USER MOD reduce.3.24.130724 H: found=0, std=0, add=544, rem=0, adj=14 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 25:sc= 0.0452 USER MOD Single : A 44 MET CE :methyl -154:sc= 0 (180deg=-0.0754) USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 LYS NZ :NH3+ 166:sc= -0.0342 (180deg=-0.288) USER MOD Single : A 60 ASN : amide:sc= -2.83! K(o=-2.8!,f=-0.13) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 LYS NZ :NH3+ -167:sc= -0.0226 (180deg=-0.273) USER MOD Single : A 67 THR OG1 : rot 33:sc= 0.233 USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 72 MET CE :methyl 162:sc= -0.113 (180deg=-0.704) USER MOD Single : B 43 SER OG : rot 31:sc= 0.052 USER MOD Single : B 44 MET CE :methyl -156:sc= 0 (180deg=-0.0988) USER MOD Single : B 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 58 LYS NZ :NH3+ 166:sc= -0.0252 (180deg=-0.232) USER MOD Single : B 60 ASN : amide:sc= -2.73! K(o=-2.7!,f=-0.16) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 LYS NZ :NH3+ -167:sc= -0.0385 (180deg=-0.265) USER MOD Single : B 67 THR OG1 : rot 35:sc= 0.215 USER MOD Single : B 69 SER OG : rot 180:sc= 0 USER MOD Single : B 72 MET CE :methyl 160:sc= -0.107 (180deg=-0.726) USER MOD ----------------------------------------------------------------- ATOM 581 N SER A 43 13.758 -7.769 7.453 1.00 0.00 N ATOM 582 CA SER A 43 12.587 -8.189 6.693 1.00 0.00 C ATOM 583 C SER A 43 11.352 -8.256 7.585 1.00 0.00 C ATOM 584 O SER A 43 11.447 -8.590 8.765 1.00 0.00 O ATOM 585 CB SER A 43 12.840 -9.553 6.046 1.00 0.00 C ATOM 586 OG SER A 43 13.939 -9.496 5.154 1.00 0.00 O ATOM 0 HA SER A 43 12.406 -7.450 5.912 1.00 0.00 H new ATOM 0 HB2 SER A 43 13.033 -10.296 6.820 1.00 0.00 H new ATOM 0 HB3 SER A 43 11.948 -9.876 5.509 1.00 0.00 H new ATOM 0 HG SER A 43 14.536 -8.765 5.417 1.00 0.00 H new ATOM 592 N MET A 44 10.193 -7.938 7.013 1.00 0.00 N ATOM 593 CA MET A 44 8.945 -7.956 7.762 1.00 0.00 C ATOM 594 C MET A 44 7.899 -8.816 7.059 1.00 0.00 C ATOM 595 O MET A 44 7.518 -8.542 5.922 1.00 0.00 O ATOM 596 CB MET A 44 8.419 -6.530 7.940 1.00 0.00 C ATOM 597 CG MET A 44 7.099 -6.455 8.689 1.00 0.00 C ATOM 598 SD MET A 44 7.204 -7.149 10.348 1.00 0.00 S ATOM 599 CE MET A 44 5.473 -7.186 10.802 1.00 0.00 C ATOM 0 H MET A 44 10.095 -7.666 6.035 1.00 0.00 H new ATOM 0 HA MET A 44 9.141 -8.390 8.742 1.00 0.00 H new ATOM 0 HB2 MET A 44 9.164 -5.941 8.475 1.00 0.00 H new ATOM 0 HB3 MET A 44 8.296 -6.072 6.958 1.00 0.00 H new ATOM 0 HG2 MET A 44 6.781 -5.414 8.754 1.00 0.00 H new ATOM 0 HG3 MET A 44 6.334 -6.988 8.124 1.00 0.00 H new ATOM 0 HE1 MET A 44 5.380 -7.137 11.887 1.00 0.00 H new ATOM 0 HE2 MET A 44 4.961 -6.334 10.355 1.00 0.00 H new ATOM 0 HE3 MET A 44 5.022 -8.110 10.441 1.00 0.00 H new ATOM 609 N GLU A 45 7.443 -9.860 7.745 1.00 0.00 N ATOM 610 CA GLU A 45 6.437 -10.761 7.196 1.00 0.00 C ATOM 611 C GLU A 45 5.045 -10.147 7.307 1.00 0.00 C ATOM 612 O GLU A 45 4.710 -9.523 8.315 1.00 0.00 O ATOM 613 CB GLU A 45 6.465 -12.106 7.928 1.00 0.00 C ATOM 614 CG GLU A 45 7.828 -12.780 7.930 1.00 0.00 C ATOM 615 CD GLU A 45 8.815 -12.107 8.865 1.00 0.00 C ATOM 616 OE1 GLU A 45 8.725 -12.340 10.089 1.00 0.00 O ATOM 617 OE2 GLU A 45 9.678 -11.351 8.374 1.00 0.00 O ATOM 0 H GLU A 45 7.756 -10.103 8.685 1.00 0.00 H new ATOM 0 HA GLU A 45 6.669 -10.923 6.143 1.00 0.00 H new ATOM 0 HB2 GLU A 45 6.145 -11.954 8.959 1.00 0.00 H new ATOM 0 HB3 GLU A 45 5.740 -12.776 7.464 1.00 0.00 H new ATOM 0 HG2 GLU A 45 7.712 -13.824 8.222 1.00 0.00 H new ATOM 0 HG3 GLU A 45 8.232 -12.775 6.918 1.00 0.00 H new ATOM 624 N VAL A 46 4.237 -10.328 6.266 1.00 0.00 N ATOM 625 CA VAL A 46 2.879 -9.797 6.251 1.00 0.00 C ATOM 626 C VAL A 46 1.855 -10.926 6.155 1.00 0.00 C ATOM 627 O VAL A 46 2.089 -11.925 5.474 1.00 0.00 O ATOM 628 CB VAL A 46 2.668 -8.818 5.080 1.00 0.00 C ATOM 629 CG1 VAL A 46 3.603 -7.626 5.209 1.00 0.00 C ATOM 630 CG2 VAL A 46 2.874 -9.518 3.746 1.00 0.00 C ATOM 0 H VAL A 46 4.500 -10.838 5.423 1.00 0.00 H new ATOM 0 HA VAL A 46 2.736 -9.258 7.187 1.00 0.00 H new ATOM 0 HB VAL A 46 1.640 -8.457 5.118 1.00 0.00 H new ATOM 0 HG11 VAL A 46 3.441 -6.944 4.374 1.00 0.00 H new ATOM 0 HG12 VAL A 46 3.403 -7.106 6.146 1.00 0.00 H new ATOM 0 HG13 VAL A 46 4.637 -7.972 5.200 1.00 0.00 H new ATOM 0 HG21 VAL A 46 2.720 -8.807 2.934 1.00 0.00 H new ATOM 0 HG22 VAL A 46 3.889 -9.912 3.695 1.00 0.00 H new ATOM 0 HG23 VAL A 46 2.161 -10.337 3.651 1.00 0.00 H new ATOM 640 N PRO A 47 0.703 -10.787 6.838 1.00 0.00 N ATOM 641 CA PRO A 47 -0.352 -11.785 6.832 1.00 0.00 C ATOM 642 C PRO A 47 -1.511 -11.408 5.914 1.00 0.00 C ATOM 643 O PRO A 47 -1.666 -10.245 5.538 1.00 0.00 O ATOM 644 CB PRO A 47 -0.798 -11.742 8.289 1.00 0.00 C ATOM 645 CG PRO A 47 -0.651 -10.300 8.685 1.00 0.00 C ATOM 646 CD PRO A 47 0.342 -9.672 7.725 1.00 0.00 C ATOM 0 HA PRO A 47 -0.022 -12.759 6.470 1.00 0.00 H new ATOM 0 HB2 PRO A 47 -1.828 -12.081 8.399 1.00 0.00 H new ATOM 0 HB3 PRO A 47 -0.181 -12.390 8.912 1.00 0.00 H new ATOM 0 HG2 PRO A 47 -1.612 -9.787 8.635 1.00 0.00 H new ATOM 0 HG3 PRO A 47 -0.298 -10.217 9.713 1.00 0.00 H new ATOM 0 HD2 PRO A 47 -0.101 -8.844 7.171 1.00 0.00 H new ATOM 0 HD3 PRO A 47 1.212 -9.276 8.248 1.00 0.00 H new ATOM 654 N ALA A 48 -2.323 -12.397 5.554 1.00 0.00 N ATOM 655 CA ALA A 48 -3.470 -12.163 4.682 1.00 0.00 C ATOM 656 C ALA A 48 -4.616 -11.496 5.443 1.00 0.00 C ATOM 657 O ALA A 48 -4.872 -11.825 6.602 1.00 0.00 O ATOM 658 CB ALA A 48 -3.938 -13.471 4.062 1.00 0.00 C ATOM 0 H ALA A 48 -2.209 -13.366 5.851 1.00 0.00 H new ATOM 0 HA ALA A 48 -3.156 -11.487 3.886 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -4.794 -13.281 3.414 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -3.129 -13.906 3.476 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -4.227 -14.165 4.851 1.00 0.00 H new ATOM 664 N PRO A 49 -5.326 -10.546 4.801 1.00 0.00 N ATOM 665 CA PRO A 49 -6.447 -9.840 5.431 1.00 0.00 C ATOM 666 C PRO A 49 -7.676 -10.727 5.600 1.00 0.00 C ATOM 667 O PRO A 49 -8.339 -10.696 6.637 1.00 0.00 O ATOM 668 CB PRO A 49 -6.741 -8.699 4.455 1.00 0.00 C ATOM 669 CG PRO A 49 -6.270 -9.199 3.134 1.00 0.00 C ATOM 670 CD PRO A 49 -5.087 -10.082 3.419 1.00 0.00 C ATOM 0 HA PRO A 49 -6.201 -9.506 6.439 1.00 0.00 H new ATOM 0 HB2 PRO A 49 -7.805 -8.462 4.432 1.00 0.00 H new ATOM 0 HB3 PRO A 49 -6.217 -7.787 4.743 1.00 0.00 H new ATOM 0 HG2 PRO A 49 -7.057 -9.755 2.625 1.00 0.00 H new ATOM 0 HG3 PRO A 49 -5.990 -8.372 2.481 1.00 0.00 H new ATOM 0 HD2 PRO A 49 -5.032 -10.916 2.720 1.00 0.00 H new ATOM 0 HD3 PRO A 49 -4.148 -9.534 3.337 1.00 0.00 H new ATOM 678 N PHE A 50 -7.977 -11.520 4.575 1.00 0.00 N ATOM 679 CA PHE A 50 -9.129 -12.413 4.614 1.00 0.00 C ATOM 680 C PHE A 50 -8.869 -13.675 3.800 1.00 0.00 C ATOM 681 O PHE A 50 -8.112 -13.655 2.829 1.00 0.00 O ATOM 682 CB PHE A 50 -10.375 -11.699 4.084 1.00 0.00 C ATOM 683 CG PHE A 50 -10.234 -11.212 2.669 1.00 0.00 C ATOM 684 CD1 PHE A 50 -9.637 -9.992 2.400 1.00 0.00 C ATOM 685 CD2 PHE A 50 -10.699 -11.974 1.608 1.00 0.00 C ATOM 686 CE1 PHE A 50 -9.504 -9.541 1.101 1.00 0.00 C ATOM 687 CE2 PHE A 50 -10.570 -11.528 0.308 1.00 0.00 C ATOM 688 CZ PHE A 50 -9.971 -10.309 0.053 1.00 0.00 C ATOM 0 H PHE A 50 -7.440 -11.562 3.709 1.00 0.00 H new ATOM 0 HA PHE A 50 -9.297 -12.700 5.652 1.00 0.00 H new ATOM 0 HB2 PHE A 50 -11.225 -12.379 4.142 1.00 0.00 H new ATOM 0 HB3 PHE A 50 -10.600 -10.851 4.731 1.00 0.00 H new ATOM 0 HD1 PHE A 50 -9.271 -9.386 3.215 1.00 0.00 H new ATOM 0 HD2 PHE A 50 -11.168 -12.928 1.801 1.00 0.00 H new ATOM 0 HE1 PHE A 50 -9.035 -8.588 0.905 1.00 0.00 H new ATOM 0 HE2 PHE A 50 -10.937 -12.131 -0.509 1.00 0.00 H new ATOM 0 HZ PHE A 50 -9.868 -9.958 -0.963 1.00 0.00 H new ATOM 698 N ALA A 51 -9.499 -14.774 4.206 1.00 0.00 N ATOM 699 CA ALA A 51 -9.342 -16.044 3.511 1.00 0.00 C ATOM 700 C ALA A 51 -9.857 -15.939 2.081 1.00 0.00 C ATOM 701 O ALA A 51 -10.734 -15.125 1.789 1.00 0.00 O ATOM 702 CB ALA A 51 -10.070 -17.149 4.259 1.00 0.00 C ATOM 0 H ALA A 51 -10.122 -14.809 5.013 1.00 0.00 H new ATOM 0 HA ALA A 51 -8.281 -16.290 3.476 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -9.944 -18.092 3.728 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.658 -17.241 5.264 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -11.131 -16.908 4.322 1.00 0.00 H new ATOM 708 N GLY A 52 -9.315 -16.764 1.191 1.00 0.00 N ATOM 709 CA GLY A 52 -9.745 -16.727 -0.195 1.00 0.00 C ATOM 710 C GLY A 52 -8.930 -17.628 -1.095 1.00 0.00 C ATOM 711 O GLY A 52 -7.837 -18.060 -0.730 1.00 0.00 O ATOM 0 H GLY A 52 -8.592 -17.452 1.402 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -10.793 -17.020 -0.251 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -9.680 -15.703 -0.562 1.00 0.00 H new ATOM 715 N VAL A 53 -9.466 -17.911 -2.277 1.00 0.00 N ATOM 716 CA VAL A 53 -8.787 -18.766 -3.240 1.00 0.00 C ATOM 717 C VAL A 53 -8.048 -17.935 -4.283 1.00 0.00 C ATOM 718 O VAL A 53 -8.599 -16.982 -4.834 1.00 0.00 O ATOM 719 CB VAL A 53 -9.779 -19.703 -3.958 1.00 0.00 C ATOM 720 CG1 VAL A 53 -9.038 -20.670 -4.869 1.00 0.00 C ATOM 721 CG2 VAL A 53 -10.630 -20.457 -2.947 1.00 0.00 C ATOM 0 H VAL A 53 -10.371 -17.559 -2.591 1.00 0.00 H new ATOM 0 HA VAL A 53 -8.071 -19.367 -2.680 1.00 0.00 H new ATOM 0 HB VAL A 53 -10.442 -19.096 -4.574 1.00 0.00 H new ATOM 0 HG11 VAL A 53 -9.755 -21.323 -5.367 1.00 0.00 H new ATOM 0 HG12 VAL A 53 -8.478 -20.109 -5.617 1.00 0.00 H new ATOM 0 HG13 VAL A 53 -8.349 -21.272 -4.277 1.00 0.00 H new ATOM 0 HG21 VAL A 53 -11.324 -21.113 -3.473 1.00 0.00 H new ATOM 0 HG22 VAL A 53 -9.985 -21.053 -2.301 1.00 0.00 H new ATOM 0 HG23 VAL A 53 -11.192 -19.746 -2.342 1.00 0.00 H new ATOM 731 N VAL A 54 -6.797 -18.298 -4.541 1.00 0.00 N ATOM 732 CA VAL A 54 -5.982 -17.589 -5.520 1.00 0.00 C ATOM 733 C VAL A 54 -6.419 -17.931 -6.941 1.00 0.00 C ATOM 734 O VAL A 54 -6.475 -19.101 -7.319 1.00 0.00 O ATOM 735 CB VAL A 54 -4.486 -17.923 -5.350 1.00 0.00 C ATOM 736 CG1 VAL A 54 -3.659 -17.272 -6.449 1.00 0.00 C ATOM 737 CG2 VAL A 54 -3.995 -17.487 -3.978 1.00 0.00 C ATOM 0 H VAL A 54 -6.325 -19.079 -4.086 1.00 0.00 H new ATOM 0 HA VAL A 54 -6.125 -16.522 -5.348 1.00 0.00 H new ATOM 0 HB VAL A 54 -4.366 -19.003 -5.431 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -2.607 -17.521 -6.309 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -3.992 -17.638 -7.420 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -3.784 -16.190 -6.406 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.937 -17.731 -3.876 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -4.132 -16.411 -3.867 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -4.563 -18.006 -3.206 1.00 0.00 H new ATOM 747 N LYS A 55 -6.727 -16.902 -7.723 1.00 0.00 N ATOM 748 CA LYS A 55 -7.163 -17.094 -9.102 1.00 0.00 C ATOM 749 C LYS A 55 -6.187 -16.448 -10.082 1.00 0.00 C ATOM 750 O LYS A 55 -5.717 -17.095 -11.018 1.00 0.00 O ATOM 751 CB LYS A 55 -8.566 -16.514 -9.300 1.00 0.00 C ATOM 752 CG LYS A 55 -9.084 -16.626 -10.728 1.00 0.00 C ATOM 753 CD LYS A 55 -9.181 -18.076 -11.176 1.00 0.00 C ATOM 754 CE LYS A 55 -9.692 -18.185 -12.604 1.00 0.00 C ATOM 755 NZ LYS A 55 -9.711 -19.597 -13.078 1.00 0.00 N ATOM 0 H LYS A 55 -6.683 -15.927 -7.426 1.00 0.00 H new ATOM 0 HA LYS A 55 -7.188 -18.165 -9.302 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -9.258 -17.026 -8.632 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -8.559 -15.464 -9.008 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -10.065 -16.157 -10.798 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -8.421 -16.080 -11.400 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -8.201 -18.547 -11.102 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -9.848 -18.621 -10.507 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -10.697 -17.768 -12.663 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -9.060 -17.589 -13.263 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -10.065 -19.630 -14.055 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -8.747 -19.987 -13.045 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -10.334 -20.161 -12.465 1.00 0.00 H new ATOM 769 N GLU A 56 -5.888 -15.173 -9.859 1.00 0.00 N ATOM 770 CA GLU A 56 -4.972 -14.441 -10.727 1.00 0.00 C ATOM 771 C GLU A 56 -4.008 -13.584 -9.911 1.00 0.00 C ATOM 772 O GLU A 56 -4.427 -12.684 -9.182 1.00 0.00 O ATOM 773 CB GLU A 56 -5.758 -13.556 -11.697 1.00 0.00 C ATOM 774 CG GLU A 56 -4.881 -12.805 -12.686 1.00 0.00 C ATOM 775 CD GLU A 56 -4.145 -13.732 -13.634 1.00 0.00 C ATOM 776 OE1 GLU A 56 -3.035 -14.182 -13.280 1.00 0.00 O ATOM 777 OE2 GLU A 56 -4.678 -14.008 -14.728 1.00 0.00 O ATOM 0 H GLU A 56 -6.266 -14.625 -9.086 1.00 0.00 H new ATOM 0 HA GLU A 56 -4.390 -15.169 -11.293 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.465 -14.176 -12.249 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -6.344 -12.836 -11.125 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -5.498 -12.116 -13.263 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -4.157 -12.202 -12.139 1.00 0.00 H new ATOM 784 N LEU A 57 -2.718 -13.871 -10.039 1.00 0.00 N ATOM 785 CA LEU A 57 -1.692 -13.120 -9.321 1.00 0.00 C ATOM 786 C LEU A 57 -1.507 -11.737 -9.940 1.00 0.00 C ATOM 787 O LEU A 57 -1.971 -11.477 -11.051 1.00 0.00 O ATOM 788 CB LEU A 57 -0.362 -13.883 -9.326 1.00 0.00 C ATOM 789 CG LEU A 57 0.469 -13.764 -10.609 1.00 0.00 C ATOM 790 CD1 LEU A 57 1.840 -14.394 -10.415 1.00 0.00 C ATOM 791 CD2 LEU A 57 -0.248 -14.413 -11.784 1.00 0.00 C ATOM 0 H LEU A 57 -2.356 -14.618 -10.633 1.00 0.00 H new ATOM 0 HA LEU A 57 -2.020 -12.999 -8.289 1.00 0.00 H new ATOM 0 HB2 LEU A 57 0.242 -13.529 -8.490 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -0.569 -14.938 -9.146 1.00 0.00 H new ATOM 0 HG LEU A 57 0.598 -12.705 -10.831 1.00 0.00 H new ATOM 0 HD11 LEU A 57 2.417 -14.301 -11.335 1.00 0.00 H new ATOM 0 HD12 LEU A 57 2.363 -13.885 -9.606 1.00 0.00 H new ATOM 0 HD13 LEU A 57 1.724 -15.449 -10.165 1.00 0.00 H new ATOM 0 HD21 LEU A 57 0.362 -14.315 -12.682 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -0.413 -15.469 -11.571 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -1.207 -13.920 -11.942 1.00 0.00 H new ATOM 803 N LYS A 58 -0.829 -10.853 -9.214 1.00 0.00 N ATOM 804 CA LYS A 58 -0.584 -9.498 -9.694 1.00 0.00 C ATOM 805 C LYS A 58 0.892 -9.295 -10.026 1.00 0.00 C ATOM 806 O LYS A 58 1.233 -8.718 -11.059 1.00 0.00 O ATOM 807 CB LYS A 58 -1.031 -8.474 -8.649 1.00 0.00 C ATOM 808 CG LYS A 58 -0.788 -7.029 -9.062 1.00 0.00 C ATOM 809 CD LYS A 58 -1.623 -6.646 -10.274 1.00 0.00 C ATOM 810 CE LYS A 58 -1.385 -5.200 -10.679 1.00 0.00 C ATOM 811 NZ LYS A 58 0.049 -4.936 -10.984 1.00 0.00 N ATOM 0 H LYS A 58 -0.440 -11.051 -8.292 1.00 0.00 H new ATOM 0 HA LYS A 58 -1.165 -9.353 -10.605 1.00 0.00 H new ATOM 0 HB2 LYS A 58 -2.094 -8.612 -8.450 1.00 0.00 H new ATOM 0 HB3 LYS A 58 -0.504 -8.669 -7.715 1.00 0.00 H new ATOM 0 HG2 LYS A 58 -1.028 -6.367 -8.230 1.00 0.00 H new ATOM 0 HG3 LYS A 58 0.269 -6.887 -9.288 1.00 0.00 H new ATOM 0 HD2 LYS A 58 -1.379 -7.304 -11.108 1.00 0.00 H new ATOM 0 HD3 LYS A 58 -2.680 -6.793 -10.051 1.00 0.00 H new ATOM 0 HE2 LYS A 58 -1.991 -4.964 -11.553 1.00 0.00 H new ATOM 0 HE3 LYS A 58 -1.713 -4.540 -9.876 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 0.137 -4.024 -11.477 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 0.592 -4.904 -10.098 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 