ATOM 0 HG3 GLU B 75 15.410 -8.064 5.660 1.00 0.00 H new ATOM 2363 N VAL B 76 13.061 -4.582 4.630 1.00 0.00 N ATOM 2364 CA VAL B 76 13.256 -3.146 4.494 1.00 0.00 C ATOM 2365 C VAL B 76 14.426 -2.665 5.345 1.00 0.00 C ATOM 2366 O VAL B 76 14.726 -3.241 6.390 1.00 0.00 O ATOM 2367 CB VAL B 76 11.977 -2.375 4.889 1.00 0.00 C ATOM 2368 CG1 VAL B 76 11.498 -2.805 6.266 1.00 0.00 C ATOM 2369 CG2 VAL B 76 12.213 -0.873 4.853 1.00 0.00 C ATOM 0 H VAL B 76 12.459 -4.853 5.408 1.00 0.00 H new ATOM 0 HA VAL B 76 13.481 -2.947 3.446 1.00 0.00 H new ATOM 0 HB VAL B 76 11.201 -2.614 4.161 1.00 0.00 H new ATOM 0 HG11 VAL B 76 10.596 -2.251 6.527 1.00 0.00 H new ATOM 0 HG12 VAL B 76 11.278 -3.873 6.258 1.00 0.00 H new ATOM 0 HG13 VAL B 76 12.275 -2.600 7.002 1.00 0.00 H new ATOM 0 HG21 VAL B 76 11.297 -0.354 5.135 1.00 0.00 H new ATOM 0 HG22 VAL B 76 13.008 -0.613 5.552 1.00 0.00 H new ATOM 0 HG23 VAL B 76 12.504 -0.574 3.846 1.00 0.00 H new