0.420 -5.695 -11.591 1.00 0.00 H new ATOM 825 N VAL A 59 1.763 -9.770 -9.140 1.00 0.00 N ATOM 826 CA VAL A 59 3.202 -9.640 -9.338 1.00 0.00 C ATOM 827 C VAL A 59 3.886 -11.004 -9.321 1.00 0.00 C ATOM 828 O VAL A 59 3.380 -11.956 -8.725 1.00 0.00 O ATOM 829 CB VAL A 59 3.842 -8.752 -8.254 1.00 0.00 C ATOM 830 CG1 VAL A 59 3.319 -7.327 -8.350 1.00 0.00 C ATOM 831 CG2 VAL A 59 3.587 -9.329 -6.870 1.00 0.00 C ATOM 0 H VAL A 59 1.497 -10.248 -8.279 1.00 0.00 H new ATOM 0 HA VAL A 59 3.343 -9.174 -10.313 1.00 0.00 H new ATOM 0 HB VAL A 59 4.919 -8.730 -8.420 1.00 0.00 H new ATOM 0 HG11 VAL A 59 3.783 -6.716 -7.576 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.561 -6.916 -9.330 1.00 0.00 H new ATOM 0 HG13 VAL A 59 2.238 -7.326 -8.213 1.00 0.00 H new ATOM 0 HG21 VAL A 59 4.047 -8.688 -6.118 1.00 0.00 H new ATOM 0 HG22 VAL A 59 2.513 -9.385 -6.691 1.00 0.00 H new ATOM 0 HG23 VAL A 59 4.018 -10.328 -6.807 1.00 0.00 H new ATOM 841 N ASN A 60 5.038 -11.091 -9.979 1.00 0.00 N ATOM 842 CA ASN A 60 5.793 -12.337 -10.036 1.00 0.00 C ATOM 843 C ASN A 60 6.849 -12.384 -8.937 1.00 0.00 C ATOM 844 O ASN A 60 7.353 -11.348 -8.503 1.00 0.00 O ATOM 845 CB ASN A 60 6.462 -12.495 -11.405 1.00 0.00 C ATOM 846 CG ASN A 60 5.474 -12.833 -12.507 1.00 0.00 C ATOM 847 OD1 ASN A 60 5.811 -13.534 -13.461 1.00 0.00 O ATOM 848 ND2 ASN A 60 4.248 -12.336 -12.385 1.00 0.00 N ATOM 0 H ASN A 60 5.468 -10.314 -10.480 1.00 0.00 H new ATOM 0 HA ASN A 60 5.095 -13.160 -9.883 1.00 0.00 H new ATOM 0 HB2 ASN A 60 6.981 -11.571 -11.659 1.00 0.00 H new ATOM 0 HB3 ASN A 60 7.217 -13.279 -11.347 1.00 0.00 H new ATOM 0 HD21 ASN A 60 3.545 -12.531 -13.098 1.00 0.00 H new ATOM 0 HD22 ASN A 60 4.009 -11.759 -11.578 1.00 0.00 H new ATOM 855 N VAL A 61 7.175 -13.593 -8.492 1.00 0.00 N ATOM 856 CA VAL A 61 8.172 -13.781 -7.444 1.00 0.00 C ATOM 857 C VAL A 61 9.508 -13.163 -7.843 1.00 0.00 C ATOM 858 O VAL A 61 10.082 -13.511 -8.875 1.00 0.00 O ATOM 859 CB VAL A 61 8.379 -15.276 -7.130 1.00 0.00 C ATOM 860 CG1 VAL A 61 9.421 -15.459 -6.037 1.00 0.00 C ATOM 861 CG2 VAL A 61 7.061 -15.923 -6.734 1.00 0.00 C ATOM 0 H VAL A 61 6.763 -14.458 -8.841 1.00 0.00 H new ATOM 0 HA VAL A 61 7.796 -13.280 -6.552 1.00 0.00 H new ATOM 0 HB VAL A 61 8.746 -15.769 -8.030 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.551 -16.522 -5.832 1.00 0.00 H new ATOM 0 HG12 VAL A 61 10.370 -15.034 -6.364 1.00 0.00 H new ATOM 0 HG13 VAL A 61 9.090 -14.952 -5.130 1.00 0.00 H new ATOM 0 HG21 VAL A 61 7.225 -16.978 -6.516 1.00 0.00 H new ATOM 0 HG22 VAL A 61 6.664 -15.427 -5.849 1.00 0.00 H new ATOM 0 HG23 VAL A 61 6.349 -15.828 -7.553 1.00 0.00 H new ATOM 871 N GLY A 62 9.995 -12.242 -7.017 1.00 0.00 N ATOM 872 CA GLY A 62 11.259 -11.586 -7.295 1.00 0.00 C ATOM 873 C GLY A 62 11.080 -10.138 -7.705 1.00 0.00 C ATOM 874 O GLY A 62 12.054 -9.440 -7.984 1.00 0.00 O ATOM 0 H GLY A 62 9.535 -11.938 -6.159 1.00 0.00 H new ATOM 0 HA2 GLY A 62 11.893 -11.634 -6.410 1.00 0.00 H new ATOM 0 HA3 GLY A 62 11.778 -12.124 -8.088 1.00 0.00 H new ATOM 878 N ASP A 63 9.829 -9.686 -7.740 1.00 0.00 N ATOM 879 CA ASP A 63 9.525 -8.311 -8.119 1.00 0.00 C ATOM 880 C ASP A 63 9.171 -7.472 -6.895 1.00 0.00 C ATOM 881 O ASP A 63 8.271 -7.819 -6.130 1.00 0.00 O ATOM 882 CB ASP A 63 8.371 -8.282 -9.124 1.00 0.00 C ATOM 883 CG ASP A 63 8.018 -6.874 -9.560 1.00 0.00 C ATOM 884 OD1 ASP A 63 8.699 -6.345 -10.464 1.00 0.00 O ATOM 885 OD2 ASP A 63 7.062 -6.300 -8.997 1.00 0.00 O ATOM 0 H ASP A 63 9.012 -10.251 -7.511 1.00 0.00 H new ATOM 0 HA ASP A 63 10.414 -7.883 -8.583 1.00 0.00 H new ATOM 0 HB2 ASP A 63 8.640 -8.873 -9.999 1.00 0.00 H new ATOM 0 HB3 ASP A 63 7.494 -8.752 -8.679 1.00 0.00 H new ATOM 890 N LYS A 64 9.890 -6.368 -6.720 1.00 0.00 N ATOM 891 CA LYS A 64 9.661 -5.462 -5.598 1.00 0.00 C ATOM 892 C LYS A 64 8.204 -5.011 -5.535 1.00 0.00 C ATOM 893 O LYS A 64 7.412 -5.299 -6.432 1.00 0.00 O ATOM 894 CB LYS A 64 10.574 -4.241 -5.713 1.00 0.00 C ATOM 895 CG LYS A 64 10.355 -3.441 -6.989 1.00 0.00 C ATOM 896 CD LYS A 64 11.282 -2.236 -7.066 1.00 0.00 C ATOM 897 CE LYS A 64 12.739 -2.655 -7.192 1.00 0.00 C ATOM 898 NZ LYS A 64 13.640 -1.482 -7.359 1.00 0.00 N ATOM 0 H LYS A 64 10.642 -6.077 -7.345 1.00 0.00 H new ATOM 0 HA LYS A 64 9.890 -6.004 -4.680 1.00 0.00 H new ATOM 0 HB2 LYS A 64 10.410 -3.592 -4.853 1.00 0.00 H new ATOM 0 HB3 LYS A 64 11.613 -4.568 -5.672 1.00 0.00 H new ATOM 0 HG2 LYS A 64 10.521 -4.083 -7.854 1.00 0.00 H new ATOM 0 HG3 LYS A 64 9.319 -3.106 -7.035 1.00 0.00 H new ATOM 0 HD2 LYS A 64 11.006 -1.618 -7.920 1.00 0.00 H new ATOM 0 HD3 LYS A 64 11.156 -1.622 -6.174 1.00 0.00 H new ATOM 0 HE2 LYS A 64 13.034 -3.216 -6.305 1.00 0.00 H new ATOM 0 HE3 LYS A 64 12.852 -3.324 -8.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 14.624 -1.809 -7.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 13.375 -0.961 -8.219 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 13.551 -0.856 -6.533 1.00 0.00 H new ATOM 912 N VAL A 65 7.863 -4.295 -4.469 1.00 0.00 N ATOM 913 CA VAL A 65 6.505 -3.801 -4.282 1.00 0.00 C ATOM 914 C VAL A 65 6.514 -2.357 -3.793 1.00 0.00 C ATOM 915 O VAL A 65 7.523 -1.872 -3.284 1.00 0.00 O ATOM 916 CB VAL A 65 5.727 -4.675 -3.274 1.00 0.00 C ATOM 917 CG1 VAL A 65 6.138 -4.353 -1.843 1.00 0.00 C ATOM 918 CG2 VAL A 65 4.228 -4.500 -3.461 1.00 0.00 C ATOM 0 H VAL A 65 8.509 -4.044 -3.721 1.00 0.00 H new ATOM 0 HA VAL A 65 6.007 -3.849 -5.251 1.00 0.00 H new ATOM 0 HB VAL A 65 5.975 -5.719 -3.466 1.00 0.00 H new ATOM 0 HG11 VAL A 65 5.576 -4.982 -1.153 1.00 0.00 H new ATOM 0 HG12 VAL A 65 7.204 -4.542 -1.719 1.00 0.00 H new ATOM 0 HG13 VAL A 65 5.928 -3.304 -1.631 1.00 0.00 H new ATOM 0 HG21 VAL A 65 3.696 -5.124 -2.742 1.00 0.00 H new ATOM 0 HG22 VAL A 65 3.961 -3.455 -3.302 1.00 0.00 H new ATOM 0 HG23 VAL A 65 3.951 -4.796 -4.473 1.00 0.00 H new ATOM 928 N LYS A 66 5.384 -1.676 -3.952 1.00 0.00 N ATOM 929 CA LYS A 66 5.260 -0.290 -3.524 1.00 0.00 C ATOM 930 C LYS A 66 3.862 -0.013 -2.981 1.00 0.00 C ATOM 931 O LYS A 66 2.896 -0.675 -3.360 1.00 0.00 O ATOM 932 CB LYS A 66 5.570 0.655 -4.686 1.00 0.00 C ATOM 933 CG LYS A 66 6.999 0.546 -5.191 1.00 0.00 C ATOM 934 CD LYS A 66 7.266 1.510 -6.336 1.00 0.00 C ATOM 935 CE LYS A 66 8.698 1.398 -6.832 1.00 0.00 C ATOM 936 NZ LYS A 66 9.683 1.724 -5.763 1.00 0.00 N ATOM 0 H LYS A 66 4.541 -2.063 -4.375 1.00 0.00 H new ATOM 0 HA LYS A 66 5.980 -0.115 -2.725 1.00 0.00 H new ATOM 0 HB2 LYS A 66 4.886 0.444 -5.508 1.00 0.00 H new ATOM 0 HB3 LYS A 66 5.382 1.681 -4.370 1.00 0.00 H new ATOM 0 HG2 LYS A 66 7.690 0.751 -4.374 1.00 0.00 H new ATOM 0 HG3 LYS A 66 7.191 -0.475 -5.522 1.00 0.00 H new ATOM 0 HD2 LYS A 66 6.578 1.303 -7.156 1.00 0.00 H new ATOM 0 HD3 LYS A 66 7.072 2.531 -6.007 1.00 0.00 H new ATOM 0 HE2 LYS A 66 8.878 0.386 -7.196 1.00 0.00 H new ATOM 0 HE3 LYS A 66 8.843 2.071 -7.677 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 10.624 1.852 -6.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 9.397 2.601 -5.283 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 9.716 0.947 -5.073 1.00 0.00 H new ATOM 950 N THR A 67 3.763 0.968 -2.090 1.00 0.00 N ATOM 951 CA THR A 67 2.483 1.330 -1.494 1.00 0.00 C ATOM 952 C THR A 67 1.497 1.803 -2.555 1.00 0.00 C ATOM 953 O THR A 67 1.800 2.700 -3.344 1.00 0.00 O ATOM 954 CB THR A 67 2.648 2.435 -0.435 1.00 0.00 C ATOM 955 OG1 THR A 67 3.253 3.593 -1.024 1.00 0.00 O ATOM 956 CG2 THR A 67 3.499 1.946 0.727 1.00 0.00 C ATOM 0 H THR A 67 4.553 1.526 -1.765 1.00 0.00 H new ATOM 0 HA THR A 67 2.094 0.432 -1.014 1.00 0.00 H new ATOM 0 HB THR A 67 1.660 2.696 -0.056 1.00 0.00 H new ATOM 0 HG1 THR A 67 2.962 3.676 -1.956 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.602 2.743 1.463 1.00 0.00 H new ATOM 0 HG22 THR A 67 3.020 1.084 1.191 1.00 0.00 H new ATOM 0 HG23 THR A 67 4.485 1.660 0.361 1.00 0.00 H new ATOM 964 N GLY A 68 0.317 1.193 -2.571 1.00 0.00 N ATOM 965 CA GLY A 68 -0.698 1.564 -3.538 1.00 0.00 C ATOM 966 C GLY A 68 -0.805 0.571 -4.679 1.00 0.00 C ATOM 967 O GLY A 68 -1.706 0.670 -5.512 1.00 0.00 O ATOM 0 H GLY A 68 0.045 0.447 -1.930 1.00 0.00 H new ATOM 0 HA2 GLY A 68 -1.662 1.641 -3.036 1.00 0.00 H new ATOM 0 HA3 GLY A 68 -0.469 2.551 -3.940 1.00 0.00 H new ATOM 971 N SER A 69 0.116 -0.388 -4.718 1.00 0.00 N ATOM 972 CA SER A 69 0.118 -1.400 -5.768 1.00 0.00 C ATOM 973 C SER A 69 -0.430 -2.725 -5.250 1.00 0.00 C ATOM 974 O SER A 69 -0.097 -3.155 -4.147 1.00 0.00 O ATOM 975 CB SER A 69 1.533 -1.599 -6.314 1.00 0.00 C ATOM 976 OG SER A 69 2.053 -0.388 -6.836 1.00 0.00 O ATOM 0 H SER A 69 0.868 -0.485 -4.036 1.00 0.00 H new ATOM 0 HA SER A 69 -0.528 -1.050 -6.573 1.00 0.00 H new ATOM 0 HB2 SER A 69 2.184 -1.966 -5.521 1.00 0.00 H new ATOM 0 HB3 SER A 69 1.521 -2.360 -7.094 1.00 0.00 H new ATOM 0 HG SER A 69 2.959 -0.541 -7.177 1.00 0.00 H new ATOM 982 N LEU A 70 -1.272 -3.364 -6.056 1.00 0.00 N ATOM 983 CA LEU A 70 -1.869 -4.642 -5.683 1.00 0.00 C ATOM 984 C LEU A 70 -0.800 -5.721 -5.552 1.00 0.00 C ATOM 985 O LEU A 70 0.339 -5.533 -5.979 1.00 0.00 O ATOM 986 CB LEU A 70 -2.912 -5.058 -6.720 1.00 0.00 C ATOM 987 CG LEU A 70 -4.044 -4.052 -6.937 1.00 0.00 C ATOM 988 CD1 LEU A 70 -4.900 -4.459 -8.126 1.00 0.00 C ATOM 989 CD2 LEU A 70 -4.896 -3.932 -5.681 1.00 0.00 C ATOM 0 H LEU A 70 -1.557 -3.018 -6.972 1.00 0.00 H new ATOM 0 HA LEU A 70 -2.357 -4.523 -4.716 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -2.409 -5.227 -7.672 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -3.346 -6.010 -6.415 1.00 0.00 H new ATOM 0 HG LEU A 70 -3.604 -3.078 -7.150 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -5.700 -3.731 -8.265 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -4.283 -4.495 -9.024 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -5.332 -5.443 -7.943 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -5.697 -3.213 -5.852 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -5.327 -4.904 -5.439 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -4.275 -3.594 -4.851 1.00 0.00 H new ATOM 1001 N ILE A 71 -1.176 -6.853 -4.962 1.00 0.00 N ATOM 1002 CA ILE A 71 -0.243 -7.957 -4.772 1.00 0.00 C ATOM 1003 C ILE A 71 -0.882 -9.300 -5.119 1.00 0.00 C ATOM 1004 O ILE A 71 -0.210 -10.207 -5.608 1.00 0.00 O ATOM 1005 CB ILE A 71 0.277 -8.009 -3.323 1.00 0.00 C ATOM 1006 CG1 ILE A 71 -0.896 -8.047 -2.337 1.00 0.00 C ATOM 1007 CG2 ILE A 71 1.181 -6.814 -3.048 1.00 0.00 C ATOM 1008 CD1 ILE A 71 -0.472 -8.183 -0.889 1.00 0.00 C ATOM 0 H ILE A 71 -2.117 -7.028 -4.609 1.00 0.00 H new ATOM 0 HA ILE A 71 0.593 -7.776 -5.448 1.00 0.00 H new ATOM 0 HB ILE A 71 0.861 -8.919 -3.189 1.00 0.00 H new ATOM 0 HG12 ILE A 71 -1.483 -7.136 -2.450 1.00 0.00 H new ATOM 0 HG13 ILE A 71 -1.549 -8.881 -2.595 1.00 0.00 H new ATOM 0 HG21 ILE A 71 1.543 -6.860 -2.021 1.00 0.00 H new ATOM 0 HG22 ILE A 71 2.029 -6.834 -3.733 1.00 0.00 H new ATOM 0 HG23 ILE A 71 0.619 -5.891 -3.193 1.00 0.00 H new ATOM 0 HD11 ILE A 71 -1.356 -8.203 -0.251 1.00 0.00 H new ATOM 0 HD12 ILE A 71 0.090 -9.108 -0.760 1.00 0.00 H new ATOM 0 HD13 ILE A 71 0.156 -7.336 -0.613 1.00 0.00 H new ATOM 1020 N MET A 72 -2.182 -9.420 -4.864 1.00 0.00 N ATOM 1021 CA MET A 72 -2.904 -10.657 -5.144 1.00 0.00 C ATOM 1022 C MET A 72 -4.413 -10.431 -5.089 1.00 0.00 C ATOM 1023 O MET A 72 -4.884 -9.473 -4.478 1.00 0.00 O ATOM 1024 CB MET A 72 -2.497 -11.738 -4.137 1.00 0.00 C ATOM 1025 CG MET A 72 -3.169 -13.083 -4.371 1.00 0.00 C ATOM 1026 SD MET A 72 -2.738 -13.809 -5.965 1.00 0.00 S ATOM 1027 CE MET A 72 -0.983 -14.090 -5.747 1.00 0.00 C ATOM 0 H MET A 72 -2.756 -8.677 -4.465 1.00 0.00 H new ATOM 0 HA MET A 72 -2.645 -10.987 -6.150 1.00 0.00 H new ATOM 0 HB2 MET A 72 -1.416 -11.871 -4.179 1.00 0.00 H new ATOM 0 HB3 MET A 72 -2.737 -11.393 -3.131 1.00 0.00 H new ATOM 0 HG2 MET A 72 -2.884 -13.770 -3.574 1.00 0.00 H new ATOM 0 HG3 MET A 72 -4.250 -12.959 -4.313 1.00 0.00 H new ATOM 0 HE1 MET A 72 -0.634 -14.808 -6.490 1.00 0.00 H new ATOM 0 HE2 MET A 72 -0.446 -13.150 -5.871 1.00 0.00 H new ATOM 0 HE3 MET A 72 -0.799 -14.484 -4.748 1.00 0.00 H new ATOM 1037 N ILE A 73 -5.164 -11.316 -5.738 1.00 0.00 N ATOM 1038 CA ILE A 73 -6.619 -11.218 -5.762 1.00 0.00 C ATOM 1039 C ILE A 73 -7.258 -12.542 -5.359 1.00 0.00 C ATOM 1040 O ILE A 73 -6.925 -13.593 -5.906 1.00 0.00 O ATOM 1041 CB ILE A 73 -7.136 -10.822 -7.158 1.00 0.00 C ATOM 1042 CG1 ILE A 73 -6.333 -9.642 -7.713 1.00 0.00 C ATOM 1043 CG2 ILE A 73 -8.618 -10.479 -7.092 1.00 0.00 C ATOM 1044 CD1 ILE A 73 -6.674 -9.296 -9.147 1.00 0.00 C ATOM 0 H ILE A 73 -4.788 -12.111 -6.255 1.00 0.00 H new ATOM 0 HA ILE A 73 -6.896 -10.443 -5.048 1.00 0.00 H new ATOM 0 HB ILE A 73 -7.006 -11.669 -7.831 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -6.508 -8.768 -7.086 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -5.270 -9.874 -7.647 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -8.972 -10.201 -8.085 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -9.177 -11.345 -6.737 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -8.768 -9.645 -6.406 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -6.066 -8.451 -9.472 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -6.472 -10.155 -9.786 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -7.729 -9.032 -9.216 1.00 0.00 H new ATOM 1056 N PHE A 74 -8.178 -12.487 -4.401 1.00 0.00 N ATOM 1057 CA PHE A 74 -8.858 -13.687 -3.924 1.00 0.00 C ATOM 1058 C PHE A 74 -10.315 -13.726 -4.365 1.00 0.00 C ATOM 1059 O PHE A 74 -10.929 -12.688 -4.607 1.00 0.00 O ATOM 1060 CB PHE A 74 -8.792 -13.760 -2.401 1.00 0.00 C ATOM 1061 CG PHE A 74 -7.394 -13.814 -1.870 1.00 0.00 C ATOM 1062 CD1 PHE A 74 -6.669 -14.989 -1.931 1.00 0.00 C ATOM 1063 CD2 PHE A 74 -6.807 -12.694 -1.308 1.00 0.00 C ATOM 1064 CE1 PHE A 74 -5.382 -15.050 -1.444 1.00 0.00 C ATOM 1065 CE2 PHE A 74 -5.518 -12.746 -0.817 1.00 0.00 C ATOM 1066 CZ PHE A 74 -4.803 -13.926 -0.884 1.00 0.00 C ATOM 0 H PHE A 74 -8.470 -11.625 -3.940 1.00 0.00 H new ATOM 0 HA PHE A 74 -8.346 -14.544 -4.361 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -9.299 -12.892 -1.980 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -9.336 -14.642 -2.063 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -7.117 -15.870 -2.366 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -7.363 -11.770 -1.253 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -4.826 -15.974 -1.499 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -5.069 -11.866 -0.381 1.00 0.00 H new ATOM 0 HZ PHE A 74 -3.795 -13.971 -0.500 1.00 0.00 H new ATOM 1076 N GLU A 75 -10.858 -14.936 -4.463 1.00 0.00 N ATOM 1077 CA GLU A 75 -12.250 -15.126 -4.850 1.00 0.00 C ATOM 1078 C GLU A 75 -13.120 -15.246 -3.604 1.00 0.00 C ATOM 1079 O GLU A 75 -13.245 -16.326 -3.026 1.00 0.00 O ATOM 1080 CB GLU A 75 -12.398 -16.377 -5.720 1.00 0.00 C ATOM 1081 CG GLU A 75 -11.496 -16.382 -6.943 1.00 0.00 C ATOM 1082 CD GLU A 75 -11.635 -17.647 -7.767 1.00 0.00 C ATOM 1083 OE1 GLU A 75 -10.958 -18.645 -7.441 1.00 0.00 O ATOM 1084 OE2 GLU A 75 -12.420 -17.641 -8.738 1.00 0.00 O ATOM 0 H GLU A 75 -10.352 -15.802 -4.279 1.00 0.00 H new ATOM 0 HA GLU A 75 -12.575 -14.263 -5.431 1.00 0.00 H new ATOM 0 HB2 GLU A 75 -12.180 -17.257 -5.115 1.00 0.00 H new ATOM 0 HB3 GLU A 75 -13.435 -16.462 -6.044 1.00 0.00 H new ATOM 0 HG2 GLU A 75 -11.731 -15.519 -7.566 1.00 0.00 H new ATOM 0 HG3 GLU A 75 -10.459 -16.272 -6.625 1.00 0.00 H new ATOM 1091 N VAL A 76 -13.714 -14.131 -3.193 1.00 0.00 N ATOM 1092 CA VAL A 76 -14.554 -14.111 -2.003 1.00 0.00 C ATOM 1093 C VAL A 76 -16.006 -13.803 -2.349 1.00 0.00 C ATOM 1094 O VAL A 76 -16.317 -12.738 -2.879 1.00 0.00 O ATOM 1095 CB VAL A 76 -14.041 -13.081 -0.974 1.00 0.00 C ATOM 1096 CG1 VAL A 76 -13.780 -11.737 -1.640 1.00 0.00 C ATOM 1097 CG2 VAL A 76 -15.026 -12.930 0.176 1.00 0.00 C ATOM 0 H VAL A 76 -13.629 -13.231 -3.666 1.00 0.00 H new ATOM 0 HA VAL A 76 -14.503 -15.107 -1.564 1.00 0.00 H new ATOM 0 HB VAL A 76 -13.098 -13.448 -0.568 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -13.419 -11.026 -0.896 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -13.029 -11.858 -2.421 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -14.705 -11.363 -2.080 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -14.644 -12.199 0.889 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -15.987 -12.592 -0.210 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -15.153 -13.891 0.675 1.00 0.00 H new ATOM 1853 N SER B 43 -14.648 -11.370 -6.385 1.00 0.00 N ATOM 1854 CA SER B 43 -13.244 -11.343 -5.995 1.00 0.00 C ATOM 1855 C SER B 43 -12.852 -9.964 -5.472 1.00 0.00 C ATOM 1856 O SER B 43 -13.302 -8.943 -5.992 1.00 0.00 O ATOM 1857 CB SER B 43 -12.360 -11.720 -7.185 1.00 0.00 C ATOM 1858 OG SER B 43 -12.659 -13.025 -7.649 1.00 0.00 O ATOM 0 HA SER B 43 -13.098 -12.069 -5.196 1.00 0.00 H new ATOM 0 HB2 SER B 43 -12.505 -11.002 -7.992 1.00 0.00 H new ATOM 0 HB3 SER B 43 -11.311 -11.665 -6.894 1.00 0.00 H new ATOM 0 HG SER B 43 -13.607 -13.218 -7.494 1.00 0.00 H new ATOM 1864 N MET B 44 -12.013 -9.942 -4.440 1.00 0.00 N ATOM 1865 CA MET B 44 -11.562 -8.688 -3.847 1.00 0.00 C ATOM 1866 C MET B 44 -10.045 -8.549 -3.949 1.00 0.00 C ATOM 1867 O MET B 44 -9.300 -9.412 -3.485 1.00 0.00 O ATOM 1868 CB MET B 44 -11.999 -8.616 -2.381 1.00 0.00 C ATOM 1869 CG MET B 44 -11.528 -7.361 -1.668 1.00 0.00 C ATOM 1870 SD MET B 44 -12.178 -5.854 -2.414 1.00 0.00 S ATOM 1871 CE MET B 44 -11.249 -4.614 -1.520 1.00 0.00 C ATOM 0 H MET B 44 -11.632 -10.778 -3.998 1.00 0.00 H new ATOM 0 HA MET B 44 -12.017 -7.865 -4.399 1.00 0.00 H new ATOM 0 HB2 MET B 44 -13.087 -8.665 -2.332 1.00 0.00 H new ATOM 0 HB3 MET B 44 -11.616 -9.489 -1.853 1.00 0.00 H new ATOM 0 HG2 MET B 44 -11.833 -7.405 -0.623 1.00 0.00 H new ATOM 0 HG3 MET B 44 -10.439 -7.328 -1.681 1.00 0.00 H new ATOM 0 HE1 MET B 44 -11.796 -3.671 -1.531 1.00 0.00 H new ATOM 0 HE2 MET B 44 -11.107 -4.939 -0.489 1.00 0.00 H new ATOM 0 HE3 MET B 44 -10.277 -4.475 -1.994 1.00 0.00 H new ATOM 1881 N GLU B 45 -9.595 -7.456 -4.559 1.00 0.00 N ATOM 1882 CA GLU B 45 -8.167 -7.201 -4.720 1.00 0.00 C ATOM 1883 C GLU B 45 -7.583 -6.581 -3.456 1.00 0.00 C ATOM 1884 O GLU B 45 -8.214 -5.738 -2.819 1.00 0.00 O ATOM 1885 CB GLU B 45 -7.918 -6.273 -5.913 1.00 0.00 C ATOM 1886 CG GLU B 45 -8.471 -6.800 -7.228 1.00 0.00 C ATOM 1887 CD GLU B 45 -9.984 -6.723 -7.299 1.00 0.00 C ATOM 1888 OE1 GLU B 45 -10.513 -5.614 -7.523 1.00 0.00 O ATOM 1889 OE2 GLU B 45 -10.641 -7.773 -7.131 1.00 0.00 O ATOM 0 H GLU B 45 -10.199 -6.733 -4.950 1.00 0.00 H new ATOM 0 HA GLU B 45 -7.674 -8.156 -4.903 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -8.366 -5.301 -5.705 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -6.845 -6.113 -6.019 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -8.043 -6.229 -8.052 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -8.157 -7.835 -7.361 1.00 0.00 H new ATOM 1896 N VAL B 46 -6.373 -7.002 -3.096 1.00 0.00 N ATOM 1897 CA VAL B 46 -5.708 -6.480 -1.908 1.00 0.00 C ATOM 1898 C VAL B 46 -4.406 -5.766 -2.275 1.00 0.00 C ATOM 1899 O VAL B 46 -3.690 -6.198 -3.179 1.00 0.00 O ATOM 1900 CB VAL B 46 -5.404 -7.598 -0.892 1.00 0.00 C ATOM 1901 CG1 VAL B 46 -6.694 -8.243 -0.409 1.00 0.00 C ATOM 1902 CG2 VAL B 46 -4.477 -8.641 -1.497 1.00 0.00 C ATOM 0 H VAL B 46 -5.836 -7.701 -3.609 1.00 0.00 H new ATOM 0 HA VAL B 46 -6.393 -5.766 -1.451 1.00 0.00 H new ATOM 0 HB VAL B 46 -4.899 -7.153 -0.035 1.00 0.00 H new ATOM 0 HG11 VAL B 46 -6.461 -9.030 0.308 1.00 0.00 H new ATOM 0 HG12 VAL B 46 -7.320 -7.490 0.070 1.00 0.00 H new ATOM 0 HG13 VAL B 46 -7.227 -8.671 -1.258 1.00 0.00 H new ATOM 0 HG21 VAL B 46 -4.277 -9.420 -0.761 1.00 0.00 H new ATOM 0 HG22 VAL B 46 -4.950 -9.083 -2.374 1.00 0.00 H new ATOM 0 HG23 VAL B 46 -3.539 -8.168 -1.790 1.00 0.00 H new ATOM 1912 N PRO B 47 -4.081 -4.660 -1.576 1.00 0.00 N ATOM 1913 CA PRO B 47 -2.874 -3.892 -1.826 1.00 0.00 C ATOM 1914 C PRO B 47 -1.774 -4.187 -0.811 1.00 0.00 C ATOM 1915 O PRO B 47 -2.023 -4.793 0.231 1.00 0.00 O ATOM 1916 CB PRO B 47 -3.387 -2.468 -1.644 1.00 0.00 C ATOM 1917 CG PRO B 47 -4.425 -2.576 -0.563 1.00 0.00 C ATOM 1918 CD PRO B 47 -4.886 -4.021 -0.525 1.00 0.00 C ATOM 0 HA PRO B 47 -2.422 -4.106 -2.794 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -2.583 -1.791 -1.356 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -3.815 -2.080 -2.568 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -4.009 -2.279 0.400 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -5.263 -1.910 -0.767 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -4.708 -4.475 0.450 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -5.954 -4.108 -0.727 1.00 0.00 H new ATOM 1926 N ALA B 48 -0.556 -3.753 -1.122 1.00 0.00 N ATOM 1927 CA ALA B 48 0.581 -3.972 -0.239 1.00 0.00 C ATOM 1928 C ALA B 48 0.591 -2.960 0.906 1.00 0.00 C ATOM 1929 O ALA B 48 0.274 -1.788 0.706 1.00 0.00 O ATOM 1930 CB ALA B 48 1.880 -3.891 -1.024 1.00 0.00 C ATOM 0 H ALA B 48 -0.333 -3.248 -1.979 1.00 0.00 H new ATOM 0 HA ALA B 48 0.488 -4.969 0.191 1.00 0.00 H new ATOM 0 HB1 ALA B 48 2.722 -4.056 -0.352 1.00 0.00 H new ATOM 0 HB2 ALA B 48 1.882 -4.653 -1.803 1.00 0.00 H new ATOM 0 HB3 ALA B 48 1.968 -2.905 -1.480 1.00 0.00 H new ATOM 1936 N PRO B 49 0.955 -3.399 2.128 1.00 0.00 N ATOM 1937 CA PRO B 49 1.004 -2.514 3.295 1.00 0.00 C ATOM 1938 C PRO B 49 2.169 -1.532 3.231 1.00 0.00 C ATOM 1939 O PRO B 49 2.021 -0.356 3.563 1.00 0.00 O ATOM 1940 CB PRO B 49 1.183 -3.479 4.467 1.00 0.00 C ATOM 1941 CG PRO B 49 1.857 -4.669 3.876 1.00 0.00 C ATOM 1942 CD PRO B 49 1.341 -4.783 2.469 1.00 0.00 C ATOM 0 HA PRO B 49 0.112 -1.892 3.370 1.00 0.00 H new ATOM 0 HB2 PRO B 49 1.787 -3.034 5.258 1.00 0.00 H new ATOM 0 HB3 PRO B 49 0.224 -3.746 4.910 1.00 0.00 H new ATOM 0 HG2 PRO B 49 2.940 -4.548 3.885 1.00 0.00 H new ATOM 0 HG3 PRO B 49 1.632 -5.569 4.448 1.00 0.00 H new ATOM 0 HD2 PRO B 49 2.105 -5.165 1.791 1.00 0.00 H new ATOM 0 HD3 PRO B 49 0.491 -5.463 2.407 1.00 0.00 H new ATOM 1950 N PHE B 50 3.329 -2.022 2.800 1.00 0.00 N ATOM 1951 CA PHE B 50 4.518 -1.182 2.697 1.00 0.00 C ATOM 1952 C PHE B 50 5.434 -1.667 1.578 1.00 0.00 C ATOM 1953 O PHE B 50 5.443 -2.849 1.236 1.00 0.00 O ATOM 1954 CB PHE B 50 5.278 -1.172 4.024 1.00 0.00 C ATOM 1955 CG PHE B 50 5.731 -2.535 4.465 1.00 0.00 C ATOM 1956 CD1 PHE B 50 4.881 -3.360 5.182 1.00 0.00 C ATOM 1957 CD2 PHE B 50 7.003 -2.991 4.160 1.00 0.00 C ATOM 1958 CE1 PHE B 50 5.290 -4.616 5.586 1.00 0.00 C ATOM 1959 CE2 PHE B 50 7.419 -4.245 4.563 1.00 0.00 C ATOM 1960 CZ PHE B 50 6.561 -5.060 5.276 1.00 0.00 C ATOM 0 H PHE B 50 3.470 -2.992 2.518 1.00 0.00 H new ATOM 0 HA PHE B 50 4.195 -0.168 2.463 1.00 0.00 H new ATOM 0 HB2 PHE B 50 6.147 -0.521 3.931 1.00 0.00 H new ATOM 0 HB3 PHE B 50 4.640 -0.742 4.796 1.00 0.00 H new ATOM 0 HD1 PHE B 50 3.887 -3.018 5.428 1.00 0.00 H new ATOM 0 HD2 PHE B 50 7.677 -2.359 3.601 1.00 0.00 H new ATOM 0 HE1 PHE B 50 4.617 -5.250 6.144 1.00 0.00 H new ATOM 0 HE2 PHE B 50 8.414 -4.588 4.321 1.00 0.00 H new ATOM 0 HZ PHE B 50 6.883 -6.042 5.590 1.00 0.00 H new ATOM 1970 N ALA B 51 6.205 -0.743 1.014 1.00 0.00 N ATOM 1971 CA ALA B 51 7.129 -1.069 -0.064 1.00 0.00 C ATOM 1972 C ALA B 51 8.276 -1.941 0.440 1.00 0.00 C ATOM 1973 O ALA B 51 8.692 -1.830 1.594 1.00 0.00 O ATOM 1974 CB ALA B 51 7.672 0.205 -0.693 1.00 0.00 C ATOM 0 H ALA B 51 6.207 0.240 1.287 1.00 0.00 H new ATOM 0 HA ALA B 51 6.583 -1.633 -0.820 1.00 0.00 H new ATOM 0 HB1 ALA B 51 8.361 -0.052 -1.497 1.00 0.00 H new ATOM 0 HB2 ALA B 51 6.847 0.792 -1.096 1.00 0.00 H new ATOM 0 HB3 ALA B 51 8.197 0.789 0.063 1.00 0.00 H new ATOM 1980 N GLY B 52 8.780 -2.806 -0.432 1.00 0.00 N ATOM 1981 CA GLY B 52 9.877 -3.684 -0.065 1.00 0.00 C ATOM 1982 C GLY B 52 10.250 -4.635 -1.184 1.00 0.00 C ATOM 1983 O GLY B 52 9.523 -4.759 -2.169 1.00 0.00 O ATOM 0 H GLY B 52 8.448 -2.916 -1.390 1.00 0.00 H new ATOM 0 HA2 GLY B 52 10.746 -3.083 0.204 1.00 0.00 H new ATOM 0 HA3 GLY B 52 9.600 -4.258 0.820 1.00 0.00 H new ATOM 1987 N VAL B 53 11.384 -5.313 -1.034 1.00 0.00 N ATOM 1988 CA VAL B 53 11.851 -6.251 -2.049 1.00 0.00 C ATOM 1989 C VAL B 53 11.480 -7.687 -1.692 1.00 0.00 C ATOM 1990 O VAL B 53 11.601 -8.104 -0.540 1.00 0.00 O ATOM 1991 CB VAL B 53 13.377 -6.158 -2.239 1.00 0.00 C ATOM 1992 CG1 VAL B 53 13.829 -7.034 -3.398 1.00 0.00 C ATOM 1993 CG2 VAL B 53 13.801 -4.713 -2.458 1.00 0.00 C ATOM 0 H VAL B 53 11.995 -5.231 -0.221 1.00 0.00 H new ATOM 0 HA VAL B 53 11.357 -5.976 -2.981 1.00 0.00 H new ATOM 0 HB VAL B 53 13.858 -6.522 -1.331 1.00 0.00 H new ATOM 0 HG11 VAL B 53 14.910 -6.954 -3.515 1.00 0.00 H new ATOM 0 HG12 VAL B 53 13.562 -8.071 -3.196 1.00 0.00 H new ATOM 0 HG13 VAL B 53 13.339 -6.706 -4.315 1.00 0.00 H new ATOM 0 HG21 VAL B 53 14.882 -4.667 -2.590 1.00 0.00 H new ATOM 0 HG22 VAL B 53 13.310 -4.321 -3.348 1.00 0.00 H new ATOM 0 HG23 VAL B 53 13.516 -4.115 -1.593 1.00 0.00 H new ATOM 2003 N VAL B 54 11.026 -8.437 -2.692 1.00 0.00 N ATOM 2004 CA VAL B 54 10.639 -9.830 -2.496 1.00 0.00 C ATOM 2005 C VAL B 54 11.869 -10.730 -2.429 1.00 0.00 C ATOM 2006 O VAL B 54 12.696 -10.737 -3.340 1.00 0.00 O ATOM 2007 CB VAL B 54 9.708 -10.313 -3.628 1.00 0.00 C ATOM 2008 CG1 VAL B 54 9.446 -11.809 -3.515 1.00 0.00 C ATOM 2009 CG2 VAL B 54 8.399 -9.539 -3.602 1.00 0.00 C ATOM 0 H VAL B 54 10.917 -8.102 -3.649 1.00 0.00 H new ATOM 0 HA VAL B 54 10.101 -9.890 -1.550 1.00 0.00 H new ATOM 0 HB VAL B 54 10.204 -10.128 -4.581 1.00 0.00 H new ATOM 0 HG11 VAL B 54 8.787 -12.125 -4.324 1.00 0.00 H new ATOM 0 HG12 VAL B 54 10.390 -12.350 -3.583 1.00 0.00 H new ATOM 0 HG13 VAL B 54 8.973 -12.024 -2.557 1.00 0.00 H new ATOM 0 HG21 VAL B 54 7.752 -9.890 -4.406 1.00 0.00 H new ATOM 0 HG22 VAL B 54 7.903 -9.694 -2.644 1.00 0.00 H new ATOM 0 HG23 VAL B 54 8.602 -8.477 -3.738 1.00 0.00 H new ATOM 2019 N LYS B 55 11.983 -11.488 -1.341 1.00 0.00 N ATOM 2020 CA LYS B 55 13.117 -12.386 -1.148 1.00 0.00 C ATOM 2021 C LYS B 55 12.665 -13.842 -1.077 1.00 0.00 C ATOM 2022 O LYS B 55 13.155 -14.689 -1.824 1.00 0.00 O ATOM 2023 CB LYS B 55 13.874 -12.009 0.130 1.00 0.00 C ATOM 2024 CG LYS B 55 15.063 -12.909 0.431 1.00 0.00 C ATOM 2025 CD LYS B 55 16.110 -12.841 -0.669 1.00 0.00 C ATOM 2026 CE LYS B 55 17.288 -13.756 -0.375 1.00 0.00 C ATOM 2027 NZ LYS B 55 18.273 -13.767 -1.490 1.00 0.00 N ATOM 0 H LYS B 55 11.304 -11.498 -0.580 1.00 0.00 H new ATOM 0 HA LYS B 55 13.781 -12.280 -2.006 1.00 0.00 H new ATOM 0 HB2 LYS B 55 14.223 -10.980 0.044 1.00 0.00 H new ATOM 0 HB3 LYS B 55 13.183 -12.042 0.973 1.00 0.00 H new ATOM 0 HG2 LYS B 55 15.512 -12.615 1.380 1.00 0.00 H new ATOM 0 HG3 LYS B 55 14.721 -13.938 0.546 1.00 0.00 H new ATOM 0 HD2 LYS B 55 15.658 -13.122 -1.620 1.00 0.00 H new ATOM 0 HD3 LYS B 55 16.462 -11.815 -0.774 1.00 0.00 H new ATOM 0 HE2 LYS B 55 17.780 -13.431 0.541 1.00 0.00 H new ATOM 0 HE3 LYS B 55 16.926 -14.769 -0.200 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 19.061 -14.402 -1.251 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 17.810 -14.101 -2.359 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 18.638 -12.805 -1.640 1.00 0.00 H new ATOM 2041 N GLU B 56 11.727 -14.126 -0.179 1.00 0.00 N ATOM 2042 CA GLU B 56 11.218 -15.482 -0.013 1.00 0.00 C ATOM 2043 C GLU B 56 9.695 -15.487 0.091 1.00 0.00 C ATOM 2044 O GLU B 56 9.122 -14.864 0.983 1.00 0.00 O ATOM 2045 CB GLU B 56 11.829 -16.123 1.235 1.00 0.00 C ATOM 2046 CG GLU B 56 11.429 -17.577 1.433 1.00 0.00 C ATOM 2047 CD GLU B 56 11.918 -18.474 0.313 1.00 0.00 C ATOM 2048 OE1 GLU B 56 11.193 -18.615 -0.693 1.00 0.00 O ATOM 2049 OE2 GLU B 56 13.026 -19.034 0.443 1.00 0.00 O ATOM 0 H GLU B 56 11.305 -13.437 0.443 1.00 0.00 H new ATOM 0 HA GLU B 56 11.502 -16.062 -0.891 1.00 0.00 H new ATOM 0 HB2 GLU B 56 12.915 -16.060 1.171 1.00 0.00 H new ATOM 0 HB3 GLU B 56 11.528 -15.550 2.112 1.00 0.00 H new ATOM 0 HG2 GLU B 56 11.830 -17.934 2.381 1.00 0.00 H new ATOM 0 HG3 GLU B 56 10.343 -17.645 1.500 1.00 0.00 H new ATOM 2056 N LEU B 57 9.048 -16.195 -0.831 1.00 0.00 N ATOM 2057 CA LEU B 57 7.592 -16.287 -0.840 1.00 0.00 C ATOM 2058 C LEU B 57 7.109 -17.233 0.254 1.00 0.00 C ATOM 2059 O LEU B 57 7.897 -17.983 0.829 1.00 0.00 O ATOM 2060 CB LEU B 57 7.086 -16.762 -2.208 1.00 0.00 C ATOM 2061 CG LEU B 57 7.218 -18.266 -2.478 1.00 0.00 C ATOM 2062 CD1 LEU B 57 6.490 -18.642 -3.759 1.00 0.00 C ATOM 2063 CD2 LEU B 57 8.682 -18.673 -2.563 1.00 0.00 C ATOM 0 H LEU B 57 9.508 -16.712 -1.580 1.00 0.00 H new ATOM 0 HA LEU B 57 7.189 -15.293 -0.647 1.00 0.00 H new ATOM 0 HB2 LEU B 57 6.036 -16.485 -2.303 1.00 0.00 H new ATOM 0 HB3 LEU B 57 7.630 -16.223 -2.984 1.00 0.00 H new ATOM 0 HG LEU B 57 6.761 -18.802 -1.647 1.00 0.00 H new ATOM 0 HD11 LEU B 57 6.594 -19.713 -3.936 1.00 0.00 H new ATOM 0 HD12 LEU B 57 5.434 -18.391 -3.664 1.00 0.00 H new ATOM 0 HD13 LEU B 57 6.920 -18.093 -4.597 1.00 0.00 H new ATOM 0 HD21 LEU B 57 8.751 -19.744 -2.755 1.00 0.00 H new ATOM 0 HD22 LEU B 57 9.165 -18.127 -3.373 1.00 0.00 H new ATOM 0 HD23 LEU B 57 9.180 -18.440 -1.622 1.00 0.00 H new ATOM 2075 N LYS B 58 5.811 -17.193 0.538 1.00 0.00 N ATOM 2076 CA LYS B 58 5.229 -18.049 1.564 1.00 0.00 C ATOM 2077 C LYS B 58 4.324 -19.108 0.944 1.00 0.00 C ATOM 2078 O LYS B 58 4.376 -20.279 1.320 1.00 0.00 O ATOM 2079 CB LYS B 58 4.440 -17.209 2.571 1.00 0.00 C ATOM 2080 CG LYS B 58 3.795 -18.029 3.680 1.00 0.00 C ATOM 2081 CD LYS B 58 4.835 -18.742 4.529 1.00 0.00 C ATOM 2082 CE LYS B 58 4.186 -19.548 5.644 1.00 0.00 C ATOM 2083 NZ LYS B 58 3.268 -20.595 5.112 1.00 0.00 N ATOM 0 H LYS B 58 5.144 -16.578 0.073 1.00 0.00 H new ATOM 0 HA LYS B 58 6.043 -18.555 2.083 1.00 0.00 H new ATOM 0 HB2 LYS B 58 5.107 -16.472 3.018 1.00 0.00 H new ATOM 0 HB3 LYS B 58 3.664 -16.657 2.041 1.00 0.00 H new ATOM 0 HG2 LYS B 58 3.194 -17.376 4.313 1.00 0.00 H new ATOM 0 HG3 LYS B 58 3.117 -18.762 3.243 1.00 0.00 H new ATOM 0 HD2 LYS B 58 5.429 -19.404 3.899 1.00 0.00 H new ATOM 0 HD3 LYS B 58 5.520 -18.010 4.958 1.00 0.00 H new ATOM 0 HE2 LYS B 58 4.960 -20.018 6.250 1.00 0.00 H new ATOM 0 HE3 LYS B 58 3.631 -18.878 6.300 1.00 0.00 H new ATOM 0 HZ1 LYS B 58 3.032 -21.268 5.869 1.00 0.00 H new ATOM 0 HZ2 LYS B 58 2.396 -20.148 4.763 1.00 0.00 H new ATOM 0 HZ3 LYS B 58 3.734 -21.101 4.332 1.00 0.00 H new ATOM 2097 N VAL B 59 3.497 -18.689 -0.008 1.00 0.00 N ATOM 2098 CA VAL B 59 2.580 -19.602 -0.679 1.00 0.00 C ATOM 2099 C VAL B 59 2.785 -19.580 -2.190 1.00 0.00 C ATOM 2100 O VAL B 59 3.224 -18.577 -2.754 1.00 0.00 O ATOM 2101 CB VAL B 59 1.113 -19.254 -0.363 1.00 0.00 C ATOM 2102 CG1 VAL B 59 0.835 -19.426 1.122 1.00 0.00 C ATOM 2103 CG2 VAL B 59 0.789 -17.836 -0.809 1.00 0.00 C ATOM 0 H VAL B 59 3.443 -17.723 -0.332 1.00 0.00 H new ATOM 0 HA VAL B 59 2.798 -20.602 -0.304 1.00 0.00 H new ATOM 0 HB VAL B 59 0.470 -19.939 -0.916 1.00 0.00 H new ATOM 0 HG11 VAL B 59 -0.206 -19.176 1.329 1.00 0.00 H new ATOM 0 HG12 VAL B 59 1.024 -20.460 1.410 1.00 0.00 H new ATOM 0 HG13 VAL B 59 1.487 -18.765 1.693 1.00 0.00 H new ATOM 0 HG21 VAL B 59 -0.252 -17.610 -0.577 1.00 0.00 H new ATOM 0 HG22 VAL B 59 1.438 -17.133 -0.287 1.00 0.00 H new ATOM 0 HG23 VAL B 59 0.948 -17.747 -1.884 1.00 0.00 H new ATOM 2113 N ASN B 60 2.465 -20.696 -2.840 1.00 0.00 N ATOM 2114 CA ASN B 60 2.613 -20.809 -4.288 1.00 0.00 C ATOM 2115 C ASN B 60 1.322 -20.415 -4.999 1.00 0.00 C ATOM 2116 O ASN B 60 0.230 -20.566 -4.451 1.00 0.00 O ATOM 2117 CB ASN B 60 3.009 -22.237 -4.676 1.00 0.00 C ATOM 2118 CG ASN B 60 4.446 -22.565 -4.316 1.00 0.00 C ATOM 2119 OD1 ASN B 60 5.109 -23.335 -5.012 1.00 0.00 O ATOM 2120 ND2 ASN B 60 4.937 -21.988 -3.224 1.00 0.00 N ATOM 0 H ASN B 60 2.102 -21.535 -2.387 1.00 0.00 H new ATOM 0 HA ASN B 60 3.403 -20.125 -4.600 1.00 0.00 H new ATOM 0 HB2 ASN B 60 2.344 -22.942 -4.177 1.00 0.00 H new ATOM 0 HB3 ASN B 60 2.868 -22.370 -5.749 1.00 0.00 H new ATOM 0 HD21 ASN B 60 5.897 -22.177 -2.935 1.00 0.00 H new ATOM 0 HD22 ASN B 60 4.354 -21.356 -2.675 1.00 0.00 H new ATOM 2127 N VAL B 61 1.457 -19.910 -6.221 1.00 0.00 N ATOM 2128 CA VAL B 61 0.304 -19.494 -7.010 1.00 0.00 C ATOM 2129 C VAL B 61 -0.673 -20.649 -7.205 1.00 0.00 C ATOM 2130 O VAL B 61 -0.311 -21.698 -7.737 1.00 0.00 O ATOM 2131 CB VAL B 61 0.733 -18.953 -8.388 1.00 0.00 C ATOM 2132 CG1 VAL B 61 -0.477 -18.491 -9.186 1.00 0.00 C ATOM 2133 CG2 VAL B 61 1.737 -17.822 -8.226 1.00 0.00 C ATOM 0 H VAL B 61 2.355 -19.779 -6.687 1.00 0.00 H new ATOM 0 HA VAL B 61 -0.191 -18.696 -6.456 1.00 0.00 H new ATOM 0 HB VAL B 61 1.213 -19.761 -8.940 1.00 0.00 H new ATOM 0 HG11 VAL B 61 -0.151 -18.113 -10.155 1.00 0.00 H new ATOM 0 HG12 VAL B 61 -1.157 -19.330 -9.334 1.00 0.00 H new ATOM 0 HG13 VAL B 61 -0.991 -17.699 -8.642 1.00 0.00 H new ATOM 0 HG21 VAL B 61 2.029 -17.452 -9.209 1.00 0.00 H new ATOM 0 HG22 VAL B 61 1.284 -17.013 -7.653 1.00 0.00 H new ATOM 0 HG23 VAL B 61 2.618 -18.190 -7.700 1.00 0.00 H new ATOM 2143 N GLY B 62 -1.913 -20.444 -6.771 1.00 0.00 N ATOM 2144 CA GLY B 62 -2.927 -21.474 -6.903 1.00 0.00 C ATOM 2145 C GLY B 62 -3.320 -22.073 -5.568 1.00 0.00 C ATOM 2146 O GLY B 62 -4.192 -22.940 -5.502 1.00 0.00 O ATOM 0 H GLY B 62 -2.234 -19.582 -6.330 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -3.810 -21.051 -7.382 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -2.556 -22.263 -7.557 1.00 0.00 H new ATOM 2150 N ASP B 63 -2.676 -21.609 -4.501 1.00 0.00 N ATOM 2151 CA ASP B 63 -2.961 -22.105 -3.158 1.00 0.00 C ATOM 2152 C ASP B 63 -3.831 -21.116 -2.388 1.00 0.00 C ATOM 2153 O ASP B 63 -3.510 -19.932 -2.299 1.00 0.00 O ATOM 2154 CB ASP B 63 -1.658 -22.360 -2.398 1.00 0.00 C ATOM 2155 CG ASP B 63 -1.897 -22.901 -1.003 1.00 0.00 C ATOM 2156 OD1 ASP B 63 -2.138 -24.120 -0.872 1.00 0.00 O ATOM 2157 OD2 ASP B 63 -1.844 -22.107 -0.041 1.00 0.00 O ATOM 0 H ASP B 63 -1.953 -20.890 -4.540 1.00 0.00 H new ATOM 0 HA ASP B 63 -3.506 -23.044 -3.251 1.00 0.00 H new ATOM 0 HB2 ASP B 63 -1.046 -23.067 -2.959 1.00 0.00 H new ATOM 0 HB3 ASP B 63 -1.092 -21.431 -2.332 1.00 0.00 H new ATOM 2162 N LYS B 64 -4.930 -21.614 -1.829 1.00 0.00 N ATOM 2163 CA LYS B 64 -5.854 -20.780 -1.066 1.00 0.00 C ATOM 2164 C LYS B 64 -5.143 -20.085 0.092 1.00 0.00 C ATOM 2165 O LYS B 64 -3.960 -20.322 0.342 1.00 0.00 O ATOM 2166 CB LYS B 64 -7.009 -21.628 -0.532 1.00 0.00 C ATOM 2167 CG LYS B 64 -6.556 -22.786 0.343 1.00 0.00 C ATOM 2168 CD LYS B 64 -7.732 -23.614 0.836 1.00 0.00 C ATOM 2169 CE LYS B 64 -8.434 -24.325 -0.311 1.00 0.00 C ATOM 2170 NZ LYS B 64 -9.527 -25.215 0.171 1.00 0.00 N ATOM 0 H LYS B 64 -5.203 -22.595 -1.890 1.00 0.00 H new ATOM 0 HA LYS B 64 -6.246 -20.014 -1.735 1.00 0.00 H new ATOM 0 HB2 LYS B 64 -7.682 -20.991 0.042 1.00 0.00 H new ATOM 0 HB3 LYS B 64 -7.581 -22.020 -1.373 1.00 0.00 H new ATOM 0 HG2 LYS B 64 -5.874 -23.423 -0.221 1.00 0.00 H new ATOM 0 HG3 LYS B 64 -5.999 -22.400 1.197 1.00 0.00 H new ATOM 0 HD2 LYS B 64 -7.382 -24.349 1.561 1.00 0.00 H new ATOM 0 HD3 LYS B 64 -8.441 -22.968 1.354 1.00 0.00 H new ATOM 0 HE2 LYS B 64 -8.845 -23.586 -0.999 1.00 0.00 H new ATOM 0 HE3 LYS B 64 -7.708 -24.913 -0.872 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 -9.980 -25.680 -0.642 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 -9.132 -25.937 0.807 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 -10.234 -24.650 0.684 1.00 0.00 H new ATOM 2184 N VAL B 65 -5.874 -19.230 0.801 1.00 0.00 N ATOM 2185 CA VAL B 65 -5.315 -18.498 1.932 1.00 0.00 C ATOM 2186 C VAL B 65 -6.304 -18.449 3.093 1.00 0.00 C ATOM 2187 O VAL B 65 -7.506 -18.641 2.903 1.00 0.00 O ATOM 2188 CB VAL B 65 -4.932 -17.058 1.538 1.00 0.00 C ATOM 2189 CG1 VAL B 65 -6.162 -16.159 1.508 1.00 0.00 C ATOM 2190 CG2 VAL B 65 -3.880 -16.504 2.488 1.00 0.00 C ATOM 0 H VAL B 65 -6.856 -19.027 0.612 1.00 0.00 H new ATOM 0 HA VAL B 65 -4.416 -19.031 2.242 1.00 0.00 H new ATOM 0 HB VAL B 65 -4.507 -17.081 0.535 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -5.867 -15.148 1.228 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -6.876 -16.544 0.780 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -6.624 -16.141 2.495 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -3.623 -15.487 2.193 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -4.274 -16.499 3.504 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -2.988 -17.130 2.448 1.00 0.00 H new ATOM 2200 N LYS B 66 -5.794 -18.184 4.291 1.00 0.00 N ATOM 2201 CA LYS B 66 -6.636 -18.106 5.479 1.00 0.00 C ATOM 2202 C LYS B 66 -6.128 -17.038 6.442 1.00 0.00 C ATOM 2203 O LYS B 66 -4.941 -16.710 6.452 1.00 0.00 O ATOM 2204 CB LYS B 66 -6.689 -19.463 6.178 1.00 0.00 C ATOM 2205 CG LYS B 66 -7.323 -20.552 5.329 1.00 0.00 C ATOM 2206 CD LYS B 66 -7.339 -21.886 6.057 1.00 0.00 C ATOM 2207 CE LYS B 66 -7.970 -22.976 5.207 1.00 0.00 C ATOM 2208 NZ LYS B 66 -9.375 -22.650 4.838 1.00 0.00 N ATOM 0 H LYS B 66 -4.802 -18.020 4.465 1.00 0.00 H new ATOM 0 HA LYS B 66 -7.642 -17.828 5.164 1.00 0.00 H new ATOM 0 HB2 LYS B 66 -5.677 -19.765 6.447 1.00 0.00 H new ATOM 0 HB3 LYS B 66 -7.250 -19.364 7.107 1.00 0.00 H new ATOM 0 HG2 LYS B 66 -8.342 -20.266 5.069 1.00 0.00 H new ATOM 0 HG3 LYS B 66 -6.772 -20.653 4.394 1.00 0.00 H new ATOM 0 HD2 LYS B 66 -6.320 -22.171 6.319 1.00 0.00 H new ATOM 0 HD3 LYS B 66 -7.892 -21.786 6.991 1.00 0.00 H new ATOM 0 HE2 LYS B 66 -7.380 -23.117 4.301 1.00 0.00 H new ATOM 0 HE3 LYS B 66 -7.948 -23.920 5.752 1.00 0.00 H new ATOM 0 HZ1 LYS B 66 -9.839 -23.498 4.454 1.00 0.00 H new ATOM 0 HZ2 LYS B 66 -9.889 -22.326 5.682 1.00 0.00 H new ATOM 0 HZ3 LYS B 66 -9.380 -21.898 4.120 1.00 0.00 H new ATOM 2222 N THR B 67 -7.038 -16.503 7.252 1.00 0.00 N ATOM 2223 CA THR B 67 -6.690 -15.471 8.222 1.00 0.00 C ATOM 2224 C THR B 67 -5.679 -15.987 9.239 1.00 0.00 C ATOM 2225 O THR B 67 -5.896 -17.017 9.877 1.00 0.00 O ATOM 2226 CB THR B 67 -7.936 -14.962 8.969 1.00 0.00 C ATOM 2227 OG1 THR B 67 -8.586 -16.051 9.635 1.00 0.00 O ATOM 2228 CG2 THR B 67 -8.912 -14.294 8.011 1.00 0.00 C ATOM 0 H THR B 67 -8.023 -16.768 7.255 1.00 0.00 H new ATOM 0 HA THR B 67 -6.247 -14.648 7.661 1.00 0.00 H new ATOM 0 HB THR B 67 -7.613 -14.225 9.704 1.00 0.00 H new ATOM 0 HG1 THR B 67 -7.913 -16.691 9.949 1.00 0.00 H new ATOM 0 HG21 THR B 67 -9.783 -13.944 8.565 1.00 0.00 H new ATOM 0 HG22 THR B 67 -8.425 -13.447 7.527 1.00 0.00 H new ATOM 0 HG23 THR B 67 -9.228 -15.012 7.254 1.00 0.00 H new ATOM 2236 N GLY B 68 -4.573 -15.263 9.384 1.00 0.00 N ATOM 2237 CA GLY B 68 -3.542 -15.660 10.324 1.00 0.00 C ATOM 2238 C GLY B 68 -2.358 -16.318 9.643 1.00 0.00 C ATOM 2239 O GLY B 68 -1.348 -16.607 10.286 1.00 0.00 O ATOM 0 H GLY B 68 -4.373 -14.407 8.866 1.00 0.00 H new ATOM 0 HA2 GLY B 68 -3.200 -14.784 10.874 1.00 0.00 H new ATOM 0 HA3 GLY B 68 -3.966 -16.349 11.054 1.00 0.00 H new ATOM 2243 N SER B 69 -2.481 -16.551 8.341 1.00 0.00 N ATOM 2244 CA SER B 69 -1.411 -17.178 7.570 1.00 0.00 C ATOM 2245 C SER B 69 -0.665 -16.146 6.730 1.00 0.00 C ATOM 2246 O SER B 69 -1.278 -15.289 6.094 1.00 0.00 O ATOM 2247 CB SER B 69 -1.978 -18.274 6.667 1.00 0.00 C ATOM 2248 OG SER B 69 -2.595 -19.296 7.430 1.00 0.00 O ATOM 0 H SER B 69 -3.311 -16.316 7.796 1.00 0.00 H new ATOM 0 HA SER B 69 -0.707 -17.624 8.273 1.00 0.00 H new ATOM 0 HB2 SER B 69 -2.704 -17.842 5.978 1.00 0.00 H new ATOM 0 HB3 SER B 69 -1.178 -18.701 6.062 1.00 0.00 H new ATOM 0 HG SER B 69 -2.951 -19.983 6.829 1.00 0.00 H new ATOM 2254 N LEU B 70 0.661 -16.238 6.733 1.00 0.00 N ATOM 2255 CA LEU B 70 1.498 -15.314 5.973 1.00 0.00 C ATOM 2256 C LEU B 70 1.267 -15.477 4.474 1.00 0.00 C ATOM 2257 O LEU B 70 0.680 -16.464 4.031 1.00 0.00 O ATOM 2258 CB LEU B 70 2.974 -15.546 6.304 1.00 0.00 C ATOM 2259 CG LEU B 70 3.340 -15.391 7.782 1.00 0.00 C ATOM 2260 CD1 LEU B 70 4.772 -15.842 8.024 1.00 0.00 C ATOM 2261 CD2 LEU B 70 3.152 -13.950 8.232 1.00 0.00 C ATOM 0 H LEU B 70 1.181 -16.944 7.254 1.00 0.00 H new ATOM 0 HA LEU B 70 1.224 -14.297 6.254 1.00 0.00 H new ATOM 0 HB2 LEU B 70 3.249 -16.550 5.981 1.00 0.00 H new ATOM 0 HB3 LEU B 70 3.575 -14.848 5.722 1.00 0.00 H new ATOM 0 HG LEU B 70 2.674 -16.023 8.370 1.00 0.00 H new ATOM 0 HD11 LEU B 70 5.017 -15.725 9.080 1.00 0.00 H new ATOM 0 HD12 LEU B 70 4.876 -16.889 7.741 1.00 0.00 H new ATOM 0 HD13 LEU B 70 5.451 -15.235 7.425 1.00 0.00 H new ATOM 0 HD21 LEU B 70 3.417 -13.860 9.285 1.00 0.00 H new ATOM 0 HD22 LEU B 70 3.793 -13.297 7.639 1.00 0.00 H new ATOM 0 HD23 LEU B 70 2.111 -13.659 8.094 1.00 0.00 H new ATOM 2273 N ILE B 71 1.733 -14.503 3.698 1.00 0.00 N ATOM 2274 CA ILE B 71 1.573 -14.540 2.248 1.00 0.00 C ATOM 2275 C ILE B 71 2.867 -14.174 1.529 1.00 0.00 C ATOM 2276 O ILE B 71 3.165 -14.712 0.462 1.00 0.00 O ATOM 2277 CB ILE B 71 0.453 -13.588 1.784 1.00 0.00 C ATOM 2278 CG1 ILE B 71 0.698 -12.174 2.322 1.00 0.00 C ATOM 2279 CG2 ILE B 71 -0.903 -14.109 2.234 1.00 0.00 C ATOM 2280 CD1 ILE B 71 -0.328 -11.159 1.862 1.00 0.00 C ATOM 0 H ILE B 71 2.223 -13.680 4.048 1.00 0.00 H new ATOM 0 HA ILE B 71 1.304 -15.565 1.991 1.00 0.00 H new ATOM 0 HB ILE B 71 0.459 -13.545 0.695 1.00 0.00 H new ATOM 0 HG12 ILE B 71 0.701 -12.205 3.412 1.00 0.00 H new ATOM 0 HG13 ILE B 71 1.688 -11.843 2.010 1.00 0.00 H new ATOM 0 HG21 ILE B 71 -1.684 -13.427 1.899 1.00 0.00 H new ATOM 0 HG22 ILE B 71 -1.075 -15.096 1.804 1.00 0.00 H new ATOM 0 HG23 ILE B 71 -0.923 -14.178 3.322 1.00 0.00 H new ATOM 0 HD11 ILE B 71 -0.088 -10.183 2.283 1.00 0.00 H new ATOM 0 HD12 ILE B 71 -0.316 -11.097 0.774 1.00 0.00 H new ATOM 0 HD13 ILE B 71 -1.319 -11.465 2.198 1.00 0.00 H new ATOM 2292 N MET B 72 3.635 -13.259 2.114 1.00 0.00 N ATOM 2293 CA MET B 72 4.893 -12.821 1.514 1.00 0.00 C ATOM 2294 C MET B 72 5.749 -12.063 2.527 1.00 0.00 C ATOM 2295 O MET B 72 5.238 -11.539 3.516 1.00 0.00 O ATOM 2296 CB MET B 72 4.606 -11.932 0.299 1.00 0.00 C ATOM 2297 CG MET B 72 5.854 -11.457 -0.428 1.00 0.00 C ATOM 2298 SD MET B 72 6.801 -12.813 -1.150 1.00 0.00 S ATOM 2299 CE MET B 72 5.635 -13.437 -2.358 1.00 0.00 C ATOM 0 H MET B 72 3.410 -12.807 3.000 1.00 0.00 H new ATOM 0 HA MET B 72 5.448 -13.703 1.195 1.00 0.00 H new ATOM 0 HB2 MET B 72 3.978 -12.483 -0.401 1.00 0.00 H new ATOM 0 HB3 MET B 72 4.035 -11.063 0.625 1.00 0.00 H new ATOM 0 HG2 MET B 72 5.567 -10.760 -1.216 1.00 0.00 H new ATOM 0 HG3 MET B 72 6.488 -10.908 0.268 1.00 0.00 H new ATOM 0 HE1 MET B 72 6.167 -14.018 -3.111 1.00 0.00 H new ATOM 0 HE2 MET B 72 4.902 -14.072 -1.861 1.00 0.00 H new ATOM 0 HE3 MET B 72 5.125 -12.601 -2.837 1.00 0.00 H new ATOM 2309 N ILE B 73 7.055 -12.019 2.278 1.00 0.00 N ATOM 2310 CA ILE B 73 7.981 -11.318 3.161 1.00 0.00 C ATOM 2311 C ILE B 73 8.831 -10.334 2.363 1.00 0.00 C ATOM 2312 O ILE B 73 9.390 -10.686 1.324 1.00 0.00 O ATOM 2313 CB ILE B 73 8.903 -12.296 3.915 1.00 0.00 C ATOM 2314 CG1 ILE B 73 8.093 -13.479 4.455 1.00 0.00 C ATOM 2315 CG2 ILE B 73 9.621 -11.574 5.050 1.00 0.00 C ATOM 2316 CD1 ILE B 73 8.942 -14.578 5.055 1.00 0.00 C ATOM 0 H ILE B 73 7.496 -12.461 1.471 1.00 0.00 H new ATOM 0 HA ILE B 73 7.383 -10.778 3.895 1.00 0.00 H new ATOM 0 HB ILE B 73 9.652 -12.679 3.222 1.00 0.00 H new ATOM 0 HG12 ILE B 73 7.398 -13.116 5.212 1.00 0.00 H new ATOM 0 HG13 ILE B 73 7.494 -13.896 3.646 1.00 0.00 H new ATOM 0 HG21 ILE B 73 10.269 -12.276 5.575 1.00 0.00 H new ATOM 0 HG22 ILE B 73 10.221 -10.761 4.642 1.00 0.00 H new ATOM 0 HG23 ILE B 73 8.886 -11.169 5.746 1.00 0.00 H new ATOM 0 HD11 ILE B 73 8.298 -15.380 5.415 1.00 0.00 H new ATOM 0 HD12 ILE B 73 9.619 -14.970 4.296 1.00 0.00 H new ATOM 0 HD13 ILE B 73 9.522 -14.177 5.887 1.00 0.00 H new ATOM 2328 N PHE B 74 8.926 -9.101 2.852 1.00 0.00 N ATOM 2329 CA PHE B 74 9.698 -8.069 2.169 1.00 0.00 C ATOM 2330 C PHE B 74 10.933 -7.685 2.970 1.00 0.00 C ATOM 2331 O PHE B 74 10.952 -7.802 4.195 1.00 0.00 O ATOM 2332 CB PHE B 74 8.836 -6.829 1.932 1.00 0.00 C ATOM 2333 CG PHE B 74 7.597 -7.097 1.125 1.00 0.00 C ATOM 2334 CD1 PHE B 74 7.676 -7.314 -0.240 1.00 0.00 C ATOM 2335 CD2 PHE B 74 6.351 -7.126 1.734 1.00 0.00 C ATOM 2336 CE1 PHE B 74 6.537 -7.555 -0.985 1.00 0.00 C ATOM 2337 CE2 PHE B 74 5.209 -7.366 0.994 1.00 0.00 C ATOM 2338 CZ PHE B 74 5.301 -7.581 -0.366 1.00 0.00 C ATOM 0 H PHE B 74 8.479 -8.793 3.716 1.00 0.00 H new ATOM 0 HA PHE B 74 10.019 -8.476 1.210 1.00 0.00 H new ATOM 0 HB2 PHE B 74 8.547 -6.409 2.896 1.00 0.00 H new ATOM 0 HB3 PHE B 74 9.434 -6.074 1.422 1.00 0.00 H new ATOM 0 HD1 PHE B 74 8.639 -7.295 -0.729 1.00 0.00 H new ATOM 0 HD2 PHE B 74 6.273 -6.959 2.798 1.00 0.00 H new ATOM 0 HE1 PHE B 74 6.612 -7.723 -2.049 1.00 0.00 H new ATOM 0 HE2 PHE B 74 4.245 -7.385 1.480 1.00 0.00 H new ATOM 0 HZ PHE B 74 4.409 -7.769 -0.946 1.00 0.00 H new ATOM 2348 N GLU B 75 11.963 -7.224 2.269 1.00 0.00 N ATOM 2349 CA GLU B 75 13.201 -6.808 2.912 1.00 0.00 C ATOM 2350 C GLU B 75 13.172 -5.311 3.194 1.00 0.00 C ATOM 2351 O GLU B 75 13.536 -4.501 2.340 1.00 0.00 O ATOM 2352 CB GLU B 75 14.402 -7.151 2.029 1.00 0.00 C ATOM 2353 CG GLU B 75 14.479 -8.621 1.651 1.00 0.00 C ATOM 2354 CD GLU B 75 15.660 -8.929 0.753 1.00 0.00 C ATOM 2355 OE1 GLU B 75 15.523 -8.784 -0.480 1.00 0.00 O ATOM 2356 OE2 GLU B 75 16.724 -9.314 1.282 1.00 0.00 O ATOM 0 H GLU B 75 11.964 -7.129 1.253 1.00 0.00 H new ATOM 0 HA GLU B 75 13.297 -7.343 3.857 1.00 0.00 H new ATOM 0 HB2 GLU B 75 14.356 -6.552 1.119 1.00 0.00 H new ATOM 0 HB3 GLU B 75 15.317 -6.870 2.550 1.00 0.00 H new ATOM 0 HG2 GLU B 75 14.549 -9.222 2.557 1.00 0.00 H new ATOM 0 HG3 GLU B 75 13.558 -8.912 1.146 1.00 0.00 H new ATOM 2363 N VAL B 76 12.729 -4.952 4.391 1.00 0.00 N ATOM 2364 CA VAL B 76 12.639 -3.552 4.785 1.00 0.00 C ATOM 2365 C VAL B 76 13.657 -3.212 5.866 1.00 0.00 C ATOM 2366 O VAL B 76 13.675 -3.829 6.931 1.00 0.00 O ATOM 2367 CB VAL B 76 11.228 -3.208 5.299 1.00 0.00 C ATOM 2368 CG1 VAL B 76 10.714 -4.297 6.229 1.00 0.00 C ATOM 2369 CG2 VAL B 76 11.235 -1.862 6.007 1.00 0.00 C ATOM 0 H VAL B 76 12.426 -5.612 5.107 1.00 0.00 H new ATOM 0 HA VAL B 76 12.853 -2.960 3.895 1.00 0.00 H new ATOM 0 HB VAL B 76 10.557 -3.146 4.443 1.00 0.00 H new ATOM 0 HG11 VAL B 76 9.716 -4.034 6.581 1.00 0.00 H new ATOM 0 HG12 VAL B 76 10.672 -5.244 5.692 1.00 0.00 H new ATOM 0 HG13 VAL B 76 11.385 -4.394 7.082 1.00 0.00 H new ATOM 0 HG21 VAL B 76 10.231 -1.634 6.364 1.00 0.00 H new ATOM 0 HG22 VAL B 76 11.921 -1.899 6.853 1.00 0.00 H new ATOM 0 HG23 VAL B 76 11.558 -1.087 5.312 1.00 0.00 H new